#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gbx h LEU 7 N 0.00 0.39 -8.12 1.09 3.38 -1.97 -3.41 115.31 106.67 2gbx h LEU 7 Ca 0.00 -0.94 -0.48 0.00 0.09 0.00 0.00 57.88 56.55 2gbx h LEU 7 Cb 0.00 -0.13 -0.30 0.00 0.09 0.00 0.00 40.66 40.32 2gbx h LEU 7 CO 0.00 1.38 -0.81 -0.69 0.09 0.00 0.00 178.44 178.41 2gbx s VAL 8 N -2.41 1.05 -0.36 1.22 1.01 -1.26 -0.15 120.40 119.50 2gbx s VAL 8 Ca -0.15 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.30 2gbx s VAL 8 Cb 0.01 -0.90 0.10 0.00 0.00 0.00 0.00 36.38 35.59 2gbx s VAL 8 CO 0.80 0.31 0.10 -0.62 0.00 0.00 0.00 175.10 175.69 2gbx s ASP 9 N -0.06 4.94 0.34 3.32 -1.08 0.18 -4.97 116.67 119.33 2gbx s ASP 9 Ca 0.00 -2.07 0.16 0.00 -0.52 0.00 0.00 52.55 50.13 2gbx s ASP 9 Cb -0.08 -1.70 0.55 0.00 -1.46 0.00 0.00 42.92 40.23 2gbx s ASP 9 CO 0.00 -0.43 1.68 0.71 0.52 0.00 0.00 175.17 177.66 2gbx h THR 10 N 6.52 1.07 0.11 1.71 1.35 -1.94 0.72 112.91 122.45 2gbx h THR 10 Ca -0.08 -1.75 -0.01 0.00 -0.55 0.00 0.00 66.41 64.02 2gbx h THR 10 Cb 1.03 2.02 0.00 0.00 -1.73 0.00 0.00 68.15 69.47 2gbx h THR 10 CO 0.58 0.45 -0.05 0.58 -0.25 0.00 0.00 175.52 176.83 2gbx h VAL 11 N 0.00 1.07 0.00 6.82 2.07 -1.93 -3.30 116.25 120.98 2gbx h VAL 11 Ca -0.00 -1.18 0.00 0.00 0.82 0.00 0.00 66.70 66.33 2gbx h VAL 11 Cb 0.98 1.77 0.00 0.00 -1.52 0.00 0.00 31.29 32.52 2gbx h VAL 11 CO 0.06 0.26 -0.26 0.59 0.02 0.00 0.00 177.57 178.24 2gbx n ASN 12 N -4.90 0.31 -2.85 0.57 3.02 -1.24 -4.98 115.26 105.20 2gbx n ASN 12 Ca -0.08 0.16 -0.10 0.00 -0.03 0.00 0.00 54.58 54.52 2gbx n ASN 12 Cb 0.28 -0.15 0.05 0.00 -0.61 0.00 0.00 39.78 39.35 2gbx n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2gbx n ALA 13 N -1.54 -2.09 -3.18 5.41 0.00 0.15 -4.83 120.51 114.43 2gbx n ALA 13 Ca 0.06 0.09 -0.13 0.00 0.00 0.00 0.00 53.44 53.46 2gbx n ALA 13 Cb 0.35 -4.14 -0.07 0.00 0.00 0.00 0.00 19.45 15.59 2gbx n ALA 13 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2gbx s SER 14 N -3.23 -0.24 0.07 0.00 1.04 -0.65 -2.06 113.70 108.62 2gbx s SER 14 Ca 0.31 0.05 0.04 0.00 0.48 0.00 0.00 55.95 56.82 2gbx s SER 14 Cb -0.04 0.38 -0.03 0.00 0.10 0.00 0.00 66.02 66.43 2gbx s SER 14 CO 0.58 -0.57 -0.11 -1.10 0.98 0.00 0.00 173.24 173.02 2gbx s GLN 15 N -1.96 0.74 0.58 4.02 1.11 -0.97 0.51 119.66 123.69 2gbx s GLN 15 Ca -0.09 -0.96 -0.16 0.00 0.01 0.00 0.00 55.36 54.17 2gbx s GLN 15 Cb -0.02 -0.58 -0.04 0.00 -1.01 0.00 0.00 33.01 31.35 2gbx s GLN 15 CO 0.01 0.11 1.04 0.45 0.01 0.00 0.00 175.29 176.91 2gbx s SER 16 N -1.90 5.95 0.00 5.90 0.15 0.78 0.79 113.70 125.37 2gbx s SER 16 Ca -0.02 1.75 0.27 0.00 0.70 0.00 0.00 55.95 58.65 2gbx s SER 16 Cb -0.08 -2.53 1.39 0.00 -1.71 0.00 0.00 66.02 63.10 2gbx s SER 16 CO 0.01 -1.05 1.94 0.54 1.20 0.00 0.00 173.24 175.88 2gbx n ARG 17 N -1.99 0.40 0.26 5.44 1.74 -1.14 -3.13 116.66 118.24 2gbx n ARG 17 Ca 0.08 0.03 0.14 0.00 -0.77 0.00 0.00 57.85 57.33 2gbx n ARG 17 Cb 0.53 -1.50 0.69 0.00 -1.02 0.00 0.00 32.46 31.16 2gbx n ARG 17 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2gbx h GLN 18 N 0.00 0.00 -0.61 5.56 1.08 -1.86 -3.16 115.11 116.12 2gbx h GLN 18 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2gbx h GLN 18 Cb 0.25 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.65 2gbx h GLN 18 CO 0.00 0.10 0.39 -0.39 -0.95 0.00 0.00 178.83 177.98 2gbx h VAL 19 N 0.00 1.16 0.00 -0.54 -1.51 -1.89 0.26 116.25 113.73 2gbx h VAL 19 Ca -0.00 -0.33 -0.18 0.00 -1.23 0.00 0.00 66.70 64.96 2gbx h VAL 19 Cb 0.47 0.28 -0.03 0.00 -2.13 0.00 0.00 31.29 29.88 2gbx h VAL 19 CO 0.01 0.17 -1.10 -0.26 -1.23 0.00 0.00 177.57 175.16 2gbx h PHE 20 N 0.83 0.00 0.00 5.19 0.04 -1.81 -3.42 116.94 117.77 2gbx h PHE 20 Ca 0.22 0.00 -0.35 0.00 2.80 0.00 0.00 57.97 60.64 2gbx h PHE 20 Cb -0.07 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.03 2gbx h PHE 20 CO 0.00 0.71 -2.20 1.87 -0.60 0.00 0.00 178.31 178.09 2gbx n TRP 21 N -3.11 0.00 -1.70 -0.55 -0.00 -1.02 -4.58 117.44 106.47 2gbx n TRP 21 Ca -0.05 0.00 -0.43 0.00 -0.00 0.00 0.00 57.50 57.01 2gbx n TRP 21 Cb 0.86 -0.78 -0.02 0.00 -0.00 0.00 0.00 31.31 31.37 2gbx n TRP 21 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 177.69 174.22 2gbx n ASP 22 N -3.82 3.29 0.06 5.87 2.03 0.88 -4.85 116.55 120.02 2gbx n ASP 22 Ca -0.42 1.13 -0.06 0.00 0.52 0.00 0.00 54.79 55.96 2gbx n ASP 22 Cb 0.82 -1.50 -0.11 0.00 -0.72 0.00 0.00 41.12 39.60 2gbx n ASP 22 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2gbx h GLU 23 N 4.72 0.00 -0.04 -0.67 4.11 -1.95 -3.05 114.58 117.69 2gbx h GLU 23 Ca -0.46 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 58.82 2gbx h GLU 23 Cb 1.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 2gbx h GLU 23 CO 0.79 0.91 -0.67 -0.44 0.07 0.00 0.00 179.01 179.67 2gbx h ASP 24 N 0.00 0.22 -0.50 3.06 3.32 -1.96 -1.83 116.42 118.73 2gbx h ASP 24 Ca -0.04 -0.14 -0.09 0.00 0.02 0.00 0.00 57.03 56.78 2gbx h ASP 24 Cb 1.77 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 41.23 2gbx h ASP 24 CO 0.12 0.83 -0.04 0.58 -1.72 0.00 0.00 179.24 179.01 2gbx h VAL 25 N 0.13 1.26 -0.47 -1.35 2.07 -1.90 -2.22 116.25 113.77 2gbx h VAL 25 Ca -0.01 -1.15 -0.04 0.00 0.82 0.00 0.00 66.70 66.32 2gbx h VAL 25 Cb 1.21 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.84 2gbx h VAL 25 CO 0.10 0.41 0.12 0.22 0.02 0.00 0.00 177.57 178.44 2gbx h TYR 26 N 0.86 0.72 -0.80 1.57 3.20 -1.40 0.13 116.97 121.26 2gbx h TYR 26 Ca 0.15 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.93 2gbx h TYR 26 Cb 0.56 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.58 2gbx h TYR 26 CO 0.03 0.61 0.35 0.00 -1.64 0.00 0.00 178.16 177.51 2gbx h ALA 27 N 1.45 1.12 -0.26 1.82 0.00 -1.02 -0.75 119.26 121.62 2gbx h ALA 27 Ca 0.16 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 2gbx h ALA 27 Cb 0.25 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2gbx h ALA 27 CO -0.00 0.65 -0.45 -0.07 0.00 0.00 0.00 179.25 179.37 2gbx h LEU 28 N 1.14 0.70 -0.25 0.00 3.38 -0.91 -2.64 115.31 116.74 2gbx h LEU 28 Ca 0.27 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2gbx h LEU 28 Cb 0.16 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2gbx h LEU 28 CO -0.03 1.05 0.10 -0.33 0.09 0.00 0.00 178.44 179.33 2gbx h GLU 29 N 0.52 0.37 -0.93 1.13 5.08 -0.67 0.17 114.58 120.26 2gbx h GLU 29 Ca 0.03 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2gbx h GLU 29 Cb 0.99 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 30.13 2gbx h GLU 29 CO 0.09 0.40 0.58 0.82 -1.00 0.00 0.00 179.01 179.90 2gbx h ILE 30 N 0.26 1.25 -0.00 3.13 1.08 -1.16 -0.13 117.51 121.94 2gbx h ILE 30 Ca 0.08 -0.51 -0.01 0.00 -0.39 0.00 0.00 64.86 64.03 2gbx h ILE 30 Cb 0.17 -0.08 0.00 0.00 -3.07 0.00 0.00 36.82 33.83 2gbx h ILE 30 CO -0.01 0.26 -0.03 -0.08 -0.69 0.00 0.00 178.15 177.60 2gbx h GLU 31 N 1.27 0.02 -0.55 2.37 4.81 -1.33 -1.52 114.58 119.65 2gbx h GLU 31 Ca 0.34 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 2gbx h GLU 31 Cb -0.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.30 2gbx h GLU 31 CO -0.07 0.75 0.00 0.54 -0.73 0.00 0.00 179.01 179.51 2gbx n ARG 32 N -4.71 3.02 0.12 1.92 1.74 0.60 -4.18 116.66 115.17 2gbx n ARG 32 Ca -0.09 -2.52 0.00 0.00 -0.77 0.00 0.00 57.85 54.47 2gbx n ARG 32 Cb 0.38 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 2gbx n ARG 32 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2gbx n ILE 33 N 0.99 0.16 0.12 0.55 5.41 -0.12 -4.56 119.36 121.91 2gbx n ILE 33 Ca 0.20 0.05 -0.03 0.00 1.00 0.00 0.00 62.75 63.97 2gbx n ILE 33 Cb 0.63 -0.61 0.12 0.00 -0.71 0.00 0.00 39.64 39.08 2gbx n ILE 33 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 2gbx h PHE 34 N 0.00 0.08 -0.45 1.39 0.04 -1.48 0.37 116.94 116.89 2gbx h PHE 34 Ca 0.00 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.74 2gbx h PHE 34 Cb 0.00 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.14 2gbx h PHE 34 CO 0.00 0.71 0.00 0.43 -0.60 0.00 0.00 178.31 178.85 2gbx n SER 35 N -3.77 3.91 0.10 2.17 7.64 -0.57 -4.56 113.62 118.54 2gbx n SER 35 Ca -0.01 -2.45 0.00 0.00 1.01 0.00 0.00 58.87 57.41 2gbx n SER 35 Cb 0.66 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 2gbx n SER 35 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2gbx n ARG 36 N 0.65 0.00 -1.73 1.43 0.63 -0.99 -3.91 116.66 112.75 2gbx n ARG 36 Ca 0.19 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.83 2gbx n ARG 36 Cb 0.78 -0.18 0.09 0.00 0.45 0.00 0.00 32.46 33.59 2gbx n ARG 36 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2gbx s ALA 37 N -2.00 2.43 -0.05 5.13 0.00 0.13 -4.42 121.76 122.98 2gbx s ALA 37 Ca 0.00 -0.42 -0.30 0.00 0.00 0.00 0.00 51.96 51.24 2gbx s ALA 37 Cb 0.00 -3.03 -0.03 0.00 0.00 0.00 0.00 23.12 20.06 2gbx s ALA 37 CO 0.00 -1.67 1.07 -1.58 0.00 0.00 0.00 175.76 173.59 2gbx s TRP 38 N -3.34 3.46 0.02 0.00 0.52 -1.26 -4.66 118.94 113.67 2gbx s TRP 38 Ca 0.61 1.49 0.03 0.00 0.02 0.00 0.00 56.10 58.25 2gbx s TRP 38 Cb -0.13 -3.26 -0.04 0.00 -1.15 0.00 0.00 33.47 28.90 2gbx