#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c4k n TYR 8 N 0.00 -0.15 -3.62 1.61 4.01 -1.26 -5.00 117.16 112.74 2c4k n TYR 8 Ca 0.00 0.07 -0.40 0.00 -0.16 0.00 0.00 57.90 57.41 2c4k n TYR 8 Cb 0.00 -1.59 -0.11 0.00 -0.31 0.00 0.00 39.34 37.33 2c4k n TYR 8 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2c4k s ARG 9 N -0.32 2.69 -0.06 -0.72 1.81 -1.26 -4.80 118.95 116.29 2c4k s ARG 9 Ca -0.00 -1.27 -0.00 0.00 -1.72 0.00 0.00 55.73 52.74 2c4k s ARG 9 Cb 0.00 -3.71 0.02 0.00 -0.45 0.00 0.00 34.95 30.81 2c4k s ARG 9 CO 0.03 -0.81 -0.03 0.54 -0.68 0.00 0.00 175.30 174.35 2c4k s VAL 10 N 1.47 0.49 0.20 3.52 0.11 -1.26 0.53 120.40 125.47 2c4k s VAL 10 Ca 0.02 -0.02 0.11 0.00 -2.93 0.00 0.00 61.98 59.16 2c4k s VAL 10 Cb -0.21 -0.57 -0.04 0.00 -1.53 0.00 0.00 36.38 34.02 2c4k s VAL 10 CO 0.04 0.25 -0.23 -0.36 -3.33 0.00 0.00 175.10 171.47 2c4k s PHE 11 N 1.42 2.32 -0.14 1.54 0.40 0.33 -1.26 117.98 122.58 2c4k s PHE 11 Ca -0.03 -0.35 -0.06 0.00 -0.60 0.00 0.00 56.93 55.88 2c4k s PHE 11 Cb -0.13 -1.14 -0.04 0.00 0.51 0.00 0.00 43.02 42.22 2c4k s PHE 11 CO -0.03 0.51 0.08 0.45 0.70 0.00 0.00 175.22 176.94 2c4k s SER 12 N -2.71 5.88 0.00 1.36 0.15 -1.26 0.40 113.70 117.52 2c4k s SER 12 Ca 0.21 0.26 0.19 0.00 0.70 0.00 0.00 55.95 57.30 2c4k s SER 12 Cb -0.08 -1.90 0.51 0.00 -1.71 0.00 0.00 66.02 62.84 2c4k s SER 12 CO 0.10 0.31 1.42 0.00 1.20 0.00 0.00 173.24 176.28 2c4k n ALA 13 N 2.64 2.43 -1.90 5.45 0.00 -0.92 -4.90 120.51 123.30 2c4k n ALA 13 Ca -0.18 -0.90 -0.34 0.00 0.00 0.00 0.00 53.44 52.02 2c4k n ALA 13 Cb 0.54 -0.96 -0.07 0.00 0.00 0.00 0.00 19.45 18.96 2c4k n ALA 13 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2c4k s ASN 14 N -1.17 6.97 -0.08 0.00 0.01 -1.26 -4.70 114.94 114.71 2c4k s ASN 14 Ca 0.36 1.61 0.03 0.00 -0.71 0.00 0.00 52.86 54.15 2c4k s ASN 14 Cb 0.19 -2.50 -0.07 0.00 0.41 0.00 0.00 41.25 39.28 2c4k s ASN 14 CO 0.26 -0.26 -0.04 -1.54 -1.51 0.00 0.00 177.10 174.02 2c4k n SER 15 N -0.31 3.25 -4.70 -1.22 3.41 -1.26 -4.84 113.62 107.95 2c4k n SER 15 Ca 0.05 -0.03 -0.42 0.00 -0.26 0.00 0.00 58.87 58.21 2c4k n SER 15 Cb 0.53 0.19 -0.03 0.00 -0.26 0.00 0.00 64.21 64.64 2c4k n SER 15 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2c4k s THR 16 N -2.18 3.40 -1.67 6.66 2.01 -1.26 -4.93 115.64 117.67 2c4k s THR 16 Ca -0.09 0.94 0.06 0.00 0.31 0.00 0.00 61.69 62.91 2c4k s THR 16 Cb 0.03 -3.60 0.22 0.00 0.01 0.00 0.00 72.50 69.15 2c4k s THR 16 CO 0.25 0.04 1.09 0.00 -0.69 0.00 0.00 174.62 175.32 2c4k n ALA 17 N 4.53 2.59 0.00 7.40 0.00 -1.26 -1.93 120.51 131.84 2c4k n ALA 17 Ca 0.12 -0.46 0.03 0.00 0.00 0.00 0.00 53.44 53.13 2c4k n ALA 17 Cb 0.42 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.84 2c4k n ALA 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c4k n ALA 18 N 0.18 2.19 1.70 0.00 0.00 -1.26 -4.39 120.51 118.94 2c4k n ALA 18 Ca 0.08 -0.12 0.06 0.00 0.00 0.00 0.00 53.44 53.46 2c4k n ALA 18 Cb 0.29 -0.17 0.35 0.00 0.00 0.00 0.00 19.45 19.91 2c4k n ALA 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c4k n THR 20 N -0.71 1.29 0.06 0.00 -1.04 -1.19 -4.51 114.28 108.17 2c4k n THR 20 Ca 0.09 -1.40 -0.13 0.00 -2.04 0.00 0.00 64.05 60.57 2c4k n THR 20 Cb 0.04 0.26 -0.09 0.00 -1.82 0.00 0.00 70.33 68.73 2c4k n THR 20 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2c4k h GLU 21 N 0.06 -0.16 -0.86 -2.82 4.39 -1.71 -1.83 114.58 111.66 2c4k h GLU 21 Ca 0.00 0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.72 2c4k h GLU 21 Cb 0.67 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.31 2c4k h GLU 21 CO 0.00 0.23 0.56 1.25 -1.16 0.00 0.00 179.01 179.89 2c4k h LEU 22 N -0.58 0.99 -0.19 1.33 5.85 -1.87 -0.90 115.31 119.95 2c4k h LEU 22 Ca -0.02 -0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.59 2c4k h LEU 22 Cb 0.46 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.24 2c4k h LEU 22 CO 0.03 0.72 -0.23 0.00 -0.34 0.00 0.00 178.44 178.61 2c4k h ALA 23 N 1.46 0.28 -0.61 1.25 0.00 -1.89 -0.55 119.26 119.21 2c4k h ALA 23 Ca 0.31 -0.37 0.12 0.00 0.00 0.00 0.00 54.91 54.97 2c4k h ALA 23 Cb -0.13 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 17.51 2c4k h ALA 23 CO -0.07 0.25 0.08 -0.22 0.00 0.00 0.00 179.25 179.29 2c4k h LYS 24 N 0.15 0.19 -0.02 0.00 1.63 -1.03 -2.69 116.57 114.80 2c4k h LYS 24 Ca 0.02 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.81 2c4k h LYS 24 Cb 0.80 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 32.38 2c4k h LYS 24 CO 0.06 0.13 0.00 0.00 -3.45 0.00 0.00 179.45 176.19 2c4k h ARG 25 N 0.20 0.03 -0.31 1.90 3.08 -0.74 -2.63 114.38 115.91 2c4k h ARG 25 Ca 0.32 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.43 2c4k h ARG 25 Cb 0.50 -0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.47 2c4k h ARG 25 CO -0.46 0.26 -0.26 0.82 -1.07 0.00 0.00 179.97 179.27 2c4k h ILE 26 N -0.21 0.34 -0.14 2.04 2.04 -1.02 -2.02 117.51 118.54 2c4k h ILE 26 Ca 0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 2c4k h ILE 26 Cb 0.25 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 2c4k h ILE 26 CO 0.00 0.00 0.06 0.71 0.00 0.00 0.00 178.15 178.92 2c4k h THR 27 N -0.24 1.06 -0.35 -0.27 1.35 -1.43 -0.94 112.91 112.09 2c4k h THR 27 Ca 0.16 -0.18 0.02 0.00 -0.55 0.00 0.00 66.41 65.86 2c4k h THR 27 Cb 0.48 0.89 -0.03 0.00 -1.73 0.00 0.00 68.15 67.76 2c4k h THR 27 CO -0.44 0.07 0.20 -0.33 -0.25 0.00 0.00 175.52 174.76 2c4k h GLU 28 N 0.20 0.39 0.00 4.72 4.39 -0.99 -0.07 114.58 123.22 2c4k h GLU 28 Ca 0.05 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 2c4k h GLU 28 Cb 0.04 -0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 28.60 2c4k h GLU 28 CO -0.01 0.26 -0.03 0.00 -1.16 0.00 0.00 179.01 178.07 2c4k h ARG 29 N 0.40 0.00 -0.01 2.33 3.08 -0.83 -2.04 114.38 117.31 2c4k h ARG 29 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 2c4k h ARG 29 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2c4k h ARG 29 CO -0.08 0.03 -0.15 1.28 -1.07 0.00 0.00 179.97 179.98 2c4k n LEU 30 N -3.13 1.60 0.00 3.04 7.99 -0.72 -4.93 117.00 120.85 2c4k n LEU 30 Ca 0.01 -0.52 0.00 0.00 -0.01 0.00 0.00 56.01 55.49 2c4k n LEU 30 Cb 0.34 -0.04 0.00 0.00 -0.11 0.00 0.00 43.42 43.61 2c4k n LEU 30 CO 0.29 0.28 0.00 0.61 -1.51 0.00 0.00 177.39 177.06 2c4k n GLY 31 N 1.29 0.39 3.85 -0.72 0.00 -0.62 -4.95 105.19 104.43 2c4k n GLY 31 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 2c4k n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4k s ALA 32 N -1.61 2.61 -0.04 4.61 0.00 -0.14 -4.95 121.76 122.25 2c4k s ALA 32 Ca 0.00 -0.29 0.07 0.00 0.00 0.00 0.00 51.96 51.74 2c4k s ALA 32 Cb 0.00 -3.06 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 2c4k s ALA 32 CO 0.00 -1.40 -0.25 -2.00 0.00 0.00 0.00 175.76 172.11 2c4k s GLU 33 N -5.27 2.31 0.58 0.00 2.12 -1.26 -4.26 118.70 112.91 2c4k s GLU 33 Ca 0.59 -0.90 -0.20 0.00 0.36 0.00 0.00 54.97 54.83 2c4k s GLU 33 Cb -0.12 -2.07 -0.04 0.00 0.26 0.00 0.00 34.13 32.16 2c4k s GLU 33 CO 0.53 0.45 1.16 1.28 -0.54 0.00 0.00 175.26 178.13 2c4k n LEU 34 N 2.74 4.65 -4.77 2.70 4.77 -1.26 -4.69 117.00 121.14 2c4k n LEU 34 Ca -0.17 0.88 -0.39 0.00 -0.03 0.00 0.00 56.01 56.30 2c4k n LEU 34 Cb 0.52 -1.48 -0.03 0.00 -2.33 0.00 0.00 43.42 40.10 2c4k n LEU 34 CO 0.24 -1.27 0.82 -0.83 -1.33 0.00 0.00 177.39 175.03 2c4k s GLY 35 N -1.13 2.97 0.07 -0.72 0.00 -0.39 -4.98 107.32 103.13 2c4k s GLY 35 Ca 0.75 0.94 -0.30 0.00 0.00 0.00 0.00 44.72 46.11 2c4k s GLY 35 CO 0.47 1.51 1.11 -1.59 0.00 0.00 0.00 173.10 174.60 2c4k s LYS 36 N -1.84 4.50 -0.30 2.90 0.00 -1.26 -4.75 119.74 118.99 2c4k s LYS 36 Ca 0.50 1.65 -0.19 0.00 0.00 0.00 0.00 55.97 57.93 2c4k s LYS 36 Cb -0.31 -3.37 0.19 0.00 0.00 0.00 0.00 37.83 34.34 2c4k s LYS 36 CO 0.40 -0.13 1.27 -1.54 0.00 0.00 0.00 175.35 175.36 2c4k s SER 37 N 0.80 -0.07 0.21 0.03 1.04 -1.26 -1.20 113.70 113.26 2c4k s SER 37 Ca 0.55 0.08 -0.30 0.00 0.48 0.00 0.00 55.95 56.76 2c4k s SER 37 Cb -0.27 1.07 -0.08 0.00 0.10 0.00 0.00 66.02 66.84 2c4k s SER 37 CO 0.30 -0.01 0.97 0.68 0.98 0.00 0.00 173.24 176.15 2c4k s VAL 38 N 2.39 4.10 -0.58 5.02 -7.23 -0.72 -4.89 120.40 118.48 2c4k s VAL 38 Ca -0.03 2.01 0.04 0.00 -1.81 0.00 0.00 61.98 62.19 2c4k s VAL 38 Cb -0.03 -4.28 0.14 0.00 0.56 0.00 0.00 36.38 32.77 2c4k s VAL 38 CO -0.13 0.44 0.34 -0.69 -0.31 0.00 0.00 175.10 174.75 2c4k s VAL 39 N -0.88 2.71 1.21 1.32 1.01 -1.26 -1.24 120.40 123.27 2c4k s VAL 39 Ca 0.43 -3.64 -0.19 0.00 0.00 0.00 0.00 61.98 58.58 2c4k s VAL 39 Cb -0.26 -2.85 0.29 0.00 0.00 0.00 0.00 36.38 33.56 2c4k s VAL 39 CO 0.32 -0.87 1.11 -0.31 0.00 0.00 0.00 175.10 175.36 2c4k s TYR 40 N -0.68 0.42 -0.10 5.22 4.12 0.27 -4.81 117.35 121.79 2c4k s TYR 40 Ca 0.20 0.47 -0.03 0.00 0.02 0.00 0.00 57.07 57.72 2c4k s TYR 40 Cb -0.19 -3.47 0.05 0.00 -1.52 0.00 0.00 41.96 36.83 2c4k s TYR 40 CO -0.05 -3.91 0.15 -0.65 0.02 0.00 0.00 175.55 171.10 2c4k s GLN 41 N -5.43 0.04 0.93 -0.62 -1.52 -1.26 -3.31 119.66 108.49 2c4k s GLN 41 Ca 0.71 0.46 -0.11 0.00 -1.95 0.00 0.00 55.36 54.47 2c4k s GLN 41 Cb -0.09 -0.51 0.15 0.00 -0.22 0.00 0.00 33.01 32.34 2c4k s GLN 41 CO 0.56 -0.37 1.09 -1.21 -0.25 0.00 0.00 175.29 175.11 2c4k s GLU 42 N 2.27 0.96 0.39 2.91 0.41 0.13 -4.91 118.70 120.86 2c4k s GLU 42 Ca 0.04 1.01 0.09 0.00 -0.41 0.00 0.00 54.97 55.70 2c4k s GLU 42 Cb -0.13 -1.76 0.81 0.00 -1.78 0.00 0.00 34.13 31.27 2c4k s GLU 42 CO -0.06 -2.50 1.95 1.79 -0.49 0.00 0.00 175.26 175.94 2c4k h THR 43 N -1.75 1.16 0.00 3.63 1.35 -2.02 -1.55 112.91 113.72 2c4k h THR 43 Ca -0.50 -0.64 0.00 0.00 -0.55 0.00 0.00 66.41 64.73 2c4k h THR 43 Cb 1.28 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 2c4k h THR 43 CO 0.51 0.21 0.00 -0.46 -0.25 0.00 0.00 175.52 175.53 2c4k n ASN 44 N -4.32 0.00 0.00 5.36 0.23 -1.26 -4.90 115.26 110.37 2c4k n ASN 44 Ca -0.00 -0.06 0.00 0.00 -0.53 0.00 0.00 54.58 53.99 2c4k n ASN 44 Cb 0.22 -0.28 0.00 0.00 -2.08 0.00 0.00 39.78 37.64 2c4k n ASN 44 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2c4k n GLY 45 N 0.74 3.03 3.68 4.83 0.00 -0.58 -5.07 105.19 111.82 2c4k n GLY 45 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2c4k n GLY 45 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c4k n GLU 46 N -1.24 1.91 -3.09 1.61 1.02 -1.26 -4.56 120.64 115.03 2c4k n GLU 46 Ca 0.00 0.68 -0.35 0.00 -0.02 0.00 0.00 57.16 57.46 2c4k n GLU 46 Cb 0.00 -2.28 -0.06 0.00 -0.02 0.00 0.00 31.44 29.08 2c4k n GLU 46 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2c4k