#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k99 h MET 12 N 0.00 0.77 -2.70 0.54 2.86 -2.11 -3.47 114.93 110.82 3k99 h MET 12 Ca 0.00 -0.10 0.09 0.00 -2.06 0.00 0.00 59.70 57.63 3k99 h MET 12 Cb 0.00 -0.14 -0.09 0.00 0.06 0.00 0.00 31.60 31.43 3k99 h MET 12 CO 0.00 0.62 0.34 -1.83 1.06 0.00 0.00 176.91 177.10 3k99 s GLU 13 N -5.76 1.37 -0.28 1.72 -1.05 -1.26 -5.17 118.70 108.28 3k99 s GLU 13 Ca -0.13 -0.69 -0.18 0.00 -0.15 0.00 0.00 54.97 53.82 3k99 s GLU 13 Cb 0.12 0.51 0.08 0.00 -0.44 0.00 0.00 34.13 34.40 3k99 s GLU 13 CO 0.77 -0.62 0.72 -1.83 0.95 0.00 0.00 175.26 175.24 3k99 s GLU 14 N -3.58 0.72 0.05 -4.83 -1.05 -1.26 -5.17 118.70 103.58 3k99 s GLU 14 Ca 0.09 1.13 -0.01 0.00 -0.15 0.00 0.00 54.97 56.03 3k99 s GLU 14 Cb -0.03 0.20 -0.04 0.00 -0.44 0.00 0.00 34.13 33.83 3k99 s GLU 14 CO -0.01 -0.13 -0.03 -1.83 0.95 0.00 0.00 175.26 174.21 3k99 s GLU 15 N 1.29 0.62 0.39 -4.83 1.03 -1.26 -5.13 118.70 110.80 3k99 s GLU 15 Ca -0.07 -1.23 -0.26 0.00 0.03 0.00 0.00 54.97 53.45 3k99 s GLU 15 Cb -0.05 0.21 -0.09 0.00 -0.80 0.00 0.00 34.13 33.41 3k99 s GLU 15 CO -0.14 -0.11 1.15 -2.00 -1.33 0.00 0.00 175.26 172.83 3k99 s GLU 16 N -3.92 4.13 -0.11 -4.83 2.56 -1.26 -5.04 118.70 110.23 3k99 s GLU 16 Ca 0.08 1.81 0.01 0.00 0.00 0.00 0.00 54.97 56.86 3k99 s GLU 16 Cb 0.08 -2.72 0.02 0.00 2.00 0.00 0.00 34.13 33.51 3k99 s GLU 16 CO -0.10 -0.25 -0.10 0.08 -0.56 0.00 0.00 175.26 174.33 3k99 s VAL 17 N -1.41 1.17 -0.14 3.70 1.01 -1.26 -4.40 120.40 119.07 3k99 s VAL 17 Ca 0.56 -0.41 -0.05 0.00 0.00 0.00 0.00 61.98 62.07 3k99 s VAL 17 Cb -0.30 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 3k99 s VAL 17 CO 0.38 0.38 0.03 -1.61 0.00 0.00 0.00 175.10 174.28 3k99 s GLU 18 N 1.36 3.55 -0.18 2.72 2.02 -0.10 -4.96 118.70 123.11 3k99 s GLU 18 Ca -0.01 -0.38 -0.04 0.00 0.02 0.00 0.00 54.97 54.57 3k99 s GLU 18 Cb -0.14 -3.02 -0.02 0.00 0.10 0.00 0.00 34.13 31.06 3k99 s GLU 18 CO -0.05 0.46 -0.04 0.99 0.02 0.00 0.00 175.26 176.64 3k99 s THR 19 N -0.17 3.69 0.04 3.63 2.01 -1.26 -0.43 115.64 123.14 3k99 s THR 19 Ca 0.06 -0.41 0.07 0.00 0.31 0.00 0.00 61.69 61.72 3k99 s THR 19 Cb -0.12 -2.64 -0.03 0.00 0.01 0.00 0.00 72.50 69.71 3k99 s THR 19 CO 0.02 0.46 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.86 3k99 s PHE 20 N 0.85 2.54 0.10 4.92 0.08 0.14 -4.97 117.98 121.64 3k99 s PHE 20 Ca -0.01 -0.27 -0.22 0.00 0.12 0.00 0.00 56.93 56.55 3k99 s PHE 20 Cb -0.15 -1.45 -0.07 0.00 -0.57 0.00 0.00 43.02 40.78 3k99 s PHE 20 CO 0.02 0.25 0.67 0.00 -0.10 0.00 0.00 175.22 176.05 3k99 s ALA 21 N -0.92 3.51 0.59 5.36 0.00 -1.26 -0.68 121.76 128.36 3k99 s ALA 21 Ca 0.14 0.18 -0.18 0.00 0.00 0.00 0.00 51.96 52.10 3k99 s ALA 21 Cb -0.10 -2.80 -0.03 0.00 0.00 0.00 0.00 23.12 20.18 3k99 s ALA 21 CO 0.05 0.31 1.18 -0.06 0.00 0.00 0.00 175.76 177.24 3k99 s PHE 22 N -0.96 2.46 0.41 0.00 0.08 -0.73 -4.62 117.98 114.60 3k99 s PHE 22 Ca 0.32 1.53 -0.27 0.00 0.12 0.00 0.00 56.93 58.64 3k99 s PHE 22 Cb -0.21 -3.41 -0.09 0.00 -0.57 0.00 0.00 43.02 38.74 3k99 s PHE 22 CO 0.22 -2.03 1.42 -1.14 -0.10 0.00 0.00 175.22 173.58 3k99 s GLN 23 N -3.42 3.94 0.25 0.44 -0.44 0.78 -4.69 119.66 116.52 3k99 s GLN 23 Ca 0.75 2.41 -0.09 0.00 -2.50 0.00 0.00 55.36 55.94 3k99 s GLN 23 Cb -0.28 -2.82 0.41 0.00 -1.64 0.00 0.00 33.01 28.68 3k99 s GLN 23 CO 0.33 -0.61 1.60 0.00 0.50 0.00 0.00 175.29 177.11 3k99 h ALA 24 N 2.72 0.66 -0.33 1.58 0.00 -1.92 0.67 119.26 122.64 3k99 h ALA 24 Ca -0.50 0.30 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 3k99 h ALA 24 Cb 1.25 0.57 -0.00 0.00 0.00 0.00 0.00 17.79 19.60 3k99 h ALA 24 CO 0.63 -0.43 -0.47 0.93 0.00 0.00 0.00 179.25 179.92 3k99 h GLU 25 N 0.03 0.90 -1.00 0.00 3.07 -1.98 -0.97 114.58 114.62 3k99 h GLU 25 Ca 0.42 -0.52 0.04 0.00 -0.50 0.00 0.00 59.36 58.80 3k99 h GLU 25 Cb 0.69 0.04 -0.06 0.00 -0.84 0.00 0.00 28.75 28.58 3k99 h GLU 25 CO -0.81 1.17 0.66 0.82 -1.40 0.00 0.00 179.01 179.45 3k99 h ILE 26 N 0.71 1.16 -0.61 3.13 2.04 -1.41 0.33 117.51 122.87 3k99 h ILE 26 Ca 0.04 -0.43 -0.02 0.00 1.00 0.00 0.00 64.86 65.45 3k99 h ILE 26 Cb 1.07 -0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 3k99 h ILE 26 CO 0.11 0.23 0.30 0.00 0.00 0.00 0.00 178.15 178.79 3k99 h ALA 27 N 1.42 0.78 -0.27 1.87 0.00 -0.62 -0.40 119.26 122.03 3k99 h ALA 27 Ca 0.40 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3k99 h ALA 27 Cb 0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3k99 h ALA 27 CO -0.13 0.33 0.18 1.96 0.00 0.00 0.00 179.25 181.58 3k99 h GLN 28 N 0.83 0.35 -0.29 0.00 4.20 -0.01 -1.95 115.11 118.24 3k99 h GLN 28 Ca 0.21 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.92 3k99 h GLN 28 Cb 0.10 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.77 3k99 h GLN 28 CO -0.03 0.23 0.11 1.25 -0.67 0.00 0.00 178.83 179.73 3k99 h LEU 29 N 0.36 0.14 -0.32 1.46 5.85 -0.02 -0.78 115.31 122.01 3k99 h LEU 29 Ca 0.10 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3k99 h LEU 29 Cb -0.04 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 3k99 h LEU 29 CO -0.02 0.12 0.17 0.24 -0.34 0.00 0.00 178.44 178.61 3k99 h MET 30 N 0.25 0.44 -0.90 1.25 2.86 -0.95 0.68 114.93 118.56 3k99 h MET 30 Ca 0.12 -0.05 0.05 0.00 -2.06 0.00 0.00 59.70 57.76 3k99 h MET 30 Cb 0.07 -0.09 -0.06 0.00 0.06 0.00 0.00 31.60 31.59 3k99 h MET 30 CO -0.11 0.38 0.59 1.03 1.06 0.00 0.00 176.91 179.85 3k99 h SER 31 N 0.39 0.93 -0.51 1.22 0.87 -1.12 0.43 113.55 115.77 3k99 h SER 31 Ca 0.11 -0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.61 3k99 h SER 31 Cb 0.07 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.80 3k99 h SER 31 CO -0.02 0.62 0.08 0.25 -0.53 0.00 0.00 176.83 177.23 3k99 h LEU 32 N 1.07 0.81 -0.46 2.23 5.85 -0.08 -1.51 115.31 123.22 3k99 h LEU 32 Ca 0.37 -0.26 -0.17 0.00 0.84 0.00 0.00 57.88 58.65 3k99 h LEU 32 Cb 0.11 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 3k99 h LEU 32 CO -0.13 0.87 -0.70 0.40 -0.34 0.00 0.00 178.44 178.54 3k99 h ILE 33 N 0.72 1.39 -0.01 4.05 2.04 -0.11 -2.32 117.51 123.27 3k99 h ILE 33 Ca 0.15 -2.12 -0.20 0.00 1.00 0.00 0.00 64.86 63.69 3k99 h ILE 33 Cb 0.41 2.09 -0.01 0.00 -0.74 0.00 0.00 36.82 38.58 3k99 h ILE 33 CO 0.01 0.63 -0.86 0.40 0.00 0.00 0.00 178.15 178.33 3k99 h ILE 34 N 0.24 1.45 -0.11 -0.67 1.08 -0.89 -3.37 117.51 115.25 3k99 h ILE 34 Ca -0.02 -2.48 0.00 0.00 -0.39 0.00 0.00 64.86 61.97 3k99 h ILE 34 Cb 1.26 2.39 0.00 0.00 -3.07 0.00 0.00 36.82 37.39 3k99 h ILE 34 CO 0.12 0.73 0.00 0.59 -0.69 0.00 0.00 178.15 178.90 3k99 n ASN 35 N -3.72 2.38 -4.59 1.72 3.02 -0.57 -4.91 115.26 108.59 3k99 n ASN 35 Ca -0.04 -1.67 -0.33 0.00 -0.03 0.00 0.00 54.58 52.51 3k99 n ASN 35 Cb 0.79 -0.06 -0.11 0.00 -0.61 0.00 0.00 39.78 39.79 3k99 n ASN 35 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3k99 s THR 36 N -1.13 3.66 -0.19 3.41 2.01 -0.88 -5.04 115.64 117.48 3k99 s THR 36 Ca 0.19 -0.68 -0.22 0.00 0.31 0.00 0.00 61.69 61.29 3k99 s THR 36 Cb 0.12 -2.56 -0.02 0.00 0.01 0.00 0.00 72.50 70.05 3k99 s THR 36 CO 0.18 0.46 0.67 0.12 -0.69 0.00 0.00 174.62 175.36 3k99 s PHE 37 N -0.94 3.38 0.09 4.92 2.19 -1.26 -4.89 117.98 121.47 3k99 s PHE 37 Ca 0.16 0.99 0.09 0.00 0.33 0.00 0.00 56.93 58.50 3k99 s PHE 37 Cb -0.11 -2.84 -0.03 0.00 -1.31 0.00 0.00 43.02 38.72 3k99 s PHE 37 CO 0.06 -0.19 -0.25 0.71 1.83 0.00 0.00 175.22 177.38 3k99 s TYR 38 N 1.98 2.14 -0.48 10.12 1.51 -1.26 -5.05 117.35 126.31 3k99 s TYR 38 Ca 0.30 -0.39 0.23 0.00 -1.01 0.00 0.00 57.07 56.20 3k99 s TYR 38 Cb -0.16 -1.21 0.05 0.00 -0.11 0.00 0.00 41.96 40.53 3k99 s TYR 38 CO 0.11 0.22 1.03 -1.13 -1.11 0.00 0.00 175.55 174.66 3k99 n SER 39 N 1.32 0.62 -2.72 2.29 3.41 -1.26 -4.29 113.62 112.99 3k99 n SER 39 Ca -0.18 -0.02 -0.37 0.00 -0.26 0.00 0.00 58.87 58.04 3k99 n SER 39 Cb 0.53 0.72 0.04 0.00 -0.26 0.00 0.00 64.21 65.24 3k99 n SER 39 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3k99 n ASN 40 N -2.17 7.15 0.25 4.04 5.15 -1.26 -4.74 115.26 123.68 3k99 n ASN 40 Ca 0.01 -3.81 0.12 0.00 -0.60 0.00 0.00 54.58 50.30 3k99 n ASN 40 Cb 0.47 -0.96 0.65 0.00 -0.53 0.00 0.00 39.78 39.42 3k99 n ASN 40 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 3k99 h LYS 41 N 2.73 0.00 0.00 1.20 1.57 -1.99 -3.10 116.57 116.98 3k99 h LYS 41 Ca 0.54 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.32 3k99 h LYS 41 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 3k99 h LYS 41 CO 1.38 0.15 0.21 1.05 -0.57 0.00 0.00 179.45 181.66 3k99 h GLU 42 N 0.00 0.00 0.00 3.15 4.11 -1.96 -1.28 114.58 118.60 3k99 h GLU 42 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3k99 h GLU 42 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3k99 h GLU 42 CO 0.02 0.00 0.00 0.44 0.07 0.00 0.00 179.01 179.54 3k99 n ILE 43 N -2.55 0.97 -0.35 -1.06 -6.64 -1.17 -2.60 119.36 105.96 3k99 n ILE 43 Ca -0.02 0.26 0.07 0.00 -1.77 0.00 0.00 62.75 61.29 3k99 n ILE 43 Cb 0.25 -1.08 0.24 0.00 -1.44 0.00 0.00 39.64 37.61 3k99 n ILE 43 CO 0.00 0.00 0.00 2.19 -1.77 0.00 0.00 176.55 176.97 3k99 h PHE 44 N 0.00 1.10 -0.29 4.28 -5.15 -1.50 -2.34 116.94 113.04 3k99 h PHE 44 Ca 0.00 0.03 -0.08 0.00 -0.20 0.00 0.00 57.97 57.72 3k99 h PHE 44 Cb 0.28 -0.35 -0.01 0.00 0.22 0.00 0.00 35.95 36.10 3k99 h PHE 44 CO 0.00 0.41 -0.15 1.25 -2.00 0.00 0.00 178.31 177.83 3k99 h LEU 45 N 0.94 0.64 -0.69 2.10 5.85 -1.76 -2.00 115.31 120.39 3k99 h LEU 45 Ca 0.50 -0.41 0.10 0.00 0.84 0.00 0.00 57.88 58.91 3k99 h LEU 45 Cb 0.53 -0.18 -0.08 0.00 0.37 0.00 0.00 40.66 41.30 3k99 h LEU 45 CO -0.28 0.91 0.31 -0.09 -0.34 0.00 0.00 178.44 178.95 3k99 h ARG 46 N 0.37 0.50 -0.29 1.25 2.43 -1.65 0.91 114.38 117.90 3k99 h ARG 46 Ca 0.06 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.13 3k99 h ARG 46 Cb 0.67 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 3k99 h ARG 46 CO 0.04 0.33 -0.16 0.93 -1.51 0.00 0.00 179.97 179.61 3k99 h GLU 47 N 0.51 0.51 -0.09 0.20 4.39 -1.05 0.19 114.58 119.24 3k99 h GLU 47 Ca 0.35 -0.16 -0.11 0.00 0.34 0.00 0.00 59.36 59.79 3k99 h GLU 47 Cb 0.43 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 3k99 h GLU 47 CO -0.31 0.65 -0.36 -0.07 -1.16 0.00 0.00 179.01 177.76 3k99 h LEU 48 N 0.47 0.47 -1.51 1.33 3.38 -0.64 -2.15 115.31 116.66 3k99 h LEU 48 Ca 0.08 -0.63 -0.03 0.00 0.09 0.00 0.00 57.88 57.39 3k99 h LEU 48 Cb 0.54 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3k99 h LEU 48 CO 0.03 1.02 0.01 0.40 0.09 0.00 0.00 178.44 180.00 3k99 h ILE 49 N -0.05 1.14 -0.29 1.22 2.04 -0.65 -1.41 117.51 119.51 3k99 h ILE 49 Ca -0.02 -0.52 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 3k99 h ILE 49 Cb 1.00 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 3k99 h ILE 49 CO 0.08 0.18 0.04 -1.28 0.00 0.00 0.00 178.15 177.16 3k99 h SER 50 N 0.32 0.47 -0.58 1.72 0.87 -0.52 -0.28 113.55 115.56 3k99 h SER 50 Ca 0.08 -0.27 -0.04 0.00 -1.23 0.00 0.00 61.79 60.32 3k99 h SER 50 Cb 0.20 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.01 3k99 h SER 50 CO 0.00 0.63 0.20 0.78 -0.53 0.00 0.00 176.83 177.91 3k99 h ASN 51 N 0.30 0.85 -0.15 6.23 2.35 -1.03 -0.96 115.58 123.17 3k99 h ASN 51 Ca 0.09 -0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 3k99 h ASN 51 Cb 0.36 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 3k99 h ASN 51 CO 0.01 0.80 0.07 0.28 -1.65 0.00 0.00 177.43 176.94 3k99 h SER 52 N 0.90 0.20 -0.85 5.81 0.02 -1.07 -1.05 113.55 117.50 3k99 h SER 52 Ca 0.20 -0.13 0.07 0.00 -0.84 0.00 0.00 61.79 61.10 3k99 h SER 52 Cb 0.24 -0.05 -0.07 0.00 0.14 0.00 0.00 62.40 62.66 3k99 h SER 52 CO -0.01 0.27 0.52 -1.28 -1.14 0.00 0.00 176.83 175.18 3k99 h SER 53 N 0.12 0.79 -0.61 3.07 0.87 -0.68 0.13 113.55 117.24 3k99 h SER 53 Ca 0.05 0.03 -0.08 0.00 -1.23 0.00 0.00 61.79 60.56 3k99 h SER 53 Cb 0.12 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 3k99 h SER 53 CO -0.01 0.48 0.08 0.44 -0.53 0.00 0.00 176.83 177.30 3k99 h ASP 54 N 0.91 0.98 -0.44 6.23 3.32 -0.98 0.57 116.42 127.00 3k99 h ASP 54 Ca 0.39 -0.27 -0.09 0.00 0.02 0.00 0.00 57.03 57.08 3k99 h ASP 54 Cb 0.25 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 3k99 h ASP 54 CO -0.20 1.00 -0.06 0.00 -1.72 0.00 0.00 179.24 178.26 3k99 h ALA 55 N 1.02 0.94 -0.42 3.45 0.00 -0.49 -2.72 119.26 121.04 3k99 h ALA 55 Ca 0.18 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.63 3k99 h ALA 55 Cb 0.45 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3k99 h ALA 55 CO 0.01 0.62 -0.32 -0.07 0.00 0.00 0.00 179.25 179.49 3k99 h LEU 56 N 0.81 1.00 -0.60 0.00 3.38 -0.38 -2.41 115.31 117.11 3k99 h LEU 56 Ca 0.14 -0.43 0.09 0.00 0.09 0.00 0.00 57.88 57.77 3k99 h LEU 56 Cb 0.57 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.97 3k99 h LEU 56 CO 0.03 1.23 0.24 0.44 0.09 0.00 0.00 178.44 180.47 3k99 h ASP 57 N 0.79 0.25 -0.30 -0.43 3.32 -0.82 -2.16 116.42 117.07 3k99 h ASP 57 Ca 0.08 0.07 -0.14 0.00 0.02 0.00 0.00 57.03 57.06 3k99 h ASP 57 Cb 0.91 0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.50 3k99 h ASP 57 CO 0.08 0.15 -0.35 0.50 -1.72 0.00 0.00 179.24 177.91 3k99 h LYS 58 N 0.43 0.77 -0.17 3.56 3.64 -1.24 0.26 116.57 123.82 3k99 h LYS 58 Ca 0.30 -0.43 -0.13 0.00 -1.27 0.00 0.00 60.65 59.12 3k99 h LYS 58 Cb 0.35 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 3k99 h LYS 58 CO -0.29 1.06 -0.47 0.97 -2.27 0.00 0.00 179.45 178.45 3k99 h ILE 59 N 0.54 1.32 -0.40 2.00 6.09 -1.50 -0.59 117.51 124.97 3k99 h ILE 59 Ca 0.04 -1.68 -0.05 0.00 -1.37 0.00 0.00 64.86 61.80 3k99 h ILE 59 Cb 0.94 1.70 -0.01 0.00 0.47 0.00 0.00 36.82 39.92 3k99 h ILE 59 CO 0.08 0.51 0.03 -0.09 -3.07 0.00 0.00 178.15 175.62 3k99 h ARG 60 N 0.35 0.68 -0.50 2.19 2.43 -1.12 -1.57 114.38 116.84 3k99 h ARG 60 Ca 0.02 -0.20 -0.01 0.00 -0.81 0.00 0.00 59.98 58.98 3k99 h ARG 60 Cb 0.96 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.41 3k99 h ARG 60 CO 0.08 0.75 0.27 -0.92 -1.51 0.00 0.00 179.97 178.64 3k99 h TYR 61 N 0.51 0.68 0.00 2.20 5.03 -0.29 -2.63 116.97 122.47 3k99 h TYR 61 Ca 0.12 -0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.38 3k99 h TYR 61 Cb 0.42 -0.22 -0.00 0.00 1.55 0.00 0.00 36.73 38.48 3k99 h TYR 61 CO 0.03 0.51 -0.12 0.93 -1.32 0.00 0.00 178.16 178.19 3k99 h GLU 62 N 0.66 0.00 0.00 1.82 5.08 -0.93 -2.60 114.58 118.61 3k99 h GLU 62 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3k99 h GLU 62 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3k99 h GLU 62 CO -0.03 0.12 -0.10 0.66 -1.00 0.00 0.00 179.01 178.66 3k99 h SER 63 N 0.00 0.00 -0.46 1.42 4.64 -0.91 -2.54 113.55 115.71 3k99 h SER 63 Ca -0.00 -0.03 0.01 0.00 -0.47 0.00 0.00 61.79 61.30 3k99 h SER 63 Cb 0.48 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.55 3k99 h SER 63 CO 0.02 0.02 0.31 -0.07 -0.87 0.00 0.00 176.83 176.23 3k99 h LEU 64 N 0.00 0.52 0.00 5.97 3.38 -1.38 -2.79 115.31 121.02 3k99 h LEU 64 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3k99 h LEU 64 Cb 0.77 