s TRP 38 CO 0.52 -0.58 -0.02 -0.51 0.02 0.00 0.00 176.95 176.38 2gbx s LEU 39 N 1.70 3.40 -0.22 2.99 1.43 0.79 -4.54 118.68 124.23 2gbx s LEU 39 Ca 0.52 -0.09 -0.29 0.00 -1.03 0.00 0.00 54.13 53.25 2gbx s LEU 39 Cb -0.22 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 2gbx s LEU 39 CO 0.23 0.26 1.40 -0.32 0.23 0.00 0.00 176.35 178.14 2gbx s MET 40 N -1.68 4.01 -0.20 1.70 -2.45 -1.26 0.04 119.30 119.46 2gbx s MET 40 Ca 0.20 1.56 -0.22 0.00 -1.25 0.00 0.00 55.69 55.98 2gbx s MET 40 Cb -0.11 -3.89 -0.20 0.00 1.25 0.00 0.00 34.83 31.88 2gbx s MET 40 CO 0.11 -1.01 0.28 -0.07 1.05 0.00 0.00 175.02 175.39 2gbx h LEU 41 N 10.66 0.00 0.00 4.11 3.38 -1.56 -3.47 115.31 128.42 2gbx h LEU 41 Ca -0.29 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.11 2gbx h LEU 41 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2gbx h LEU 41 CO 1.00 1.42 0.00 0.61 0.09 0.00 0.00 178.44 181.56 2gbx n GLY 42 N 1.46 -0.85 3.11 0.83 0.00 -0.85 -4.92 105.19 103.97 2gbx n GLY 42 Ca -0.29 -0.12 -0.07 0.00 0.00 0.00 0.00 46.02 45.54 2gbx n GLY 42 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2gbx s HIS 43 N -3.98 0.43 -0.28 1.61 2.46 -1.26 -0.51 115.29 113.75 2gbx s HIS 43 Ca 0.00 -0.94 0.26 0.00 0.47 0.00 0.00 55.06 54.85 2gbx s HIS 43 Cb 0.00 -0.31 1.15 0.00 -0.13 0.00 0.00 32.58 33.29 2gbx s HIS 43 CO 0.00 -0.41 1.78 1.05 -2.47 0.00 0.00 174.74 174.69 2gbx h GLU 44 N 3.12 0.00 0.00 2.88 4.11 -1.68 -2.28 114.58 120.72 2gbx h GLU 44 Ca -0.34 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.02 2gbx h GLU 44 Cb 1.16 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 2gbx h GLU 44 CO 0.63 0.00 -0.35 0.66 0.07 0.00 0.00 179.01 180.02 2gbx h SER 45 N 0.00 0.00 1.08 3.06 4.64 -1.86 -2.46 113.55 118.01 2gbx h SER 45 Ca 0.00 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 2gbx h SER 45 Cb 0.31 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.39 2gbx h SER 45 CO 0.00 0.35 -0.50 -0.07 -0.87 0.00 0.00 176.83 175.75 2gbx h LEU 46 N 0.00 0.00 -6.05 5.97 3.38 -1.65 -3.36 115.31 113.61 2gbx h LEU 46 Ca -0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 2gbx h LEU 46 Cb 0.98 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.33 2gbx h LEU 46 CO 0.05 0.50 -0.91 1.33 0.09 0.00 0.00 178.44 179.49 2gbx n VAL 47 N -3.42 0.55 0.04 1.22 0.24 -1.14 -4.80 118.33 111.02 2gbx n VAL 47 Ca 0.01 -4.52 -0.12 0.00 -2.04 0.00 0.00 64.34 57.66 2gbx n VAL 47 Cb 0.64 -1.91 -0.09 0.00 -1.47 0.00 0.00 33.84 31.01 2gbx n VAL 47 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2gbx h PRO 48 N 3.98 -0.14 -6.39 7.34 0.13 -1.60 -3.44 132.00 131.88 2gbx h PRO 48 Ca 0.12 0.01 -0.54 0.00 -0.87 0.00 0.00 66.00 64.72 2gbx h PRO 48 Cb 0.79 0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.93 2gbx h PRO 48 CO 0.61 0.31 -0.17 0.15 -0.23 0.00 0.00 178.00 178.67 2gbx s LYS 49 N -4.10 3.70 0.04 0.86 1.02 -1.26 -5.01 119.74 114.99 2gbx s LYS 49 Ca -0.15 0.09 -0.34 0.00 0.02 0.00 0.00 55.97 55.59 2gbx s LYS 49 Cb 0.01 -2.69 -0.13 0.00 -0.52 0.00 0.00 37.83 34.50 2gbx s LYS 49 CO 0.60 0.32 1.70 -2.30 -0.92 0.00 0.00 175.35 174.74 2gbx n PRO 50 N -0.37 2.10 0.00 -1.68 -0.02 -1.26 -1.51 135.00 132.25 2gbx n PRO 50 Ca -0.01 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2gbx n PRO 50 Cb 0.53 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 2gbx n PRO 50 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gbx n GLY 51 N 3.81 2.37 3.77 -1.23 0.00 -0.30 -4.97 105.19 108.64 2gbx n GLY 51 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 2gbx n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gbx s ASP 52 N -0.29 6.67 0.14 1.61 1.01 -0.57 -1.59 116.67 123.66 2gbx s ASP 52 Ca 0.00 2.78 -0.04 0.00 0.71 0.00 0.00 52.55 55.99 2gbx s ASP 52 Cb 0.00 -2.65 -0.03 0.00 1.01 0.00 0.00 42.92 41.25 2gbx s ASP 52 CO 0.00 -0.62 0.15 0.72 0.21 0.00 0.00 175.17 175.63 2gbx s PHE 53 N -1.13 0.62 -0.05 4.23 -0.71 -0.10 -0.26 117.98 120.58 2gbx s PHE 53 Ca 0.50 -1.00 -0.04 0.00 -1.04 0.00 0.00 56.93 55.34 2gbx s PHE 53 Cb -0.41 -0.29 0.02 0.00 -1.21 0.00 0.00 43.02 41.13 2gbx s PHE 53 CO 0.55 -0.59 0.13 0.96 -1.34 0.00 0.00 175.22 174.94 2gbx s ILE 54 N -4.00 -0.01 0.06 -4.49 -4.36 0.27 -2.79 121.20 105.89 2gbx s ILE 54 Ca 0.19 0.04 -0.26 0.00 -0.26 0.00 0.00 60.65 60.37 2gbx s ILE 54 Cb 0.06 -0.20 -0.06 0.00 1.25 0.00 0.00 42.46 43.51 2gbx s ILE 54 CO -0.00 0.02 0.80 0.42 0.24 0.00 0.00 174.94 176.41 2gbx s THR 55 N 0.33 4.67 0.32 8.37 -4.23 -0.89 -1.25 115.64 122.96 2gbx s THR 55 Ca -0.02 1.71 -0.07 0.00 -1.18 0.00 0.00 61.69 62.13 2gbx s THR 55 Cb -0.03 -4.15 0.01 0.00 1.34 0.00 0.00 72.50 69.66 2gbx s THR 55 CO -0.01 0.37 0.51 0.28 -0.54 0.00 0.00 174.62 175.22 2gbx s THR 56 N -0.13 0.00 -0.11 3.99 -1.32 0.31 -4.93 115.64 113.45 2gbx s THR 56 Ca 0.40 -1.48 -0.01 0.00 -1.21 0.00 0.00 61.69 59.38 2gbx s THR 56 Cb -0.21 -2.55 -0.03 0.00 -1.51 0.00 0.00 72.50 68.20 2gbx s THR 56 CO 0.24 0.00 -0.05 -0.31 -2.21 0.00 0.00 174.62 172.29 2gbx s TYR 57 N -3.25 2.99 -0.88 9.09 2.02 -1.26 -0.73 117.35 125.32 2gbx s TYR 57 Ca 0.27 -0.14 -0.08 0.00 -0.37 0.00 0.00 57.07 56.75 2gbx s TYR 57 Cb -0.01 -1.83 0.22 0.00 -0.40 0.00 0.00 41.96 39.94 2gbx s TYR 57 CO 0.16 0.15 0.80 -1.64 -1.57 0.00 0.00 175.55 173.45 2gbx s MET 58 N -0.24 3.49 6.15 -0.62 -1.94 0.94 -4.89 119.30 122.19 2gbx s MET 58 Ca 0.04 -2.86 0.00 0.00 -1.71 0.00 0.00 55.69 51.16 2gbx s MET 58 Cb -0.13 -4.22 0.00 0.00 2.01 0.00 0.00 34.83 32.49 2gbx s MET 58 CO 0.02 -1.25 0.00 0.00 -0.01 0.00 0.00 175.02 173.79 2gbx n ALA 59 N 3.17 0.00 0.84 3.03 0.00 -1.26 -2.17 120.51 124.12 2gbx n ALA 59 Ca 0.17 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.70 2gbx n ALA 59 Cb 0.41 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.87 2gbx n ALA 59 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2gbx n GLU 60 N 1.08 1.51 -3.09 0.00 1.02 -1.26 -4.45 120.64 115.44 2gbx n GLU 60 Ca 0.00 -1.00 -0.40 0.00 -0.02 0.00 0.00 57.16 55.74 2gbx n GLU 60 Cb 0.00 -1.37 -0.05 0.00 -0.02 0.00 0.00 31.44 30.00 2gbx n GLU 60 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2gbx s ASP 61 N -2.10 6.86 0.16 1.62 1.01 -0.92 -5.06 116.67 118.24 2gbx s ASP 61 Ca 0.17 1.04 -0.30 0.00 0.71 0.00 0.00 52.55 54.17 2gbx s ASP 61 Cb 0.15 -2.38 -0.07 0.00 1.01 0.00 0.00 42.92 41.63 2gbx s ASP 61 CO 0.45 -0.16 0.96 -0.54 0.21 0.00 0.00 175.17 176.09 2gbx s LYS 62 N 1.16 4.76 0.02 8.23 1.02 -1.26 -0.04 119.74 133.62 2gbx s LYS 62 Ca 0.34 1.47 0.00 0.00 0.02 0.00 0.00 55.97 57.80 2gbx s LYS 62 Cb -0.17 -3.34 -0.02 0.00 -0.52 0.00 0.00 37.83 33.79 2gbx s LYS 62 CO 0.14 0.33 -0.03 0.14 -0.92 0.00 0.00 175.35 175.01 2gbx s VAL 63 N -0.46 0.17 -0.42 3.17 -7.23 0.09 -0.29 120.40 115.43 2gbx s VAL 63 Ca 0.45 -0.74 -0.08 0.00 -1.81 0.00 0.00 61.98 59.80 2gbx s VAL 63 Cb -0.24 -0.27 0.09 0.00 0.56 0.00 0.00 36.38 36.51 2gbx s VAL 63 CO 0.31 -0.37 0.25 -0.63 -0.31 0.00 0.00 175.10 174.36 2gbx s ILE 64 N -1.13 3.99 -0.22 -0.62 1.01 -0.40 -0.53 121.20 123.31 2gbx s ILE 64 Ca -0.11 -1.59 -0.26 0.00 0.00 0.00 0.00 60.65 58.68 2gbx s ILE 64 Cb -0.08 -3.52 -0.00 0.00 0.01 0.00 0.00 42.46 38.86 2gbx s ILE 64 CO -0.01 -0.57 0.88 -0.22 0.00 0.00 0.00 174.94 175.02 2gbx s LEU 65 N 1.35 4.11 -0.02 2.97 2.96 -0.38 -3.26 118.68 126.41 2gbx s LEU 65 Ca 0.04 1.15 0.04 0.00 -0.22 0.00 0.00 54.13 55.15 2gbx s LEU 65 Cb -0.23 -3.28 -0.01 0.00 0.50 0.00 0.00 46.19 43.17 2gbx s LEU 65 CO 0.00 -0.51 -0.15 -0.55 -1.32 0.00 0.00 176.35 173.82 2gbx s SER 66 N 1.26 1.80 -0.24 3.68 0.15 -0.34 -0.56 113.70 119.45 2gbx s SER 66 Ca 0.38 -0.28 -0.27 0.00 0.70 0.00 0.00 55.95 56.48 2gbx s SER 66 Cb -0.16 -0.33 0.00 0.00 -1.71 0.00 0.00 66.02 63.83 2gbx s SER 66 CO 0.09 0.16 0.94 -2.28 1.20 0.00 0.00 173.24 173.34 2gbx s HIS 67 N -0.16 3.33 0.67 3.44 2.46 0.64 -2.24 115.29 123.43 2gbx s HIS 67 Ca 0.02 1.30 -0.11 0.00 0.47 0.00 0.00 55.06 56.74 2gbx s HIS 67 Cb -0.08 -3.16 -0.01 0.00 -0.13 0.00 0.00 32.58 29.20 2gbx s HIS 67 CO 0.00 -0.44 1.06 -1.14 -2.47 0.00 0.00 174.74 171.75 2gbx s GLN 68 N 3.02 3.15 0.31 2.88 2.00 -0.08 -1.15 119.66 129.79 2gbx s GLN 68 Ca 0.39 0.73 0.08 0.00 -2.00 0.00 0.00 55.36 54.57 2gbx s GLN 68 Cb -0.15 -2.03 0.51 0.00 0.80 0.00 0.00 33.01 32.13 2gbx s GLN 68 CO 0.07 -0.89 1.72 0.77 -0.50 0.00 0.00 175.29 176.46 2gbx h SER 69 N -0.56 0.17 1.32 6.67 0.02 -1.93 -3.00 113.55 116.25 2gbx h SER 69 Ca -0.44 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 2gbx h SER 69 Cb 1.21 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2gbx h SER 69 CO 0.61 0.57 0.00 -2.24 -1.14 0.00 0.00 176.83 174.63 2gbx h ASP 70 N 0.13 0.00 0.00 3.07 3.04 -2.02 -3.47 116.42 117.17 2gbx h ASP 70 Ca 0.01 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.80 2gbx h ASP 70 Cb 0.81 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.10 2gbx h ASP 70 CO 0.06 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.87 2gbx n GLY 71 N 0.94 2.19 3.83 7.15 0.00 -1.13 -5.11 105.19 113.05 2gbx n GLY 71 