s THR 47 N -1.15 4.57 -0.00 2.62 2.01 -1.26 0.17 115.64 122.59 2c4k s THR 47 Ca 0.59 1.25 0.01 0.00 0.31 0.00 0.00 61.69 63.84 2c4k s THR 47 Cb -0.55 -3.82 -0.00 0.00 0.01 0.00 0.00 72.50 68.14 2c4k s THR 47 CO 0.60 0.13 -0.02 -0.13 -0.69 0.00 0.00 174.62 174.51 2c4k s ARG 48 N -2.17 0.19 -0.02 4.92 0.52 -1.21 -4.90 118.95 116.29 2c4k s ARG 48 Ca 0.45 -0.09 0.03 0.00 -0.52 0.00 0.00 55.73 55.60 2c4k s ARG 48 Cb -0.16 -0.18 -0.00 0.00 0.52 0.00 0.00 34.95 35.14 2c4k s ARG 48 CO 0.20 0.05 -0.10 0.08 0.02 0.00 0.00 175.30 175.55 2c4k s VAL 49 N -0.08 0.83 -0.08 3.52 1.01 -1.26 0.94 120.40 125.28 2c4k s VAL 49 Ca 0.01 -0.41 -0.00 0.00 0.00 0.00 0.00 61.98 61.58 2c4k s VAL 49 Cb -0.01 -0.72 0.02 0.00 0.00 0.00 0.00 36.38 35.67 2c4k s VAL 49 CO -0.00 0.25 -0.04 -0.70 0.00 0.00 0.00 175.10 174.60 2c4k s GLU 50 N 0.04 1.06 -0.26 2.72 -6.30 -0.37 -5.01 118.70 110.58 2c4k s GLU 50 Ca -0.01 -0.10 -0.22 0.00 -2.50 0.00 0.00 54.97 52.14 2c4k s GLU 50 Cb -0.07 -1.20 -0.01 0.00 0.00 0.00 0.00 34.13 32.84 2c4k s GLU 50 CO 0.00 -0.22 0.69 0.42 0.02 0.00 0.00 175.26 176.17 2c4k s ILE 51 N 1.58 4.93 -0.49 -3.70 1.09 -1.26 -1.76 121.20 121.58 2c4k s ILE 51 Ca 0.00 1.22 0.08 0.00 -1.10 0.00 0.00 60.65 60.86 2c4k s ILE 51 Cb -0.13 -4.00 0.50 0.00 -1.06 0.00 0.00 42.46 37.78 2c4k s ILE 51 CO -0.05 -0.03 1.33 0.29 -0.10 0.00 0.00 174.94 176.39 2c4k n LYS 52 N 5.83 3.22 -3.57 2.79 4.76 -0.34 -4.90 118.16 125.96 2c4k n LYS 52 Ca 0.01 -1.97 -0.13 0.00 -2.87 0.00 0.00 58.31 53.35 2c4k n LYS 52 Cb 0.48 -1.95 -0.05 0.00 -1.84 0.00 0.00 35.03 31.68 2c4k n LYS 52 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 2c4k s GLU 53 N -2.11 1.06 0.33 1.97 -1.05 -1.26 -4.87 118.70 112.78 2c4k s GLU 53 Ca 0.35 -0.32 -0.28 0.00 -0.15 0.00 0.00 54.97 54.57 2c4k s GLU 53 Cb 0.27 0.48 -0.09 0.00 -0.44 0.00 0.00 34.13 34.35 2c4k s GLU 53 CO 0.10 -0.40 1.14 0.45 0.95 0.00 0.00 175.26 177.50 2c4k s SER 54 N -2.15 6.95 0.00 0.83 0.15 -1.26 -4.95 113.70 113.28 2c4k s SER 54 Ca -0.04 2.32 0.00 0.00 0.70 0.00 0.00 55.95 58.93 2c4k s SER 54 Cb -0.00 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.68 2c4k s SER 54 CO -0.04 -0.37 0.00 0.52 1.20 0.00 0.00 173.24 174.55 2c4k n VAL 55 N 0.70 0.00 -0.11 4.45 0.31 -1.26 -5.04 118.33 117.37 2c4k n VAL 55 Ca 0.01 -0.15 -0.04 0.00 -0.01 0.00 0.00 64.34 64.15 2c4k n VAL 55 Cb 0.45 0.63 -0.01 0.00 -0.91 0.00 0.00 33.84 34.00 2c4k n VAL 55 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2c4k n ARG 56 N -1.16 0.00 -1.00 5.55 5.12 -1.18 -0.11 116.66 123.88 2c4k n ARG 56 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2c4k n ARG 56 Cb 0.00 -0.12 0.00 0.00 -1.16 0.00 0.00 32.46 31.18 2c4k n ARG 56 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2c4k n GLY 57 N 0.54 0.73 3.93 -0.13 0.00 0.79 -4.96 105.19 106.09 2c4k n GLY 57 Ca 0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 2c4k n GLY 57 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c4k s GLN 58 N -0.02 3.32 -0.31 1.61 -0.21 0.84 -4.25 119.66 120.64 2c4k s GLN 58 Ca 0.00 -0.80 -0.19 0.00 0.02 0.00 0.00 55.36 54.39 2c4k s GLN 58 Cb 0.00 -2.83 -0.01 0.00 1.00 0.00 0.00 33.01 31.17 2c4k s GLN 58 CO 0.00 0.44 0.56 -0.51 -2.12 0.00 0.00 175.29 173.66 2c4k s ASP 59 N -3.80 6.42 -0.05 5.90 1.01 -1.26 -0.71 116.67 124.17 2c4k s ASP 59 Ca 0.34 0.32 0.04 0.00 0.71 0.00 0.00 52.55 53.95 2c4k s ASP 59 Cb -0.09 -2.30 -0.02 0.00 1.01 0.00 0.00 42.92 41.52 2c4k s ASP 59 CO 0.28 -0.42 -0.15 -0.63 0.21 0.00 0.00 175.17 174.46 2c4k s ILE 60 N 2.46 3.01 -0.25 0.77 -1.09 0.23 -4.21 121.20 122.12 2c4k s ILE 60 Ca 0.22 -0.74 -0.04 0.00 -2.23 0.00 0.00 60.65 57.86 2c4k s ILE 60 Cb -0.15 -2.18 0.01 0.00 -1.58 0.00 0.00 42.46 38.56 2c4k s ILE 60 CO 0.11 0.59 -0.00 -0.36 -1.23 0.00 0.00 174.94 174.05 2c4k s PHE 61 N -0.67 3.05 0.02 3.97 0.40 0.19 -0.05 117.98 124.89 2c4k s PHE 61 Ca 0.10 -1.11 -0.11 0.00 -0.60 0.00 0.00 56.93 55.21 2c4k s PHE 61 Cb -0.11 -2.14 -0.05 0.00 0.51 0.00 0.00 43.02 41.22 2c4k s PHE 61 CO 0.01 -0.60 0.37 0.42 0.70 0.00 0.00 175.22 176.11 2c4k s ILE 62 N 1.45 5.13 -0.11 0.64 1.01 0.42 0.12 121.20 129.85 2c4k s ILE 62 Ca 0.03 0.55 0.01 0.00 0.00 0.00 0.00 60.65 61.25 2c4k s ILE 62 Cb -0.16 -3.64 -0.01 0.00 0.01 0.00 0.00 42.46 38.66 2c4k s ILE 62 CO -0.02 0.44 -0.16 -0.63 0.00 0.00 0.00 174.94 174.58 2c4k s ILE 63 N -1.23 2.84 -0.04 2.92 1.01 0.16 0.06 121.20 126.92 2c4k s ILE 63 Ca 0.27 -0.75 0.01 0.00 0.00 0.00 0.00 60.65 60.18 2c4k s ILE 63 Cb -0.15 -2.16 0.02 0.00 0.01 0.00 0.00 42.46 40.19 2c4k s ILE 63 CO 0.15 0.54 -0.02 -1.10 0.00 0.00 0.00 174.94 174.51 2c4k s GLN 64 N 0.18 0.56 0.18 2.79 -1.52 -0.39 -2.17 119.66 119.29 2c4k s GLN 64 Ca -0.09 0.00 0.07 0.00 -1.95 0.00 0.00 55.36 53.39 2c4k s GLN 64 Cb -0.15 -0.68 -0.04 0.00 -0.22 0.00 0.00 33.01 31.92 2c4k s GLN 64 CO 0.05 -0.13 0.06 0.95 -0.25 0.00 0.00 175.29 175.98 2c4k s THR 65 N 1.06 4.01 -0.26 -0.19 -4.23 -1.26 -3.90 115.64 110.86 2c4k s THR 65 Ca -0.09 -1.33 -0.04 0.00 -1.18 0.00 0.00 61.69 59.05 2c4k s THR 65 Cb -0.14 -3.05 0.02 0.00 1.34 0.00 0.00 72.50 70.68 2c4k s THR 65 CO -0.01 -0.14 -0.01 0.27 -0.54 0.00 0.00 174.62 174.19 2c4k s ILE 66 N -1.80 3.30 -0.89 2.99 -5.25 -1.26 -4.96 121.20 113.34 2c4k s ILE 66 Ca 0.29 -0.88 -0.00 0.00 -0.99 0.00 0.00 60.65 59.07 2c4k s ILE 66 Cb -0.09 -2.68 0.27 0.00 2.95 0.00 0.00 42.46 42.90 2c4k s ILE 66 CO 0.21 0.16 1.04 -0.81 -1.79 0.00 0.00 174.94 173.75 2c4k n PRO 67 N 4.75 3.32 0.00 0.37 -0.04 -1.26 -4.68 135.00 137.45 2c4k n PRO 67 Ca -0.16 -4.58 0.00 0.00 -0.04 0.00 0.00 63.50 58.73 2c4k n PRO 67 Cb 0.47 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.53 2c4k n PRO 67 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2c4k n ARG 68 N 1.45 0.00 -2.54 0.54 3.00 -1.26 -4.71 116.66 113.14 2c4k n ARG 68 Ca 0.26 0.00 -0.42 0.00 -0.00 0.00 0.00 57.85 57.69 2c4k n ARG 68 Cb 0.37 0.00 -0.00 0.00 0.00 0.00 0.00 32.46 32.83 2c4k n ARG 68 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 2c4k n ASP 69 N 3.67 4.85 -0.03 6.15 -0.08 -1.26 -4.71 116.55 125.12 2c4k n ASP 69 Ca 0.00 -2.91 -0.17 0.00 -1.51 0.00 0.00 54.79 50.20 2c4k n ASP 69 Cb 0.00 -1.75 -0.07 0.00 2.34 0.00 0.00 41.12 41.65 2c4k n ASP 69 CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 2c4k h VAL 70 N 5.56 1.28 -0.96 5.18 3.04 -1.96 -2.78 116.25 125.61 2c4k h VAL 70 Ca 0.44 -1.91 0.26 0.00 -1.01 0.00 0.00 66.70 64.49 2c4k h VAL 70 Cb 0.87 1.93 -0.05 0.00 -2.01 0.00 0.00 31.29 32.02 2c4k h VAL 70 CO 1.46 0.61 0.67 0.78 -1.01 0.00 0.00 177.57 180.08 2c4k h ASN 71 N 0.53 0.14 0.30 3.17 2.35 -2.00 -1.53 115.58 118.55 2c4k h ASN 71 Ca -0.04 0.02 -0.33 0.00 -0.55 0.00 0.00 56.30 55.40 2c4k h ASN 71 Cb 1.34 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.71 2c4k h ASN 71 CO 0.15 0.04 -1.65 0.74 -1.65 0.00 0.00 177.43 175.06 2c4k h THR 72 N 0.13 1.04 -0.56 2.81 2.02 -1.90 -3.23 112.91 113.22 2c4k h THR 72 Ca 0.48 -2.64 0.11 0.00 0.77 0.00 0.00 66.41 65.13 2c4k h THR 72 Cb 1.68 2.78 -0.03 0.00 -1.74 0.00 0.00 68.15 70.83 2c4k h THR 72 CO -0.08 0.84 0.38 0.00 0.37 0.00 0.00 175.52 177.03 2c4k h ALA 73 N 0.28 2.13 0.06 6.16 0.00 -1.17 -0.78 119.26 125.94 2c4k h ALA 73 Ca -0.30 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.35 2c4k h ALA 73 Cb 2.07 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.80 2c4k h ALA 73 CO 0.18 -0.26 -1.19 -0.39 0.00 0.00 0.00 179.25 177.58 2c4k h VAL 74 N 0.30 1.52 -0.01 0.00 -1.51 -1.47 -2.44 116.25 112.64 2c4k h VAL 74 Ca 0.26 -3.18 -0.01 0.00 -1.23 0.00 0.00 66.70 62.54 2c4k h VAL 74 Cb 0.64 2.85 0.00 0.00 -2.13 0.00 0.00 31.29 32.65 2c4k h VAL 74 CO -0.06 0.90 -0.05 0.24 -1.23 0.00 0.00 177.57 177.37 2c4k h MET 75 N 0.03 0.04 -0.93 5.19 2.86 -1.49 0.87 114.93 121.51 2c4k h MET 75 Ca -0.10 -0.04 0.25 0.00 -2.06 0.00 0.00 59.70 57.75 2c4k h MET 75 Cb 1.89 0.01 -0.17 0.00 0.06 0.00 0.00 31.60 33.39 2c4k h MET 75 CO 0.16 0.75 0.08 0.93 1.06 0.00 0.00 176.91 179.89 2c4k h GLU 76 N -0.65 0.06 0.64 1.72 5.08 -1.26 1.26 114.58 121.43 2c4k h GLU 76 Ca -0.00 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2c4k h GLU 76 Cb 0.77 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 30.01 2c4k h GLU 76 CO 0.01 0.04 -0.31 1.25 -1.00 0.00 0.00 179.01 179.00 2c4k h LEU 77 N 0.06 -0.72 -0.25 1.33 5.85 -1.30 -0.69 115.31 119.59 2c4k h LEU 77 Ca 0.57 0.02 0.06 0.00 0.84 0.00 0.00 57.88 59.37 2c4k h LEU 77 Cb 1.15 0.19 -0.07 0.00 0.37 0.00 0.00 40.66 42.30 2c4k h LEU 77 CO -0.82 -0.35 -0.28 -0.07 -0.34 0.00 0.00 178.44 176.57 2c4k h LEU 78 N -1.18 -0.89 -0.59 2.25 3.38 -0.10 -0.50 115.31 117.68 2c4k h LEU 78 Ca -0.09 0.15 0.08 0.00 0.09 0.00 0.00 57.88 58.12 2c4k h LEU 78 Cb 0.65 0.41 -0.07 0.00 0.09 0.00 0.00 40.66 41.75 2c4k h LEU 78 CO 0.14 -0.31 0.24 0.40 0.09 0.00 0.00 178.44 179.01 2c4k h ILE 79 N -0.28 0.82 -0.57 1.22 2.04 0.15 -0.22 117.51 120.66 2c4k h ILE 79 Ca 0.14 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 2c4k h ILE 79 Cb 0.50 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 2c4k h ILE 79 CO -0.41 0.08 0.23 -0.03 0.00 0.00 0.00 178.15 178.02 2c4k h MET 80 N 0.44 0.85 0.12 2.37 4.05 -0.27 0.61 114.93 123.09 2c4k h MET 80 Ca 0.29 -0.15 0.01 0.00 -0.28 0.00 0.00 59.70 59.56 2c4k h MET 80 Cb 0.32 -0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 30.97 2c4k h MET 80 CO -0.27 0.73 -0.15 0.00 0.23 0.00 0.00 176.91 177.45 2c4k h ALA 81 N 1.07 -0.27 -0.93 0.39 0.00 -0.61 -0.10 119.26 118.81 2c4k h ALA 81 Ca 0.19 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.11 2c4k h ALA 81 Cb 0.20 0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 2c4k h ALA 81 CO -0.02 -0.68 0.61 -0.92 0.00 0.00 0.00 179.25 178.25 2c4k h TYR 82 N -0.31 1.13 -0.10 0.00 3.20 0.01 0.45 116.97 121.35 2c4k h TYR 82 Ca 0.01 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.79 2c4k h TYR 82 Cb 0.31 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.19 2c4k h TYR 82 CO -0.14 0.64 -0.46 0.00 -1.64 0.00 0.00 178.16 176.56 2c4k h ALA 83 N 1.46 1.04 0.01 1.82 0.00 -0.58 -1.64 119.26 121.37 2c4k h ALA 83 Ca 0.37 -0.44 -0.20 0.00 0.00 0.00 0.00 54.91 54.64 2c4k h ALA 83 Cb 0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2c4k h ALA 83 CO -0.12 0.63 -0.90 -0.07 0.00 0.00 0.00 179.25 178.79 2c4k h LEU 84 N 0.20 0.29 -0.42 0.00 3.38 0.79 -1.48 115.31 118.08 2c4k h LEU 84 Ca 0.01 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 2c4k h LEU 84 Cb 0.89 