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.39 3k99 h LEU 64 CO 0.00 0.37 -0.66 0.35 0.09 0.00 0.00 178.44 178.59 3k99 n THR 65 N -4.47 0.00 -3.38 0.22 -2.24 -1.21 -4.77 114.28 98.43 3k99 n THR 65 Ca 0.04 -0.23 -0.25 0.00 -2.27 0.00 0.00 64.05 61.34 3k99 n THR 65 Cb 0.06 0.92 -0.10 0.00 -2.10 0.00 0.00 70.33 69.11 3k99 n THR 65 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3k99 s ASP 66 N -2.25 1.85 0.54 3.42 2.15 -0.96 -4.99 116.67 116.43 3k99 s ASP 66 Ca 0.03 -2.36 0.25 0.00 0.43 0.00 0.00 52.55 50.90 3k99 s ASP 66 Cb 0.09 -0.11 1.43 0.00 -0.30 0.00 0.00 42.92 44.02 3k99 s ASP 66 CO 0.48 -0.24 2.03 -0.65 -0.17 0.00 0.00 175.17 176.62 3k99 h PRO 67 N 6.44 0.00 0.00 4.34 0.11 -1.78 -0.56 132.00 140.55 3k99 h PRO 67 Ca 0.13 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 3k99 h PRO 67 Cb 0.97 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.08 3k99 h PRO 67 CO 0.27 0.00 -0.04 0.66 -0.21 0.00 0.00 178.00 178.69 3k99 h SER 68 N 0.00 0.00 -0.35 -2.05 4.64 -1.94 -0.60 113.55 113.25 3k99 h SER 68 Ca 0.19 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.61 3k99 h SER 68 Cb 0.80 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.88 3k99 h SER 68 CO -0.00 0.04 0.38 0.11 -0.87 0.00 0.00 176.83 176.49 3k99 h LYS 69 N 0.00 0.00 -0.39 4.77 1.79 -1.45 0.18 116.57 121.47 3k99 h LYS 69 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3k99 h LYS 69 Cb 0.25 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.90 3k99 h LYS 69 CO 0.00 0.00 0.00 1.28 -1.08 0.00 0.00 179.45 179.65 3k99 n LEU 70 N -3.74 2.63 0.26 2.94 4.77 -0.23 -4.24 117.00 119.39 3k99 n LEU 70 Ca 0.06 -1.22 0.15 0.00 -0.03 0.00 0.00 56.01 54.97 3k99 n LEU 70 Cb 0.54 -0.26 0.86 0.00 -2.33 0.00 0.00 43.42 42.24 3k99 n LEU 70 CO 0.27 0.61 1.13 0.44 -1.33 0.00 0.00 177.39 178.52 3k99 h ASP 71 N 3.15 0.00 -0.23 -1.43 3.32 -1.09 0.27 116.42 120.41 3k99 h ASP 71 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3k99 h ASP 71 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.26 3k99 h ASP 71 CO 0.00 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 175.98 3k99 n SER 72 N -3.88 1.84 0.00 6.45 3.41 -1.26 -4.90 113.62 115.28 3k99 n SER 72 Ca -0.01 -2.12 0.00 0.00 -0.26 0.00 0.00 58.87 56.47 3k99 n SER 72 Cb 0.18 -0.32 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 3k99 n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k99 n GLY 73 N 0.63 3.83 0.09 5.00 0.00 0.93 -3.93 105.19 111.75 3k99 n GLY 73 Ca 0.09 -0.70 -0.13 0.00 0.00 0.00 0.00 46.02 45.28 3k99 n GLY 73 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k99 h LYS 74 N 0.00 0.13 -6.57 1.61 1.57 -1.90 -3.44 116.57 107.96 3k99 h LYS 74 Ca 0.00 -0.22 -0.53 0.00 -1.87 0.00 0.00 60.65 58.04 3k99 h LYS 74 Cb 0.00 0.08 0.04 0.00 0.08 0.00 0.00 32.23 32.43 3k99 h LYS 74 CO 0.00 0.92 0.86 -1.21 -0.57 0.00 0.00 179.45 179.45 3k99 s GLU 75 N -2.63 4.24 -0.32 3.15 2.02 -1.26 -4.99 118.70 118.91 3k99 s GLU 75 Ca -0.06 2.29 0.01 0.00 0.02 0.00 0.00 54.97 57.23 3k99 s GLU 75 Cb 0.08 -3.23 0.08 0.00 0.10 0.00 0.00 34.13 31.16 3k99 s GLU 75 CO 0.83 -0.59 0.03 -0.51 0.02 0.00 0.00 175.26 175.05 3k99 s LEU 76 N 1.33 4.33 0.34 1.80 1.43 -1.26 -4.76 118.68 121.88 3k99 s LEU 76 Ca 0.69 -1.72 -0.13 0.00 -1.03 0.00 0.00 54.13 51.94 3k99 s LEU 76 Cb -0.42 -1.67 0.03 0.00 0.03 0.00 0.00 46.19 44.16 3k99 s LEU 76 CO 0.31 -0.34 0.65 -1.38 0.23 0.00 0.00 176.35 175.82 3k99 s HIS 77 N 1.09 0.35 -0.08 0.29 -3.43 -1.26 -4.37 115.29 107.88 3k99 s HIS 77 Ca 0.01 -0.83 0.01 0.00 -0.80 0.00 0.00 55.06 53.46 3k99 s HIS 77 Cb -0.20 0.48 0.02 0.00 -1.43 0.00 0.00 32.58 31.45 3k99 s HIS 77 CO -0.05 -1.32 -0.10 0.42 -2.00 0.00 0.00 174.74 171.69 3k99 s ILE 78 N -3.01 1.04 -0.10 -5.38 1.01 -0.34 -2.79 121.20 111.64 3k99 s ILE 78 Ca 0.20 -0.39 0.00 0.00 0.00 0.00 0.00 60.65 60.46 3k99 s ILE 78 Cb -0.03 -0.99 -0.02 0.00 0.01 0.00 0.00 42.46 41.42 3k99 s ILE 78 CO 0.13 0.35 -0.09 0.20 0.00 0.00 0.00 174.94 175.52 3k99 s ASN 79 N 0.97 4.39 -0.17 3.58 0.01 0.15 -1.19 114.94 122.69 3k99 s ASN 79 Ca -0.09 -0.16 -0.01 0.00 -0.71 0.00 0.00 52.86 51.89 3k99 s ASN 79 Cb -0.15 -1.36 -0.01 0.00 0.41 0.00 0.00 41.25 40.15 3k99 s ASN 79 CO 0.00 0.27 -0.11 -0.76 -1.51 0.00 0.00 177.10 174.99 3k99 s LEU 80 N -0.24 2.70 -0.40 0.60 1.43 0.34 -0.37 118.68 122.73 3k99 s LEU 80 Ca 0.02 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.74 3k99 s LEU 80 Cb -0.13 -1.64 0.13 0.00 0.03 0.00 0.00 46.19 44.58 3k99 s LEU 80 CO 0.03 0.07 0.22 -0.63 0.23 0.00 0.00 176.35 176.26 3k99 s ILE 81 N 0.92 0.97 0.25 -0.59 1.01 0.61 -0.40 121.20 123.96 3k99 s ILE 81 Ca -0.02 -2.18 -0.30 0.00 0.00 0.00 0.00 60.65 58.15 3k99 s ILE 81 Cb -0.15 -1.69 -0.09 0.00 0.01 0.00 0.00 42.46 40.54 3k99 s ILE 81 CO -0.00 -0.90 1.00 -2.16 0.00 0.00 0.00 174.94 172.87 3k99 s PRO 82 N 0.70 4.78 -0.33 2.79 0.04 -1.24 -1.16 135.00 140.57 3k99 s PRO 82 Ca 0.17 1.60 -0.01 0.00 0.04 0.00 0.00 61.00 62.80 3k99 s PRO 82 Cb -0.23 -3.25 0.11 0.00 0.04 0.00 0.00 34.50 31.16 3k99 s PRO 82 CO -0.02 0.40 0.14 1.21 0.04 0.00 0.00 177.00 178.77 3k99 s ASN 83 N -1.02 3.78 0.40 6.66 3.84 0.64 -1.45 114.94 127.79 3k99 s ASN 83 Ca 0.42 -1.81 0.07 0.00 0.21 0.00 0.00 52.86 51.76 3k99 s ASN 83 Cb -0.28 -0.76 0.84 0.00 -0.55 0.00 0.00 41.25 40.50 3k99 s ASN 83 CO 0.35 -0.38 2.05 0.11 -2.79 0.00 0.00 177.10 176.43 3k99 h LYS 84 N 7.80 0.55 -0.29 0.43 1.57 -1.83 0.14 116.57 124.95 3k99 h LYS 84 Ca -0.10 -0.04 -0.15 0.00 -1.87 0.00 0.00 60.65 58.49 3k99 h LYS 84 Cb 0.99 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.17 3k99 h LYS 84 CO 0.45 0.37 -0.41 1.96 -0.57 0.00 0.00 179.45 181.25 3k99 h GLN 85 N 0.57 0.70 0.00 3.15 4.20 -1.95 -2.61 115.11 119.17 3k99 h GLN 85 Ca 0.15 -0.37 0.00 0.00 0.06 0.00 0.00 58.65 58.49 3k99 h GLN 85 Cb -0.05 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.75 3k99 h GLN 85 CO -0.03 0.98 -0.58 -0.25 -0.67 0.00 0.00 178.83 178.28 3k99 n ASP 86 N -4.03 0.66 -3.65 1.46 9.92 -1.08 -4.97 116.55 114.86 3k99 n ASP 86 Ca -0.02 0.09 -0.21 0.00 -0.53 0.00 0.00 54.79 54.13 3k99 n ASP 86 Cb 0.54 0.13 0.04 0.00 -0.64 0.00 0.00 41.12 41.19 3k99 n ASP 86 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 3k99 n ARG 87 N -2.02 -5.30 -4.71 -1.24 0.63 0.45 -4.90 116.66 99.58 3k99 n ARG 87 Ca 0.04 0.67 -0.25 0.00 -0.92 0.00 0.00 57.85 57.39 3k99 n ARG 87 Cb 0.42 -5.33 -0.15 0.00 0.45 0.00 0.00 32.46 27.86 3k99 n ARG 87 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3k99 s THR 88 N -3.60 1.52 -0.18 5.15 -4.23 -0.87 -1.97 115.64 111.46 3k99 s THR 88 Ca 0.02 -1.01 -0.02 0.00 -1.18 0.00 0.00 61.69 59.50 3k99 s THR 88 Cb -0.01 -1.30 -0.00 0.00 1.34 0.00 0.00 72.50 72.53 3k99 s THR 88 CO 0.79 0.27 -0.10 -0.22 -0.54 0.00 0.00 174.62 174.82 3k99 s LEU 89 N -0.87 2.68 -0.14 4.79 2.96 -0.63 -0.26 118.68 127.20 3k99 s LEU 89 Ca 0.07 -0.42 -0.01 0.00 -0.22 0.00 0.00 54.13 53.55 3k99 s LEU 89 Cb -0.08 -1.64 -0.02 0.00 0.50 0.00 0.00 46.19 44.95 3k99 s LEU 89 CO 0.01 0.05 -0.11 -0.89 -1.32 0.00 0.00 176.35 174.08 3k99 s THR 90 N 1.06 3.18 -0.24 3.68 2.01 -0.31 -0.96 115.64 124.04 3k99 s THR 90 Ca -0.00 -0.61 -0.06 0.00 0.31 0.00 0.00 61.69 61.33 3k99 s THR 90 Cb -0.15 -2.35 -0.01 0.00 0.01 0.00 0.00 72.50 70.00 3k99 s THR 90 CO -0.02 0.51 0.02 -0.63 -0.69 0.00 0.00 174.62 173.81 3k99 s ILE 91 N 0.48 3.80 -0.05 1.82 1.09 -0.41 -0.29 121.20 127.64 3k99 s ILE 91 Ca -0.08 -0.43 0.04 0.00 -1.10 0.00 