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 2gbx n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2gbx s THR 72 N -2.01 1.94 -0.14 2.61 -4.23 -1.26 -4.72 115.64 107.82 2gbx s THR 72 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 2gbx s THR 72 Cb 0.00 -2.84 -0.01 0.00 1.34 0.00 0.00 72.50 71.00 2gbx s THR 72 CO 0.00 0.00 -0.15 -0.36 -0.54 0.00 0.00 174.62 173.57 2gbx s PHE 73 N -3.49 2.78 0.10 3.99 0.08 -1.26 -0.91 117.98 119.27 2gbx s PHE 73 Ca 0.68 -0.88 0.07 0.00 0.12 0.00 0.00 56.93 56.92 2gbx s PHE 73 Cb -0.10 -1.87 -0.03 0.00 -0.57 0.00 0.00 43.02 40.45 2gbx s PHE 73 CO 0.53 -0.37 -0.17 1.03 -0.10 0.00 0.00 175.22 176.14 2gbx s ARG 74 N 0.62 1.02 0.02 0.44 1.81 -0.95 -4.74 118.95 117.18 2gbx s ARG 74 Ca -0.08 -1.13 0.00 0.00 -1.72 0.00 0.00 55.73 52.80 2gbx s ARG 74 Cb -0.16 -1.11 -0.02 0.00 -0.45 0.00 0.00 34.95 33.22 2gbx s ARG 74 CO 0.03 0.24 -0.03 0.00 -0.68 0.00 0.00 175.30 174.86 2gbx s ALA 75 N -1.47 0.16 0.14 2.13 0.00 -1.26 -1.20 121.76 120.26 2gbx s ALA 75 Ca 0.05 -0.56 -0.15 0.00 0.00 0.00 0.00 51.96 51.29 2gbx s ALA 75 Cb -0.09 0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.19 2gbx s ALA 75 CO 0.04 -0.13 0.40 -0.59 0.00 0.00 0.00 175.76 175.48 2gbx s PHE 76 N -1.33 -0.13 0.11 0.00 -0.71 -1.20 -0.08 117.98 114.64 2gbx s PHE 76 Ca -0.14 -0.21 -0.31 0.00 -1.04 0.00 0.00 56.93 55.23 2gbx s PHE 76 Cb -0.09 0.24 -0.08 0.00 -1.21 0.00 0.00 43.02 41.88 2gbx s PHE 76 CO -0.01 -0.73 1.47 0.42 -1.34 0.00 0.00 175.22 175.03 2gbx s ILE 77 N -3.83 3.16 -1.24 -4.49 -1.09 0.25 -1.28 121.20 112.68 2gbx s ILE 77 Ca 0.05 0.78 -0.16 0.00 -2.23 0.00 0.00 60.65 59.10 2gbx s ILE 77 Cb 0.02 -3.50 -0.03 0.00 -1.58 0.00 0.00 42.46 37.36 2gbx s ILE 77 CO -0.10 0.04 2.18 -3.20 -1.23 0.00 0.00 174.94 172.64 2gbx n ASN 78 N 4.35 3.81 -3.67 3.58 5.15 0.60 -4.59 115.26 124.49 2gbx n ASN 78 Ca 0.13 -2.76 -0.09 0.00 -0.60 0.00 0.00 54.58 51.26 2gbx n ASN 78 Cb 0.41 -1.47 -0.09 0.00 -0.53 0.00 0.00 39.78 38.10 2gbx n ASN 78 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2gbx s SER 79 N 3.68 -0.62 0.37 1.20 0.15 -1.26 -4.11 113.70 113.11 2gbx s SER 79 Ca 0.51 1.10 -0.27 0.00 0.70 0.00 0.00 55.95 58.00 2gbx s SER 79 Cb 0.14 1.10 -0.09 0.00 -1.71 0.00 0.00 66.02 65.46 2gbx s SER 79 CO -0.02 -0.21 1.20 0.00 1.20 0.00 0.00 173.24 175.40 2gbx n SER 81 N 0.38 0.41 0.00 0.00 3.41 -1.26 -1.84 113.62 114.72 2gbx n SER 81 Ca 0.03 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.20 2gbx n SER 81 Cb 0.45 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 2gbx n SER 81 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2gbx n HIS 82 N -1.91 0.00 -0.01 7.33 -0.00 -1.26 -4.69 115.22 114.68 2gbx n HIS 82 Ca 0.05 0.00 0.01 0.00 -0.00 0.00 0.00 57.72 57.78 2gbx n HIS 82 Cb 0.32 -0.31 0.02 0.00 -0.00 0.00 0.00 29.99 30.02 2gbx n HIS 82 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 2gbx n ARG 83 N -1.44 2.38 -0.50 1.57 5.12 -1.26 -5.00 116.66 117.53 2gbx n ARG 83 Ca 0.00 -1.42 0.00 0.00 -1.93 0.00 0.00 57.85 54.50 2gbx n ARG 83 Cb 0.00 -1.04 0.00 0.00 -1.16 0.00 0.00 32.46 30.26 2gbx n ARG 83 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2gbx n GLY 84 N -0.29 0.84 3.75 -0.13 0.00 -0.77 -5.02 105.19 103.57 2gbx n GLY 84 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 2gbx n GLY 84 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2gbx s ASN 85 N -3.01 5.09 0.18 1.61 3.84 -1.26 -4.05 114.94 117.34 2gbx s ASN 85 Ca 0.00 2.58 -0.31 0.00 0.21 0.00 0.00 52.86 55.34 2gbx s ASN 85 Cb 0.00 -2.62 -0.09 0.00 -0.55 0.00 0.00 41.25 37.99 2gbx s ASN 85 CO 0.00 -1.68 1.45 -1.58 -2.79 0.00 0.00 177.10 172.50 2gbx s GLN 86 N -3.17 4.28 -0.12 0.43 0.74 -1.26 0.47 119.66 121.03 2gbx s GLN 86 Ca 0.76 2.22 -0.25 0.00 0.05 0.00 0.00 55.36 58.15 2gbx s GLN 86 Cb -0.36 -3.17 -0.22 0.00 1.10 0.00 0.00 33.01 30.36 2gbx s GLN 86 CO 0.40 -0.46 0.71 0.82 -0.55 0.00 0.00 175.29 176.22 2gbx h ILE 87 N 3.92 1.49 -3.74 -2.34 2.04 -1.90 -3.41 117.51 113.57 2gbx h ILE 87 Ca -0.44 -2.03 -0.55 0.00 1.00 0.00 0.00 64.86 62.85 2gbx h ILE 87 Cb 1.21 2.78 -0.32 0.00 -0.74 0.00 0.00 36.82 39.75 2gbx h ILE 87 CO 0.84 0.49 -0.83 0.00 0.00 0.00 0.00 178.15 178.65 2gbx n HIS 89 N 3.34 0.00 -2.28 0.00 8.25 -1.26 -5.01 115.22 118.25 2gbx n HIS 89 Ca -0.19 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 56.88 2gbx n HIS 89 Cb 0.53 -0.16 -0.02 0.00 1.12 0.00 0.00 29.99 31.46 2gbx n HIS 89 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2gbx s ALA 90 N -2.63 3.28 0.17 -1.41 0.00 -1.26 -4.95 121.76 114.95 2gbx s ALA 90 Ca 0.00 1.02 -0.08 0.00 0.00 0.00 0.00 51.96 52.90 2gbx s ALA 90 Cb 0.10 -3.39 0.05 0.00 0.00 0.00 0.00 23.12 19.88 2gbx s ALA 90 CO 0.58 -0.49 1.55 -0.44 0.00 0.00 0.00 175.76 176.96 2gbx h ASP 91 N 3.01 0.94 -5.00 0.00 3.32 -1.95 -3.37 116.42 113.38 2gbx h ASP 91 Ca -0.48 -0.37 0.06 0.00 0.02 0.00 0.00 57.03 56.25 2gbx h ASP 91 Cb 1.23 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 40.46 2gbx h ASP 91 CO 0.64 1.15 0.23 -0.94 -1.72 0.00 0.00 179.24 178.59 2gbx s SER 92 N -6.77 -0.30 0.00 6.45 1.04 -1.26 -2.09 113.70 110.77 2gbx s SER 92 Ca -0.11 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 55.80 2gbx s SER 92 Cb 0.12 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.95 2gbx s SER 92 CO 0.86 -1.29 0.00 0.61 0.98 0.00 0.00 173.24 174.40 2gbx n GLY 93 N -0.45 -1.15 3.18 7.32 0.00 -1.12 -5.01 105.19 107.96 2gbx n GLY 93 Ca -0.06 -1.34 -0.32 0.00 0.00 0.00 0.00 46.02 44.29 2gbx n GLY 93 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2gbx s ASN 94 N -3.60 3.12 -0.18 1.61 3.84 -1.26 -0.92 114.94 117.54 2gbx s ASN 94 Ca 0.00 -0.59 -0.10 0.00 0.21 0.00 0.00 52.86 52.38 2gbx s ASN 94 Cb 0.00 -1.44 0.06 0.00 -0.55 0.00 0.00 41.25 39.32 2gbx s ASN 94 CO 0.00 0.10 0.43 0.00 -2.79 0.00 0.00 177.10 174.83 2gbx s ALA 95 N 0.71 -1.10 -0.52 1.71 0.00 -0.62 -4.96 121.76 116.98 2gbx s ALA 95 Ca -0.10 1.58 0.24 0.00 0.00 0.00 0.00 51.96 53.69 2gbx s ALA 95 Cb -0.16 -0.97 0.43 0.00 0.00 0.00 0.00 23.12 22.42 2gbx s ALA 95 CO 0.00 -0.28 1.54 0.87 0.00 0.00 0.00 175.76 177.89 2gbx h LYS 96 N 7.14 0.00 -2.23 0.00 1.57 -1.97 -3.45 116.57 117.63 2gbx h LYS 96 Ca -0.36 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.35 2gbx h LYS 96 Cb 1.18 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.29 2gbx h LYS 96 CO 0.28 0.00 0.06 0.00 -0.57 0.00 0.00 179.45 179.22 2gbx s ALA 97 N -3.19 -1.55 -0.19 3.86 0.00 -1.26 -4.19 121.76 115.24 2gbx s ALA 97 Ca 0.07 1.37 -0.06 0.00 0.00 0.00 0.00 51.96 53.34 2gbx s ALA 97 Cb 0.09 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.76 2gbx s ALA 97 CO 0.67 -0.33 0.03 -0.06 0.00 0.00 0.00 175.76 176.08 2gbx s PHE 98 N -0.58 3.13 -0.14 0.00 0.08 0.51 -4.92 117.98 116.06 2gbx s PHE 98 Ca -0.07 -0.17 -0.04 0.00 0.12 0.00 0.00 56.93 56.77 2gbx s PHE 98 Cb -0.03 -2.08 -0.03 0.00 -0.57 0.00 0.00 43.02 40.32 2gbx s PHE 98 CO 0.05 -0.03 -0.00 0.08 -0.10 0.00 0.00 175.22 175.22 2gbx s VAL 99 N 0.66 4.21 0.30 -0.44 1.01 -1.26 0.69 120.40 125.57 2gbx s VAL 99 Ca 0.01 -0.25 -0.28 0.00 0.00 0.00 0.00 61.98 61.46 2gbx s VAL 99 Cb -0.14 -2.84 -0.09 0.00 0.00 0.00 0.00 36.38 33.31 2gbx s VAL 99 CO 0.02 0.51 1.01 0.00 0.00 0.00 0.00 175.10 176.64 2gbx h ASN 101 N 3.55 0.00 0.06 0.00 2.35 -1.80 -2.90 115.58 116.85 2gbx h ASN 101 Ca -0.46 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.28 2gbx h ASN 101 Cb 1.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.57 2gbx h ASN 101 CO 0.66 0.00 -0.03 0.22 -1.65 0.00 0.00 177.43 176.63 2gbx h TYR 102 N 0.00 -0.08 0.00 1.19 5.03 -1.93 -3.44 116.97 117.74 2gbx h TYR 102 Ca 0.00 -0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.25 2gbx h TYR 102 Cb 0.77 0.03 -0.01 0.00 1.55 0.00 0.00 36.73 39.07 2gbx h TYR 102 CO 0.00 -0.05 -1.32 0.72 -1.32 0.00 0.00 178.16 176.19 2gbx n HIS 103 N -2.72 0.00 0.00 -3.82 8.25 -1.26 -5.05 115.22 110.62 2gbx n HIS 103 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2gbx n HIS 103 Cb 0.03 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 30.93 2gbx n HIS 103 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gbx n GLY 104 N 2.50 1.70 3.63 -1.41 0.00 -1.09 -4.83 105.19 105.68 2gbx n GLY 104 Ca -0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 2gbx n GLY 104 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2gbx s TRP 105 N -2.00 1.56 -0.17 1.61 0.52 -1.26 -4.39 118.94 114.82 2gbx s TRP 105 Ca 0.00 0.25 -0.26 0.00 0.02 0.00 0.00 56.10 56.11 2gbx s TRP 105 Cb 0.00 -4.04 -0.01 0.00 -1.15 0.00 0.00 33.47 28.26 2gbx s TRP 105 CO 0.00 -4.07 0.86 0.08 0.02 0.00 0.00 176.95 173.84 2gbx s VAL 106 N 5.97 4.86 0.03 4.03 1.01 0.18 -2.45 120.40 134.03 2gbx s VAL 106 Ca 0.86 1.70 0.02 0.00 0.00 0.00 0.00 61.98 64.56 2gbx s VAL 106 Cb -0.33 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 31.85 2gbx s VAL 106 CO 0.35 0.01 0.01 -0.36 0.00 0.00 0.00 175.10 175.11 2gbx s PHE 107 N 2.20 3.07 0.00 5.22 0.08 0.22 -2.05 117.98 