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 2c4k h LEU 84 CO 0.07 1.05 0.20 0.50 0.09 0.00 0.00 178.44 180.35 2c4k h LYS 85 N 0.12 0.60 -0.30 1.13 3.64 -0.11 -0.67 116.57 120.98 2c4k h LYS 85 Ca -0.05 -0.09 -0.05 0.00 -1.27 0.00 0.00 60.65 59.19 2c4k h LYS 85 Cb 1.53 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 33.23 2c4k h LYS 85 CO 0.14 0.52 -0.03 1.15 -2.27 0.00 0.00 179.45 178.96 2c4k h THR 86 N 0.53 1.19 0.00 1.00 2.02 -1.25 -1.65 112.91 114.75 2c4k h THR 86 Ca 0.14 -0.77 0.00 0.00 0.77 0.00 0.00 66.41 66.56 2c4k h THR 86 Cb 0.12 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 2c4k h THR 86 CO -0.02 0.26 0.00 0.00 0.37 0.00 0.00 175.52 176.13 2c4k n ALA 87 N -2.48 2.30 -2.53 6.16 0.00 -0.56 -4.89 120.51 118.50 2c4k n ALA 87 Ca 0.01 -0.13 -0.05 0.00 0.00 0.00 0.00 53.44 53.27 2c4k n ALA 87 Cb 0.25 -1.35 0.02 0.00 0.00 0.00 0.00 19.45 18.36 2c4k n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c4k s ALA 89 N -3.08 3.59 0.01 0.00 0.00 -0.30 -0.15 121.76 121.83 2c4k s ALA 89 Ca 0.06 1.16 -0.16 0.00 0.00 0.00 0.00 51.96 53.03 2c4k s ALA 89 Cb -0.03 -3.53 -0.09 0.00 0.00 0.00 0.00 23.12 19.48 2c4k s ALA 89 CO 0.18 -0.62 1.00 -0.09 0.00 0.00 0.00 175.76 176.24 2c4k h ARG 90 N 6.05 -0.56 -5.25 0.00 2.43 -1.10 -3.45 114.38 112.51 2c4k h ARG 90 Ca -0.44 0.04 -0.65 0.00 -0.81 0.00 0.00 59.98 58.12 2c4k h ARG 90 Cb 1.21 0.13 -0.33 0.00 -0.42 0.00 0.00 29.97 30.56 2c4k h ARG 90 CO 0.82 -0.37 -0.87 -0.80 -1.51 0.00 0.00 179.97 177.24 2c4k s ASN 91 N -3.41 2.85 -0.34 -3.80 0.02 -1.23 -4.99 114.94 104.06 2c4k s ASN 91 Ca -0.08 -0.51 -0.05 0.00 -1.02 0.00 0.00 52.86 51.19 2c4k s ASN 91 Cb 0.01 -1.26 0.04 0.00 0.02 0.00 0.00 41.25 40.06 2c4k s ASN 91 CO 0.25 0.14 0.09 -0.63 0.02 0.00 0.00 177.10 176.98 2c4k s ILE 92 N 0.36 3.63 -0.22 0.60 1.01 -1.26 0.75 121.20 126.06 2c4k s ILE 92 Ca -0.17 -1.21 -0.05 0.00 0.00 0.00 0.00 60.65 59.21 2c4k s ILE 92 Cb -0.17 -3.08 -0.02 0.00 0.01 0.00 0.00 42.46 39.20 2c4k s ILE 92 CO 0.08 -0.19 0.00 -0.63 0.00 0.00 0.00 174.94 174.20 2c4k s ILE 93 N 1.37 3.80 -0.31 2.92 1.09 0.93 0.15 121.20 131.14 2c4k s ILE 93 Ca -0.02 -0.35 -0.20 0.00 -1.10 0.00 0.00 60.65 58.98 2c4k s ILE 93 Cb -0.20 -2.74 -0.01 0.00 -1.06 0.00 0.00 42.46 38.45 2c4k s ILE 93 CO 0.02 0.40 0.63 -0.83 -0.10 0.00 0.00 174.94 175.05 2c4k s GLY 94 N 1.40 1.78 -0.56 6.18 0.00 -0.21 -0.44 107.32 115.47 2c4k s GLY 94 Ca 0.05 -0.67 -0.15 0.00 0.00 0.00 0.00 44.72 43.95 2c4k s GLY 94 CO 0.00 1.46 0.50 0.14 0.00 0.00 0.00 173.10 175.20 2c4k s VAL 95 N 2.61 5.11 -0.61 1.40 1.01 0.11 -0.09 120.40 129.93 2c4k s VAL 95 Ca 0.25 -1.63 0.04 0.00 0.00 0.00 0.00 61.98 60.65 2c4k s VAL 95 Cb -0.15 -4.27 0.15 0.00 0.00 0.00 0.00 36.38 32.11 2c4k s VAL 95 CO 0.12 -0.87 0.39 -0.63 0.00 0.00 0.00 175.10 174.11 2c4k s ILE 96 N 1.44 2.61 0.08 2.22 1.09 -0.71 -1.26 121.20 126.68 2c4k s ILE 96 Ca 0.05 -3.78 -0.33 0.00 -1.10 0.00 0.00 60.65 55.48 2c4k s ILE 96 Cb -0.28 -2.75 -0.16 0.00 -1.06 0.00 0.00 42.46 38.21 2c4k s ILE 96 CO 0.02 -0.94 1.52 -0.65 -0.10 0.00 0.00 174.94 174.79 2c4k h PRO 97 N 5.87 -0.85 -5.55 2.79 0.11 -1.79 -3.29 132.00 129.28 2c4k h PRO 97 Ca 0.06 0.06 -0.62 0.00 0.11 0.00 0.00 66.00 65.61 2c4k h PRO 97 Cb 0.82 0.19 -0.12 0.00 0.11 0.00 0.00 31.00 32.00 2c4k h PRO 97 CO 0.68 -0.57 0.20 -0.47 -0.21 0.00 0.00 178.00 177.63 2c4k s TYR 98 N -5.63 3.19 -0.31 0.65 5.04 -1.26 -1.88 117.35 117.14 2c4k s TYR 98 Ca -0.16 0.54 -0.27 0.00 -2.44 0.00 0.00 57.07 54.74 2c4k s TYR 98 Cb 0.04 -3.09 0.01 0.00 0.35 0.00 0.00 41.96 39.27 2c4k s TYR 98 CO 0.56 -0.55 0.96 0.12 -1.34 0.00 0.00 175.55 175.30 2c4k s PHE 99 N 2.72 3.18 0.84 4.97 2.19 -1.24 -4.73 117.98 125.91 2c4k s PHE 99 Ca 0.26 1.05 -0.11 0.00 0.33 0.00 0.00 56.93 58.46 2c4k s PHE 99 Cb -0.15 -3.49 0.10 0.00 -1.31 0.00 0.00 43.02 38.17 2c4k s PHE 99 CO 0.13 -0.68 1.09 -1.25 1.83 0.00 0.00 175.22 176.34 2c4k s PRO 100 N 3.36 1.73 -0.19 10.12 0.04 -1.26 -3.16 135.00 145.64 2c4k s PRO 100 Ca 0.40 0.84 0.00 0.00 0.04 0.00 0.00 61.00 62.28 2c4k s PRO 100 Cb -0.13 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.55 2c4k s PRO 100 CO 0.14 -1.92 0.00 0.66 0.04 0.00 0.00 177.00 175.92 2c4k n TYR 101 N -3.67 -0.02 0.23 0.56 4.01 -1.26 -4.84 117.16 112.17 2c4k n TYR 101 Ca 0.07 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.92 2c4k n TYR 101 Cb 0.55 -1.84 0.51 0.00 -0.31 0.00 0.00 39.34 38.25 2c4k n TYR 101 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2c4k h SER 102 N 0.00 0.00 1.00 7.72 4.64 -1.94 0.09 113.55 125.07 2c4k h SER 102 Ca -0.04 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.25 2c4k h SER 102 Cb 0.83 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.92 2c4k h SER 102 CO 0.05 0.21 -0.14 0.11 -0.87 0.00 0.00 176.83 176.19 2c4k h LYS 103 N 0.00 0.00 -2.01 4.77 6.56 -1.88 -3.29 116.57 120.71 2c4k h LYS 103 Ca -0.00 0.00 -0.31 0.00 -1.06 0.00 0.00 60.65 59.28 2c4k h LYS 103 Cb 0.67 0.00 -0.11 0.00 -0.57 0.00 0.00 32.23 32.22 2c4k h LYS 103 CO 0.03 0.14 -0.06 1.04 -2.06 0.00 0.00 179.45 178.54 2c4k n GLN 104 N -3.28 2.17 -0.08 3.15 6.02 0.02 -4.37 117.38 121.01 2c4k n GLN 104 Ca 0.00 -1.51 -0.09 0.00 -0.01 0.00 0.00 57.00 55.39 2c4k n GLN 104 Cb 0.39 -2.06 -0.12 0.00 1.02 0.00 0.00 30.24 29.47 2c4k n GLN 104 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2c4k n SER 105 N 1.91 1.22 -4.80 1.08 3.41 -1.24 -2.49 113.62 112.70 2c4k n SER 105 Ca 0.46 -0.01 -0.29 0.00 -0.26 0.00 0.00 58.87 58.76 2c4k n SER 105 Cb 0.78 0.75 0.12 0.00 -0.26 0.00 0.00 64.21 65.60 2c4k n SER 105 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2c4k s LYS 106 N -2.39 1.48 -0.23 4.33 1.02 -1.26 -4.89 119.74 117.80 2c4k s LYS 106 Ca -0.10 0.18 -0.08 0.00 0.02 0.00 0.00 55.97 55.98 2c4k s LYS 106 Cb 0.05 -1.89 -0.04 0.00 -0.52 0.00 0.00 37.83 35.43 2c4k s LYS 106 CO 0.63 -1.94 0.09 1.41 -0.92 0.00 0.00 175.35 174.62 2c4k s MET 107 N -5.44 3.86 0.00 1.68 -2.45 -1.26 -4.37 119.30 111.32 2c4k s MET 107 Ca 0.63 -0.38 0.00 0.00 -1.25 0.00 0.00 55.69 54.69 2c4k s MET 107 Cb -0.13 -3.35 0.00 0.00 1.25 0.00 0.00 34.83 32.60 2c4k s MET 107 CO 0.51 0.02 0.00 0.54 1.05 0.00 0.00 175.02 177.14 2c4k n ARG 108 N 4.35 0.00 0.00 4.11 5.12 -1.26 -5.03 116.66 123.95 2c4k n ARG 108 Ca -0.16 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.76 2c4k n ARG 108 Cb 0.52 -0.01 0.00 0.00 -1.16 0.00 0.00 32.46 31.81 2c4k n ARG 108 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2c4k n LYS 109 N 0.00 0.00 -0.03 5.56 4.01 -1.26 -4.83 118.16 121.61 2c4k n LYS 109 Ca 0.00 0.00 0.08 0.00 -0.51 0.00 0.00 58.31 57.88 2c4k n LYS 109 Cb 0.00 0.00 0.40 0.00 -0.51 0.00 0.00 35.03 34.92 2c4k n LYS 109 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 2c4k n ARG 110 N 0.00 1.26 0.00 1.97 0.63 -1.26 -4.81 116.66 114.45 2c4k n ARG 110 Ca 0.00 -0.39 0.00 0.00 -0.92 0.00 0.00 57.85 56.54 2c4k n ARG 110 Cb 0.00 -1.28 0.00 0.00 0.45 0.00 0.00 32.46 31.63 2c4k n ARG 110 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2c4k n GLY 111 N 0.87 -3.14 3.47 5.14 0.00 -1.26 -5.10 105.19 105.16 2c4k n GLY 111 Ca 0.13 -0.79 -0.14 0.00 0.00 0.00 0.00 46.02 45.22 2c4k n GLY 111 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2c4k s SER 112 N -1.91 -0.57 -1.39 1.61 1.04 -1.26 -4.96 113.70 106.26 2c4k s SER 112 Ca 0.00 0.25 -0.16 0.00 0.48 0.00 0.00 55.95 56.52 2c4k s SER 112 Cb 0.00 0.55 0.05 0.00 0.10 0.00 0.00 66.02 66.72 2c4k s SER 112 CO 0.00 -0.80 2.00 -0.38 0.98 0.00 0.00 173.24 175.04 2c4k n ILE 113 N 0.09 3.68 0.31 -1.02 5.41 -1.26 -4.79 119.36 121.79 2c4k n ILE 113 Ca -0.17 -3.52 0.07 0.00 1.00 0.00 0.00 62.75 60.13 2c4k n ILE 113 Cb 0.62 -2.49 0.31 0.00 -0.71 0.00 0.00 39.64 37.37 2c4k n ILE 113 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 2c4k n VAL 114 N 5.68 1.22 0.11 1.39 0.24 -1.11 -1.22 118.33 124.64 2c4k n VAL 114 Ca 0.51 0.37 -0.00 0.00 -2.04 0.00 0.00 64.34 63.17 2c4k n VAL 114 Cb 0.42 -1.25 0.29 0.00 -1.47 0.00 0.00 33.84 31.83 2c4k n VAL 114 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2c4k h LYS 116 N 0.18 0.14 -0.68 0.00 1.63 -1.43 -2.34 116.57 114.06 2c4k h LYS 116 Ca 0.02 -0.15 0.14 0.00 -0.85 0.00 0.00 60.65 59.81 2c4k h LYS 116 Cb 0.66 0.04 -0.13 0.00 -0.60 0.00 0.00 32.23 32.21 2c4k h LYS 116 CO 0.05 0.90 -0.17 1.25 -3.45 0.00 0.00 179.45 178.02 2c4k h LEU 117 N -0.57 -0.64 -0.84 5.20 5.85 -1.47 -0.46 115.31 122.38 2c4k h LEU 117 Ca -0.03 0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 2c4k h LEU 117 Cb 0.97 0.42 -0.04 0.00 0.37 0.00 0.00 40.66 42.38 2c4k h LEU 117 CO 0.04 -0.23 0.46 0.25 -0.34 0.00 0.00 178.44 178.62 2c4k h LEU 118 N -0.00 1.05 -1.80 2.25 5.85 -1.21 -2.08 115.31 119.37 2c4k h LEU 118 Ca 0.33 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 2c4k h LEU 118 Cb 0.50 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 2c4k h LEU 118 CO -0.70 0.85 -0.09 0.00 -0.34 0.00 0.00 178.44 178.16 2c4k h ALA 119 N 1.25 1.10 0.06 1.25 0.00 -0.56 -0.12 119.26 122.24 2c4k h ALA 119 Ca 0.30 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.98 2c4k h ALA 119 Cb 0.03 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 17.82 2c4k h ALA 119 CO -0.05 0.11 -0.63 0.77 0.00 0.00 0.00 179.25 179.45 2c4k h SER 120 N 0.00 0.45 -0.43 0.00 0.02 -0.61 -3.28 113.55 109.70 2c4k h SER 120 Ca -0.00 -0.86 -0.13 0.00 -0.84 0.00 0.00 61.79 59.96 2c4k h SER 120 Cb 0.41 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2c4k h SER 120 CO 0.01 1.26 -0.23 0.24 -1.14 0.00 0.00 176.83 176.97 2c4k h MET 121 N -0.30 0.91 -0.91 3.45 2.07 -0.91 -1.83 114.93 117.41 2c4k h MET 121 Ca -0.10 -0.41 0.18 0.00 -2.07 0.00 0.00 59.70 57.31 2c4k h MET 121 Cb 1.41 -0.02 -0.07 0.00 -1.87 0.00 0.00 31.60 31.05 2c4k h MET 121 CO 0.12 1.06 0.59 -0.07 1.07 0.00 0.00 176.91 179.68 2c4k h LEU 122 N 0.74 0.54 0.07 1.22 4.07 -1.17 -0.42 115.31 120.36 2c4k h LEU 122 Ca 0.09 0.05 -0.26 0.00 0.08 0.00 0.00 57.88 57.84 2c4k h LEU 122 Cb 0.80 -0.05 0.02 0.00 1.08 0.00 0.00 40.66 42.51 2c4k h LEU 122 CO 0.07 0.23 -1.07 0.00 -1.08 0.00 0.00 178.44 176.58 2c4k h ALA 123 N 1.61 0.04 -0.64 1.53 0.00 -1.45 -2.93 119.26 117.41 2c4k h ALA 123 Ca 0.48 -0.72 0.09 0.00 0.00 0.00 0.00 54.91 54.76 2c4k h ALA 123 Cb 0.98 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.79 2c4k h ALA 123 CO -0.21 0.63 0.29 0.87 0.00 0.00 0.00 179.25 180.82 2c4k h LYS 124 N 0.24 0.50 0.00 0.00 1.79 -0.69 0.89 116.57 119.30 2c4k h LYS 124 Ca -0.15 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.29 2c4k h LYS 124 Cb 1.75 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 32.29 2c4k h LYS 124 CO 0.21 0.33 0.00 0.00 -1.08 0.00 0.00 179.45 178.91 2c4k n ALA 125 N -2.42 1.36 -1.03 3.86 0.00 -0.23 -4.87 120.51 117.18 2c4k n ALA 125 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2c4k n ALA 125 Cb 0.25 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.61 2c4k n ALA 125 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c4k n GLY 126 N -0.86 0.40 3.30 0.00 0.00 0.31 -1.54 105.19 106.80 2c4k n GLY 126 Ca 0.02 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.29 2c4k n GLY 126 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2c4k s LEU 127 N -1.65 2.84 0.13 0.99 2.96 -1.11 -4.63 118.68 118.20 2c4k s LEU 127 Ca 0.00 -0.40 -0.13 0.00 -0.22 0.00 0.00 54.13 53.38 2c4k s LEU 127 Cb 0.00 -1.72 -0.04 0.00 0.50 0.00 0.00 46.19 44.93 2c4k s LEU 127 CO 0.00 -0.01 1.49 0.74 -1.32 0.00 0.00 176.35 177.25 2c4k h THR 128 N 5.71 1.28 -1.41 3.68 2.02 -0.65 -3.43 112.91 120.10 2c4k h THR 128 Ca -0.41 -1.40 0.27 0.00 0.77 0.00 0.00 66.41 65.64 2c4k h THR 128 Cb 1.16 1.35 -0.19 0.00 -1.74 0.00 0.00 68.15 68.73 2c4k h THR 128 CO 0.60 0.46 0.84 -1.38 0.37 0.00 0.00 175.52 176.42 2c4k s HIS 129 N -4.54 -0.11 0.01 3.16 -3.43 -1.14 -4.09 115.29 105.14 2c4k s HIS 129 Ca -0.12 0.07 0.07 0.00 -0.80 0.00 0.00 55.06 54.28 2c4k s HIS 129 Cb 0.10 0.51 -0.03 0.00 -1.43 0.00 0.00 32.58 31.74 2c4k s HIS 129 CO 0.85 -0.18 -0.21 0.96 -2.00 0.00 0.00 174.74 174.16 2c4k s ILE 130 N -2.36 2.53 -0.07 -5.38 -5.25 -0.94 -1.04 121.20 108.68 2c4k s ILE 130 Ca 0.10 -1.10 -0.11 0.00 -0.99 0.00 0.00 60.65 58.55 2c4k s ILE 130 Cb -0.01 -1.99 -0.05 0.00 2.95 0.00 0.00 42.46 43.36 2c4k s ILE 130 CO -0.04 0.46 0.26 -0.63 -1.79 0.00 0.00 174.94 173.20 2c4k s ILE 131 N -0.78 5.29 0.32 8.37 1.01 0.87 -1.73 121.20 134.57 2c4k s ILE 131 Ca 0.12 0.49 -0.11 0.00 0.00 0.00 0.00 60.65 61.16 2c4k s ILE 131 Cb -0.10 -3.55 0.02 0.00 0.01 0.00 0.00 42.46 38.84 2c4k s ILE 131 CO 0.02 0.58 0.59 0.28 0.00 0.00 0.00 174.94 176.41 2c4k s THR 132 N -0.92 0.00 -0.03 2.92 -1.32 -0.08 -1.73 115.64 114.47 2c4k s THR 132 Ca 0.19 -1.32 0.05 0.00 -1.21 0.00 0.00 61.69 59.39 2c4k s THR 132 Cb -0.14 -2.54 -0.01 0.00 -1.51 0.00 0.00 72.50 68.30 2c4k s THR 132 CO 0.08 0.00 -0.17 -0.04 -2.21 0.00 0.00 174.62 172.27 2c4k s MET 133 N -3.17 1.68 -1.20 7.08 -1.94 -0.79 -0.23 119.30 120.74 2c4k s MET 133 Ca 0.22 -0.62 -0.34 0.00 -1.71 0.00 0.00 55.69 53.24 2c4k s MET 133 Cb -0.02 -1.50 0.05 0.00 2.01 0.00 0.00 34.83 35.36 2c4k s MET 133 CO 0.14 0.28 0.68 -0.25 -0.01 0.00 0.00 175.02 175.86 2c4k n ASP 134 N 3.00 -4.11 -4.49 3.03 8.00 0.35 -4.76 116.55 117.57 2c4k n ASP 134 Ca -0.17 -1.30 -0.47 0.00 0.71 0.00 0.00 54.79 53.55 2c4k n ASP 134 Cb 0.53 -1.58 -0.03 0.00 -0.02 0.00 0.00 41.12 40.03 2c4k n ASP 134 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2c4k n LEU 135 N -5.01 0.21 -0.33 0.64 4.77 -1.26 -4.84 117.00 111.17 2c4k n LEU 135 Ca -0.12 1.15 0.16 0.00 -0.03 0.00 0.00 56.01 57.17 2c4k n LEU 135 Cb 0.56 -1.10 0.36 0.00 -2.33 0.00 0.00 43.42 40.91 2c4k n LEU 135 CO 0.74 -2.19 1.12 -0.74 -1.33 0.00 0.00 177.39 174.99 2c4k h HIS 136 N 1.64 0.89 -3.51 -1.77 -0.00 -1.89 -3.39 115.15 107.12 2c4k h HIS 136 Ca -0.35 0.04 -0.23 0.00 -0.00 0.00 0.00 60.37 59.83 2c4k h HIS 136 Cb 1.39 -0.24 -0.29 0.00 -0.00 0.00 0.00 27.41 28.27 2c4k h HIS 136 CO 0.46 0.02 -0.65 -0.65 -0.00 0.00 0.00 177.93 177.11 2c4k s GLN 137 N -5.81 0.06 0.31 5.26 -1.52 -1.26 -5.03 119.66 111.67 2c4k s GLN 137 Ca -0.11 0.15 0.12 0.00 -1.95 0.00 0.00 55.36 53.57 2c4k s GLN 137 Cb 0.27 -0.04 0.48 0.00 -0.22 0.00 0.00 33.01 33.49 2c4k s GLN 137 CO 0.79 -0.06 1.67 0.87 -0.25 0.00 0.00 175.29 178.32 2c4k h LYS 138 N 6.42 0.00 -0.55 2.91 1.57 -1.99 -1.97 116.57 122.96 2c4k h LYS 138 Ca -0.31 0.00 0.11 0.00 -1.87 0.00 0.00 60.65 58.59 2c4k h LYS 138 Cb 1.18 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.46 2c4k h LYS 138 CO 0.46 0.53 0.38 1.05 -0.57 0.00 0.00 179.45 181.30 2c4k h GLU 139 N 0.00 0.23 -0.30 3.15 9.09 -1.95 -2.25 114.58 122.55 2c4k h GLU 139 Ca -0.01 -0.01 0.09 0.00 0.05 0.00 0.00 59.36 59.48 2c4k h GLU 139 Cb 0.98 -0.05 -0.01 0.00 -1.65 0.00 0.00 28.75 28.01 2c4k h GLU 139 CO 0.07 0.16 0.23 0.82 0.05 0.00 0.00 179.01 180.33 2c4k h ILE 140 N 0.24 0.80 -0.62 -1.06 2.04 -1.77 0.31 117.51 117.45 2c4k h ILE 140 Ca 0.26 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.30 2c4k h ILE 140 Cb 0.69 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.59 2c4k h ILE 140 CO -0.05 0.00 0.62 -0.61 0.00 0.00 0.00 178.15 178.11 2c4k h GLN 141 N 0.00 0.00 0.00 2.37 4.15 -1.58 0.80 115.11 120.86 2c4k h GLN 141 Ca 0.14 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.52 2c4k h GLN 141 Cb 0.60 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.28 2c4k h GLN 141 CO -0.00 0.00 -0.19 0.78 -1.93 0.00 0.00 178.83 177.49 2c4k h GLY 142 N 0.00 0.00 2.00 2.39 0.00 -1.13 -3.21 103.07 103.12 2c4k h GLY 142 Ca 0.29 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.62 2c4k h GLY 142 CO -0.00 0.00 -0.03 0.74 0.00 0.00 0.00 176.54 177.24 2c4k h PHE 143 N 0.00 0.00 -3.36 5.60 0.04 0.48 -3.42 116.94 116.28 2c4k h PHE 143 Ca -0.00 0.00 -0.58 0.00 2.80 0.00 0.00 57.97 60.19 2c4k h PHE 143 Cb 0.37 0.00 -0.08 0.00 2.20 0.00 0.00 35.95 38.44 2c4k h PHE 143 CO 0.00 0.03 -0.09 -0.06 -0.60 0.00 0.00 178.31 177.59 2c4k s PHE 144 N -4.42 3.49 -1.76 -0.55 0.40 -1.21 -4.70 117.98 109.22 2c4k s PHE 144 Ca -0.04 0.91 0.03 0.00 -0.60 0.00 0.00 56.93 57.23 2c4k s PHE 144 Cb 0.14 -2.61 0.11 0.00 0.51 0.00 0.00 43.02 41.18 2c4k s PHE 144 CO 0.54 0.10 1.01 -1.13 0.70 0.00 0.00 175.22 176.44 2c4k n SER 145 N 3.92 0.89 -4.13 1.36 3.41 -1.26 -4.82 113.62 112.98 2c4k n SER 145 Ca -0.06 -2.03 -0.10 0.00 -0.26 0.00 0.00 58.87 56.42 2c4k n SER 145 Cb 0.51 -0.18 -0.09 0.00 -0.26 0.00 0.00 64.21 64.19 2c4k n SER 145 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2c4k s PHE 146 N -1.72 0.87 0.72 7.33 -0.12 -1.26 -5.13 117.98 118.67 2c4k s PHE 146 Ca 0.08 -1.20 -0.16 0.00 -0.05 0.00 0.00 56.93 55.61 2c4k s PHE 146 Cb 0.05 -0.42 0.03 0.00 -0.63 0.00 0.00 43.02 42.04 2c4k s PHE 146 CO 0.05 -0.60 1.21 -2.30 -0.05 0.00 0.00 175.22 173.53 2c4k n PRO 147 N -0.17 0.65 -4.05 1.99 -0.02 -1.26 -4.84 135.00 127.29 2c4k n PRO 147 Ca -0.03 0.29 -0.13 0.00 -2.02 0.00 0.00 63.50 61.61 2c4k n PRO 147 Cb 0.64 -2.45 -0.11 0.00 -0.02 0.00 0.00 33.50 31.56 2c4k n PRO 147 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2c4k s VAL 148 N -1.75 0.49 -0.27 -1.45 1.01 -1.26 -2.21 120.40 114.97 2c4k s VAL 148 Ca 0.78 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 61.72 2c4k s VAL 148 Cb -0.34 -0.57 0.07 0.00 0.00 0.00 0.00 36.38 35.54 2c4k s VAL 148 CO 0.46 -0.39 -0.02 -1.81 0.00 0.00 0.00 175.10 173.34 2c4k s ASP 149 N -1.55 4.12 -0.97 3.32 1.11 -0.70 -5.00 116.67 117.00 2c4k s ASP 149 Ca -0.10 -1.44 -0.14 0.00 0.18 0.00 0.00 52.55 51.05 2c4k s ASP 149 Cb -0.10 -1.28 0.21 0.00 1.07 0.00 0.00 42.92 42.83 2c4k s ASP 149 CO 0.00 -0.28 1.00 0.21 1.18 0.00 0.00 175.17 177.29 2c4k s ASN 150 N 1.29 6.93 0.51 0.27 2.47 -1.26 -0.90 114.94 124.25 2c4k s ASN 150 Ca -0.01 -2.85 -0.18 0.00 0.42 0.00 0.00 52.86 50.23 2c4k s ASN 150 Cb -0.19 -2.27 -0.07 0.00 -1.45 0.00 0.00 41.25 37.27 2c4k s ASN 150 CO -0.09 -0.60 1.02 -0.76 -3.72 0.00 0.00 177.10 172.95 2c4k s LEU 151 N 0.39 3.71 0.03 3.21 1.43 0.68 -4.61 118.68 123.51 2c4k s LEU 151 Ca 0.27 1.76 -0.01 0.00 -1.03 0.00 0.00 54.13 55.12 2c4k s LEU 151 Cb -0.08 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.56 2c4k s LEU 151 CO -0.08 -0.77 0.18 -0.13 0.23 0.00 0.00 176.35 175.78 2c4k s ARG 152 N -3.67 3.36 -0.01 1.70 1.81 -1.26 0.13 118.95 121.01 2c4k s ARG 152 Ca 0.63 -0.42 0.21 0.00 -1.72 0.00 0.00 55.73 54.44 2c4k s ARG 152 Cb -0.13 -3.02 -0.25 0.00 -0.45 0.00 0.00 34.95 31.10 2c4k s ARG 152 CO 0.26 0.64 0.82 0.00 -0.68 0.00 0.00 175.30 176.34 2c4k n ALA 153 N 0.65 4.40 -0.23 2.13 0.00 -1.26 -4.66 120.51 121.54 2c4k n ALA 153 Ca -0.08 -0.58 -0.07 0.00 0.00 0.00 0.00 53.44 52.71 2c4k n ALA 153 Cb 0.52 -0.76 -0.02 0.00 0.00 0.00 0.00 19.45 19.19 2c4k n ALA 153 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2c4k h SER 154 N 0.00 -1.40 -0.96 0.00 0.02 -1.97 -1.28 113.55 107.96 2c4k h SER 154 Ca 0.00 0.25 0.17 0.00 -0.84 0.00 0.00 61.79 61.37 2c4k h SER 154 Cb 0.59 0.66 -0.17 0.00 0.14 0.00 0.00 62.40 63.62 2c4k h SER 154 CO 0.00 -0.32 -0.29 -2.65 -1.14 0.00 0.00 176.83 172.43 2c4k n PRO 155 N -5.42 -0.14 0.00 3.45 -0.02 -1.26 0.41 135.00 132.02 2c4k n PRO 155 Ca 0.03 1.48 -0.12 0.00 -2.02 0.00 0.00 63.50 62.87 2c4k n PRO 155 Cb 0.35 -2.21 -0.10 0.00 -0.02 0.00 0.00 33.50 31.53 2c4k n PRO 155 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2c4k h PHE 156 N 0.00 -0.07 -0.73 6.00 -1.00 -1.62 -1.78 116.94 117.74 2c4k h PHE 156 Ca 0.41 -0.00 0.09 0.00 2.81 0.00 0.00 57.97 61.28 2c4k h PHE 156 Cb 0.65 0.02 -0.07 0.00 3.61 0.00 0.00 35.95 40.16 2c4k h PHE 156 CO -0.78 0.49 0.38 -0.07 -1.61 0.00 0.00 178.31 176.73 2c4k h LEU 157 N -0.72 0.51 -0.38 1.54 3.38 -0.45 -0.74 115.31 118.44 2c4k h LEU 157 Ca -0.01 0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.04 2c4k h LEU 157 Cb 0.60 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 2c4k h LEU 157 CO 0.01 0.30 0.21 -0.07 0.09 0.00 0.00 178.44 178.98 2c4k h LEU 158 N 0.65 0.33 -0.47 1.67 4.07 -0.09 -2.16 115.31 119.31 2c4k h LEU 158 Ca 0.35 0.01 0.06 0.00 0.08 0.00 0.00 57.88 58.39 2c4k h LEU 158 Cb 0.34 -0.06 -0.05 0.00 1.08 0.00 0.00 40.66 41.97 2c4k h LEU 158 CO -0.25 0.24 0.16 -0.61 -1.08 0.00 0.00 178.44 176.90 2c4k h GLN 159 N 0.43 0.32 -0.70 1.13 -0.00 -0.49 -1.54 115.11 114.26 2c4k h GLN 159 Ca 0.16 -0.02 0.06 0.00 -0.00 0.00 0.00 58.65 58.84 2c4k h GLN 159 Cb 0.03 -0.07 -0.04 0.00 0.00 0.00 0.00 27.48 27.40 2c4k h GLN 159 CO -0.09 0.21 0.46 -0.92 0.00 0.00 0.00 178.83 178.50 2c4k h TYR 160 N 0.33 0.75 0.16 3.99 3.20 -0.94 -1.16 116.97 123.30 2c4k h TYR 160 Ca 0.22 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.13 2c4k h TYR 160 Cb 0.23 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.22 2c4k h TYR 160 CO -0.16 0.40 -0.38 0.82 -1.64 0.00 0.00 178.16 177.21 2c4k h ILE 161 N 0.75 0.23 -0.09 1.81 1.08 -0.62 -2.31 117.51 118.35 2c4k h ILE 161 Ca 0.30 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.77 