0.00 60.65 59.08 3k99 s ILE 91 Cb -0.15 -2.80 -0.02 0.00 -1.06 0.00 0.00 42.46 38.43 3k99 s ILE 91 CO 0.04 0.32 -0.17 -0.69 -0.10 0.00 0.00 174.94 174.35 3k99 s VAL 92 N 1.53 2.84 0.09 2.92 1.01 0.49 -0.36 120.40 128.92 3k99 s VAL 92 Ca 0.05 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.24 3k99 s VAL 92 Cb -0.15 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 3k99 s VAL 92 CO 0.00 0.58 -0.05 1.51 0.00 0.00 0.00 175.10 177.14 3k99 s ASP 93 N -0.55 0.93 -0.46 3.32 1.47 -0.08 0.35 116.67 121.65 3k99 s ASP 93 Ca 0.07 -1.02 0.03 0.00 1.18 0.00 0.00 52.55 52.82 3k99 s ASP 93 Cb -0.11 0.13 0.49 0.00 -0.34 0.00 0.00 42.92 43.09 3k99 s ASP 93 CO 0.01 -0.52 1.67 0.35 0.68 0.00 0.00 175.17 177.37 3k99 n THR 94 N -0.01 3.06 -0.14 2.11 -2.24 -1.12 -2.01 114.28 113.93 3k99 n THR 94 Ca -0.12 -3.13 0.00 0.00 -2.27 0.00 0.00 64.05 58.52 3k99 n THR 94 Cb 0.61 -0.90 0.00 0.00 -2.10 0.00 0.00 70.33 67.94 3k99 n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k99 n GLY 95 N -0.93 -1.76 0.20 3.38 0.00 -1.26 -4.73 105.19 100.09 3k99 n GLY 95 Ca 0.51 -1.48 0.08 0.00 0.00 0.00 0.00 46.02 45.13 3k99 n GLY 95 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3k99 h ILE 96 N -0.55 0.66 0.00 -0.61 2.10 -1.77 -3.26 117.51 114.08 3k99 h ILE 96 Ca 0.00 -1.33 0.00 0.00 1.08 0.00 0.00 64.86 64.61 3k99 h ILE 96 Cb 0.00 1.88 0.00 0.00 -1.09 0.00 0.00 36.82 37.61 3k99 h ILE 96 CO 0.00 0.28 0.00 0.61 -1.08 0.00 0.00 178.15 177.96 3k99 n GLY 97 N 0.29 -2.38 3.03 8.18 0.00 -1.26 -4.37 105.19 108.69 3k99 n GLY 97 Ca 0.00 -1.57 -0.22 0.00 0.00 0.00 0.00 46.02 44.23 3k99 n GLY 97 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3k99 s MET 98 N -0.91 1.28 0.93 1.61 1.00 -1.26 -4.81 119.30 117.14 3k99 s MET 98 Ca 0.00 -0.39 -0.12 0.00 0.00 0.00 0.00 55.69 55.18 3k99 s MET 98 Cb 0.00 -1.14 0.15 0.00 0.00 0.00 0.00 34.83 33.84 3k99 s MET 98 CO 0.00 0.12 1.10 0.95 0.00 0.00 0.00 175.02 177.19 3k99 s THR 99 N 0.26 2.35 0.27 2.05 -4.23 -1.26 -4.00 115.64 111.08 3k99 s THR 99 Ca -0.05 0.11 -0.00 0.00 -1.18 0.00 0.00 61.69 60.57 3k99 s THR 99 Cb -0.11 -2.67 0.27 0.00 1.34 0.00 0.00 72.50 71.34 3k99 s THR 99 CO 0.01 -0.15 1.84 0.50 -0.54 0.00 0.00 174.62 176.28 3k99 h LYS 100 N -1.65 0.96 -0.25 3.99 3.64 -1.97 -1.41 116.57 119.88 3k99 h LYS 100 Ca -0.52 -0.06 -0.20 0.00 -1.27 0.00 0.00 60.65 58.61 3k99 h LYS 100 Cb 1.31 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 3k99 h LYS 100 CO 0.57 0.63 -0.61 0.00 -2.27 0.00 0.00 179.45 177.78 3k99 h ALA 101 N 1.51 0.41 -0.77 5.00 0.00 -1.99 -2.41 119.26 121.01 3k99 h ALA 101 Ca 0.47 -0.54 0.13 0.00 0.00 0.00 0.00 54.91 54.97 3k99 h ALA 101 Cb 0.42 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.07 3k99 h ALA 101 CO -0.25 0.67 0.36 -0.44 0.00 0.00 0.00 179.25 179.59 3k99 h ASP 102 N 0.63 0.41 -0.05 0.00 3.32 -1.77 0.34 116.42 119.30 3k99 h ASP 102 Ca -0.01 0.09 0.01 0.00 0.02 0.00 0.00 57.03 57.14 3k99 h ASP 102 Cb 1.23 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.80 3k99 h ASP 102 CO 0.13 0.19 0.01 -0.07 -1.72 0.00 0.00 179.24 177.78 3k99 h LEU 103 N 0.55 0.01 -0.20 1.55 3.38 -1.04 0.28 115.31 119.84 3k99 h LEU 103 Ca 0.41 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 58.26 3k99 h LEU 103 Cb 0.56 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3k99 h LEU 103 CO -0.35 0.02 -0.37 0.40 0.09 0.00 0.00 178.44 178.22 3k99 h ILE 104 N 0.04 1.33 -0.15 1.22 2.04 -0.93 -1.89 117.51 119.17 3k99 h ILE 104 Ca 0.02 -1.60 -0.03 0.00 1.00 0.00 0.00 64.86 64.25 3k99 h ILE 104 Cb 0.01 1.86 -0.00 0.00 -0.74 0.00 0.00 36.82 37.95 3k99 h ILE 104 CO -0.03 0.49 -0.03 0.78 0.00 0.00 0.00 178.15 179.36 3k99 h ASN 105 N 0.27 0.28 0.58 1.72 2.35 -0.30 -2.74 115.58 117.74 3k99 h ASN 105 Ca 0.01 -0.37 0.00 0.00 -0.55 0.00 0.00 56.30 55.39 3k99 h ASN 105 Cb 0.97 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.26 3k99 h ASN 105 CO 0.08 0.58 -1.15 0.59 -1.65 0.00 0.00 177.43 175.89 3k99 n ASN 106 N -4.70 0.60 -2.41 5.81 3.02 0.97 -2.72 115.26 115.82 3k99 n ASN 106 Ca -0.06 0.02 -0.28 0.00 -0.03 0.00 0.00 54.58 54.24 3k99 n ASN 106 Cb 0.26 0.83 0.01 0.00 -0.61 0.00 0.00 39.78 40.27 3k99 n ASN 106 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3k99 n LEU 107 N -2.26 5.09 0.00 3.41 4.77 -0.71 -4.93 117.00 122.38 3k99 n LEU 107 Ca 0.00 -5.05 0.00 0.00 -0.03 0.00 0.00 56.01 50.93 3k99 n LEU 107 Cb 0.50 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 3k99 n LEU 107 CO 0.41 2.15 0.00 0.61 -1.33 0.00 0.00 177.39 179.22 3k99 n GLY 108 N -0.55 2.79 0.13 -0.72 0.00 -1.25 -4.89 105.19 100.69 3k99 n GLY 108 Ca 0.42 -0.35 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 3k99 n GLY 108 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3k99 h THR 109 N 0.00 0.98 -3.48 2.61 1.35 -1.63 0.22 112.91 112.96 3k99 h THR 109 Ca 0.00 -2.41 -0.53 0.00 -0.55 0.00 0.00 66.41 62.92 3k99 h THR 109 Cb 0.00 2.70 -0.03 0.00 -1.73 0.00 0.00 68.15 69.09 3k99 h THR 109 CO 0.00 0.74 0.30 -0.63 -0.25 0.00 0.00 175.52 175.68 3k99 s ILE 110 N -2.50 4.68 0.25 6.82 -1.09 -1.10 -4.25 121.20 124.01 3k99 s ILE 110 Ca -0.20 1.93 -0.31 0.00 -2.23 0.00 0.00 60.65 59.85 3k99 s ILE 110 Cb 0.05 -4.26 -0.12 0.00 -1.58 0.00 0.00 42.46 36.55 3k99 s ILE 110 CO 0.78 0.28 1.65 0.00 -1.23 0.00 0.00 174.94 176.42 3k99 s ALA 111 N 0.31 3.84 -0.15 9.38 0.00 -1.26 -4.94 121.76 128.94 3k99 s ALA 111 Ca 0.46 1.57 -0.12 0.00 0.00 0.00 0.00 51.96 53.87 3k99 s ALA 111 Cb -0.22 -3.67 -0.05 0.00 0.00 0.00 0.00 23.12 19.19 3k99 s ALA 111 CO 0.27 -0.95 0.25 0.15 0.00 0.00 0.00 175.76 175.49 3k99 s LYS 112 N 0.34 4.12 0.63 0.00 3.01 -1.26 -4.99 119.74 121.58 3k99 s LYS 112 Ca 0.69 0.03 0.41 0.00 -1.01 0.00 0.00 55.97 56.09 3k99 s LYS 112 Cb -0.48 -3.38 2.10 0.00 -1.01 0.00 0.00 37.83 35.05 3k99 s LYS 112 CO 0.40 0.35 2.25 0.66 0.51 0.00 0.00 175.35 179.52 3k99 h SER 113 N 6.30 0.00 -0.01 2.83 4.64 -1.94 -2.50 113.55 122.86 3k99 h SER 113 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 3k99 h SER 113 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3k99 h SER 113 CO 0.72 0.00 -0.11 0.61 -0.87 0.00 0.00 176.83 177.18 3k99 n GLY 114 N -0.75 0.60 0.05 -0.77 0.00 -1.26 -4.49 105.19 98.58 3k99 n GLY 114 Ca -0.02 -0.64 -0.12 0.00 0.00 0.00 0.00 46.02 45.24 3k99 n GLY 114 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3k99 h THR 115 N 3.79 1.11 -0.40 2.61 2.02 -1.66 -1.41 112.91 118.96 3k99 h THR 115 Ca 0.00 -0.34 0.01 0.00 0.77 0.00 0.00 66.41 66.86 3k99 h THR 115 Cb 0.87 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 3k99 h THR 115 CO 0.00 0.09 0.24 0.11 0.37 0.00 0.00 175.52 176.33 3k99 h LYS 116 N -0.15 0.48 -0.41 6.66 1.57 -1.80 -0.96 116.57 121.96 3k99 h LYS 116 Ca -0.00 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 3k99 h LYS 116 Cb 0.15 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 3k99 h LYS 116 CO 0.00 0.32 0.01 0.00 -0.57 0.00 0.00 179.45 179.21 3k99 h ALA 117 N 1.17 1.26 -0.25 3.86 0.00 -1.79 -0.04 119.26 123.47 3k99 h ALA 117 Ca 0.15 -0.22 -0.19 0.00 0.00 0.00 0.00 54.91 54.65 3k99 h ALA 117 Cb -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.61 3k99 h ALA 117 CO -0.06 0.50 -0.58 0.35 0.00 0.00 0.00 179.25 179.45 3k99 h PHE 118 N 0.61 1.08 -0.38 0.00 3.57 -0.87 -1.42 116.94 119.53 3k99 h PHE 118 Ca 0.13 -0.41 -0.05 0.00 3.53 0.00 0.00 57.97 61.18 3k99 h PHE 118 Cb 0.37 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 