126.72 2gbx s PHE 107 Ca 0.40 0.06 0.00 0.00 0.12 0.00 0.00 56.93 57.51 2gbx s PHE 107 Cb -0.17 -1.64 0.00 0.00 -0.57 0.00 0.00 43.02 40.65 2gbx s PHE 107 CO 0.13 0.47 0.00 0.41 -0.10 0.00 0.00 175.22 176.13 2gbx n GLY 108 N 1.12 -1.65 0.18 4.36 0.00 0.28 -0.37 105.19 109.13 2gbx n GLY 108 Ca -0.13 -1.57 0.12 0.00 0.00 0.00 0.00 46.02 44.44 2gbx n GLY 108 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2gbx h GLN 109 N 0.00 0.00 -0.44 1.61 4.15 -1.87 -3.11 115.11 115.45 2gbx h GLN 109 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2gbx h GLN 109 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 2gbx h GLN 109 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 178.83 176.50 2gbx n ASP 110 N -2.86 3.50 0.00 -0.69 5.75 -1.26 -4.76 116.55 116.22 2gbx n ASP 110 Ca 0.04 -2.22 0.00 0.00 -0.01 0.00 0.00 54.79 52.60 2gbx n ASP 110 Cb 0.51 -0.37 0.00 0.00 -1.03 0.00 0.00 41.12 40.23 2gbx n ASP 110 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2gbx n GLY 111 N 0.62 0.64 3.74 6.12 0.00 -1.18 -4.81 105.19 110.33 2gbx n GLY 111 Ca 0.17 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2gbx n GLY 111 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gbx s SER 112 N -2.02 7.52 -0.71 1.61 0.01 -1.26 -0.12 113.70 118.73 2gbx s SER 112 Ca 0.00 1.90 -0.26 0.00 1.31 0.00 0.00 55.95 58.90 2gbx s SER 112 Cb 0.00 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.62 2gbx s SER 112 CO 0.00 -0.00 1.77 -0.22 0.41 0.00 0.00 173.24 175.20 2gbx s LEU 113 N -0.51 3.26 0.02 2.44 2.96 -1.26 0.10 118.68 125.69 2gbx s LEU 113 Ca 0.45 -0.06 -0.05 0.00 -0.22 0.00 0.00 54.13 54.24 2gbx s LEU 113 Cb -0.25 -2.54 -0.29 0.00 0.50 0.00 0.00 46.19 43.61 2gbx s LEU 113 CO 0.31 -2.33 0.93 -0.37 -1.32 0.00 0.00 176.35 173.57 2gbx h VAL 114 N 6.83 1.24 -2.19 1.68 -1.51 -1.74 -3.45 116.25 117.12 2gbx h VAL 114 Ca -0.17 -2.83 -0.06 0.00 -1.23 0.00 0.00 66.70 62.41 2gbx h VAL 114 Cb 1.11 2.84 -0.18 0.00 -2.13 0.00 0.00 31.29 32.92 2gbx h VAL 114 CO 1.24 0.84 0.17 -0.62 -1.23 0.00 0.00 177.57 177.96 2gbx s ASP 115 N -7.10 -0.62 -0.02 4.19 2.15 -1.08 -5.05 116.67 109.14 2gbx s ASP 115 Ca -0.08 0.59 0.01 0.00 0.43 0.00 0.00 52.55 53.50 2gbx s ASP 115 Cb 0.06 0.53 0.01 0.00 -0.30 0.00 0.00 42.92 43.23 2gbx s ASP 115 CO 0.87 -0.65 -0.03 0.68 -0.17 0.00 0.00 175.17 175.87 2gbx s VAL 116 N -1.54 0.34 0.32 1.11 -7.23 -1.26 -0.65 120.40 111.49 2gbx s VAL 116 Ca -0.10 -0.10 -0.29 0.00 -1.81 0.00 0.00 61.98 59.69 2gbx s VAL 116 Cb -0.00 -0.34 -0.13 0.00 0.56 0.00 0.00 36.38 36.47 2gbx s VAL 116 CO 0.07 0.14 1.31 -2.65 -0.31 0.00 0.00 175.10 173.66 2gbx n PRO 117 N 3.49 2.10 -3.58 4.82 -0.02 -1.26 -3.21 135.00 137.33 2gbx n PRO 117 Ca -0.19 0.74 -0.20 0.00 -2.02 0.00 0.00 63.50 61.83 2gbx n PRO 117 Cb 0.55 -2.34 0.05 0.00 -0.02 0.00 0.00 33.50 31.74 2gbx n PRO 117 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2gbx n LEU 118 N 1.11 -3.56 0.00 2.45 4.77 -1.26 -4.93 117.00 115.57 2gbx n LEU 118 Ca 0.06 -0.76 -0.18 0.00 -0.03 0.00 0.00 56.01 55.10 2gbx n LEU 118 Cb 0.35 -2.83 -0.10 0.00 -2.33 0.00 0.00 43.42 38.51 2gbx n LEU 118 CO 0.62 0.38 0.23 -0.08 -1.33 0.00 0.00 177.39 177.21 2gbx h GLU 119 N -1.82 0.60 0.05 3.23 4.81 -1.96 -2.23 114.58 117.25 2gbx h GLU 119 Ca -0.61 -0.57 -0.23 0.00 -0.13 0.00 0.00 59.36 57.82 2gbx h GLU 119 Cb 1.35 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.86 2gbx h GLU 119 CO 0.53 1.19 -1.08 0.77 -0.73 0.00 0.00 179.01 179.69 2gbx h SER 120 N 0.22 0.19 0.14 1.04 0.02 -1.91 0.10 113.55 113.35 2gbx h SER 120 Ca -0.08 -0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 60.67 2gbx h SER 120 Cb 1.41 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.89 2gbx h SER 120 CO 0.15 1.13 -0.07 0.03 -1.14 0.00 0.00 176.83 176.93 2gbx h ARG 121 N 0.04 -0.18 0.07 3.45 2.47 -1.96 -3.27 114.38 115.00 2gbx h ARG 121 Ca -0.06 0.01 -0.31 0.00 -1.26 0.00 0.00 59.98 58.37 2gbx h ARG 121 Cb 1.81 0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 30.15 2gbx h ARG 121 CO 0.16 -0.12 -1.67 0.00 0.56 0.00 0.00 179.97 178.90 2gbx h TYR 123 N -0.44 0.00 -3.79 0.00 0.05 -1.47 -3.48 116.97 107.84 2gbx h TYR 123 Ca -0.39 0.00 -0.40 0.00 0.05 0.00 0.00 58.73 57.99 2gbx h TYR 123 Cb 1.69 0.00 0.01 0.00 1.01 0.00 0.00 36.73 39.45 2gbx h TYR 123 CO 0.08 0.00 -0.55 0.72 -1.05 0.00 0.00 178.16 177.36 2gbx n HIS 124 N -2.94 -1.48 -2.42 4.88 8.25 0.12 -2.08 115.22 119.56 2gbx n HIS 124 Ca 0.03 0.24 -0.15 0.00 -0.26 0.00 0.00 57.72 57.58 2gbx n HIS 124 Cb 0.53 -4.08 -0.01 0.00 1.12 0.00 0.00 29.99 27.55 2gbx n HIS 124 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2gbx n ASN 125 N -2.23 -4.64 -0.94 0.41 5.03 0.09 -4.86 115.26 108.12 2gbx n ASN 125 Ca -0.17 0.12 0.12 0.00 0.87 0.00 0.00 54.58 55.51 2gbx n ASN 125 Cb 0.65 -3.91 0.10 0.00 -1.02 0.00 0.00 39.78 35.59 2gbx n ASN 125 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 2gbx n SER 126 N -1.87 2.95 -4.62 6.41 7.64 -0.88 -4.91 113.62 118.33 2gbx n SER 126 Ca -0.18 -1.97 -0.43 0.00 1.01 0.00 0.00 58.87 57.30 2gbx n SER 126 Cb 0.64 0.01 -0.03 0.00 -1.01 0.00 0.00 64.21 63.81 2gbx n SER 126 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2gbx s LEU 127 N -1.96 3.98 -0.92 -3.43 2.96 -1.26 -4.97 118.68 113.07 2gbx s LEU 127 Ca 0.27 0.73 -0.24 0.00 -0.22 0.00 0.00 54.13 54.68 2gbx s LEU 127 Cb 0.20 -3.33 0.02 0.00 0.50 0.00 0.00 46.19 43.58 2gbx s LEU 127 CO 0.30 -0.84 1.56 -0.62 -1.32 0.00 0.00 176.35 175.43 2gbx s ASP 128 N 1.79 6.06 0.42 3.68 -1.08 -1.26 -4.84 116.67 121.45 2gbx s ASP 128 Ca 0.40 -1.00 0.21 0.00 -0.52 0.00 0.00 52.55 51.64 2gbx s ASP 128 Cb -0.12 -2.56 0.92 0.00 -1.46 0.00 0.00 42.92 39.69 2gbx s ASP 128 CO 0.17 -1.90 1.84 0.11 0.52 0.00 0.00 175.17 175.92 2gbx h LYS 129 N 10.51 0.00 -0.16 4.34 1.57 -1.93 -3.00 116.57 127.90 2gbx h LYS 129 Ca 0.07 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 2gbx h LYS 129 Cb 1.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 2gbx h LYS 129 CO 1.34 0.28 -0.29 1.96 -0.57 0.00 0.00 179.45 182.17 2gbx h GLN 130 N 0.00 0.32 0.00 3.15 4.20 -1.88 -2.61 115.11 118.29 2gbx h GLN 130 Ca -0.00 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.59 2gbx h GLN 130 Cb 0.71 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.47 2gbx h GLN 130 CO 0.04 0.59 -0.13 1.63 -0.67 0.00 0.00 178.83 180.28 2gbx n LYS 131 N -4.11 0.19 -1.34 1.46 5.02 -1.14 -3.90 118.16 114.35 2gbx n LYS 131 Ca -0.01 0.13 -0.27 0.00 -2.02 0.00 0.00 58.31 56.15 2gbx n LYS 131 Cb 0.41 -1.70 0.11 0.00 -0.02 0.00 0.00 35.03 33.83 2gbx n LYS 131 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2gbx n LEU 132 N -2.02 6.59 -4.83 -0.35 4.77 -0.98 -5.00 117.00 115.18 2gbx n LEU 132 Ca 0.06 -4.13 -0.33 0.00 -0.03 0.00 0.00 56.01 51.58 2gbx n LEU 132 Cb 0.41 -0.81 -0.06 0.00 -2.33 0.00 0.00 43.42 40.63 2gbx n LEU 132 CO 0.31 1.44 0.57 0.00 -1.33 0.00 0.00 177.39 178.38 2gbx s ALA 133 N -3.59 3.14 0.31 -1.18 0.00 -1.24 -4.40 121.76 114.81 2gbx s ALA 133 Ca 0.58 0.24 -0.29 0.00 0.00 0.00 0.00 51.96 52.50 2gbx s ALA 133 Cb 0.47 -3.01 -0.10 0.00 0.00 0.00 0.00 23.12 20.48 2gbx s ALA 133 CO 0.03 0.16 1.31 0.00 0.00 0.00 0.00 175.76 177.26 2gbx s ALA 134 N -2.17 3.51 -0.49 0.00 0.00 0.83 -4.86 121.76 118.58 2gbx s ALA 134 Ca 0.59 1.25 -0.29 0.00 0.00 0.00 0.00 51.96 53.51 2gbx s ALA 134 Cb -0.09 -3.48 -0.10 0.00 0.00 0.00 0.00 23.12 19.44 2gbx s ALA 134 CO 0.17 -0.63 2.38 1.17 0.00 0.00 0.00 175.76 178.84 2gbx n LYS 135 N 1.07 1.06 -2.13 0.00 3.00 -1.26 -4.74 118.16 115.16 2gbx n LYS 135 Ca 0.01 0.15 -0.34 0.00 -0.00 0.00 0.00 58.31 58.13 2gbx n LYS 135 Cb 0.42 -2.92 0.01 0.00 0.00 0.00 0.00 35.03 32.54 2gbx n LYS 135 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2gbx s SER 136 N 10.04 5.64 -0.03 3.14 1.04 -1.26 -0.59 113.70 131.68 2gbx s SER 136 Ca 1.07 2.04 0.07 0.00 0.48 0.00 0.00 55.95 59.60 2gbx s SER 136 Cb -0.51 -2.56 -0.01 0.00 0.10 0.00 0.00 66.02 63.03 2gbx s SER 136 CO 0.36 -1.27 -0.23 -0.69 0.98 0.00 0.00 173.24 172.39 2gbx s VAL 137 N -2.06 1.84 0.05 5.02 1.01 0.89 -4.87 120.40 122.29 2gbx s VAL 137 Ca 0.69 -0.98 -0.30 0.00 0.00 0.00 0.00 61.98 61.39 2gbx s VAL 137 Cb -0.21 -1.55 -0.08 0.00 0.00 0.00 0.00 36.38 34.55 2gbx s VAL 137 CO 0.31 0.52 1.67 -0.13 0.00 0.00 0.00 175.10 177.48 2gbx s ARG 138 N -0.37 4.19 -0.11 2.72 0.52 -0.81 -4.09 118.95 121.01 2gbx s ARG 138 Ca 0.04 2.33 0.04 0.00 -0.52 0.00 0.00 55.73 57.61 2gbx s ARG 138 Cb -0.11 -3.68 0.00 0.00 0.52 0.00 0.00 34.95 31.68 2gbx s ARG 138 CO 0.01 -0.76 -0.23 0.08 0.02 0.00 0.00 175.30 174.41 2gbx s VAL 139 N 2.93 2.05 0.01 3.52 1.01 -1.26 -1.46 120.40 127.19 2gbx s VAL 139 Ca 0.75 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 61.73 2gbx s VAL 139 Cb -0.39 -1.78 -0.01 0.00 0.00 0.00 0.00 36.38 34.20 2gbx s VAL 139 CO 0.32 0.55 -0.02 -1.61 0.00 0.00 0.00 175.10 174.35 2gbx s GLU 140 N 0.49 0.19 -0.02 2.72 2.02 -1.19 -4.98 118.70 117.94 2gbx s GLU 140 Ca -0.15 -0.22 0.00 0.00 0.02 0.00 0.00 54.97 54.62 