2c4k h ILE 161 Cb 0.22 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 34.19 2c4k h ILE 161 CO -0.09 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.37 2c4k n GLN 162 N -5.45 1.43 -0.02 2.37 6.02 -0.76 -1.55 117.38 119.42 2c4k n GLN 162 Ca -0.07 -0.41 -0.03 0.00 -0.01 0.00 0.00 57.00 56.48 2c4k n GLN 162 Cb 0.36 -1.42 -0.01 0.00 1.02 0.00 0.00 30.24 30.20 2c4k n GLN 162 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2c4k n GLU 163 N -0.02 0.16 -2.65 -1.09 0.00 -0.51 -4.86 120.64 111.66 2c4k n GLU 163 Ca 0.04 0.06 -0.10 0.00 0.00 0.00 0.00 57.16 57.16 2c4k n GLU 163 Cb 0.28 -0.67 0.03 0.00 0.00 0.00 0.00 31.44 31.08 2c4k n GLU 163 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2c4k n GLU 164 N -3.29 1.59 -3.50 5.31 -0.58 -1.05 -4.90 120.64 114.22 2c4k n GLU 164 Ca -0.04 -3.47 -0.42 0.00 -0.42 0.00 0.00 57.16 52.80 2c4k n GLU 164 Cb 0.15 -1.46 -0.09 0.00 -0.57 0.00 0.00 31.44 29.47 2c4k n GLU 164 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2c4k s ILE 165 N -3.58 4.80 0.12 -3.67 1.01 -0.60 -4.99 121.20 114.31 2c4k s ILE 165 Ca 0.30 -1.09 -0.32 0.00 0.00 0.00 0.00 60.65 59.54 2c4k s ILE 165 Cb 0.42 -3.84 -0.12 0.00 0.01 0.00 0.00 42.46 38.94 2c4k s ILE 165 CO -0.00 -0.47 1.77 -2.65 0.00 0.00 0.00 174.94 173.59 2c4k n PRO 166 N 5.07 2.59 -3.71 2.79 -0.02 -1.26 -2.95 135.00 137.51 2c4k n PRO 166 Ca -0.11 0.94 -0.24 0.00 -2.02 0.00 0.00 63.50 62.06 2c4k n PRO 166 Cb 0.44 -2.79 0.05 0.00 -0.02 0.00 0.00 33.50 31.18 2c4k n PRO 166 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2c4k n ASN 167 N 4.96 -3.85 -0.25 2.55 3.02 -1.26 -4.87 115.26 115.56 2c4k n ASN 167 Ca 0.18 -0.71 0.14 0.00 -0.03 0.00 0.00 54.58 54.16 2c4k n ASN 167 Cb 0.34 -4.41 0.42 0.00 -0.61 0.00 0.00 39.78 35.52 2c4k n ASN 167 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 2c4k h TYR 168 N -2.16 0.72 -0.32 3.10 -0.00 -1.84 -2.13 116.97 114.33 2c4k h TYR 168 Ca -0.59 0.02 0.09 0.00 0.00 0.00 0.00 58.73 58.26 2c4k h TYR 168 Cb 1.36 -0.23 -0.01 0.00 0.00 0.00 0.00 36.73 37.85 2c4k h TYR 168 CO 0.51 0.26 0.27 0.07 -0.00 0.00 0.00 178.16 179.26 2c4k h ARG 169 N 0.60 0.00 0.00 0.10 -0.00 -1.90 0.98 114.38 114.17 2c4k h ARG 169 Ca 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 60.42 2c4k h ARG 169 Cb 0.81 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.78 2c4k h ARG 169 CO -0.19 0.00 0.00 -1.71 -0.00 0.00 0.00 179.97 178.07 2c4k n ASN 170 N -4.17 0.00 -4.81 0.08 2.85 -0.80 -4.89 115.26 103.51 2c4k n ASN 170 Ca 0.05 0.02 -0.30 0.00 -0.11 0.00 0.00 54.58 54.24 2c4k n ASN 170 Cb 0.43 -0.34 0.07 0.00 1.24 0.00 0.00 39.78 41.19 2c4k n ASN 170 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2c4k s ALA 171 N -2.67 2.46 -0.09 5.20 0.00 0.34 -3.82 121.76 123.18 2c4k s ALA 171 Ca 0.24 -0.05 -0.01 0.00 0.00 0.00 0.00 51.96 52.14 2c4k s ALA 171 Cb 0.19 -3.14 0.03 0.00 0.00 0.00 0.00 23.12 20.19 2c4k s ALA 171 CO 0.46 -1.48 -0.05 0.54 0.00 0.00 0.00 175.76 175.23 2c4k s VAL 172 N -3.10 0.76 0.14 0.00 0.11 -0.19 -4.39 120.40 113.74 2c4k s VAL 172 Ca 0.59 -0.13 -0.31 0.00 -2.93 0.00 0.00 61.98 59.21 2c4k s VAL 172 Cb -0.14 -0.83 -0.08 0.00 -1.53 0.00 0.00 36.38 33.79 2c4k s VAL 172 CO 0.55 0.32 1.39 -0.63 -3.33 0.00 0.00 175.10 173.40 2c4k s ILE 173 N 1.76 3.20 0.10 7.04 1.09 -1.02 -1.40 121.20 131.97 2c4k s ILE 173 Ca 0.04 0.89 0.09 0.00 -1.10 0.00 0.00 60.65 60.57 2c4k s ILE 173 Cb -0.13 -3.57 -0.03 0.00 -1.06 0.00 0.00 42.46 37.67 2c4k s ILE 173 CO -0.07 0.09 -0.24 -0.69 -0.10 0.00 0.00 174.94 173.93 2c4k s VAL 174 N 0.84 1.97 -0.24 2.92 1.01 0.31 -1.51 120.40 125.72 2c4k s VAL 174 Ca 0.63 -1.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.02 2c4k s VAL 174 Cb -0.38 -1.75 0.02 0.00 0.00 0.00 0.00 36.38 34.27 2c4k s VAL 174 CO 0.33 0.08 -0.07 0.00 0.00 0.00 0.00 175.10 175.44 2c4k s ALA 175 N -1.03 2.69 0.45 5.51 0.00 -0.68 -1.11 121.76 127.59 2c4k s ALA 175 Ca 0.10 -1.37 0.25 0.00 0.00 0.00 0.00 51.96 50.95 2c4k s ALA 175 Cb -0.10 -1.65 1.28 0.00 0.00 0.00 0.00 23.12 22.65 2c4k s ALA 175 CO 0.04 -0.67 1.76 -0.22 0.00 0.00 0.00 175.76 176.67 2c4k h LYS 176 N 8.03 0.23 -3.29 0.00 3.64 -1.87 0.24 116.57 123.56 2c4k h LYS 176 Ca -0.36 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.00 2c4k h LYS 176 Cb 1.12 -0.05 -0.09 0.00 -0.41 0.00 0.00 32.23 32.80 2c4k h LYS 176 CO 0.59 0.15 0.05 -1.54 -2.27 0.00 0.00 179.45 176.43 2c4k s SER 177 N -5.14 -0.24 0.24 4.20 1.04 -1.25 -4.44 113.70 108.11 2c4k s SER 177 Ca -0.07 -0.57 -0.07 0.00 0.48 0.00 0.00 55.95 55.71 2c4k s SER 177 Cb 0.25 0.61 0.42 0.00 0.10 0.00 0.00 66.02 67.41 2c4k s SER 177 CO 0.80 -1.13 1.65 -0.65 0.98 0.00 0.00 173.24 174.90 2c4k h PRO 178 N 2.16 0.14 -1.03 4.02 0.11 -1.84 0.14 132.00 135.70 2c4k h PRO 178 Ca -0.26 -0.01 0.27 0.00 0.11 0.00 0.00 66.00 66.11 2c4k h PRO 178 Cb 1.26 -0.03 -0.07 0.00 0.11 0.00 0.00 31.00 32.27 2c4k h PRO 178 CO 0.34 0.09 0.70 0.22 -0.21 0.00 0.00 178.00 179.14 2c4k h ASP 179 N 0.15 0.27 -0.05 -2.05 1.82 -1.96 0.25 116.42 114.85 2c4k h ASP 179 Ca 0.40 0.05 0.00 0.00 -0.39 0.00 0.00 57.03 57.09 2c4k h ASP 179 Cb 0.70 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.71 2c4k h ASP 179 CO -0.60 0.06 0.00 0.00 -1.61 0.00 0.00 179.24 177.10 2c4k n ALA 180 N -2.58 2.57 -0.33 -0.78 0.00 0.47 -4.31 120.51 115.54 2c4k n ALA 180 Ca 0.23 -0.45 0.04 0.00 0.00 0.00 0.00 53.44 53.27 2c4k n ALA 180 Cb 0.95 -1.17 0.22 0.00 0.00 0.00 0.00 19.45 19.46 2c4k n ALA 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c4k h ALA 181 N 4.27 1.49 -0.02 0.00 0.00 -0.24 -2.39 119.26 122.37 2c4k h ALA 181 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2c4k h ALA 181 Cb 0.47 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2c4k h ALA 181 CO 0.00 0.35 -0.02 0.87 0.00 0.00 0.00 179.25 180.45 2c4k h LYS 182 N 1.07 0.05 -0.86 0.00 1.57 -1.77 -1.11 116.57 115.52 2c4k h LYS 182 Ca 0.42 -0.03 0.09 0.00 -1.87 0.00 0.00 60.65 59.26 2c4k h LYS 182 Cb 0.24 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.48 2c4k h LYS 182 CO -0.17 0.55 0.52 0.00 -0.57 0.00 0.00 179.45 179.78 2c4k h ARG 183 N -0.45 0.86 -0.39 3.15 3.08 -1.81 -1.80 114.38 117.02 2c4k h ARG 183 Ca 0.00 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 59.93 2c4k h ARG 183 Cb 0.55 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2c4k h ARG 183 CO 0.01 0.57 -0.02 0.00 -1.07 0.00 0.00 179.97 179.45 2c4k h ALA 184 N 1.45 0.53 -0.94 0.04 0.00 -1.45 -3.14 119.26 115.74 2c4k h ALA 184 Ca 0.40 -0.27 0.20 0.00 0.00 0.00 0.00 54.91 55.24 2c4k h ALA 184 Cb 0.31 -0.14 -0.11 0.00 0.00 0.00 0.00 17.79 17.84 2c4k h ALA 184 CO -0.22 0.33 0.50 0.37 0.00 0.00 0.00 179.25 180.23 2c4k h GLN 185 N 0.52 0.56 0.00 0.00 -0.00 -0.32 -0.98 115.11 114.89 2c4k h GLN 185 Ca 0.11 -0.03 -0.07 0.00 -0.00 0.00 0.00 58.65 58.65 2c4k h GLN 185 Cb 0.51 -0.13 -0.01 0.00 0.00 0.00 0.00 27.48 27.85 2c4k h GLN 185 CO 0.02 0.37 -0.33 1.03 0.00 0.00 0.00 178.83 179.92 2c4k h SER 186 N 0.58 0.00 0.11 -0.69 0.87 -1.44 -0.61 113.55 112.36 2c4k h SER 186 Ca 0.56 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.98 2c4k h SER 186 Cb 0.97 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.95 2c4k h SER 186 CO -0.44 0.33 -0.63 1.88 -0.53 0.00 0.00 176.83 177.44 2c4k h TYR 187 N 0.00 0.41 -0.19 2.24 -1.99 -1.28 -2.62 116.97 113.54 2c4k h TYR 187 Ca -0.00 -0.30 0.05 0.00 2.00 0.00 0.00 58.73 60.47 2c4k h TYR 187 Cb 0.61 -0.02 -0.05 0.00 2.00 0.00 0.00 36.73 39.27 2c4k h TYR 187 CO 0.00 1.24 -0.12 0.00 -0.00 0.00 0.00 178.16 179.28 2c4k h ALA 188 N 0.06 0.04 -0.70 3.88 0.00 -1.33 0.93 119.26 122.14 2c4k h ALA 188 Ca -0.11 0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.96 2c4k h ALA 188 Cb 1.49 0.27 -0.07 0.00 0.00 0.00 0.00 17.79 19.48 2c4k h ALA 188 CO 0.11 -0.55 0.36 1.49 0.00 0.00 0.00 179.25 180.67 2c4k h GLU 189 N -0.11 0.60 0.13 0.00 4.22 -1.20 -0.84 114.58 117.39 2c4k h GLU 189 Ca 0.11 -0.04 -0.29 0.00 0.08 0.00 0.00 59.36 59.22 2c4k h GLU 189 Cb 0.27 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2c4k h GLU 189 CO -0.26 0.40 -1.36 0.00 -2.18 0.00 0.00 179.01 175.61 2c4k h ARG 190 N 0.62 0.28 -0.00 1.92 3.08 -1.09 -3.28 114.38 115.91 2c4k h ARG 190 Ca 0.34 -0.49 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2c4k h ARG 190 Cb 0.33 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.56 2c4k h ARG 190 CO -0.25 1.20 -0.24 1.28 -1.07 0.00 0.00 179.97 180.89 2c4k n LEU 191 N -3.52 0.48 -2.74 3.04 4.77 0.29 -4.96 117.00 114.36 2c4k n LEU 191 Ca -0.12 0.06 -0.19 0.00 -0.03 0.00 0.00 56.01 55.73 2c4k n LEU 191 Cb 1.04 -0.26 0.05 0.00 -2.33 0.00 0.00 43.42 41.92 2c4k n LEU 191 CO 0.53 0.10 0.09 0.54 -1.33 0.00 0.00 177.39 177.32 2c4k n ARG 192 N -1.19 -5.16 -4.28 3.23 1.74 -0.39 -5.03 116.66 105.59 2c4k n ARG 192 Ca 0.10 0.71 -0.25 0.00 -0.77 0.00 0.00 57.85 57.64 2c4k n ARG 192 Cb 0.32 -5.26 -0.08 0.00 -1.02 0.00 0.00 32.46 26.42 2c4k n ARG 192 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2c4k s LEU 193 N -5.81 3.04 1.13 0.55 1.43 -0.78 -5.05 118.68 113.19 2c4k s LEU 193 Ca 0.35 -1.12 -0.14 0.00 -1.03 0.00 0.00 54.13 52.19 2c4k s LEU 193 Cb -0.16 -1.31 0.26 0.00 0.03 0.00 0.00 46.19 45.01 2c4k s LEU 193 CO 0.44 -0.46 1.05 -0.83 0.23 0.00 0.00 176.35 176.78 2c4k s GLY 194 N -3.82 1.54 -0.12 -3.19 0.00 -1.26 -4.65 107.32 95.82 2c4k s GLY 194 Ca 0.38 -0.39 -0.06 0.00 0.00 0.00 0.00 44.72 44.66 2c4k s GLY 194 CO 0.21 0.34 0.27 -2.27 0.00 0.00 0.00 173.10 171.64 2c4k s LEU 195 N -6.95 0.28 0.32 0.66 2.96 -1.26 -2.45 118.68 112.24 2c4k s LEU 195 Ca 0.67 0.57 0.05 0.00 -0.22 0.00 0.00 54.13 55.21 2c4k s LEU 195 Cb -0.20 0.80 -0.06 0.00 0.50 0.00 0.00 46.19 47.23 2c4k s LEU 195 CO 0.60 -0.18 0.00 0.00 -1.32 0.00 0.00 176.35 175.46 2c4k s ALA 196 N 1.40 2.47 -0.05 5.97 0.00 -0.57 -4.86 121.76 126.13 2c4k s ALA 196 Ca -0.08 -2.03 -0.06 0.00 0.00 0.00 0.00 51.96 49.78 2c4k s ALA 196 Cb -0.10 0.39 0.01 0.00 0.00 0.00 0.00 23.12 23.43 2c4k s ALA 196 CO -0.09 -0.18 0.16 0.54 0.00 0.00 0.00 175.76 176.19 2c4k s VAL 197 N -3.09 0.01 0.10 0.00 0.11 -0.50 -1.68 120.40 115.34 2c4k s VAL 197 Ca 0.33 -0.10 0.02 0.00 -2.93 0.00 0.00 61.98 59.31 2c4k s VAL 197 Cb 0.07 -0.27 -0.04 0.00 -1.53 0.00 0.00 36.38 34.61 2c4k s VAL 197 CO 0.14 -0.05 0.16 -0.63 -3.33 0.00 0.00 175.10 171.39 2c4k s ILE 198 N -0.12 4.93 -0.30 7.04 1.01 0.85 -0.48 121.20 134.13 2c4k s ILE 198 Ca -0.02 -0.67 -0.16 0.00 0.00 0.00 0.00 60.65 59.80 2c4k s ILE 