3k99 h PHE 118 CO 0.02 1.23 0.03 0.52 -2.23 0.00 0.00 178.31 177.88 3k99 h MET 119 N 0.62 0.58 -0.34 1.11 2.86 -0.67 -1.22 114.93 117.86 3k99 h MET 119 Ca -0.00 -0.12 -0.13 0.00 -2.06 0.00 0.00 59.70 57.39 3k99 h MET 119 Cb 1.20 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.76 3k99 h MET 119 CO 0.13 0.58 -0.32 1.49 1.06 0.00 0.00 176.91 179.85 3k99 h GLU 120 N 0.56 0.73 -0.26 1.72 4.57 -0.88 -2.43 114.58 118.59 3k99 h GLU 120 Ca 0.12 -0.34 -0.10 0.00 -1.18 0.00 0.00 59.36 57.86 3k99 h GLU 120 Cb 0.31 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.87 3k99 h GLU 120 CO 0.01 0.95 -0.28 0.00 -1.18 0.00 0.00 179.01 178.51 3k99 h ALA 121 N 1.02 1.03 -0.05 2.92 0.00 -0.62 -2.11 119.26 121.45 3k99 h ALA 121 Ca 0.07 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 3k99 h ALA 121 Cb 0.84 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 3k99 h ALA 121 CO 0.07 0.58 -0.37 -0.07 0.00 0.00 0.00 179.25 179.46 3k99 h LEU 122 N 0.46 0.10 -0.71 0.00 3.38 -1.15 -1.71 115.31 115.67 3k99 h LEU 122 Ca 0.06 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3k99 h LEU 122 Cb 0.72 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.45 3k99 h LEU 122 CO 0.06 0.47 0.00 0.00 0.09 0.00 0.00 178.44 179.06 3k99 n GLN 123 N -4.08 0.21 -0.29 1.13 3.00 -0.81 -1.52 117.38 115.02 3k99 n GLN 123 Ca -0.02 0.42 0.08 0.00 -0.01 0.00 0.00 57.00 57.48 3k99 n GLN 123 Cb 0.43 -1.89 0.23 0.00 0.00 0.00 0.00 30.24 29.00 3k99 n GLN 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3k99 n ALA 124 N -1.79 2.35 -0.62 -1.58 0.00 -0.91 -4.97 120.51 112.99 3k99 n ALA 124 Ca 0.02 -1.29 0.00 0.00 0.00 0.00 0.00 53.44 52.17 3k99 n ALA 124 Cb 0.24 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.04 3k99 n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k99 n GLY 125 N 0.88 0.65 3.76 0.00 0.00 -0.58 -5.04 105.19 104.86 3k99 n GLY 125 Ca 0.17 -0.35 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 3k99 n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k99 s ALA 126 N -2.00 2.65 0.51 4.61 0.00 -0.69 -4.98 121.76 121.86 3k99 s ALA 126 Ca 0.00 1.01 -0.21 0.00 0.00 0.00 0.00 51.96 52.76 3k99 s ALA 126 Cb 0.00 -3.44 -0.07 0.00 0.00 0.00 0.00 23.12 19.61 3k99 s ALA 126 CO 0.00 -1.05 1.12 0.34 0.00 0.00 0.00 175.76 176.16 3k99 s ASP 127 N -1.52 5.99 0.54 0.00 2.15 -1.26 -4.63 116.67 117.93 3k99 s ASP 127 Ca 0.74 2.16 0.36 0.00 0.43 0.00 0.00 52.55 56.24 3k99 s ASP 127 Cb -0.30 -2.58 1.90 0.00 -0.30 0.00 0.00 42.92 41.64 3k99 s ASP 127 CO 0.34 -1.04 2.10 -0.29 -0.17 0.00 0.00 175.17 176.11 3k99 h ILE 128 N 1.47 0.00 0.00 4.11 6.09 -1.93 -2.13 117.51 125.13 3k99 h ILE 128 Ca -0.50 -0.06 0.00 0.00 -1.37 0.00 0.00 64.86 62.94 3k99 h ILE 128 Cb 1.25 0.89 0.00 0.00 0.47 0.00 0.00 36.82 39.43 3k99 h ILE 128 CO 0.58 0.00 0.00 0.77 -3.07 0.00 0.00 178.15 176.43 3k99 h SER 129 N 0.00 0.00 0.56 2.19 4.64 -1.90 -1.73 113.55 117.31 3k99 h SER 129 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3k99 h SER 129 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 3k99 h SER 129 CO 0.00 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.19 3k99 n MET 130 N -2.72 0.11 -0.15 4.77 2.81 -0.80 -4.04 117.12 117.11 3k99 n MET 130 Ca -0.01 0.37 0.14 0.00 -1.81 0.00 0.00 57.70 56.40 3k99 n MET 130 Cb 0.15 -1.72 0.49 0.00 -0.71 0.00 0.00 33.22 31.44 3k99 n MET 130 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 3k99 h ILE 131 N 0.00 0.84 -0.20 2.02 2.10 -1.54 -0.17 117.51 120.55 3k99 h ILE 131 Ca 0.00 -0.15 -0.08 0.00 1.08 0.00 0.00 64.86 65.71 3k99 h ILE 131 Cb 0.28 0.36 -0.01 0.00 -1.09 0.00 0.00 36.82 36.35 3k99 h ILE 131 CO 0.00 0.08 -0.23 1.23 -1.08 0.00 0.00 178.15 178.15 3k99 h GLY 132 N 0.44 0.39 2.00 8.18 0.00 -1.84 -2.43 103.07 109.81 3k99 h GLY 132 Ca 0.34 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 3k99 h GLY 132 CO -0.11 0.28 -0.00 1.46 0.00 0.00 0.00 176.54 178.17 3k99 h GLN 133 N 0.33 0.00 -0.48 4.80 4.20 -1.31 -1.76 115.11 120.89 3k99 h GLN 133 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 3k99 h GLN 133 Cb 0.59 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.37 3k99 h GLN 133 CO 0.04 0.00 0.00 1.19 -0.67 0.00 0.00 178.83 179.39 3k99 n PHE 134 N -3.09 0.85 -1.00 2.96 3.01 -0.92 -4.97 117.46 114.30 3k99 n PHE 134 Ca -0.02 -0.58 0.00 0.00 1.01 0.00 0.00 57.45 57.86 3k99 n PHE 134 Cb 0.12 -0.11 0.00 0.00 -0.01 0.00 0.00 39.48 39.48 3k99 n PHE 134 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3k99 n GLY 135 N 0.72 0.37 1.08 1.37 0.00 -0.66 -4.20 105.19 103.87 3k99 n GLY 135 Ca 0.19 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.17 3k99 n GLY 135 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3k99 n VAL 136 N -2.71 2.39 0.24 1.61 0.24 -1.24 -4.81 118.33 114.05 3k99 n VAL 136 Ca 0.00 -3.38 0.09 0.00 -2.04 0.00 0.00 64.34 59.01 3k99 n VAL 136 Cb 0.14 -0.49 0.61 0.00 -1.47 0.00 0.00 33.84 32.62 3k99 n VAL 136 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3k99 h GLY 137 N 1.30 0.00 -0.17 7.63 0.00 -1.84 -2.62 103.07 107.37 3k99 h GLY 137 Ca 0.14 0.00 0.25 0.00 0.00 0.00 0.00 47.33 47.73 3k99 h GLY 137 CO 0.29 0.00 0.61 -2.75 0.00 0.00 0.00 176.54 174.69 3k99 h PHE 138 N 0.00 0.95 0.00 5.60 3.57 -1.87 -1.18 116.94 124.01 3k99 h PHE 138 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 3k99 h PHE 138 Cb 0.36 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.83 3k99 h PHE 138 CO 0.00 0.05 0.00 0.66 -2.23 0.00 0.00 178.31 176.79 3k99 n TYR 139 N -4.85 0.00 0.26 0.41 4.01 -0.99 -2.06 117.16 113.94 3k99 n TYR 139 Ca 0.27 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 58.07 3k99 n TYR 139 Cb 0.78 -0.43 0.28 0.00 -0.31 0.00 0.00 39.34 39.66 3k99 n TYR 139 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3k99 n SER 140 N -1.43 0.21 -0.05 7.72 3.41 -0.45 -2.13 113.62 120.89 3k99 n SER 140 Ca 0.07 0.57 0.11 0.00 -0.26 0.00 0.00 58.87 59.36 3k99 n SER 140 Cb 0.24 -0.61 0.51 0.00 -0.26 0.00 0.00 64.21 64.09 3k99 n SER 140 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k99 h ALA 141 N 2.21 1.99 0.00 7.33 0.00 -1.61 -1.41 119.26 127.78 3k99 h ALA 141 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3k99 h ALA 141 Cb 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3k99 h ALA 141 CO 0.00 -0.10 0.00 0.66 0.00 0.00 0.00 179.25 179.81 3k99 n TYR 142 N -4.47 0.00 -0.25 0.00 4.01 -0.91 -1.42 117.16 114.12 3k99 n TYR 142 Ca 0.08 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.75 3k99 n TYR 142 Cb 0.32 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.40 3k99 n TYR 142 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3k99 h LEU 143 N 0.00 1.05 0.00 7.72 3.38 -1.46 -3.37 115.31 122.63 3k99 h LEU 143 Ca 0.00 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.74 3k99 h LEU 143 Cb 0.00 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.47 3k99 h LEU 143 CO 0.00 1.00 -0.28 1.33 0.09 0.00 0.00 178.44 180.58 3k99 n VAL 144 N -4.26 0.00 -5.07 1.22 0.24 -0.88 -4.99 118.33 104.59 3k99 n VAL 144 Ca 0.05 -0.38 -0.32 0.00 -2.04 0.00 0.00 64.34 61.65 3k99 n VAL 144 Cb 0.25 0.93 -0.15 0.00 -1.47 0.00 0.00 33.84 33.40 3k99 n VAL 144 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3k99 s ALA 145 N -1.42 2.44 -0.21 2.33 0.00 -0.51 -0.91 121.76 123.49 3k99 s ALA 145 Ca 0.01 -1.03 0.21 0.00 0.00 0.00 0.00 51.96 51.15 3k99 s ALA 145 Cb 0.02 -0.81 -0.02 0.00 0.00 0.00 0.00 23.12 22.31 3k99 s