2gbx s GLU 140 Cb -0.17 -0.09 -0.04 0.00 0.10 0.00 0.00 34.13 33.93 2gbx s GLU 140 CO 0.06 0.02 0.02 0.95 0.02 0.00 0.00 175.26 176.32 2gbx s THR 141 N -0.43 4.33 -0.23 3.63 -4.23 -1.26 -1.56 115.64 115.88 2gbx s THR 141 Ca -0.04 -0.49 -0.03 0.00 -1.18 0.00 0.00 61.69 59.95 2gbx s THR 141 Cb -0.03 -2.92 0.08 0.00 1.34 0.00 0.00 72.50 70.96 2gbx s THR 141 CO -0.00 0.41 0.08 -0.47 -0.54 0.00 0.00 174.62 174.09 2gbx s TYR 142 N -1.08 0.89 -1.44 3.99 5.04 -0.57 -4.84 117.35 119.34 2gbx s TYR 142 Ca 0.19 -0.96 -0.10 0.00 -2.44 0.00 0.00 57.07 53.77 2gbx s TYR 142 Cb -0.12 -1.09 0.04 0.00 0.35 0.00 0.00 41.96 41.14 2gbx s TYR 142 CO 0.10 -0.70 1.00 1.63 -1.34 0.00 0.00 175.55 176.24 2gbx n LYS 143 N 5.09 -6.55 0.00 4.97 4.76 -1.26 -2.00 118.16 123.17 2gbx n LYS 143 Ca -0.07 0.76 0.00 0.00 -2.87 0.00 0.00 58.31 56.13 2gbx n LYS 143 Cb 0.45 -5.72 0.00 0.00 -1.84 0.00 0.00 35.03 27.92 2gbx n LYS 143 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2gbx n GLY 144 N -1.80 2.91 3.64 0.72 0.00 -1.26 -4.78 105.19 104.62 2gbx n GLY 144 Ca -0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2gbx n GLY 144 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gbx s PHE 145 N -1.93 2.55 -0.23 1.61 0.08 -0.84 -1.78 117.98 117.44 2gbx s PHE 145 Ca 0.00 0.79 -0.20 0.00 0.12 0.00 0.00 56.93 57.64 2gbx s PHE 145 Cb 0.00 -3.82 -0.02 0.00 -0.57 0.00 0.00 43.02 38.60 2gbx s PHE 145 CO 0.00 -2.11 0.61 0.42 -0.10 0.00 0.00 175.22 174.04 2gbx s ILE 146 N 4.33 5.02 0.39 0.64 1.01 0.33 -1.50 121.20 131.41 2gbx s ILE 146 Ca 0.60 1.11 0.08 0.00 0.00 0.00 0.00 60.65 62.44 2gbx s ILE 146 Cb -0.21 -3.92 -0.03 0.00 0.01 0.00 0.00 42.46 38.32 2gbx s ILE 146 CO 0.23 0.08 0.33 -0.36 0.00 0.00 0.00 174.94 175.21 2gbx s PHE 147 N 2.19 2.76 -0.00 3.97 0.08 -0.60 -1.50 117.98 124.87 2gbx s PHE 147 Ca 0.26 -0.44 -0.02 0.00 0.12 0.00 0.00 56.93 56.86 2gbx s PHE 147 Cb -0.16 -2.02 -0.00 0.00 -0.57 0.00 0.00 43.02 40.27 2gbx s PHE 147 CO 0.09 0.01 0.03 0.20 -0.10 0.00 0.00 175.22 175.45 2gbx s GLY 148 N -4.06 0.06 -0.03 4.36 0.00 0.11 -3.15 107.32 104.60 2gbx s GLY 148 Ca 0.45 -0.12 -0.05 0.00 0.00 0.00 0.00 44.72 45.00 2gbx s GLY 148 CO 0.27 -0.17 0.12 0.00 0.00 0.00 0.00 173.10 173.32 2gbx n HIS 150 N 2.45 0.05 -3.45 0.00 8.25 -1.26 -1.92 115.22 119.34 2gbx n HIS 150 Ca -0.16 0.02 -0.39 0.00 -0.26 0.00 0.00 57.72 56.92 2gbx n HIS 150 Cb 0.58 -0.41 -0.10 0.00 1.12 0.00 0.00 29.99 31.18 2gbx n HIS 150 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2gbx s ASP 151 N -4.21 6.16 0.38 0.41 -1.08 -1.25 -4.96 116.67 112.12 2gbx s ASP 151 Ca -0.04 -0.00 0.10 0.00 -0.52 0.00 0.00 52.55 52.09 2gbx s ASP 151 Cb 0.14 -2.18 0.76 0.00 -1.46 0.00 0.00 42.92 40.18 2gbx s ASP 151 CO 0.89 -0.21 1.89 -0.65 0.52 0.00 0.00 175.17 177.61 2gbx h PRO 152 N 8.34 0.20 0.00 4.34 0.11 -1.95 -3.03 132.00 140.01 2gbx h PRO 152 Ca -0.32 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2gbx h PRO 152 Cb 1.16 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2gbx h PRO 152 CO 0.64 0.39 0.00 0.39 -0.21 0.00 0.00 178.00 179.21 2gbx n GLU 153 N -4.24 0.45 -1.19 1.05 -0.58 -1.26 -4.86 120.64 110.01 2gbx n GLU 153 Ca -0.01 0.03 -0.31 0.00 -0.42 0.00 0.00 57.16 56.46 2gbx n GLU 153 Cb 0.30 -1.50 0.11 0.00 -0.57 0.00 0.00 31.44 29.78 2gbx n GLU 153 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2gbx s ALA 154 N -2.48 1.98 1.06 0.62 0.00 -1.15 -4.85 121.76 116.95 2gbx s ALA 154 Ca 0.27 0.21 -0.10 0.00 0.00 0.00 0.00 51.96 52.34 2gbx s ALA 154 Cb 0.18 -3.27 0.14 0.00 0.00 0.00 0.00 23.12 20.17 2gbx s ALA 154 CO 0.39 -2.02 0.66 -0.35 0.00 0.00 0.00 175.76 174.44 2gbx n PRO 155 N -3.69 -1.39 -1.68 0.00 -0.04 -1.26 -5.05 135.00 121.89 2gbx n PRO 155 Ca 0.09 -1.04 -0.31 0.00 -0.04 0.00 0.00 63.50 62.21 2gbx n PRO 155 Cb 0.53 -0.81 0.05 0.00 -0.04 0.00 0.00 33.50 33.24 2gbx n PRO 155 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2gbx s SER 156 N -3.39 5.30 0.44 3.54 1.04 -1.26 -4.86 113.70 114.51 2gbx s SER 156 Ca 0.40 1.41 0.13 0.00 0.48 0.00 0.00 55.95 58.36 2gbx s SER 156 Cb -0.02 -2.26 0.98 0.00 0.10 0.00 0.00 66.02 64.81 2gbx s SER 156 CO 0.29 -1.47 2.00 0.25 0.98 0.00 0.00 173.24 175.30 2gbx h LEU 157 N -0.74 0.10 0.31 2.42 5.85 -1.96 0.10 115.31 121.39 2gbx h LEU 157 Ca -0.45 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.24 2gbx h LEU 157 Cb 1.23 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.24 2gbx h LEU 157 CO 0.60 0.22 -0.15 -0.33 -0.34 0.00 0.00 178.44 178.44 2gbx h GLU 158 N 0.11 -0.40 -0.33 1.25 4.39 -1.93 -2.33 114.58 115.33 2gbx h GLU 158 Ca 0.02 0.03 -0.09 0.00 0.34 0.00 0.00 59.36 59.66 2gbx h GLU 158 Cb 0.25 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 2gbx h GLU 158 CO 0.01 -0.20 -0.18 -0.44 -1.16 0.00 0.00 179.01 177.04 2gbx h ASP 159 N -0.51 0.60 -0.60 1.42 3.32 -1.84 0.45 116.42 119.27 2gbx h ASP 159 Ca -0.04 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 56.81 2gbx h ASP 159 Cb 0.38 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 2gbx h ASP 159 CO 0.07 0.79 0.31 0.22 -1.72 0.00 0.00 179.24 178.91 2gbx h TYR 160 N 0.54 0.84 0.07 4.55 3.20 -0.78 -2.69 116.97 122.70 2gbx h TYR 160 Ca 0.09 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 2gbx h TYR 160 Cb 0.61 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.62 2gbx h TYR 160 CO 0.02 0.62 -0.03 -0.07 -1.64 0.00 0.00 178.16 177.07 2gbx h LEU 161 N 0.81 -0.07 0.00 2.82 3.38 -1.31 -3.43 115.31 117.51 2gbx h LEU 161 Ca 0.21 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2gbx h LEU 161 Cb 0.08 0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2gbx h LEU 161 CO -0.03 0.44 0.00 0.61 0.09 0.00 0.00 178.44 179.55 2gbx n GLY 162 N 0.31 3.19 0.12 0.83 0.00 0.16 -1.81 105.19 107.99 2gbx n GLY 162 Ca -0.09 0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.11 2gbx n GLY 162 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2gbx n GLU 163 N 9.87 0.20 0.26 1.61 0.28 -1.26 -2.52 120.64 129.08 2gbx n GLU 163 Ca 0.00 0.36 0.17 0.00 -0.16 0.00 0.00 57.16 57.53 2gbx n GLU 163 Cb 0.00 -1.84 0.64 0.00 1.43 0.00 0.00 31.44 31.67 2gbx n GLU 163 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 2gbx h PHE 164 N 0.00 0.00 -0.03 -1.84 3.57 -1.74 -2.96 116.94 113.94 2gbx h PHE 164 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2gbx h PHE 164 Cb 0.45 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.19 2gbx h PHE 164 CO 0.00 0.00 -0.02 0.00 -2.23 0.00 0.00 178.31 176.06 2gbx h ARG 165 N 0.00 0.05 -0.62 1.11 3.08 -1.66 -2.04 114.38 114.30 2gbx h ARG 165 Ca 0.00 -0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.16 2gbx h ARG 165 Cb 0.53 -0.01 -0.08 0.00 0.08 0.00 0.00 29.97 30.49 2gbx h ARG 165 CO 0.00 0.07 0.17 -0.92 -1.07 0.00 0.00 179.97 178.22 2gbx h TYR 166 N 0.05 0.27 0.03 3.04 3.20 -1.73 -1.29 116.97 120.53 2gbx h TYR 166 Ca 0.01 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.86 2gbx h TYR 166 Cb 0.07 -0.03 0.01 0.00 1.54 0.00 0.00 36.73 38.32 2gbx h TYR 166 CO 0.00 0.00 -0.22 1.88 -1.64 0.00 0.00 178.16 178.18 2gbx h TYR 167 N 0.31 0.17 -0.92 -3.82 0.05 -1.61 -3.34 116.97 107.81 2gbx h TYR 167 Ca 0.32 -0.11 0.10 0.00 0.05 0.00 0.00 58.73 59.09 2gbx h TYR 167 Cb 0.47 -0.01 -0.08 0.00 1.01 0.00 0.00 36.73 38.12 2gbx h TYR 167 CO -0.22 1.02 0.56 -0.07 -1.05 0.00 0.00 178.16 178.40 2gbx h LEU 168 N -0.72 0.83 -1.63 3.88 3.38 -1.33 -1.08 115.31 118.64 2gbx h LEU 168 Ca -0.04 0.04 0.17 0.00 0.09 0.00 0.00 57.88 58.14 2gbx h LEU 168 Cb 1.10 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.68 2gbx h LEU 168 CO 0.04 0.47 0.52 0.44 0.09 0.00 0.00 178.44 180.00 2gbx h ASP 169 N 0.93 0.33 -0.97 -0.43 5.19 -1.35 0.49 116.42 120.60 2gbx h ASP 169 Ca 0.44 0.02 0.09 0.00 -0.62 0.00 0.00 57.03 56.97 2gbx h ASP 169 Cb 0.39 -0.04 -0.08 0.00 0.18 0.00 0.00 39.33 39.78 2gbx h ASP 169 CO -0.25 0.16 0.61 0.74 -3.12 0.00 0.00 179.24 177.39 2gbx h THR 170 N 0.35 0.99 0.00 0.35 2.02 -1.31 -2.46 112.91 112.85 2gbx h THR 170 Ca 0.38 -0.36 -0.20 0.00 0.77 0.00 0.00 66.41 67.01 2gbx h THR 170 Cb 0.98 -0.14 -0.04 0.00 -1.74 0.00 0.00 68.15 67.21 2gbx h THR 170 CO -0.11 0.19 -1.74 2.30 0.37 0.00 0.00 175.52 176.53 2gbx n ILE 171 N -4.59 0.75 0.71 3.11 -5.35 -0.82 -3.31 119.36 109.86 2gbx n ILE 171 Ca 0.17 -0.29 0.12 0.00 -0.27 0.00 0.00 62.75 62.47 2gbx n ILE 171 Cb 0.27 -0.95 0.48 0.00 -1.74 0.00 0.00 39.64 37.69 2gbx n ILE 171 CO 0.00 0.00 0.00 0.79 -1.76 0.00 0.00 176.55 175.58 2gbx n TRP 172 N -2.86 0.31 -0.02 4.28 7.02 0.16 -3.78 117.44 122.55 2gbx n TRP 172 Ca -0.23 0.10 -0.06 0.00 -1.02 0.00 0.00 57.50 56.29 2gbx n TRP 172 Cb 0.75 -0.67 -0.02 0.00 -2.42 0.00 0.00 31.31 28.95 2gbx n TRP 172 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 2gbx n GLU 173 N -1.76 0.20 0.00 -0.99 4.07 -0.98 -3.67 120.64 117.51 2gbx n GLU 173 Ca 0.05 0.08 0.00 0.00 -0.06 0.00 0.00 57.16 57.24 2gbx n GLU 173 Cb 0.30 -0.85 0.00 0.00 -0.06 0.00 0.00 31.44 30.83 2gbx n GLU 173 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2gbx