198 Cb -0.02 -3.43 0.17 0.00 0.01 0.00 0.00 42.46 39.19 2c4k s ILE 198 CO 0.00 0.06 1.05 -1.38 0.00 0.00 0.00 174.94 174.68 2c4k s HIS 199 N -1.53 -0.53 0.00 3.97 -3.43 0.19 -3.89 115.29 110.07 2c4k s HIS 199 Ca 0.32 0.95 0.00 0.00 -0.80 0.00 0.00 55.06 55.53 2c4k s HIS 199 Cb -0.12 0.32 0.00 0.00 -1.43 0.00 0.00 32.58 31.35 2c4k s HIS 199 CO 0.25 -0.26 0.00 -0.35 -2.00 0.00 0.00 174.74 172.38 2c4k n PRO 239 N 4.56 0.00 0.00 -0.38 -0.04 -1.26 -2.96 135.00 134.92 2c4k n PRO 239 Ca -0.11 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.37 2c4k n PRO 239 Cb 0.54 0.00 0.13 0.00 -0.04 0.00 0.00 33.50 34.13 2c4k n PRO 239 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2c4k n PRO 240 N -0.40 0.10 -1.45 0.54 -0.02 -1.26 -4.94 135.00 127.57 2c4k n PRO 240 Ca 0.00 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 2c4k n PRO 240 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2c4k n PRO 240 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 2c4k n ILE 241 N -1.17 -0.51 -3.92 4.25 0.13 -1.15 -5.02 119.36 111.98 2c4k n ILE 241 Ca 0.03 0.02 -0.11 0.00 -1.10 0.00 0.00 62.75 61.59 2c4k n ILE 241 Cb 0.03 -1.17 -0.12 0.00 -0.84 0.00 0.00 39.64 37.53 2c4k n ILE 241 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 2c4k s THR 242 N -0.05 0.06 0.19 9.51 -4.23 -1.24 -4.97 115.64 114.91 2c4k s THR 242 Ca 0.00 -0.46 -0.20 0.00 -1.18 0.00 0.00 61.69 59.85 2c4k s THR 242 Cb 0.00 -0.17 -0.08 0.00 1.34 0.00 0.00 72.50 73.59 2c4k s THR 242 CO 0.00 -0.25 0.70 0.68 -0.54 0.00 0.00 174.62 175.20 2c4k s VAL 243 N -0.76 4.58 -0.30 2.29 -7.23 -1.26 -0.64 120.40 117.09 2c4k s VAL 243 Ca -0.08 1.30 -0.00 0.00 -1.81 0.00 0.00 61.98 61.38 2c4k s VAL 243 Cb -0.05 -3.90 0.06 0.00 0.56 0.00 0.00 36.38 33.05 2c4k s VAL 243 CO -0.00 0.30 -0.01 -0.69 -0.31 0.00 0.00 175.10 174.38 2c4k s VAL 244 N -1.41 2.76 0.00 1.32 1.01 0.36 -4.98 120.40 119.47 2c4k s VAL 244 Ca 0.40 -1.54 0.00 0.00 0.00 0.00 0.00 61.98 60.83 2c4k s VAL 244 Cb -0.18 -2.64 0.00 0.00 0.00 0.00 0.00 36.38 33.56 2c4k s VAL 244 CO 0.21 -0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.77 2c4k n GLY 245 N 4.55 4.01 3.69 4.51 0.00 -1.26 -1.41 105.19 119.29 2c4k n GLY 245 Ca -0.12 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 43.92 2c4k n GLY 245 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2c4k s ASP 246 N 0.00 6.87 0.00 1.61 1.11 -1.26 -4.87 116.67 120.14 2c4k s ASP 246 Ca 0.00 2.12 0.00 0.00 0.18 0.00 0.00 52.55 54.85 2c4k s ASP 246 Cb 0.00 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.43 2c4k s ASP 246 CO 0.00 -0.69 0.00 0.55 1.18 0.00 0.00 175.17 176.21 2c4k n VAL 247 N 4.52 0.00 -1.11 -1.27 3.14 -1.26 -4.88 118.33 117.47 2c4k n VAL 247 Ca 0.13 0.00 -0.35 0.00 -2.96 0.00 0.00 64.34 61.16 2c4k n VAL 247 Cb 0.44 -0.72 0.01 0.00 -1.06 0.00 0.00 33.84 32.50 2c4k n VAL 247 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2c4k n GLY 248 N 2.89 -2.89 2.69 7.55 0.00 -1.02 -2.67 105.19 111.74 2c4k n GLY 248 Ca 0.00 -0.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.70 2c4k n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c4k n GLY 249 N 2.25 1.43 3.08 -0.02 0.00 0.89 -4.94 105.19 107.88 2c4k n GLY 249 Ca 0.07 -0.03 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 2c4k n GLY 249 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c4k s ARG 250 N -3.24 0.59 -0.18 1.61 0.52 -1.09 -4.98 118.95 112.18 2c4k s ARG 250 Ca 0.00 -0.95 -0.29 0.00 -0.52 0.00 0.00 55.73 53.97 2c4k s ARG 250 Cb 0.00 -0.14 -0.01 0.00 0.52 0.00 0.00 34.95 35.31 2c4k s ARG 250 CO 0.00 -0.00 1.28 -1.50 0.02 0.00 0.00 175.30 175.10 2c4k s ILE 251 N -2.32 4.25 0.19 1.52 2.07 -1.25 -2.79 121.20 122.87 2c4k s ILE 251 Ca -0.03 1.49 -0.28 0.00 -1.41 0.00 0.00 60.65 60.42 2c4k s ILE 251 Cb -0.04 -4.00 -0.08 0.00 0.13 0.00 0.00 42.46 38.47 2c4k s ILE 251 CO -0.02 -0.17 0.89 0.00 -1.91 0.00 0.00 174.94 173.72 2c4k s ALA 252 N 3.63 3.36 -0.22 1.50 0.00 0.30 -1.02 121.76 129.31 2c4k s ALA 252 Ca 0.55 0.53 -0.00 0.00 0.00 0.00 0.00 51.96 53.04 2c4k s ALA 252 Cb -0.21 -3.14 0.06 0.00 0.00 0.00 0.00 23.12 19.82 2c4k s ALA 252 CO 0.16 0.20 -0.03 0.42 0.00 0.00 0.00 175.76 176.50 2c4k s ILE 253 N -0.97 1.26 0.05 0.00 1.01 -0.49 -1.42 121.20 120.64 2c4k s ILE 253 Ca 0.40 -1.01 -0.23 0.00 0.00 0.00 0.00 60.65 59.81 2c4k s ILE 253 Cb -0.25 -1.57 -0.06 0.00 0.01 0.00 0.00 42.46 40.59 2c4k s ILE 253 CO 0.30 -0.10 0.70 -0.63 0.00 0.00 0.00 174.94 175.20 2c4k s ILE 254 N 1.52 4.74 -0.04 2.92 1.01 0.18 0.12 121.20 131.64 2c4k s ILE 254 Ca -0.04 1.49 0.06 0.00 0.00 0.00 0.00 60.65 62.15 2c4k s ILE 254 Cb -0.18 -4.04 -0.01 0.00 0.01 0.00 0.00 42.46 38.24 2c4k s ILE 254 CO -0.07 0.42 -0.22 -0.69 0.00 0.00 0.00 174.94 174.38 2c4k s VAL 255 N -0.34 1.78 0.28 2.92 1.01 -0.26 -0.40 120.40 125.39 2c4k s VAL 255 Ca 0.35 -0.92 -0.21 0.00 0.00 0.00 0.00 61.98 61.20 2c4k s VAL 255 Cb -0.20 -1.50 0.02 0.00 0.00 0.00 0.00 36.38 34.70 2c4k s VAL 255 CO 0.21 0.50 0.72 -0.62 0.00 0.00 0.00 175.10 175.92 2c4k s ASP 256 N -0.20 -0.25 -0.08 3.32 -1.08 -0.74 -4.49 116.67 113.15 2c4k s ASP 256 Ca -0.00 -0.63 -0.14 0.00 -0.52 0.00 0.00 52.55 51.26 2c4k s ASP 256 Cb -0.12 0.73 -0.29 0.00 -1.46 0.00 0.00 42.92 41.79 2c4k s ASP 256 CO 0.02 -1.36 0.60 -2.24 0.52 0.00 0.00 175.17 172.71 2c4k h ASP 257 N 2.00 0.48 -4.31 -0.34 2.03 -1.95 -3.31 116.42 111.02 2c4k h ASP 257 Ca -0.20 -0.89 -0.50 0.00 -0.73 0.00 0.00 57.03 54.71 2c4k h ASP 257 Cb 1.25 -0.16 -0.24 0.00 -0.83 0.00 0.00 39.33 39.35 2c4k h ASP 257 CO 0.24 1.69 -0.81 -0.63 -1.03 0.00 0.00 179.24 178.70 2c4k s ILE 258 N -2.52 1.37 -0.46 4.15 1.01 -1.26 -0.47 121.20 123.02 2c4k s ILE 258 Ca -0.18 -1.19 0.03 0.00 0.00 0.00 0.00 60.65 59.31 2c4k s ILE 258 Cb 0.05 -1.23 0.13 0.00 0.01 0.00 0.00 42.46 41.41 2c4k s ILE 258 CO 0.80 0.02 0.22 -0.63 0.00 0.00 0.00 174.94 175.35 2c4k s ILE 259 N -0.94 2.10 0.00 2.92 1.01 -0.55 -4.97 121.20 120.78 2c4k s ILE 259 Ca 0.04 -2.86 0.00 0.00 0.00 0.00 0.00 60.65 57.82 2c4k s ILE 259 Cb -0.09 -2.48 0.00 0.00 0.01 0.00 0.00 42.46 39.90 2c4k s ILE 259 CO 0.02 -0.79 0.00 -0.67 0.00 0.00 0.00 174.94 173.50 2c4k n ASP 260 N 3.48 0.00 -4.40 3.58 2.03 -1.26 0.30 116.55 120.28 2c4k n ASP 260 Ca 0.05 0.00 -0.44 0.00 0.52 0.00 0.00 54.79 54.93 2c4k n ASP 260 Cb 0.35 -0.04 -0.08 0.00 -0.72 0.00 0.00 41.12 40.63 2c4k n ASP 260 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2c4k s ASP 261 N -1.23 6.15 0.48 1.67 -1.08 -1.26 -2.31 116.67 119.09 2c4k s ASP 261 Ca 0.00 -1.23 0.32 0.00 -0.52 0.00 0.00 52.55 51.12 2c4k s ASP 261 Cb 0.00 -2.19 1.71 0.00 -1.46 0.00 0.00 42.92 40.98 2c4k s ASP 261 CO 0.00 -0.65 1.98 1.62 0.52 0.00 0.00 175.17 178.64 2c4k h VAL 262 N 5.75 0.00 -0.88 1.11 3.04 -1.90 -3.37 116.25 120.00 2c4k h VAL 262 Ca -0.28 -0.04 0.14 0.00 -1.01 0.00 0.00 66.70 65.51 2c4k h VAL 262 Cb 1.11 0.77 -0.15 0.00 -2.01 0.00 0.00 31.29 31.02 2c4k h VAL 262 CO 0.87 0.00 -0.39 -0.08 -1.01 0.00 0.00 177.57 176.97 2c4k h GLU 263 N 0.00 -0.05 0.00 4.17 4.22 -1.97 0.74 114.58 121.70 2c4k h GLU 263 Ca 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.41 2c4k h GLU 263 Cb 0.04 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 2c4k h GLU 263 CO 0.00 -0.03 -0.16 0.66 -2.18 0.00 0.00 179.01 177.29 2c4k h SER 264 N -0.05 0.00 -0.04 1.04 4.64 -2.00 -2.37 113.55 114.77 2c4k h SER 264 Ca 0.31 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.52 2c4k h SER 264 Cb 0.58 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.66 2c4k h SER 264 CO -0.90 0.16 -0.31 -0.26 -0.87 0.00 0.00 176.83 174.65 2c4k h PHE 265 N 0.00 0.58 0.43 4.77 0.04 -1.14 -2.16 116.94 119.46 2c4k h PHE 265 Ca -0.00 -0.14 -0.02 0.00 2.80 0.00 0.00 57.97 60.61 2c4k h PHE 265 Cb 0.90 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.92 2c4k h PHE 265 CO 0.00 0.76 -0.21 0.28 -0.60 0.00 0.00 178.31 178.54 2c4k h VAL 266 N 0.43 0.02 -1.00 -0.55 2.07 -1.17 -2.77 116.25 113.29 2c4k h VAL 266 Ca 0.05 -0.58 0.29 0.00 0.82 0.00 0.00 66.70 67.28 2c4k h VAL 266 Cb 0.76 0.04 -0.14 0.00 -1.52 0.00 0.00 31.29 30.42 2c4k h VAL 266 CO 0.06 0.01 0.56 0.00 0.02 0.00 0.00 177.57 178.22 2c4k h ALA 267 N -1.13 1.87 -1.00 1.67 0.00 -1.48 0.85 119.26 120.03 2c4k h ALA 267 Ca -0.06 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.04 2c4k h ALA 267 Cb 0.45 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 2c4k h ALA 267 CO 0.10 -0.46 0.66 0.00 0.00 0.00 0.00 179.25 179.54 2c4k h ALA 268 N 1.81 1.29 -0.04 0.00 0.00 -1.47 -2.59 119.26 118.26 2c4k h ALA 268 Ca 0.70 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 55.34 2c4k h ALA 268 Cb 1.49 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 2c4k h ALA 268 CO -0.56 0.61 -0.85 0.00 0.00 0.00 0.00 179.25 178.44 2c4k h ALA 269 N 1.38 0.45 -0.03 0.00 0.00 0.97 -1.18 119.26 120.86 2c4k h ALA 269 Ca 0.38 -0.67 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2c4k h ALA 269 Cb -0.09 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 2c4k h ALA 269 CO -0.10 0.79 -0.02 0.93 0.00 0.00 0.00 179.25 180.85 2c4k h GLU 270 N 0.26 0.06 -0.71 0.00 4.39 -1.25 -1.28 114.58 116.05 2c4k h GLU 270 Ca -0.06 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.57 2c4k h GLU 270 Cb 1.47 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 30.09 2c4k h GLU 270 CO 0.15 0.50 0.29 0.97 -1.16 0.00 0.00 179.01 179.76 2c4k h ILE 271 N -0.37 1.25 -0.01 3.13 6.09 -1.49 0.18 117.51 126.29 2c4k h ILE 271 Ca 0.01 -0.76 0.03 0.00 -1.37 0.00 0.00 64.86 62.77 2c4k h ILE 271 Cb 0.48 0.41 -0.04 0.00 0.47 0.00 0.00 36.82 38.14 2c4k h ILE 271 CO 0.01 0.31 -0.24 -0.07 -3.07 0.00 0.00 178.15 175.09 2c4k h LEU 272 N 1.02 -0.70 -0.42 2.19 3.38 -1.25 -2.07 115.31 117.46 2c4k h LEU 272 Ca 0.24 0.10 0.09 0.00 0.09 0.00 0.00 57.88 58.39 2c4k h LEU 272 Cb 0.20 0.29 -0.09 0.00 0.09 0.00 0.00 40.66 41.15 2c4k h LEU 272 CO -0.02 -0.30 -0.19 0.50 0.09 0.00 0.00 178.44 178.52 2c4k h LYS 273 N -0.37 -0.10 0.00 1.13 1.63 -0.74 -1.15 116.57 116.97 2c4k h LYS 273 Ca 0.06 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 2c4k h LYS 273 Cb 0.45 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.10 2c4k h LYS 273 CO -0.22 -0.07 0.00 -1.91 -3.45 0.00 0.00 179.45 173.80 2c4k n GLU 274 N -5.38 0.02 -0.40 1.90 2.13 0.58 -0.70 120.64 118.79 2c4k n GLU 274 Ca 0.03 0.37 0.08 0.00 0.66 0.00 0.00 57.16 58.29 2c4k n GLU 274 Cb 0.28 -1.50 0.24 0.00 0.27 0.00 0.00 31.44 30.74 2c4k n GLU 274 