ALA 145 CO 0.13 0.51 1.02 1.05 0.00 0.00 0.00 175.76 178.48 3k99 h GLU 146 N 5.55 0.00 -3.38 0.00 4.11 -1.35 -3.40 114.58 116.11 3k99 h GLU 146 Ca -0.42 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 58.83 3k99 h GLU 146 Cb 1.15 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.15 3k99 h GLU 146 CO 0.49 0.10 -0.51 0.21 0.07 0.00 0.00 179.01 179.37 3k99 s LYS 147 N -3.21 0.27 -0.07 1.06 2.20 -1.18 -4.48 119.74 114.33 3k99 s LYS 147 Ca -0.01 0.05 0.02 0.00 -0.36 0.00 0.00 55.97 55.68 3k99 s LYS 147 Cb 0.09 0.12 0.01 0.00 -1.51 0.00 0.00 37.83 36.55 3k99 s LYS 147 CO 0.79 -0.05 -0.11 0.08 -0.36 0.00 0.00 175.35 175.70 3k99 s VAL 148 N -0.32 1.08 -0.12 4.02 1.01 -0.87 -0.93 120.40 124.27 3k99 s VAL 148 Ca -0.04 -0.43 0.03 0.00 0.00 0.00 0.00 61.98 61.53 3k99 s VAL 148 Cb -0.03 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.35 3k99 s VAL 148 CO 0.01 0.35 -0.21 -0.89 0.00 0.00 0.00 175.10 174.35 3k99 s THR 149 N 0.77 2.23 -0.25 3.92 2.01 -0.49 -2.08 115.64 121.75 3k99 s THR 149 Ca -0.13 -0.95 -0.02 0.00 0.31 0.00 0.00 61.69 60.90 3k99 s THR 149 Cb -0.15 -1.88 0.02 0.00 0.01 0.00 0.00 72.50 70.49 3k99 s THR 149 CO 0.02 0.55 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.77 3k99 s VAL 150 N 0.53 3.05 -0.14 3.82 1.01 0.84 0.33 120.40 129.84 3k99 s VAL 150 Ca -0.13 -0.89 -0.05 0.00 0.00 0.00 0.00 61.98 60.90 3k99 s VAL 150 Cb -0.17 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 3k99 s VAL 150 CO 0.05 0.23 0.03 -0.63 0.00 0.00 0.00 175.10 174.78 3k99 s ILE 151 N 1.37 4.55 -0.01 2.22 1.01 0.33 -0.04 121.20 130.63 3k99 s ILE 151 Ca 0.02 -0.14 -0.10 0.00 0.00 0.00 0.00 60.65 60.43 3k99 s ILE 151 Cb -0.16 -2.99 0.01 0.00 0.01 0.00 0.00 42.46 39.33 3k99 s ILE 151 CO -0.04 0.54 0.21 0.28 0.00 0.00 0.00 174.94 175.93 3k99 s THR 152 N -0.25 0.07 -0.06 2.92 -1.32 -0.48 0.17 115.64 116.69 3k99 s THR 152 Ca 0.07 -0.56 -0.02 0.00 -1.21 0.00 0.00 61.69 59.96 3k99 s THR 152 Cb -0.12 -0.50 0.04 0.00 -1.51 0.00 0.00 72.50 70.40 3k99 s THR 152 CO 0.02 -0.31 0.08 -0.75 -2.21 0.00 0.00 174.62 171.45 3k99 s LYS 153 N -1.27 -0.05 0.07 7.08 2.47 0.47 -1.49 119.74 127.03 3k99 s LYS 153 Ca -0.13 0.39 0.05 0.00 -1.56 0.00 0.00 55.97 54.71 3k99 s LYS 153 Cb -0.06 -0.54 -0.04 0.00 -1.46 0.00 0.00 37.83 35.72 3k99 s LYS 153 CO 0.03 -0.35 -0.03 -1.58 0.16 0.00 0.00 175.35 173.58 3k99 s HIS 154 N 2.19 2.94 0.31 4.03 5.65 -1.26 -1.12 115.29 128.04 3k99 s HIS 154 Ca 0.04 -0.04 -0.29 0.00 0.25 0.00 0.00 55.06 55.03 3k99 s HIS 154 Cb -0.12 -1.54 -0.13 0.00 -1.18 0.00 0.00 32.58 29.61 3k99 s HIS 154 CO -0.04 0.45 1.23 0.09 -0.65 0.00 0.00 174.74 175.82 3k99 n ASN 155 N 0.80 2.33 -1.30 9.88 3.02 -1.26 -2.43 115.26 126.29 3k99 n ASN 155 Ca -0.12 1.19 -0.13 0.00 -0.03 0.00 0.00 54.58 55.48 3k99 n ASN 155 Cb 0.52 -1.42 -0.03 0.00 -0.61 0.00 0.00 39.78 38.24 3k99 n ASN 155 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3k99 n ASP 156 N 1.13 -4.40 -4.00 6.41 10.43 -1.26 -4.98 116.55 119.88 3k99 n ASP 156 Ca 0.07 0.15 -0.09 0.00 2.57 0.00 0.00 54.79 57.49 3k99 n ASP 156 Cb 0.34 -3.34 -0.06 0.00 1.84 0.00 0.00 41.12 39.90 3k99 n ASP 156 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 3k99 s ASP 157 N -2.61 -0.08 0.72 -2.24 -1.08 -1.02 -5.15 116.67 105.21 3k99 s ASP 157 Ca 0.00 -0.94 -0.08 0.00 -0.52 0.00 0.00 52.55 51.02 3k99 s ASP 157 Cb 0.00 0.57 0.06 0.00 -1.46 0.00 0.00 42.92 42.09 3k99 s ASP 157 CO 0.00 -1.11 1.04 -1.61 0.52 0.00 0.00 175.17 174.01 3k99 s GLU 158 N -4.02 2.21 0.03 4.34 0.41 -1.26 -4.54 118.70 115.87 3k99 s GLU 158 Ca 0.23 -0.16 -0.29 0.00 -0.41 0.00 0.00 54.97 54.34 3k99 s GLU 158 Cb -0.00 -2.13 -0.04 0.00 -1.78 0.00 0.00 34.13 30.17 3k99 s GLU 158 CO 0.08 -1.26 0.91 -1.14 -0.49 0.00 0.00 175.26 173.36 3k99 s GLN 159 N -5.29 4.57 0.24 1.61 0.74 -1.26 -4.45 119.66 115.82 3k99 s GLN 159 Ca 0.60 1.32 0.09 0.00 0.05 0.00 0.00 55.36 57.42 3k99 s GLN 159 Cb -0.11 -3.43 -0.05 0.00 1.10 0.00 0.00 33.01 30.53 3k99 s GLN 159 CO 0.46 0.07 -0.16 0.71 -0.55 0.00 0.00 175.29 175.81 3k99 s TYR 160 N 0.59 1.96 -0.13 1.67 2.02 -0.56 -0.62 117.35 122.28 3k99 s TYR 160 Ca 0.47 -0.48 0.01 0.00 -0.37 0.00 0.00 57.07 56.71 3k99 s TYR 160 Cb -0.21 -0.89 0.02 0.00 -0.40 0.00 0.00 41.96 40.48 3k99 s TYR 160 CO 0.27 0.51 -0.16 0.00 -1.57 0.00 0.00 175.55 174.59 3k99 s ALA 161 N -2.78 1.85 -0.05 3.71 0.00 -0.14 -1.38 121.76 122.97 3k99 s ALA 161 Ca 0.26 -0.86 -0.02 0.00 0.00 0.00 0.00 51.96 51.34 3k99 s ALA 161 Cb -0.02 -0.93 -0.04 0.00 0.00 0.00 0.00 23.12 22.13 3k99 s ALA 161 CO 0.10 -0.16 0.05 -0.46 0.00 0.00 0.00 175.76 175.29 3k99 s TRP 162 N 1.10 3.25 -0.13 0.00 -0.00 0.94 -2.13 118.94 121.96 3k99 s TRP 162 Ca -0.03 0.23 -0.11 0.00 -0.00 0.00 0.00 56.10 56.18 3k99 s TRP 162 Cb -0.14 -1.78 0.04 0.00 -0.00 0.00 0.00 33.47 31.59 3k99 s TRP 162 CO -0.04 0.53 0.35 -2.00 -0.00 0.00 0.00 176.95 175.79 3k99 s GLU 163 N -1.28 0.40 -0.19 5.86 -6.30 -0.57 -0.11 118.70 116.50 3k99 s GLU 163 Ca 0.18 0.52 -0.16 0.00 -2.50 0.00 0.00 54.97 53.00 3k99 s GLU 163 Cb -0.12 0.16 0.05 0.00 0.00 0.00 0.00 34.13 34.22 3k99 s GLU 163 CO 0.08 -0.07 0.49 0.45 0.02 0.00 0.00 175.26 176.23 3k99 s SER 164 N 0.36 -0.53 -0.31 -1.70 0.15 -0.88 -0.96 113.70 109.83 3k99 s SER 164 Ca -0.01 1.00 0.10 0.00 0.70 0.00 0.00 55.95 57.74 3k99 s SER 164 Cb -0.03 0.99 0.67 0.00 -1.71 0.00 0.00 66.02 65.94 3k99 s SER 164 CO -0.01 -0.18 1.71 -1.20 1.20 0.00 0.00 173.24 174.76 3k99 n SER 165 N 3.07 4.21 0.00 5.45 7.64 -1.26 -2.04 113.62 130.68 3k99 n SER 165 Ca -0.15 -3.33 0.00 0.00 1.01 0.00 0.00 58.87 56.41 3k99 n SER 165 Cb 0.57 -0.71 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 3k99 n SER 165 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3k99 n ALA 166 N -0.47 0.00 -1.13 -0.43 0.00 -1.26 -4.90 120.51 112.32 3k99 n ALA 166 Ca 0.39 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.78 3k99 n ALA 166 Cb 1.29 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.72 3k99 n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k99 n GLY 167 N 0.00 0.61 0.00 0.00 0.00 -1.26 -3.76 105.19 100.78 3k99 n GLY 167 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.85 3k99 n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k99 n GLY 168 N -0.97 0.42 3.40 -0.02 0.00 -1.26 -5.06 105.19 101.69 3k99 n GLY 168 Ca -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 3k99 n GLY 168 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k99 s SER 169 N -2.64 -0.01 0.08 1.61 1.04 -1.25 -1.78 113.70 110.75 3k99 s SER 169 Ca 0.00 -0.86 -0.04 0.00 0.48 0.00 0.00 55.95 55.53 3k99 s SER 169 Cb 0.00 0.48 -0.03 0.00 0.10 0.00 0.00 66.02 66.57 3k99 s SER 169 CO 0.00 -0.95 0.06 0.72 0.98 0.00 0.00 173.24 174.05 3k99 s PHE 170 N -3.97 0.44 0.09 5.02 -0.12 0.15 -4.47 117.98 115.11 3k99 s PHE 170 Ca 0.18 -0.93 0.06 0.00 -0.05 0.00 0.00 56.93 56.20 3k99 s PHE 170 Cb 0.02 -0.28 -0.04 0.00 -0.63 0.00 0.00 43.02 42.09 3k99 s PHE 170 CO 0.02 -0.46 -0.08 0.95 -0.05 0.00 0.00 175.22 175.59 3k99 s THR 171 N -3.92 3.48 -0.02 -4.49 -4.23 -0.14 -0.69 115.64 105.64 3k99 s THR 171 Ca 0.09 -1.18 0.05 0.00 -1.18 0.00 0.00 61.69 59.46 3k99 s THR 171 Cb 0.07 -2.62 -0.01 0.00 1.34 0.00 0.00 72.50 71.28 3k99 s THR 171 CO -0.08 0.14 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.28 3k99 s VAL 172 N -1.21 1.35 0.08 2.29 1.01 0.42 -1.52 120.40 122.84 3k99 s VAL 172 Ca 0.22 -0.71 -0.18 0.00 0.00 0.00 0.00 61.98 61.31 