n GLY 174 N 2.59 3.51 2.27 8.31 0.00 -0.96 -0.98 105.19 119.92 2gbx n GLY 174 Ca -0.11 -0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 2gbx n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gbx n ALA 175 N 11.40 6.07 0.00 4.61 0.00 -1.26 -4.63 120.51 136.71 2gbx n ALA 175 Ca 0.00 -3.35 0.00 0.00 0.00 0.00 0.00 53.44 50.09 2gbx n ALA 175 Cb 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 19.45 17.83 2gbx n ALA 175 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gbx n GLY 176 N -0.97 3.03 0.20 0.00 0.00 -1.04 -4.92 105.19 101.49 2gbx n GLY 176 Ca 0.61 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.53 2gbx n GLY 176 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2gbx h GLY 177 N 0.00 -0.43 0.00 -0.02 0.00 -1.87 -3.50 103.07 97.26 2gbx h GLY 177 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2gbx h GLY 177 CO 0.00 -0.15 0.00 0.61 0.00 0.00 0.00 176.54 177.00 2gbx n GLY 178 N 0.37 -2.18 3.37 4.60 0.00 -0.15 -4.60 105.19 106.59 2gbx n GLY 178 Ca -0.08 -1.64 -0.19 0.00 0.00 0.00 0.00 46.02 44.11 2gbx n GLY 178 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2gbx s MET 179 N -0.22 1.40 0.06 1.61 -1.94 -1.24 -1.07 119.30 117.90 2gbx s MET 179 Ca 0.00 -1.65 -0.12 0.00 -1.71 0.00 0.00 55.69 52.21 2gbx s MET 179 Cb 0.00 -1.11 0.01 0.00 2.01 0.00 0.00 34.83 35.74 2gbx s MET 179 CO 0.00 0.13 0.26 -1.83 -0.01 0.00 0.00 175.02 173.56 2gbx s GLU 180 N -3.68 0.81 0.17 2.03 -1.05 0.17 -4.79 118.70 112.36 2gbx s GLU 180 Ca 0.25 -0.66 -0.11 0.00 -0.15 0.00 0.00 54.97 54.30 2gbx s GLU 180 Cb 0.01 0.34 -0.07 0.00 -0.44 0.00 0.00 34.13 33.97 2gbx s GLU 180 CO 0.08 -0.26 0.52 -0.51 0.95 0.00 0.00 175.26 176.04 2gbx s LEU 181 N -2.31 4.26 -0.08 1.83 1.43 -1.26 -0.37 118.68 122.17 2gbx s LEU 181 Ca -0.02 0.93 0.03 0.00 -1.03 0.00 0.00 54.13 54.04 2gbx s LEU 181 Cb 0.01 -3.42 -0.02 0.00 0.03 0.00 0.00 46.19 42.79 2gbx s LEU 181 CO -0.06 0.03 -0.18 -0.76 0.23 0.00 0.00 176.35 175.61 2gbx s LEU 182 N -2.39 2.50 0.00 1.79 1.43 0.05 -4.55 118.68 117.51 2gbx s LEU 182 Ca 0.42 -0.35 0.01 0.00 -1.03 0.00 0.00 54.13 53.17 2gbx s LEU 182 Cb -0.13 -1.51 -0.00 0.00 0.03 0.00 0.00 46.19 44.58 2gbx s LEU 182 CO 0.20 0.25 0.03 0.61 0.23 0.00 0.00 176.35 177.67 2gbx n GLY 183 N 2.97 3.53 3.81 -3.19 0.00 -1.26 -2.98 105.19 108.07 2gbx n GLY 183 Ca -0.18 -2.30 -0.32 0.00 0.00 0.00 0.00 46.02 43.22 2gbx n GLY 183 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2gbx s PRO 184 N -3.66 3.32 0.85 1.61 0.04 -1.26 -5.09 135.00 130.81 2gbx s PRO 184 Ca 0.05 1.12 -0.12 0.00 0.04 0.00 0.00 61.00 62.09 2gbx s PRO 184 Cb 0.00 -2.04 0.10 0.00 0.04 0.00 0.00 34.50 32.61 2gbx s PRO 184 CO 0.03 -0.80 1.14 -1.25 0.04 0.00 0.00 177.00 176.15 2gbx s PRO 185 N -4.29 1.61 -0.47 0.56 0.04 -1.26 -4.96 135.00 126.23 2gbx s PRO 185 Ca 0.62 0.33 -0.15 0.00 0.04 0.00 0.00 61.00 61.84 2gbx s PRO 185 Cb -0.15 -1.89 0.07 0.00 0.04 0.00 0.00 34.50 32.58 2gbx s PRO 185 CO 0.40 -1.88 0.38 -1.64 0.04 0.00 0.00 177.00 174.30 2gbx s MET 186 N -5.32 2.94 -0.00 4.56 -1.94 -0.79 -4.87 119.30 113.88 2gbx s MET 186 Ca 0.62 -1.37 -0.19 0.00 -1.71 0.00 0.00 55.69 53.04 2gbx s MET 186 Cb -0.14 -4.10 -0.06 0.00 2.01 0.00 0.00 34.83 32.55 2gbx s MET 186 CO 0.52 -1.03 0.55 0.15 -0.01 0.00 0.00 175.02 175.21 2gbx s LYS 187 N 1.62 4.25 -0.27 2.03 1.02 -1.26 -2.22 119.74 124.90 2gbx s LYS 187 Ca 0.04 0.66 -0.25 0.00 0.02 0.00 0.00 55.97 56.44 2gbx s LYS 187 Cb -0.24 -3.32 0.09 0.00 -0.52 0.00 0.00 37.83 33.83 2gbx s LYS 187 CO 0.06 0.43 0.81 -1.54 -0.92 0.00 0.00 175.35 174.20 2gbx s SER 188 N -0.38 -0.67 -0.05 2.83 1.04 -1.01 -4.99 113.70 110.48 2gbx s SER 188 Ca 0.29 1.28 -0.22 0.00 0.48 0.00 0.00 55.95 57.78 2gbx s SER 188 Cb -0.18 1.30 -0.04 0.00 0.10 0.00 0.00 66.02 67.20 2gbx s SER 188 CO 0.16 -0.22 0.65 -0.76 0.98 0.00 0.00 173.24 174.05 2gbx s LEU 189 N 0.36 4.34 -0.15 2.42 1.43 -1.26 -0.55 118.68 125.27 2gbx s LEU 189 Ca 0.01 1.15 0.00 0.00 -1.03 0.00 0.00 54.13 54.26 2gbx s LEU 189 Cb -0.05 -3.01 0.03 0.00 0.03 0.00 0.00 46.19 43.19 2gbx s LEU 189 CO -0.02 -0.04 -0.12 -0.22 0.23 0.00 0.00 176.35 176.18 2gbx s LEU 190 N 0.50 1.69 -1.24 1.79 2.96 -0.60 -4.98 118.68 118.81 2gbx s LEU 190 Ca 0.35 -0.53 -0.20 0.00 -0.22 0.00 0.00 54.13 53.53 2gbx s LEU 190 Cb -0.18 -1.12 -0.01 0.00 0.50 0.00 0.00 46.19 45.38 2gbx s LEU 190 CO 0.17 -0.09 1.85 0.00 -1.32 0.00 0.00 176.35 176.96 2gbx n GLN 191 N 4.79 2.39 -3.81 1.98 6.02 -1.26 -1.92 117.38 125.56 2gbx n GLN 191 Ca -0.16 -2.84 -0.09 0.00 -0.01 0.00 0.00 57.00 53.91 2gbx n GLN 191 Cb 0.49 -3.59 -0.03 0.00 1.02 0.00 0.00 30.24 28.13 2gbx n GLN 191 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2gbx s ASN 193 N -2.91 6.11 0.49 0.00 3.84 -1.25 -1.97 114.94 119.25 2gbx s ASN 193 Ca 0.12 2.00 0.32 0.00 0.21 0.00 0.00 52.86 55.51 2gbx s ASN 193 Cb -0.03 -2.56 1.39 0.00 -0.55 0.00 0.00 41.25 39.50 2gbx s ASN 193 CO 0.03 -0.95 1.95 4.11 -2.79 0.00 0.00 177.10 179.45 2gbx h TRP 194 N 1.37 0.00 0.00 0.43 5.08 -1.86 -3.03 115.95 117.93 2gbx h TRP 194 Ca -0.49 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.47 2gbx h TRP 194 Cb 1.23 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.39 2gbx h TRP 194 CO 0.55 0.00 -0.32 0.87 -1.28 0.00 0.00 178.44 178.26 2gbx h LYS 195 N 0.00 0.00 -0.12 0.12 1.57 -1.95 -3.13 116.57 113.06 2gbx h LYS 195 Ca 0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 2gbx h LYS 195 Cb 0.40 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 2gbx h LYS 195 CO 0.00 0.01 -0.22 0.28 -0.57 0.00 0.00 179.45 178.96 2gbx h VAL 196 N 0.00 1.37 -0.01 0.50 2.07 -1.91 0.20 116.25 118.47 2gbx h VAL 196 Ca -0.00 -1.47 -0.10 0.00 0.82 0.00 0.00 66.70 65.95 2gbx h VAL 196 Cb 1.01 2.03 -0.01 0.00 -1.52 0.00 0.00 31.29 32.80 2gbx h VAL 196 CO 0.00 0.43 -0.46 -0.65 0.02 0.00 0.00 177.57 176.91 2gbx h PRO 197 N -0.05 0.03 -0.03 1.57 0.11 -1.74 -2.49 132.00 129.40 2gbx h PRO 197 Ca 0.01 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.10 2gbx h PRO 197 Cb 0.79 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.90 2gbx h PRO 197 CO 0.05 0.49 0.01 0.00 -0.21 0.00 0.00 178.00 178.34 2gbx h ALA 198 N 1.51 0.04 -0.03 -0.75 0.00 -1.44 -1.26 119.26 117.33 2gbx h ALA 198 Ca -0.00 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 2gbx h ALA 198 Cb 0.83 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2gbx h ALA 198 CO 0.06 -0.36 -0.48 1.05 0.00 0.00 0.00 179.25 179.53 2gbx h GLU 199 N -0.13 0.08 0.42 0.00 4.11 -0.69 -2.69 114.58 115.68 2gbx h GLU 199 Ca 0.01 -0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.38 2gbx h GLU 199 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2gbx h GLU 199 CO -0.00 0.54 -0.20 -0.97 0.07 0.00 0.00 179.01 178.45 2gbx h ASN 200 N 0.07 -0.47 0.38 3.06 -1.24 -1.29 -3.16 115.58 112.92 2gbx h ASN 200 Ca 0.00 -0.08 0.00 0.00 0.71 0.00 0.00 56.30 56.94 2gbx h ASN 200 Cb 0.87 0.12 0.00 0.00 0.73 0.00 0.00 38.32 40.04 2gbx h ASN 200 CO 0.07 -0.20 0.00 0.49 -1.29 0.00 0.00 177.43 176.49 2gbx n PHE 201 N -5.26 0.00 -0.00 0.67 3.01 -0.49 -1.70 117.46 113.68 2gbx n PHE 201 Ca -0.11 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.26 2gbx n PHE 201 Cb 0.28 -0.24 -0.14 0.00 -0.01 0.00 0.00 39.48 39.37 2gbx n PHE 201 CO 0.00 0.00 0.00 0.97 1.01 0.00 0.00 176.76 178.74 2gbx h ILE 202 N 0.00 0.96 0.00 4.37 2.10 -1.44 -2.64 117.51 120.86 2gbx h ILE 202 Ca 0.00 -2.78 -0.05 0.00 1.08 0.00 0.00 64.86 63.11 2gbx h ILE 202 Cb 0.19 2.50 -0.05 0.00 -1.09 0.00 0.00 36.82 38.37 2gbx h ILE 202 CO 0.00 0.60 -0.01 0.61 -1.08 0.00 0.00 178.15 178.27 2gbx n GLY 203 N 1.57 -0.36 2.78 8.18 0.00 -1.21 -3.18 105.19 112.97 2gbx n GLY 203 Ca -0.16 -0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 2gbx n GLY 203 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2gbx n ASP 204 N -0.40 5.82 0.09 1.61 -0.08 -0.69 -4.37 116.55 118.53 2gbx n ASP 204 Ca -0.10 -3.52 0.12 0.00 -1.51 0.00 0.00 54.79 49.78 2gbx n ASP 204 Cb 0.61 -1.02 0.45 0.00 2.34 0.00 0.00 41.12 43.50 2gbx n ASP 204 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2gbx n GLY 205 N 0.68 -1.49 0.17 0.27 0.00 -1.25 -3.64 105.19 99.93 2gbx n GLY 205 Ca 0.32 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.34 2gbx n GLY 205 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2gbx h TYR 206 N 0.00 0.05 0.00 1.61 3.20 -1.83 -3.07 116.97 116.92 2gbx h TYR 206 Ca 0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2gbx h TYR 206 Cb 0.55 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.81 2gbx h TYR 206 CO 0.00 0.52 -0.62 1.12 -1.64 0.00 0.00 178.16 177.54 2gbx h HIS 207 N 0.03 0.00 -0.79 -3.82 2.07 -1.96 -3.39 115.15 107.30 2gbx h HIS 207 Ca -0.00 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.51 2gbx h HIS 207 Cb 0.87 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 30.81 2gbx h HIS 207 CO 0.00 0.00 0.47 0.28 -3.07 0.00 0.00 177.93 175.62 2gbx h VAL 208 N 0.00 1.22 -0.25 6.12 2.07 -1.68 0.24 116.25 