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2c4k n ARG 275 N -1.45 2.99 -1.71 5.31 5.12 -0.50 -4.96 116.66 121.46 2c4k n ARG 275 Ca 0.02 -2.68 0.00 0.00 -1.93 0.00 0.00 57.85 53.25 2c4k n ARG 275 Cb 0.06 -1.73 0.00 0.00 -1.16 0.00 0.00 32.46 29.63 2c4k n ARG 275 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2c4k n GLY 276 N -0.23 0.93 3.53 -0.13 0.00 0.12 -2.43 105.19 106.98 2c4k n GLY 276 Ca 0.19 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 2c4k n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4k s ALA 277 N -2.54 3.45 0.06 4.61 0.00 -0.83 -0.07 121.76 126.44 2c4k s ALA 277 Ca 0.00 -1.23 0.06 0.00 0.00 0.00 0.00 51.96 50.79 2c4k s ALA 277 Cb 0.00 -3.01 -0.23 0.00 0.00 0.00 0.00 23.12 19.88 2c4k s ALA 277 CO 0.00 -1.35 1.06 0.10 0.00 0.00 0.00 175.76 175.57 2c4k h TYR 278 N 8.58 0.09 -3.96 0.00 -0.00 -1.85 -3.38 116.97 116.45 2c4k h TYR 278 Ca -0.28 -0.07 -0.48 0.00 0.00 0.00 0.00 58.73 57.91 2c4k h TYR 278 Cb 1.12 -0.00 -0.30 0.00 0.00 0.00 0.00 36.73 37.55 2c4k h TYR 278 CO 0.68 1.07 -0.81 0.15 -0.00 0.00 0.00 178.16 179.26 2c4k s LYS 279 N -2.67 1.20 -0.20 0.10 -0.14 -1.26 -5.02 119.74 111.75 2c4k s LYS 279 Ca -0.02 -0.44 0.01 0.00 -1.36 0.00 0.00 55.97 54.16 2c4k s LYS 279 Cb 0.09 -1.11 0.03 0.00 -1.68 0.00 0.00 37.83 35.16 2c4k s LYS 279 CO 0.83 0.21 -0.17 0.42 -0.76 0.00 0.00 175.35 175.88 2c4k s ILE 280 N -0.02 2.17 -0.15 2.17 -1.09 -1.26 0.11 121.20 123.14 2c4k s ILE 280 Ca -0.00 -1.08 -0.02 0.00 -2.23 0.00 0.00 60.65 57.32 2c4k s ILE 280 Cb -0.08 -2.01 -0.02 0.00 -1.58 0.00 0.00 42.46 38.78 2c4k s ILE 280 CO 0.01 0.39 -0.09 -0.31 -1.23 0.00 0.00 174.94 173.70 2c4k s TYR 281 N 1.26 2.89 -0.27 3.97 1.51 -0.50 -1.28 117.35 124.93 2c4k s TYR 281 Ca 0.02 -0.56 -0.09 0.00 -1.01 0.00 0.00 57.07 55.43 2c4k s TYR 281 Cb -0.15 -1.90 -0.04 0.00 -0.11 0.00 0.00 41.96 39.76 2c4k s TYR 281 CO -0.10 -0.18 0.13 0.08 -1.11 0.00 0.00 175.55 174.36 2c4k s VAL 282 N 0.45 4.79 -0.09 0.71 1.01 -0.50 0.48 120.40 127.24 2c4k s VAL 282 Ca -0.07 -0.02 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 2c4k s VAL 282 Cb -0.15 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 2c4k s VAL 282 CO 0.04 0.29 0.01 -0.04 0.00 0.00 0.00 175.10 175.40 2c4k s MET 283 N 1.68 3.06 0.19 2.72 -1.94 0.47 -0.46 119.30 125.02 2c4k s MET 283 Ca 0.07 -0.39 -0.22 0.00 -1.71 0.00 0.00 55.69 53.43 2c4k s MET 283 Cb -0.16 -2.83 0.06 0.00 2.01 0.00 0.00 34.83 33.91 2c4k s MET 283 CO 0.07 0.68 0.62 0.00 -0.01 0.00 0.00 175.02 176.38 2c4k s ALA 284 N -0.82 -1.47 -0.15 3.03 0.00 -0.77 -1.79 121.76 119.79 2c4k s ALA 284 Ca 0.13 0.26 -0.17 0.00 0.00 0.00 0.00 51.96 52.17 2c4k s ALA 284 Cb -0.11 0.87 -0.14 0.00 0.00 0.00 0.00 23.12 23.74 2c4k s ALA 284 CO 0.02 -0.83 0.27 1.15 0.00 0.00 0.00 175.76 176.37 2c4k h THR 285 N 2.02 0.83 -3.43 0.00 2.02 -0.99 -3.30 112.91 110.06 2c4k h THR 285 Ca -0.30 -1.78 -0.72 0.00 0.77 0.00 0.00 66.41 64.38 2c4k h THR 285 Cb 1.29 1.73 -0.26 0.00 -1.74 0.00 0.00 68.15 69.17 2c4k h THR 285 CO 0.35 0.28 -0.44 -1.00 0.37 0.00 0.00 175.52 175.08 2c4k s HIS 286 N -2.14 3.30 -1.05 3.16 3.76 0.38 -2.67 115.29 120.03 2c4k s HIS 286 Ca -0.18 -1.29 -0.07 0.00 -0.15 0.00 0.00 55.06 53.37 2c4k s HIS 286 Cb 0.01 -2.94 0.26 0.00 1.11 0.00 0.00 32.58 31.02 2c4k s HIS 286 CO 0.44 -0.81 1.01 0.20 -0.85 0.00 0.00 174.74 174.73 2c4k s GLY 287 N 2.17 3.18 -0.06 -2.22 0.00 -1.26 -1.48 107.32 107.65 2c4k s GLY 287 Ca 0.03 -3.83 -0.09 0.00 0.00 0.00 0.00 44.72 40.83 2c4k s GLY 287 CO 0.04 1.29 0.63 0.16 0.00 0.00 0.00 173.10 175.22 2c4k h ILE 288 N 3.81 0.90 -6.14 0.90 3.07 -1.80 -3.45 117.51 114.80 2c4k h ILE 288 Ca 0.17 -2.51 -0.42 0.00 1.55 0.00 0.00 64.86 63.65 2c4k h ILE 288 Cb 0.86 2.71 0.06 0.00 -0.27 0.00 0.00 36.82 40.19 2c4k h ILE 288 CO 0.96 0.86 -0.88 0.18 -1.05 0.00 0.00 178.15 178.22 2c4k n LEU 289 N -3.55 -3.11 -4.79 0.16 4.77 0.15 -4.89 117.00 105.73 2c4k n LEU 289 Ca -0.25 -0.91 -0.34 0.00 -0.03 0.00 0.00 56.01 54.48 2c4k n LEU 289 Cb 1.07 -2.55 -0.01 0.00 -2.33 0.00 0.00 43.42 39.60 2c4k n LEU 289 CO 0.50 0.40 0.73 -0.94 -1.33 0.00 0.00 177.39 176.75 2c4k s SER 290 N -3.97 6.00 0.65 -1.43 1.04 -0.98 -4.52 113.70 110.50 2c4k s SER 290 Ca 0.21 1.96 0.00 0.00 0.48 0.00 0.00 55.95 58.59 2c4k s SER 290 Cb -0.06 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.50 2c4k s SER 290 CO 0.83 -1.02 0.00 0.00 0.98 0.00 0.00 173.24 174.04 2c4k n ALA 291 N -1.38 0.00 -0.21 5.32 0.00 -1.26 -3.31 120.51 119.67 2c4k n ALA 291 Ca 0.10 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.42 2c4k n ALA 291 Cb 0.52 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.03 2c4k n ALA 291 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2c4k n GLU 292 N 12.88 1.58 -0.17 0.00 0.00 -1.26 -4.51 120.64 129.16 2c4k n GLU 292 Ca 0.00 -1.29 -0.08 0.00 0.00 0.00 0.00 57.16 55.79 2c4k n GLU 292 Cb 0.00 -1.51 0.02 0.00 0.00 0.00 0.00 31.44 29.95 2c4k n GLU 292 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2c4k h ALA 293 N 1.53 0.65 -0.24 -1.84 0.00 -1.78 -2.40 119.26 115.17 2c4k h ALA 293 Ca 0.26 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2c4k h ALA 293 Cb 1.52 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 2c4k h ALA 293 CO 0.52 0.17 -0.08 -1.35 0.00 0.00 0.00 179.25 178.52 2c4k h PRO 294 N 0.67 0.39 0.29 0.00 0.11 -1.83 -1.72 132.00 129.91 2c4k h PRO 294 Ca 0.18 -0.09 -0.01 0.00 0.11 0.00 0.00 66.00 66.18 2c4k h PRO 294 Cb 0.06 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.12 2c4k h PRO 294 CO -0.03 0.48 -0.14 -0.09 -0.21 0.00 0.00 178.00 178.01 2c4k h ARG 295 N 0.37 -0.38 -0.55 1.05 2.43 -1.87 -2.98 114.38 112.45 2c4k h ARG 295 Ca 0.08 0.03 0.13 0.00 -0.81 0.00 0.00 59.98 59.40 2c4k h ARG 295 Cb 0.37 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.98 2c4k h ARG 295 CO 0.02 -0.10 0.38 -0.07 -1.51 0.00 0.00 179.97 178.68 2c4k h LEU 296 N -0.64 0.17 -0.23 3.80 3.38 -1.08 -1.29 115.31 119.43 2c4k h LEU 296 Ca -0.04 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 2c4k h LEU 296 Cb 0.45 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2c4k h LEU 296 CO 0.07 0.10 -0.14 0.40 0.09 0.00 0.00 178.44 178.95 2c4k h ILE 297 N 0.19 1.31 0.29 1.22 2.04 -1.30 -1.55 117.51 119.72 2c4k h ILE 297 Ca 0.26 -1.24 0.00 0.00 1.00 0.00 0.00 64.86 64.88 2c4k h ILE 297 Cb 0.77 1.62 -0.04 0.00 -0.74 0.00 0.00 36.82 38.43 2c4k h ILE 297 CO -0.04 0.38 -0.52 -0.33 0.00 0.00 0.00 178.15 177.64 2c4k h GLU 298 N 0.21 -0.84 -0.05 2.37 4.39 -1.11 -2.88 114.58 116.68 2c4k h GLU 298 Ca 0.05 0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.82 2c4k h GLU 298 Cb 0.65 0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 29.49 2c4k h GLU 298 CO 0.04 -0.56 0.06 0.93 -1.16 0.00 0.00 179.01 178.32 2c4k h GLU 299 N -0.87 0.00 -7.32 2.33 4.39 -1.35 -3.43 114.58 108.32 2c4k h GLU 299 Ca -0.03 0.00 -0.46 0.00 0.34 0.00 0.00 59.36 59.21 2c4k h GLU 299 Cb 0.82 0.00 0.08 0.00 -0.10 0.00 0.00 28.75 29.55 2c4k h GLU 299 CO -0.19 0.00 0.24 -1.54 -1.16 0.00 0.00 179.01 176.36 2c4k s SER 300 N -5.91 4.79 0.00 1.42 1.04 -0.59 -5.01 113.70 109.45 2c4k s SER 300 Ca -0.05 0.48 0.28 0.00 0.48 0.00 0.00 55.95 57.14 2c4k s SER 300 Cb 0.15 -1.12 1.04 0.00 0.10 0.00 0.00 66.02 66.19 2c4k s SER 300 CO 0.53 -1.62 1.74 -1.54 0.98 0.00 0.00 173.24 173.32 2c4k n SER 301 N -2.95 1.50 -4.70 7.02 3.41 -1.26 -4.86 113.62 111.78 2c4k n SER 301 Ca 0.08 -1.51 -0.42 0.00 -0.26 0.00 0.00 58.87 56.76 2c4k n SER 301 Cb 0.60 -0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.52 2c4k n SER 301 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2c4k s VAL 302 N -1.99 2.55 -0.00 -3.33 0.11 -1.26 -4.68 120.40 111.80 2c4k s VAL 302 Ca 0.38 0.18 -0.12 0.00 -2.93 0.00 0.00 61.98 59.49 2c4k s VAL 302 Cb 0.21 -3.12 -0.33 0.00 -1.53 0.00 0.00 36.38 31.61 2c4k s VAL 302 CO 0.33 0.00 0.86 0.44 -3.33 0.00 0.00 175.10 173.41 2c4k h ASP 303 N 7.97 0.70 -4.04 3.54 3.45 -1.52 -3.47 116.42 123.05 2c4k h ASP 303 Ca -0.44 -0.87 -0.15 0.00 0.43 0.00 0.00 57.03 56.00 2c4k h ASP 303 Cb 1.21 -0.23 -0.25 0.00 -0.56 0.00 0.00 39.33 39.51 2c4k h ASP 303 CO 0.94 1.70 -0.40 -0.70 -1.57 0.00 0.00 179.24 179.21 2c4k s GLU 304 N -2.60 0.36 -0.15 3.56 2.12 -1.12 -4.87 118.70 115.99 2c4k s GLU 304 Ca -0.12 0.25 0.02 0.00 0.36 0.00 0.00 54.97 55.48 2c4k s GLU 304 Cb 0.05 0.17 0.02 0.00 0.26 0.00 0.00 34.13 34.62 2c4k s GLU 304 CO 0.90 -0.06 -0.20 0.08 -0.54 0.00 0.00 175.26 175.45 2c4k s VAL 305 N -0.13 1.95 -0.21 3.70 1.01 -0.36 -1.42 120.40 124.94 2c4k s VAL 305 Ca -0.03 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.05 2c4k s VAL 305 Cb -0.03 -1.75 0.01 0.00 0.00 0.00 0.00 36.38 34.61 2c4k s VAL 305 CO 0.01 0.53 -0.10 -0.69 0.00 0.00 0.00 175.10 174.85 2c4k s VAL 306 N 1.09 2.85 0.33 2.92 1.01 0.39 -0.63 120.40 128.36 2c4k s VAL 306 Ca -0.01 -0.75 0.04 0.00 0.00 0.00 0.00 61.98 61.26 2c4k s VAL 306 Cb -0.14 -2.30 -0.06 0.00 0.00 0.00 0.00 36.38 33.87 2c4k s VAL 306 CO -0.07 0.41 0.07 0.68 0.00 0.00 0.00 175.10 176.19 2c4k s VAL 307 N 1.39 1.09 0.24 2.92 -7.23 -0.89 -1.85 120.40 116.07 2c4k s VAL 307 Ca 0.04 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.25 2c4k s VAL 307 Cb -0.14 -2.74 -0.03 0.00 0.56 0.00 0.00 36.38 34.03 2c4k s VAL 307 CO -0.07 0.00 0.37 0.42 -0.31 0.00 0.00 175.10 175.52 2c4k s THR 308 N -3.32 5.25 -0.12 5.32 -4.23 -1.09 0.15 115.64 117.59 2c4k s THR 308 Ca 0.35 -0.88 0.00 0.00 -1.18 0.00 0.00 61.69 59.99 2c4k s THR 308 Cb 0.08 -3.84 0.00 0.00 1.34 0.00 0.00 72.50 70.08 2c4k s THR 308 CO 0.15 -0.32 0.83 -0.46 -0.54 0.00 0.00 174.62 174.28 2c4k n ASN 309 N -1.33 2.44 -0.28 3.99 6.94 -0.78 -4.06 115.26 122.18 2c4k n ASN 309 Ca -0.08 -1.78 -0.04 0.00 -0.02 0.00 0.00 54.58 52.66 2c4k n ASN 309 Cb 0.56 -0.44 0.07 0.00 -2.36 0.00 0.00 39.78 37.61 2c4k n ASN 309 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2c4k h THR 310 N 0.10 1.20 -3.86 5.53 1.03 -1.87 -3.42 112.91 111.62 2c4k h THR 310 Ca 0.00 -0.37 -0.69 0.00 -0.01 0.00 0.00 66.41 65.34 2c4k h THR 310 Cb 0.83 0.07 -0.22 0.00 -1.07 0.00 0.00 68.15 67.77 2c4k h THR 310 CO 0.00 0.20 -0.87 0.68 -0.01 0.00 0.00 175.52 175.52 2c4k s VAL 311 N -6.12 2.28 0.28 0.00 -7.23 -1.26 -4.30 120.40 104.06 2c4k s VAL 311 Ca -0.13 -1.77 -0.30 0.00 -1.81 0.00 0.00 61.98 57.97 2c4k s VAL 311 Cb 0.15 -2.01 -0.10 0.00 0.56 0.00 0.00 36.38 34.97 2c4k s VAL 311 CO 0.78 0.08 1.47 -2.84 -0.31 0.00 0.00 175.10 174.28 2c4k s PRO 312 N -2.10 4.22 -0.02 4.82 