3k99 s VAL 172 Cb -0.11 -1.14 0.04 0.00 0.00 0.00 0.00 36.38 35.16 3k99 s VAL 172 CO 0.14 0.39 0.43 0.00 0.00 0.00 0.00 175.10 176.05 3k99 s ARG 173 N -0.21 1.01 0.31 2.72 1.70 -0.91 -0.92 118.95 122.64 3k99 s ARG 173 Ca 0.02 -0.49 -0.29 0.00 -0.47 0.00 0.00 55.73 54.50 3k99 s ARG 173 Cb -0.08 0.45 -0.10 0.00 -0.57 0.00 0.00 34.95 34.64 3k99 s ARG 173 CO 0.00 -0.37 1.43 0.99 -1.08 0.00 0.00 175.30 176.27 3k99 s THR 174 N -3.06 2.46 -0.14 4.99 2.01 -1.26 -0.96 115.64 119.68 3k99 s THR 174 Ca -0.02 0.43 -0.12 0.00 0.31 0.00 0.00 61.69 62.29 3k99 s THR 174 Cb 0.00 -3.27 -0.05 0.00 0.01 0.00 0.00 72.50 69.19 3k99 s THR 174 CO -0.07 0.09 0.26 -0.62 -0.69 0.00 0.00 174.62 173.60 3k99 s ASP 175 N 0.02 6.44 0.00 3.53 2.15 0.20 -4.73 116.67 124.28 3k99 s ASP 175 Ca 0.55 0.52 0.16 0.00 0.43 0.00 0.00 52.55 54.21 3k99 s ASP 175 Cb -0.43 -2.16 0.33 0.00 -0.30 0.00 0.00 42.92 40.36 3k99 s ASP 175 CO 0.51 0.18 1.24 0.35 -0.17 0.00 0.00 175.17 177.28 3k99 n THR 176 N 3.14 0.62 -0.79 1.71 -2.24 -1.26 -4.76 114.28 110.70 3k99 n THR 176 Ca -0.14 -0.81 -0.07 0.00 -2.27 0.00 0.00 64.05 60.76 3k99 n THR 176 Cb 0.52 0.82 0.06 0.00 -2.10 0.00 0.00 70.33 69.63 3k99 n THR 176 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k99 n GLY 177 N 0.97 -2.15 3.66 3.38 0.00 -1.26 -4.91 105.19 104.89 3k99 n GLY 177 Ca 0.14 -1.52 -0.50 0.00 0.00 0.00 0.00 46.02 44.14 3k99 n GLY 177 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k99 n GLU 178 N -2.10 1.72 -1.82 1.61 1.02 -1.26 -4.88 120.64 114.94 3k99 n GLU 178 Ca 0.04 0.63 -0.42 0.00 -0.02 0.00 0.00 57.16 57.38 3k99 n GLU 178 Cb 0.14 -2.37 -0.03 0.00 -0.02 0.00 0.00 31.44 29.16 3k99 n GLU 178 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3k99 s PRO 179 N 2.15 4.17 0.10 3.49 0.04 -1.26 -5.01 135.00 138.67 3k99 s PRO 179 Ca 0.88 2.46 -0.14 0.00 0.04 0.00 0.00 61.00 64.24 3k99 s PRO 179 Cb -0.82 -3.68 -0.06 0.00 0.04 0.00 0.00 34.50 29.97 3k99 s PRO 179 CO 0.49 -0.81 0.49 -1.64 0.04 0.00 0.00 177.00 175.57 3k99 s MET 180 N 2.96 3.93 0.10 4.56 -1.94 -1.26 -5.00 119.30 122.65 3k99 s MET 180 Ca 0.78 0.42 -0.17 0.00 -1.71 0.00 0.00 55.69 55.01 3k99 s MET 180 Cb -0.42 -3.02 -0.06 0.00 2.01 0.00 0.00 34.83 33.33 3k99 s MET 180 CO 0.35 0.55 1.53 0.78 -0.01 0.00 0.00 175.02 178.22 3k99 h GLY 181 N 3.88 0.58 -5.59 -0.03 0.00 -1.95 -3.47 103.07 96.49 3k99 h GLY 181 Ca -0.49 -0.43 0.11 0.00 0.00 0.00 0.00 47.33 46.52 3k99 h GLY 181 CO 0.65 0.40 0.62 -1.60 0.00 0.00 0.00 176.54 176.61 3k99 s ARG 182 N -4.97 0.33 0.00 4.80 3.52 -1.25 -4.85 118.95 116.52 3k99 s ARG 182 Ca -0.13 0.39 0.00 0.00 -0.13 0.00 0.00 55.73 55.86 3k99 s ARG 182 Cb 0.08 0.16 0.00 0.00 -1.56 0.00 0.00 34.95 33.64 3k99 s ARG 182 CO 0.76 -0.04 0.00 0.41 -0.81 0.00 0.00 175.30 175.62 3k99 n GLY 183 N 1.95 0.88 2.90 8.12 0.00 -0.27 -4.34 105.19 114.43 3k99 n GLY 183 Ca -0.12 -1.89 -0.14 0.00 0.00 0.00 0.00 46.02 43.87 3k99 n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k99 s THR 184 N -2.72 0.16 -0.11 2.61 2.01 -0.85 -0.39 115.64 116.35 3k99 s THR 184 Ca 0.00 -0.08 0.00 0.00 0.31 0.00 0.00 61.69 61.92 3k99 s THR 184 Cb 0.00 -0.15 0.02 0.00 0.01 0.00 0.00 72.50 72.38 3k99 s THR 184 CO 0.00 0.05 -0.10 -0.75 -0.69 0.00 0.00 174.62 173.13 3k99 s LYS 185 N -0.01 1.72 -0.25 4.92 2.20 0.13 -0.91 119.74 127.54 3k99 s LYS 185 Ca 0.00 -0.35 -0.05 0.00 -0.36 0.00 0.00 55.97 55.21 3k99 s LYS 185 Cb -0.01 -1.64 -0.00 0.00 -1.51 0.00 0.00 37.83 34.66 3k99 s LYS 185 CO -0.00 -0.18 0.01 0.08 -0.36 0.00 0.00 175.35 174.89 3k99 s VAL 186 N 1.40 3.64 -0.35 4.02 1.01 0.51 -0.52 120.40 130.12 3k99 s VAL 186 Ca -0.00 -0.55 -0.10 0.00 0.00 0.00 0.00 61.98 61.32 3k99 s VAL 186 Cb -0.13 -2.75 0.02 0.00 0.00 0.00 0.00 36.38 33.51 3k99 s VAL 186 CO -0.06 0.29 0.18 -0.63 0.00 0.00 0.00 175.10 174.88 3k99 s ILE 187 N 1.49 4.47 -0.36 2.22 1.01 0.15 -1.29 121.20 128.90 3k99 s ILE 187 Ca 0.04 -0.76 -0.16 0.00 0.00 0.00 0.00 60.65 59.78 3k99 s ILE 187 Cb -0.15 -3.43 -0.00 0.00 0.01 0.00 0.00 42.46 38.88 3k99 s ILE 187 CO -0.01 -0.13 0.37 -0.76 0.00 0.00 0.00 174.94 174.42 3k99 s LEU 188 N 1.55 4.56 -0.56 2.97 1.43 -0.14 -1.40 118.68 127.09 3k99 s LEU 188 Ca 0.02 -0.36 -0.25 0.00 -1.03 0.00 0.00 54.13 52.52 3k99 s LEU 188 Cb -0.18 -2.34 0.04 0.00 0.03 0.00 0.00 46.19 43.73 3k99 s LEU 188 CO 0.06 -0.39 1.01 -1.00 0.23 0.00 0.00 176.35 176.26 3k99 s HIS 189 N 2.02 2.73 0.46 0.29 3.76 -0.10 -1.61 115.29 122.84 3k99 s HIS 189 Ca 0.11 0.10 -0.21 0.00 -0.15 0.00 0.00 55.06 54.91 3k99 s HIS 189 Cb -0.17 -4.20 -0.09 0.00 1.11 0.00 0.00 32.58 29.23 3k99 s HIS 189 CO 0.12 -1.43 1.04 -0.51 -0.85 0.00 0.00 174.74 173.11 3k99 s LEU 190 N 4.24 3.94 0.72 0.89 1.43 -0.83 -1.06 118.68 128.01 3k99 s LEU 190 Ca 0.34 1.95 -0.15 0.00 -1.03 0.00 0.00 54.13 55.24 3k99 s LEU 190 Cb -0.11 -4.45 0.03 0.00 0.03 0.00 0.00 46.19 41.69 3k99 s LEU 190 CO 0.21 -0.68 1.20 -0.54 0.23 0.00 0.00 176.35 176.77 3k99 s LYS 191 N -3.01 2.22 0.50 1.70 1.02 -0.08 -4.62 119.74 117.47 3k99 s LYS 191 Ca 0.64 1.75 0.20 0.00 0.02 0.00 0.00 55.97 58.58 3k99 s LYS 191 Cb -0.18 -1.84 1.30 0.00 -0.52 0.00 0.00 37.83 36.59 3k99 s LYS 191 CO 0.22 -1.77 2.09 1.49 -0.92 0.00 0.00 175.35 176.46 3k99 h GLU 192 N -0.20 0.00 -0.00 1.68 4.81 -1.95 -1.39 114.58 117.52 3k99 h GLU 192 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 3k99 h GLU 192 Cb 1.29 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.67 3k99 h GLU 192 CO 0.50 0.10 -0.11 -0.25 -0.73 0.00 0.00 179.01 178.53 3k99 n ASP 193 N -4.12 0.34 -1.34 1.04 8.00 -1.26 -4.05 116.55 115.16 3k99 n ASP 193 Ca -0.03 -0.35 -0.08 0.00 0.71 0.00 0.00 54.79 55.04 3k99 n ASP 193 Cb 0.19 -0.13 0.19 0.00 -0.02 0.00 0.00 41.12 41.34 3k99 n ASP 193 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3k99 n GLN 194 N -1.12 1.95 0.00 -1.24 1.13 -0.52 -4.65 117.38 112.93 3k99 n GLN 194 Ca 0.13 -3.22 0.15 0.00 -1.94 0.00 0.00 57.00 52.12 3k99 n GLN 194 Cb 0.28 -1.88 0.78 0.00 0.11 0.00 0.00 30.24 29.53 3k99 n GLN 194 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3k99 n THR 195 N -1.11 0.00 0.25 5.09 -2.24 -1.26 -3.29 114.28 111.71 3k99 n THR 195 Ca 0.37 -0.03 0.08 0.00 -2.27 0.00 0.00 64.05 62.20 3k99 n THR 195 Cb 1.09 -0.34 0.60 0.00 -2.10 0.00 0.00 70.33 69.59 3k99 n THR 195 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3k99 h GLU 196 N 0.29 0.00 0.00 -0.78 4.11 -1.93 -1.34 114.58 114.93 3k99 h GLU 196 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3k99 h GLU 196 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 3k99 h GLU 196 CO 0.00 0.10 0.00 0.66 0.07 0.00 0.00 179.01 179.84 3k99 n TYR 197 N -4.32 0.00 1.26 2.06 4.01 -1.21 -0.82 117.16 118.15 3k99 n TYR 197 Ca -0.03 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.84 3k99 n TYR 197 Cb 0.17 0.00 0.32 0.00 -0.31 0.00 0.00 39.34 39.52 3k99 n TYR 197 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3k99 n LEU 198 N -0.86 2.01 -4.64 7.72 4.77 -0.50 -4.75 117.00 120.75 3k99 n LEU 198 Ca 0.16 -0.67 -0.41 0.00 -0.03 0.00 0.00 56.01 55.06 3k99 n LEU 198 Cb 0.07 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.10 3k99 n LEU 198 CO 0.12 0.34 0.59 -1.61 -1.33 0.00 0.00 177.39 175.50 3k99 s GLU 199 N -2.09 4.16 0.24 3.23 0.41 0.00 -4.87 118.70 119.78 3k99 s GLU 199 Ca 0.32 0.85 -0.06 0.00 -0.41 0.00 0.00 54.97 55.66 3k99 s GLU 199 Cb 0.20 -3.65 0.44 0.00 -1.78 0.00 0.00 34.13 29.35 3k99 s GLU 199 CO 0.36 -0.50 1.67 