123.97 2gbx h VAL 208 Ca 0.00 -0.49 -0.16 0.00 0.82 0.00 0.00 66.70 66.87 2gbx h VAL 208 Cb 0.77 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 2gbx h VAL 208 CO 0.00 0.23 -0.49 1.23 0.02 0.00 0.00 177.57 178.56 2gbx h GLY 209 N 1.08 0.74 0.00 2.17 0.00 -1.74 -2.88 103.07 102.45 2gbx h GLY 209 Ca 0.28 -0.82 -0.03 0.00 0.00 0.00 0.00 47.33 46.76 2gbx h GLY 209 CO -0.05 0.74 -0.31 -0.25 0.00 0.00 0.00 176.54 176.67 2gbx h TRP 210 N 0.54 0.00 -0.10 5.60 2.91 -1.70 -1.87 115.95 121.33 2gbx h TRP 210 Ca 0.03 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.02 2gbx h TRP 210 Cb 1.04 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 29.69 2gbx h TRP 210 CO 0.05 0.37 -0.02 1.15 -1.03 0.00 0.00 178.44 178.96 2gbx h THR 211 N -1.00 1.29 -1.50 2.65 2.02 -0.70 -3.22 112.91 112.44 2gbx h THR 211 Ca -0.05 -0.93 -0.72 0.00 0.77 0.00 0.00 66.41 65.49 2gbx h THR 211 Cb 0.49 1.71 -0.29 0.00 -1.74 0.00 0.00 68.15 68.33 2gbx h THR 211 CO -0.03 0.26 0.90 1.41 0.37 0.00 0.00 175.52 178.43 2gbx n HIS 212 N -4.78 3.11 0.16 3.16 8.25 -1.09 -4.55 115.22 119.47 2gbx n HIS 212 Ca -0.06 -2.67 0.03 0.00 -0.26 0.00 0.00 57.72 54.76 2gbx n HIS 212 Cb 0.23 -1.27 0.17 0.00 1.12 0.00 0.00 29.99 30.24 2gbx n HIS 212 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2gbx h ALA 213 N 2.51 0.81 0.09 -1.41 0.00 -1.61 -3.05 119.26 116.60 2gbx h ALA 213 Ca 0.58 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2gbx h ALA 213 Cb 0.44 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2gbx h ALA 213 CO 1.49 0.62 -0.04 0.00 0.00 0.00 0.00 179.25 181.31 2gbx h ALA 214 N 1.50 -0.12 -0.35 0.00 0.00 -1.87 -3.15 119.26 115.27 2gbx h ALA 214 Ca -0.00 -0.26 -0.16 0.00 0.00 0.00 0.00 54.91 54.49 2gbx h ALA 214 Cb 1.17 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 2gbx h ALA 214 CO 0.06 -0.28 -0.40 0.00 0.00 0.00 0.00 179.25 178.64 2gbx h ALA 215 N 0.10 0.52 -0.16 0.00 0.00 -1.87 -3.20 119.26 114.65 2gbx h ALA 215 Ca -0.01 -0.46 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 2gbx h ALA 215 Cb 0.55 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2gbx h ALA 215 CO 0.02 0.63 -0.20 -0.07 0.00 0.00 0.00 179.25 179.64 2gbx h LEU 216 N 0.69 0.26 -0.38 0.00 4.07 -1.67 -2.51 115.31 115.77 2gbx h LEU 216 Ca 0.05 -0.07 -0.17 0.00 0.08 0.00 0.00 57.88 57.77 2gbx h LEU 216 Cb 1.00 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 42.66 2gbx h LEU 216 CO 0.10 0.48 -0.43 0.77 -1.08 0.00 0.00 178.44 178.28 2gbx h SER 217 N 0.25 0.98 -0.08 -0.43 4.64 -1.54 -2.71 113.55 114.66 2gbx h SER 217 Ca 0.05 -0.47 -0.17 0.00 -0.47 0.00 0.00 61.79 60.73 2gbx h SER 217 Cb 0.50 -0.28 0.01 0.00 -0.31 0.00 0.00 62.40 62.32 2gbx h SER 217 CO 0.03 1.26 -0.60 -0.61 -0.87 0.00 0.00 176.83 176.05 2gbx h GLN 218 N 0.73 0.54 -0.58 4.77 4.15 -1.54 -3.30 115.11 119.87 2gbx h GLN 218 Ca 0.05 -0.48 -0.03 0.00 0.77 0.00 0.00 58.65 58.96 2gbx h GLN 218 Cb 1.02 0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.80 2gbx h GLN 218 CO 0.10 1.11 0.25 0.82 -1.93 0.00 0.00 178.83 179.18 2gbx h ILE 219 N 0.13 1.22 0.00 2.39 2.04 -1.52 -3.48 117.51 118.29 2gbx h ILE 219 Ca -0.05 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.15 2gbx h ILE 219 Cb 1.26 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 37.91 2gbx h ILE 219 CO 0.12 0.26 0.00 0.61 0.00 0.00 0.00 178.15 179.14 2gbx n GLY 220 N -0.86 0.19 7.00 5.37 0.00 -1.02 -5.01 105.19 110.86 2gbx n GLY 220 Ca 0.03 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.09 2gbx n GLY 220 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gbx n GLY 221 N 0.00 1.31 0.14 -0.02 0.00 -1.26 -3.57 105.19 101.79 2gbx n GLY 221 Ca 0.00 -0.53 -0.21 0.00 0.00 0.00 0.00 46.02 45.28 2gbx n GLY 221 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2gbx n GLU 222 N 12.36 0.73 -0.01 1.61 4.71 -1.26 -4.37 120.64 134.40 2gbx n GLU 222 Ca 0.00 0.26 0.13 0.00 -0.01 0.00 0.00 57.16 57.54 2gbx n GLU 222 Cb 0.00 -1.68 0.64 0.00 -1.01 0.00 0.00 31.44 29.39 2gbx n GLU 222 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2gbx n LEU 223 N -3.52 0.61 0.19 -4.62 4.77 -1.25 -3.77 117.00 109.42 2gbx n LEU 223 Ca -0.34 -0.23 0.04 0.00 -0.03 0.00 0.00 56.01 55.45 2gbx n LEU 223 Cb 1.02 -0.02 0.38 0.00 -2.33 0.00 0.00 43.42 42.46 2gbx n LEU 223 CO 0.39 0.11 0.71 0.00 -1.33 0.00 0.00 177.39 177.27 2gbx h ALA 224 N 3.96 1.19 0.00 -1.18 0.00 -1.71 -3.07 119.26 118.45 2gbx h ALA 224 Ca 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2gbx h ALA 224 Cb 0.19 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2gbx h ALA 224 CO 0.00 0.47 -0.07 0.78 0.00 0.00 0.00 179.25 180.43 2gbx h GLY 225 N 1.48 0.00 2.00 0.00 0.00 -1.87 -3.01 103.07 101.66 2gbx h GLY 225 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 2gbx h GLY 225 CO 0.05 0.00 -0.42 1.41 0.00 0.00 0.00 176.54 177.58 2gbx h LEU 226 N 0.00 0.00 -9.63 3.11 3.38 -1.81 -3.43 115.31 106.93 2gbx h LEU 226 Ca -0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 2gbx h LEU 226 Cb 0.47 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.28 2gbx h LEU 226 CO 0.01 0.42 1.03 0.00 0.09 0.00 0.00 178.44 179.99 2gbx s ALA 227 N -3.97 3.91 0.00 1.53 0.00 -1.14 -2.42 121.76 119.67 2gbx s ALA 227 Ca -0.02 1.57 0.00 0.00 0.00 0.00 0.00 51.96 53.51 2gbx s ALA 227 Cb 0.13 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.54 2gbx s ALA 227 CO 0.72 -0.98 0.00 0.41 0.00 0.00 0.00 175.76 175.91 2gbx n GLY 228 N 4.03 0.70 3.55 0.00 0.00 -0.70 -4.52 105.19 108.25 2gbx n GLY 228 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.93 2gbx n GLY 228 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2gbx n ASN 229 N 0.00 -5.79 -4.76 1.61 3.02 -1.02 -4.95 115.26 103.38 2gbx n ASN 229 Ca 0.00 -0.88 -0.40 0.00 -0.03 0.00 0.00 54.58 53.27 2gbx n ASN 229 Cb 0.00 -3.82 -0.05 0.00 -0.61 0.00 0.00 39.78 35.30 2gbx n ASN 229 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2gbx s ARG 230 N -5.38 4.72 0.00 3.52 0.52 -1.26 -4.96 118.95 116.11 2gbx s ARG 230 Ca 0.42 1.64 0.27 0.00 -0.52 0.00 0.00 55.73 57.54 2gbx s ARG 230 Cb -0.13 -3.20 0.83 0.00 0.52 0.00 0.00 34.95 32.98 2gbx s ARG 230 CO 0.83 0.34 1.63 0.00 0.02 0.00 0.00 175.30 178.12 2gbx n ALA 231 N 1.26 3.07 -0.06 2.13 0.00 -1.26 -4.16 120.51 121.48 2gbx n ALA 231 Ca -0.01 -0.28 -0.14 0.00 0.00 0.00 0.00 53.44 53.01 2gbx n ALA 231 Cb 0.46 -1.24 -0.02 0.00 0.00 0.00 0.00 19.45 18.64 2gbx n ALA 231 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2gbx h ASP 232 N 0.21 0.92 -3.26 0.00 2.03 -2.00 -3.44 116.42 110.89 2gbx h ASP 232 Ca 0.00 -0.50 -0.54 0.00 -0.73 0.00 0.00 57.03 55.26 2gbx h ASP 232 Cb 0.48 -0.26 -0.01 0.00 -0.83 0.00 0.00 39.33 38.70 2gbx h ASP 232 CO 0.00 1.28 0.52 0.27 -1.03 0.00 0.00 179.24 180.28 2gbx s ILE 233 N -4.10 4.40 -0.37 4.15 -4.36 -1.26 -4.99 121.20 114.67 2gbx s ILE 233 Ca -0.10 1.72 -0.29 0.00 -0.26 0.00 0.00 60.65 61.72 2gbx s ILE 233 Cb 0.10 -4.11 0.02 0.00 1.25 0.00 0.00 42.46 39.72 2gbx s ILE 233 CO 0.88 0.10 1.17 -2.16 0.24 0.00 0.00 174.94 175.17 2gbx s PRO 234 N 1.28 3.91 0.30 0.37 0.04 -1.26 -4.91 135.00 134.72 2gbx s PRO 234 Ca 0.55 0.96 0.20 0.00 0.04 0.00 0.00 61.00 62.75 2gbx s PRO 234 Cb -0.25 -3.84 0.13 0.00 0.04 0.00 0.00 34.50 30.58 2gbx s PRO 234 CO 0.27 -1.13 1.34 0.74 0.04 0.00 0.00 177.00 178.26 2gbx h PHE 235 N 8.84 0.00 -0.51 0.56 0.04 -1.95 -3.09 116.94 120.83 2gbx h PHE 235 Ca -0.23 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.47 2gbx h PHE 235 Cb 1.07 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.20 2gbx h PHE 235 CO 0.89 0.21 0.02 -0.44 -0.60 0.00 0.00 178.31 178.40 2gbx h ASP 236 N 0.00 0.86 1.12 2.17 5.19 -1.83 -2.52 116.42 121.41 2gbx h ASP 236 Ca -0.02 -0.29 -0.14 0.00 -0.62 0.00 0.00 57.03 55.95 2gbx h ASP 236 Cb 1.18 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 40.44 2gbx h ASP 236 CO 0.02 0.94 -0.66 0.44 -3.12 0.00 0.00 179.24 176.86 2gbx h ASP 237 N 0.75 0.00 1.39 6.45 3.32 -1.82 -3.32 116.42 123.20 2gbx h ASP 237 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2gbx h ASP 237 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 2gbx h ASP 237 CO 0.02 0.66 -0.15 -0.07 -1.72 0.00 0.00 179.24 177.98 2gbx h LEU 238 N 0.00 0.00 -7.92 1.55 4.07 -1.44 -3.48 115.31 108.09 2gbx h LEU 238 Ca -0.01 -0.05 0.10 0.00 0.08 0.00 0.00 57.88 58.01 2gbx h LEU 238 Cb 1.40 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 43.11 2gbx h LEU 238 CO 0.09 0.02 0.45 -0.83 -1.08 0.00 0.00 178.44 177.08 2gbx s GLY 239 N -3.68 0.12 0.23 0.83 0.00 -0.96 -1.23 107.32 102.63 2gbx s GLY 239 Ca 0.09 -0.38 -0.03 0.00 0.00 0.00 0.00 44.72 44.40 2gbx s GLY 239 CO 0.64 0.97 0.25 1.08 0.00 0.00 0.00 173.10 176.03 2gbx s LEU 240 N -3.19 1.02 0.04 0.66 1.43 -0.62 -3.95 118.68 114.07 2gbx s LEU 240 Ca 0.17 -1.34 0.00 0.00 -1.03 0.00 0.00 54.13 51.94 2gbx s LEU 240 Cb -0.03 0.78 -0.03 0.00 0.03 0.00 0.00 46.19 46.94 2gbx s LEU 240 CO 0.07 -0.96 -0.04 -1.58 0.23 0.00 0.00 176.35 174.06 2gbx s GLN 241 N -3.97 0.45 0.06 