0.02 -1.26 -4.80 135.00 135.88 2c4k s PRO 312 Ca 0.14 2.39 0.02 0.00 0.02 0.00 0.00 61.00 63.58 2c4k s PRO 312 Cb -0.10 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 31.31 2c4k s PRO 312 CO 0.06 -0.46 0.02 0.72 -0.33 0.00 0.00 177.00 177.01 2c4k n HIS 313 N 2.01 0.00 -0.32 6.54 8.25 -1.26 -4.93 115.22 125.50 2c4k n HIS 313 Ca 0.06 0.00 0.31 0.00 -0.26 0.00 0.00 57.72 57.83 2c4k n HIS 313 Cb 0.40 -0.11 0.57 0.00 1.12 0.00 0.00 29.99 31.96 2c4k n HIS 313 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 2c4k h GLU 314 N 0.00 0.04 -0.25 -0.41 4.39 -1.98 0.96 114.58 117.33 2c4k h GLU 314 Ca -0.05 -0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.52 2c4k h GLU 314 Cb 0.87 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 2c4k h GLU 314 CO 0.00 0.03 -0.38 0.28 -1.16 0.00 0.00 179.01 177.78 2c4k h VAL 315 N 0.04 1.29 0.00 3.13 2.07 -2.00 -2.56 116.25 118.23 2c4k h VAL 315 Ca 0.83 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 66.82 2c4k h VAL 315 Cb 2.15 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 33.43 2c4k h VAL 315 CO -0.75 0.48 -0.61 1.56 0.02 0.00 0.00 177.57 178.27 2c4k h GLN 316 N 0.47 0.00 -0.00 1.57 4.20 0.56 -2.52 115.11 119.40 2c4k h GLN 316 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2c4k h GLN 316 Cb 0.87 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.65 2c4k h GLN 316 CO 0.07 0.00 -0.70 0.36 -0.67 0.00 0.00 178.83 177.90 2c4k n LYS 317 N -2.15 0.30 0.00 1.46 2.85 -1.13 -2.81 118.16 116.68 2c4k n LYS 317 Ca 0.03 -0.22 -0.17 0.00 -1.05 0.00 0.00 58.31 56.90 2c4k n LYS 317 Cb 0.44 -1.50 -0.11 0.00 -0.65 0.00 0.00 35.03 33.21 2c4k n LYS 317 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 2c4k h LEU 318 N 0.55 0.46 -0.45 -5.58 4.07 -1.31 -3.28 115.31 109.77 2c4k h LEU 318 Ca 0.00 -0.79 0.08 0.00 0.08 0.00 0.00 57.88 57.25 2c4k h LEU 318 Cb 0.54 -0.14 -0.06 0.00 1.08 0.00 0.00 40.66 42.08 2c4k h LEU 318 CO 0.00 1.19 0.07 1.56 -1.08 0.00 0.00 178.44 180.18 2c4k h GLN 319 N -0.21 0.19 -3.81 1.13 7.50 -1.53 -3.39 115.11 114.99 2c4k h GLN 319 Ca -0.07 -0.01 -0.59 0.00 0.50 0.00 0.00 58.65 58.47 2c4k h GLN 319 Cb 1.29 -0.04 -0.40 0.00 0.05 0.00 0.00 27.48 28.38 2c4k h GLN 319 CO 0.11 0.13 -0.75 0.00 -1.50 0.00 0.00 178.83 176.81 2c4k n PRO 321 N 4.75 0.36 0.29 0.00 -0.04 -1.24 -2.18 135.00 136.95 2c4k n PRO 321 Ca -0.03 0.05 0.18 0.00 -0.04 0.00 0.00 63.50 63.67 2c4k n PRO 321 Cb 0.43 -1.50 0.99 0.00 -0.04 0.00 0.00 33.50 33.37 2c4k n PRO 321 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2c4k h LYS 322 N 0.00 0.00 -5.49 0.54 3.64 -1.89 -3.40 116.57 109.97 2c4k h LYS 322 Ca 0.00 0.00 -0.64 0.00 -1.27 0.00 0.00 60.65 58.74 2c4k h LYS 322 Cb 0.23 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 31.90 2c4k h LYS 322 CO 0.00 0.00 0.38 0.42 -2.27 0.00 0.00 179.45 177.98 2c4k s ILE 323 N -4.42 4.56 0.15 2.00 1.01 -0.93 -1.22 121.20 122.35 2c4k s ILE 323 Ca -0.05 -0.07 -0.09 0.00 0.00 0.00 0.00 60.65 60.45 2c4k s ILE 323 Cb 0.14 -4.47 -0.06 0.00 0.01 0.00 0.00 42.46 38.08 2c4k s ILE 323 CO 0.47 -1.04 0.46 -0.75 0.00 0.00 0.00 174.94 174.09 2c4k s LYS 324 N 3.48 3.76 -0.06 2.79 2.47 0.20 -4.94 119.74 127.42 2c4k s LYS 324 Ca 0.24 0.17 0.03 0.00 -1.56 0.00 0.00 55.97 54.84 2c4k s LYS 324 Cb -0.15 -2.83 0.01 0.00 -1.46 0.00 0.00 37.83 33.39 2c4k s LYS 324 CO 0.16 0.45 -0.14 -0.08 0.16 0.00 0.00 175.35 175.89 2c4k s THR 325 N -1.62 1.25 -0.19 3.43 -1.32 -1.26 -2.09 115.64 113.85 2c4k s THR 325 Ca 0.40 -0.57 -0.09 0.00 -1.21 0.00 0.00 61.69 60.23 2c4k s THR 325 Cb -0.13 -1.12 -0.05 0.00 -1.51 0.00 0.00 72.50 69.70 2c4k s THR 325 CO 0.21 0.38 0.12 0.68 -2.21 0.00 0.00 174.62 173.79 2c4k s VAL 326 N 0.48 5.29 0.17 5.08 -7.23 0.39 -4.93 120.40 119.64 2c4k s VAL 326 Ca -0.12 0.15 -0.30 0.00 -1.81 0.00 0.00 61.98 59.89 2c4k s VAL 326 Cb -0.15 -3.40 -0.07 0.00 0.56 0.00 0.00 36.38 33.32 2c4k s VAL 326 CO 0.04 0.46 1.13 -0.62 -0.31 0.00 0.00 175.10 175.80 2c4k s ASP 327 N 0.21 7.21 0.00 4.85 2.15 -1.26 -1.86 116.67 127.97 2c4k s ASP 327 Ca 0.08 2.11 0.00 0.00 0.43 0.00 0.00 52.55 55.17 2c4k s ASP 327 Cb -0.11 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.90 2c4k s ASP 327 CO -0.01 -0.28 0.08 0.00 -0.17 0.00 0.00 175.17 174.79 2c4k n ILE 328 N 2.54 0.00 0.30 4.11 0.13 -1.26 -4.76 119.36 120.42 2c4k n ILE 328 Ca 0.04 -0.35 0.13 0.00 -1.10 0.00 0.00 62.75 61.47 2c4k n ILE 328 Cb 0.46 1.07 0.71 0.00 -0.84 0.00 0.00 39.64 41.04 2c4k n ILE 328 CO 0.00 0.00 0.00 0.77 2.80 0.00 0.00 176.55 180.12 2c4k h SER 329 N 0.00 0.00 -0.03 9.51 4.64 -1.92 -1.77 113.55 123.97 2c4k h SER 329 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2c4k h SER 329 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2c4k h SER 329 CO 0.00 0.00 -0.13 0.25 -0.87 0.00 0.00 176.83 176.08 2c4k h LEU 330 N 0.00 0.17 -1.15 5.97 6.46 -1.96 0.43 115.31 125.23 2c4k h LEU 330 Ca 0.00 -0.64 0.06 0.00 -0.12 0.00 0.00 57.88 57.17 2c4k h LEU 330 Cb 0.66 -0.05 -0.06 0.00 -0.73 0.00 0.00 40.66 40.48 2c4k h LEU 330 CO 0.00 0.78 0.58 -0.29 -0.62 0.00 0.00 178.44 178.90 2c4k h ILE 331 N -0.43 1.09 -0.01 4.05 2.10 -1.69 -0.38 117.51 122.24 2c4k h ILE 331 Ca -0.01 -0.36 -0.03 0.00 1.08 0.00 0.00 64.86 65.55 2c4k h ILE 331 Cb 0.77 -0.05 0.00 0.00 -1.09 0.00 0.00 36.82 36.46 2c4k h ILE 331 CO 0.03 0.19 -0.10 -0.07 -1.08 0.00 0.00 178.15 177.12 2c4k h LEU 332 N 1.05 0.11 -0.87 2.19 3.38 -1.52 -1.10 115.31 118.54 2c4k h LEU 332 Ca 0.38 -0.70 0.13 0.00 0.09 0.00 0.00 57.88 57.77 2c4k h LEU 332 Cb 0.14 -0.03 -0.14 0.00 0.09 0.00 0.00 40.66 40.72 2c4k h LEU 332 CO -0.13 0.79 -0.42 -1.28 0.09 0.00 0.00 178.44 177.49 2c4k h SER 333 N -0.56 -1.51 0.68 -0.43 0.87 0.13 -1.19 113.55 111.53 2c4k h SER 333 Ca -0.01 0.29 -0.03 0.00 -1.23 0.00 0.00 61.79 60.82 2c4k h SER 333 Cb 0.80 0.75 -0.01 0.00 -0.44 0.00 0.00 62.40 63.50 2c4k h SER 333 CO 0.02 -0.29 -0.44 -0.33 -0.53 0.00 0.00 176.83 175.26 2c4k h GLU 334 N -0.06 -1.02 -0.77 2.24 4.39 -1.02 -1.48 114.58 116.85 2c4k h GLU 334 Ca 0.28 0.07 0.15 0.00 0.34 0.00 0.00 59.36 60.20 2c4k h GLU 334 Cb 0.56 0.23 -0.10 0.00 -0.10 0.00 0.00 28.75 29.35 2c4k h GLU 334 CO -0.89 -0.68 0.31 0.00 -1.16 0.00 0.00 179.01 176.59 2c4k h ALA 335 N -0.87 1.10 -0.61 3.43 0.00 -0.75 0.32 119.26 121.89 2c4k h ALA 335 Ca -0.09 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2c4k h ALA 335 Cb 0.87 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 2c4k h ALA 335 CO 0.07 -0.22 0.37 0.82 0.00 0.00 0.00 179.25 180.29 2c4k h ILE 336 N 0.45 1.18 -0.98 0.00 2.04 -1.19 -2.92 117.51 116.08 2c4k h ILE 336 Ca 0.43 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.90 2c4k h ILE 336 Cb 0.66 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 37.04 2c4k h ILE 336 CO -0.42 0.18 0.63 -0.09 0.00 0.00 0.00 178.15 178.46 2c4k h ARG 337 N 0.82 1.31 0.46 2.37 2.43 0.65 -3.02 114.38 119.40 2c4k h ARG 337 Ca 0.22 -0.09 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 2c4k h ARG 337 Cb -0.02 -0.29 0.00 0.00 -0.42 0.00 0.00 29.97 29.25 2c4k h ARG 337 CO -0.04 0.88 -0.22 0.00 -1.51 0.00 0.00 179.97 179.08 2c4k h ARG 338 N 1.34 -0.60 0.00 0.20 2.47 -0.81 -2.77 114.38 114.20 2c4k h ARG 338 Ca 0.36 0.04 -0.04 0.00 -1.26 0.00 0.00 59.98 59.08 2c4k h ARG 338 Cb -0.12 0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.33 2c4k h ARG 338 CO -0.07 -0.30 -0.20 -0.84 0.56 0.00 0.00 179.97 179.12 2c4k h ILE 339 N -0.99 0.96 0.68 2.04 3.07 -1.58 0.38 117.51 122.06 2c4k h ILE 339 Ca -0.06 -0.72 -0.03 0.00 1.55 0.00 0.00 64.86 65.59 2c4k h ILE 339 Cb 0.58 1.41 0.01 0.00 -0.27 0.00 0.00 36.82 38.55 2c4k h ILE 339 CO 0.10 0.19 -0.33 -0.74 -1.05 0.00 0.00 178.15 176.33 2c4k h HIS 340 N 0.00 -0.85 0.00 0.16 2.76 -1.55 -3.04 115.15 112.64 2c4k h HIS 340 Ca -0.00 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.15 2c4k h HIS 340 Cb 0.40 0.28 0.00 0.00 1.55 0.00 0.00 27.41 29.63 2c4k h HIS 340 CO 0.00 -0.53 0.00 0.09 -1.30 0.00 0.00 177.93 176.19 2c4k n ASN 341 N -4.72 0.00 0.00 3.26 3.02 -1.05 -4.84 115.26 110.93 2c4k n ASN 341 Ca -0.11 0.37 0.00 0.00 -0.03 0.00 0.00 54.58 54.81 2c4k n ASN 341 Cb 0.36 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.10 2c4k n ASN 341 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c4k n GLY 342 N -0.40 0.45 3.81 7.41 0.00 0.15 -5.05 105.19 111.55 2c4k n GLY 342 Ca 0.03 -0.97 -0.30 0.00 0.00 0.00 0.00 46.02 44.79 2c4k n GLY 342 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c4k s GLU 343 N -2.31 0.29 0.00 1.61 0.41 0.11 -4.96 118.70 113.86 2c4k s GLU 343 Ca 0.00 -0.16 -0.15 0.00 -0.41 0.00 0.00 54.97 54.25 2c4k s GLU 343 Cb 0.00 -1.78 -0.06 0.00 -1.78 0.00 0.00 34.13 30.51 2c4k s GLU 343 CO 0.00 -2.69 0.43 0.45 -0.49 0.00 0.00 175.26 172.96 2c4k s SER 344 N -4.44 6.83 -0.51 -0.19 0.15 -1.26 -4.56 113.70 109.72 2c4k s SER 344 Ca 0.70 0.99 0.02 0.00 0.70 0.00 0.00 55.95 58.37 2c4k s SER 344 Cb -0.08 -2.26 0.55 0.00 -1.71 0.00 0.00 66.02 62.52 2c4k s SER 344 CO 0.54 0.31 1.87 0.23 1.20 0.00 0.00 173.24 177.38 2c4k n MET 345 N 1.89 2.45 0.03 5.44 2.81 -1.26 -4.57 117.12 123.92 2c4k n MET 345 Ca -0.13 -3.21 -0.04 0.00 -1.81 0.00 0.00 57.70 52.51 2c4k n MET 345 Cb 0.52 -2.19 0.18 0.00 -0.71 0.00 0.00 33.22 31.02 2c4k n MET 345 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2c4k h ALA 346 N 1.46 1.02 -0.56 3.04 0.00 -1.94 -3.11 119.26 119.18 2c4k h ALA 346 Ca 0.57 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2c4k h ALA 346 Cb 1.86 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 19.51 2c4k h ALA 346 CO 1.20 0.59 0.22 1.88 0.00 0.00 0.00 179.25 183.15 2c4k h TYR 347 N 0.38 0.81 0.00 0.00 -1.99 -1.80 0.60 116.97 114.96 2c4k h TYR 347 Ca 0.04 -0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2c4k h TYR 347 Cb 0.78 -0.25 0.00 0.00 2.00 0.00 0.00 36.73 39.26 2c4k h TYR 347 CO 0.02 0.63 -0.08 -0.07 -0.00 0.00 0.00 178.16 178.66 2c4k h LEU 348 N 0.80 0.00 0.00 3.88 -0.00 -1.90 -3.40 115.31 114.69 2c4k h LEU 348 Ca 0.19 -0.02 0.00 0.00 -0.00 0.00 0.00 57.88 58.05 2c4k h LEU 348 Cb 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.82 2c4k h LEU 348 CO -0.02 0.01 0.00 0.49 -0.00 0.00 0.00 178.44 178.92 2c4k n PHE 349 N -2.33 0.00 1.71 1.13 3.72 -1.09 -4.55 117.46 116.06 2c4k n PHE 349 Ca 0.05 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.60 2c4k n PHE 349 Cb 0.44 0.00 0.71 0.00 -0.94 0.00 0.00 39.48 39.69 2c4k n PHE 349 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60