1.49 -0.49 0.00 0.00 175.26 177.80 3k99 h GLU 200 N 7.73 0.20 -0.41 1.61 4.81 -1.91 0.17 114.58 126.80 3k99 h GLU 200 Ca -0.24 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.04 3k99 h GLU 200 Cb 1.10 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.38 3k99 h GLU 200 CO 0.85 0.13 0.09 -0.09 -0.73 0.00 0.00 179.01 179.26 3k99 h ARG 201 N 0.21 0.21 -0.22 1.92 9.65 -1.94 -1.94 114.38 122.28 3k99 h ARG 201 Ca 0.40 -0.01 -0.16 0.00 -1.10 0.00 0.00 59.98 59.11 3k99 h ARG 201 Cb 0.70 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.23 3k99 h ARG 201 CO -0.55 0.14 -0.51 -0.09 2.80 0.00 0.00 179.97 181.77 3k99 h ARG 202 N 0.22 0.72 -0.35 0.20 9.65 -1.18 -2.34 114.38 121.30 3k99 h ARG 202 Ca 0.20 -0.49 0.03 0.00 -1.10 0.00 0.00 59.98 58.61 3k99 h ARG 202 Cb 0.23 0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.85 3k99 h ARG 202 CO -0.25 1.11 0.18 0.82 2.80 0.00 0.00 179.97 184.63 3k99 h ILE 203 N 0.44 0.98 -0.27 1.20 2.04 -0.63 -1.75 117.51 119.54 3k99 h ILE 203 Ca -0.00 -0.13 -0.08 0.00 1.00 0.00 0.00 64.86 65.66 3k99 h ILE 203 Cb 1.12 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 3k99 h ILE 203 CO 0.11 0.07 -0.16 0.11 0.00 0.00 0.00 178.15 178.28 3k99 h LYS 204 N 0.36 0.46 -0.24 2.37 1.57 -1.30 -1.45 116.57 118.34 3k99 h LYS 204 Ca 0.15 -0.14 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 3k99 h LYS 204 Cb 0.06 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 3k99 h LYS 204 CO -0.10 0.61 -0.07 1.49 -0.57 0.00 0.00 179.45 180.81 3k99 h GLU 205 N 0.42 0.47 -0.47 3.15 4.81 -1.13 -1.53 114.58 120.30 3k99 h GLU 205 Ca 0.08 -0.19 -0.12 0.00 -0.13 0.00 0.00 59.36 59.00 3k99 h GLU 205 Cb 0.53 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 3k99 h GLU 205 CO 0.03 0.71 -0.17 0.82 -0.73 0.00 0.00 179.01 179.67 3k99 h ILE 206 N 0.20 1.27 0.04 2.32 2.04 -1.12 0.98 117.51 123.24 3k99 h ILE 206 Ca 0.06 -1.31 -0.00 0.00 1.00 0.00 0.00 64.86 64.61 3k99 h ILE 206 Cb 0.55 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 3k99 h ILE 206 CO 0.03 0.45 -0.02 0.58 0.00 0.00 0.00 178.15 179.19 3k99 h VAL 207 N 0.80 0.97 -0.97 1.67 2.07 -1.25 -1.27 116.25 118.28 3k99 h VAL 207 Ca 0.12 -0.03 0.01 0.00 0.82 0.00 0.00 66.70 67.61 3k99 h VAL 207 Cb 0.72 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.44 3k99 h VAL 207 CO 0.06 0.01 0.64 0.50 0.02 0.00 0.00 177.57 178.79 3k99 h LYS 208 N -0.06 1.27 -0.00 1.57 1.63 -0.99 0.52 116.57 120.50 3k99 h LYS 208 Ca -0.01 -0.08 -0.24 0.00 -0.85 0.00 0.00 60.65 59.48 3k99 h LYS 208 Cb 0.05 -0.29 0.01 0.00 -0.60 0.00 0.00 32.23 31.40 3k99 h LYS 208 CO 0.01 0.84 -0.97 -0.22 -3.45 0.00 0.00 179.45 175.66 3k99 h LYS 209 N 1.31 0.50 0.00 1.90 3.64 -0.61 -3.39 116.57 119.91 3k99 h LYS 209 Ca 0.36 -0.53 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 3k99 h LYS 209 Cb -0.15 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 3k99 h LYS 209 CO -0.08 1.17 -0.63 0.72 -2.27 0.00 0.00 179.45 178.37 3k99 n HIS 210 N -3.78 0.00 -1.93 1.91 8.25 -0.50 -4.72 115.22 114.46 3k99 n HIS 210 Ca -0.08 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.12 3k99 n HIS 210 Cb 0.85 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.99 3k99 n HIS 210 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3k99 n SER 211 N -1.24 5.33 0.11 0.41 7.64 0.17 -4.81 113.62 121.24 3k99 n SER 211 Ca 0.00 -3.76 -0.02 0.00 1.01 0.00 0.00 58.87 56.10 3k99 n SER 211 Cb 0.00 -0.43 0.20 0.00 -1.01 0.00 0.00 64.21 62.97 3k99 n SER 211 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 3k99 h GLN 212 N 2.16 0.16 -0.25 1.43 5.75 -1.75 -3.15 115.11 119.45 3k99 h GLN 212 Ca 0.40 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 58.82 3k99 h GLN 212 Cb 1.42 0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.98 3k99 h GLN 212 CO 0.88 0.63 0.00 1.19 -2.65 0.00 0.00 178.83 178.88 3k99 n PHE 213 N -3.95 0.31 -1.79 3.99 3.72 -1.26 -4.96 117.46 113.52 3k99 n PHE 213 Ca -0.02 -0.15 -0.42 0.00 -0.05 0.00 0.00 57.45 56.81 3k99 n PHE 213 Cb 0.54 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.05 3k99 n PHE 213 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3k99 s ILE 214 N -1.69 2.19 -0.55 4.37 -1.09 -1.19 -4.90 121.20 118.33 3k99 s ILE 214 Ca 0.35 0.14 0.01 0.00 -2.23 0.00 0.00 60.65 58.92 3k99 s ILE 214 Cb 0.21 -3.09 0.54 0.00 -1.58 0.00 0.00 42.46 38.55 3k99 s ILE 214 CO 0.31 0.01 1.94 0.61 -1.23 0.00 0.00 174.94 176.57 3k99 n GLY 215 N 3.74 5.32 3.04 6.18 0.00 -1.26 -4.88 105.19 117.34 3k99 n GLY 215 Ca 0.15 -1.80 -0.10 0.00 0.00 0.00 0.00 46.02 44.27 3k99 n GLY 215 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k99 s TYR 216 N -3.59 0.20 0.36 1.61 2.02 -1.26 -5.10 117.35 111.59 3k99 s TYR 216 Ca 0.60 -0.44 -0.28 0.00 -0.37 0.00 0.00 57.07 56.58 3k99 s TYR 216 Cb 0.49 -0.15 -0.11 0.00 -0.40 0.00 0.00 41.96 41.79 3k99 s TYR 216 CO 0.04 -0.26 1.45 -2.14 -1.57 0.00 0.00 175.55 173.07 3k99 s PRO 217 N -1.76 4.17 -0.17 -1.71 0.02 -1.26 -4.82 135.00 129.47 3k99 s PRO 217 Ca -0.13 2.48 0.01 0.00 0.02 0.00 0.00 61.00 63.39 3k99 s PRO 217 Cb -0.07 -3.00 0.01 0.00 0.02 0.00 0.00 34.50 31.46 3k99 s PRO 217 CO -0.01 -0.46 -0.18 0.42 -0.33 0.00 0.00 177.00 176.44 3k99 s ILE 218 N -1.02 2.34 -0.09 2.83 1.01 -1.26 -1.19 121.20 123.82 3k99 s ILE 218 Ca 0.53 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 60.35 3k99 s ILE 218 Cb -0.45 -1.98 0.00 0.00 0.01 0.00 0.00 42.46 40.05 3k99 s ILE 218 CO 0.59 0.53 -0.20 -0.89 0.00 0.00 0.00 174.94 174.97 3k99 s THR 219 N 1.05 1.75 -0.06 2.92 2.01 -0.33 -5.01 115.64 117.96 3k99 s THR 219 Ca -0.01 -0.84 -0.19 0.00 0.31 0.00 0.00 61.69 60.96 3k99 s THR 219 Cb -0.14 -1.53 -0.05 0.00 0.01 0.00 0.00 72.50 70.79 3k99 s THR 219 CO -0.06 0.49 0.52 -0.22 -0.69 0.00 0.00 174.62 174.67 3k99 s LEU 220 N 0.43 4.35 -0.29 4.42 2.96 -1.26 -0.50 118.68 128.78 3k99 s LEU 220 Ca -0.17 0.97 0.02 0.00 -0.22 0.00 0.00 54.13 54.73 3k99 s LEU 220 Cb -0.17 -2.78 0.09 0.00 0.50 0.00 0.00 46.19 43.83 3k99 s LEU 220 CO 0.07 0.07 0.02 -0.36 -1.32 0.00 0.00 176.35 174.83 3k99 s PHE 221 N 0.13 2.77 -0.34 5.38 0.08 0.46 -4.94 117.98 121.53 3k99 s PHE 221 Ca 0.28 -2.25 -0.29 0.00 0.12 0.00 0.00 56.93 54.79 3k99 s PHE 221 Cb -0.16 -2.13 0.02 0.00 -0.57 0.00 0.00 43.02 40.17 3k99 s PHE 221 CO 0.13 -0.87 1.11 0.08 -0.10 0.00 0.00 175.22 175.57 3k99 s VAL 222 N 1.25 4.43 -0.12 -0.44 1.01 -1.26 -3.62 120.40 121.65 3k99 s VAL 222 Ca 0.04 1.62 -0.11 0.00 0.00 0.00 0.00 61.98 63.54 3k99 s VAL 222 Cb -0.19 -4.41 -0.05 0.00 0.00 0.00 0.00 36.38 31.73 3k99 s VAL 222 CO -0.12 -0.55 0.23 -0.70 0.00 0.00 0.00 175.10 173.96 3k99 s GLU 223 N 3.81 3.89 -0.16 2.72 2.12 -0.52 -5.01 118.70 125.54 3k99 s GLU 223 Ca 0.47 0.01 -0.07 0.00 0.36 0.00 0.00 54.97 55.75 3k99 s GLU 223 Cb -0.12 -3.30 0.07 0.00 0.26 0.00 0.00 34.13 31.04 3k99 s GLU 223 CO 0.18 0.53 0.35 -1.59 -0.54 0.00 0.00 175.26 174.19 3k99 s LYS 224 N -0.38 0.28 0.22 4.30 0.00 -1.26 -4.29 119.74 118.61 3k99 s LYS 224 Ca 0.16 0.82 -0.30 0.00 0.00 0.00 0.00 55.97 56.65 3k99 s LYS 224 Cb -0.13 0.07 -0.09 0.00 0.00 0.00 0.00 37.83 37.69 3k99 s LYS 224 CO 0.05 -0.22 1.14 -2.00 0.00 0.00 0.00 175.35 174.31 3k99 s GLU 225 N 2.04 4.57 0.00 1.78 2.12 -1.26 -5.18 118.70 122.76 3k99 s GLU 225 Ca -0.04 1.82 0.26 0.00 0.36 0.00 0.00 54.97 57.37 3k99 s GLU 225 Cb -0.11 -3.22 0.57 0.00 0.26 0.00 0.00 34.13 31.63 3k99 s GLU 225 CO -0.11 0.06 1.47 1.28 -0.54 0.00 0.00 175.26 177.42