1.70 0.74 -1.09 -0.27 119.66 117.28 2gbx s GLN 241 Ca 0.35 -0.82 0.01 0.00 0.05 0.00 0.00 55.36 54.94 2gbx s GLN 241 Cb 0.04 0.04 -0.03 0.00 1.10 0.00 0.00 33.01 34.16 2gbx s GLN 241 CO 0.14 -0.04 -0.05 -0.06 -0.55 0.00 0.00 175.29 174.72 2gbx s PHE 242 N -2.14 0.61 -0.12 1.67 0.08 0.51 0.07 117.98 118.67 2gbx s PHE 242 Ca -0.08 -0.81 -0.25 0.00 0.12 0.00 0.00 56.93 55.91 2gbx s PHE 242 Cb -0.05 -0.39 0.06 0.00 -0.57 0.00 0.00 43.02 42.07 2gbx s PHE 242 CO -0.03 -0.22 0.59 -0.08 -0.10 0.00 0.00 175.22 175.39 2gbx s THR 243 N -2.89 0.01 0.46 0.64 -1.32 -0.54 -2.01 115.64 109.99 2gbx s THR 243 Ca 0.01 -0.08 0.01 0.00 -1.21 0.00 0.00 61.69 60.42 2gbx s THR 243 Cb 0.00 -0.88 0.01 0.00 -1.51 0.00 0.00 72.50 70.12 2gbx s THR 243 CO -0.05 -0.04 0.07 0.35 -2.21 0.00 0.00 174.62 172.74 2gbx n THR 244 N 1.71 0.00 -0.02 5.08 -2.24 0.14 -1.68 114.28 117.27 2gbx n THR 244 Ca -0.17 -2.08 -0.11 0.00 -2.27 0.00 0.00 64.05 59.42 2gbx n THR 244 Cb 0.56 0.32 -0.05 0.00 -2.10 0.00 0.00 70.33 69.06 2gbx n THR 244 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2gbx h ARG 245 N 0.00 0.18 -1.14 -0.78 1.12 -1.92 -3.18 114.38 108.66 2gbx h ARG 245 Ca -0.36 -0.01 -0.37 0.00 -1.11 0.00 0.00 59.98 58.13 2gbx h ARG 245 Cb 1.12 -0.04 -0.19 0.00 -0.01 0.00 0.00 29.97 30.85 2gbx h ARG 245 CO 0.59 0.15 0.48 0.72 -3.11 0.00 0.00 179.97 178.79 2gbx n HIS 246 N -4.98 2.01 -0.99 2.20 8.25 -1.26 -4.84 115.22 115.61 2gbx n HIS 246 Ca -0.05 -1.73 0.00 0.00 -0.26 0.00 0.00 57.72 55.69 2gbx n HIS 246 Cb 0.05 -0.86 0.00 0.00 1.12 0.00 0.00 29.99 30.30 2gbx n HIS 246 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gbx n GLY 247 N -0.36 0.39 3.77 -1.41 0.00 -1.20 -4.69 105.19 101.68 2gbx n GLY 247 Ca 0.39 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.02 2gbx n GLY 247 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2gbx s HIS 248 N -1.81 3.73 0.11 1.61 3.76 -1.26 -4.31 115.29 117.12 2gbx s HIS 248 Ca 0.00 1.29 -0.25 0.00 -0.15 0.00 0.00 55.06 55.95 2gbx s HIS 248 Cb 0.00 -2.64 0.07 0.00 1.11 0.00 0.00 32.58 31.13 2gbx s HIS 248 CO 0.00 0.39 0.80 0.20 -0.85 0.00 0.00 174.74 175.28 2gbx s GLY 249 N -0.39 -0.41 -0.06 -2.22 0.00 -1.21 0.26 107.32 103.28 2gbx s GLY 249 Ca 0.32 0.51 -0.30 0.00 0.00 0.00 0.00 44.72 45.25 2gbx s GLY 249 CO 0.19 0.16 0.74 -0.11 0.00 0.00 0.00 173.10 174.09 2gbx s PHE 250 N -3.44 -0.59 0.28 1.90 -0.71 -0.85 -2.48 117.98 112.09 2gbx s PHE 250 Ca 0.06 0.99 -0.00 0.00 -1.04 0.00 0.00 56.93 56.93 2gbx s PHE 250 Cb -0.02 0.43 -0.04 0.00 -1.21 0.00 0.00 43.02 42.18 2gbx s PHE 250 CO -0.06 -0.57 0.48 0.20 -1.34 0.00 0.00 175.22 173.94 2gbx s GLY 251 N -1.25 1.57 -0.03 1.99 0.00 -1.06 -0.36 107.32 108.18 2gbx s GLY 251 Ca -0.08 -0.85 -0.01 0.00 0.00 0.00 0.00 44.72 43.78 2gbx s GLY 251 CO 0.07 -0.79 0.06 0.54 0.00 0.00 0.00 173.10 172.98 2gbx s VAL 252 N -2.10 -0.07 -0.21 1.40 0.11 0.62 -1.50 120.40 118.66 2gbx s VAL 252 Ca 0.40 0.23 -0.07 0.00 -2.93 0.00 0.00 61.98 59.61 2gbx s VAL 252 Cb -0.10 -0.13 -0.03 0.00 -1.53 0.00 0.00 36.38 34.59 2gbx s VAL 252 CO 0.32 0.09 0.05 -0.63 -3.33 0.00 0.00 175.10 171.60 2gbx s ILE 253 N 1.21 4.42 0.24 7.04 1.01 -0.06 -1.59 121.20 133.46 2gbx s ILE 253 Ca -0.08 -0.15 -0.30 0.00 0.00 0.00 0.00 60.65 60.12 2gbx s ILE 253 Cb -0.13 -3.02 -0.09 0.00 0.01 0.00 0.00 42.46 39.24 2gbx s ILE 253 CO -0.04 0.41 1.16 -1.81 0.00 0.00 0.00 174.94 174.66 2gbx s ASP 254 N 0.95 7.14 -1.47 3.58 1.01 -0.37 -0.55 116.67 126.96 2gbx s ASP 254 Ca 0.03 2.29 -0.12 0.00 0.71 0.00 0.00 52.55 55.47 2gbx s ASP 254 Cb -0.14 -2.62 0.06 0.00 1.01 0.00 0.00 42.92 41.23 2gbx s ASP 254 CO 0.03 -0.29 1.06 0.59 0.21 0.00 0.00 175.17 176.77 2gbx n ASN 255 N 1.76 -5.38 -0.95 0.27 5.03 -1.23 -4.89 115.26 109.87 2gbx n ASN 255 Ca 0.01 -0.69 0.04 0.00 0.87 0.00 0.00 54.58 54.81 2gbx n ASN 255 Cb 0.44 -4.32 0.06 0.00 -1.02 0.00 0.00 39.78 34.95 2gbx n ASN 255 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2gbx n ALA 256 N -4.81 2.49 0.11 5.41 0.00 -1.17 -4.90 120.51 117.64 2gbx n ALA 256 Ca 0.03 -2.21 -0.12 0.00 0.00 0.00 0.00 53.44 51.14 2gbx n ALA 256 Cb 0.54 -0.58 -0.05 0.00 0.00 0.00 0.00 19.45 19.36 2gbx n ALA 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gbx h ALA 257 N 0.65 -0.41 -0.73 0.00 0.00 -1.66 -1.95 119.26 115.16 2gbx h ALA 257 Ca -0.11 -0.03 -0.69 0.00 0.00 0.00 0.00 54.91 54.08 2gbx h ALA 257 Cb 1.53 0.41 -0.17 0.00 0.00 0.00 0.00 17.79 19.55 2gbx h ALA 257 CO 0.05 -0.78 1.53 0.00 0.00 0.00 0.00 179.25 180.05 2gbx n ALA 258 N -2.60 6.58 0.01 0.00 0.00 -1.26 -3.99 120.51 119.25 2gbx n ALA 258 Ca -0.06 -3.88 -0.01 0.00 0.00 0.00 0.00 53.44 49.49 2gbx n ALA 258 Cb 0.28 -2.45 -0.00 0.00 0.00 0.00 0.00 19.45 17.28 2gbx n ALA 258 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2gbx h GLY 259 N 4.70 -0.06 2.00 0.00 0.00 -1.65 -3.37 103.07 104.68 2gbx h GLY 259 Ca 0.58 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.93 2gbx h GLY 259 CO 1.26 -0.02 -0.04 1.41 0.00 0.00 0.00 176.54 179.15 2gbx h LEU 260 N -0.28 0.00 -9.28 3.11 3.38 -1.85 -3.44 115.31 106.94 2gbx h LEU 260 Ca -0.01 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.42 2gbx h LEU 260 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2gbx h LEU 260 CO 0.01 0.04 1.03 -1.00 0.09 0.00 0.00 178.44 178.61 2gbx s HIS 261 N -3.45 2.22 -0.16 1.13 3.76 -1.26 -4.90 115.29 112.63 2gbx s HIS 261 Ca 0.04 0.37 -0.24 0.00 -0.15 0.00 0.00 55.06 55.08 2gbx s HIS 261 Cb 0.07 -3.85 -0.21 0.00 1.11 0.00 0.00 32.58 29.71 2gbx s HIS 261 CO 0.61 -3.45 0.49 0.82 -0.85 0.00 0.00 174.74 172.36 2gbx h ILE 262 N 5.41 1.31 -1.82 0.60 2.04 -1.90 -3.40 117.51 119.74 2gbx h ILE 262 Ca -0.38 -2.16 -0.63 0.00 1.00 0.00 0.00 64.86 62.68 2gbx h ILE 262 Cb 1.17 2.65 -0.13 0.00 -0.74 0.00 0.00 36.82 39.77 2gbx h ILE 262 CO 0.95 0.44 1.14 -0.54 0.00 0.00 0.00 178.15 180.14 2gbx s LYS 263 N -2.24 3.53 -0.01 2.37 1.02 -1.26 -4.75 119.74 118.39 2gbx s LYS 263 Ca -0.21 -1.28 0.02 0.00 0.02 0.00 0.00 55.97 54.52 2gbx s LYS 263 Cb 0.01 -5.02 0.03 0.00 -0.52 0.00 0.00 37.83 32.33 2gbx s LYS 263 CO 0.60 -2.01 0.84 2.89 -0.92 0.00 0.00 175.35 176.76 2gbx n ARG 264 N 7.93 1.52 0.04 1.68 1.85 -1.26 -4.87 116.66 123.54 2gbx n ARG 264 Ca 0.24 -1.23 -0.11 0.00 -1.00 0.00 0.00 57.85 55.75 2gbx n ARG 264 Cb 0.50 -0.84 -0.05 0.00 -1.05 0.00 0.00 32.46 31.02 2gbx n ARG 264 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 2gbx h GLU 265 N 0.00 -0.17 -0.57 2.89 5.08 -1.96 0.97 114.58 120.82 2gbx h GLU 265 Ca 0.00 0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.27 2gbx h GLU 265 Cb 0.80 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.07 2gbx h GLU 265 CO 0.00 -0.11 -0.03 0.78 -1.00 0.00 0.00 179.01 178.64 2gbx h GLY 266 N -0.18 1.09 1.42 -3.84 0.00 -1.96 -1.26 103.07 98.34 2gbx h GLY 266 Ca 0.05 -0.81 -0.21 0.00 0.00 0.00 0.00 47.33 46.36 2gbx h GLY 266 CO -0.14 0.75 -0.79 -0.25 0.00 0.00 0.00 176.54 176.11 2gbx h TRP 267 N 0.92 0.77 -0.15 5.60 -0.00 -1.78 -2.20 115.95 119.11 2gbx h TRP 267 Ca 0.16 -0.35 -0.10 0.00 -0.00 0.00 0.00 58.89 58.60 2gbx h TRP 267 Cb 0.58 -0.11 0.00 0.00 -0.00 0.00 0.00 29.16 29.63 2gbx h TRP 267 CO 0.04 1.15 -0.30 1.15 -0.00 0.00 0.00 178.44 180.48 2gbx h THR 268 N 0.37 1.36 -0.23 2.65 2.02 0.98 -2.98 112.91 117.08 2gbx h THR 268 Ca -0.05 -1.55 -0.04 0.00 0.77 0.00 0.00 66.41 65.54 2gbx h THR 268 Cb 1.39 1.98 -0.01 0.00 -1.74 0.00 0.00 68.15 69.77 2gbx h THR 268 CO 0.15 0.47 -0.04 0.11 0.37 0.00 0.00 175.52 176.57 2gbx h LYS 269 N 0.09 0.34 -0.50 6.66 1.57 -1.29 -2.09 116.57 121.35 2gbx h LYS 269 Ca 0.01 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 2gbx h LYS 269 Cb 0.89 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 2gbx h LYS 269 CO 0.07 0.41 0.24 0.35 -0.57 0.00 0.00 179.45 179.94 2gbx h PHE 270 N 0.33 0.71 -0.34 -1.35 3.57 -1.37 -1.52 116.94 116.98 2gbx h PHE 270 Ca 0.07 -0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.47 2gbx h PHE 270 Cb 0.29 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 2gbx h PHE 270 CO 0.01 0.56 -0.05 -0.07 -2.23 0.00 0.00 178.31 176.52 2gbx h LEU 271 N 0.66 0.64 -1.42 0.59 3.38 -1.33 -1.64 115.31 116.18 2gbx h LEU 271 Ca 0.17 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 2gbx h LEU 271 Cb 0.11 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2gbx h LEU 271 CO -0.02 0.83 -0.26 -0.33 0.09 0.00 0.00 178.44 178.75 2gbx h GLU 272 N 0.43 0.04 0.06 1.13 5.08 -1.32 0.20 114.58 120.19 2gbx h GLU 272 Ca 0.09 -0.01 -0.24 0.00 -1.00 0.00 0.00 59.36 58.20 2gbx h GLU 272 Cb 0.54 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 2gbx h GLU 272 CO 0.03 0.30 -1.08 -0.44 -1.00 0.00 0.00 179.01 176.82 2gbx h ASP 273 N 0.04 0.25 0.18 1.42 5.19 -1.19 -3.37 116.42 118.94 2gbx h ASP 273 Ca 0.00 -0.25 0.00 0.00 -0.62 0.00 0.00 57.03 56.16 2gbx h ASP 273 Cb 0.48 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.91 2gbx h ASP 273 CO 0.03 1.16 -1.18 0.35 -3.12 0.00 0.00 179.24 176.49 2gbx n THR 274 N -3.50 0.06 0.17 0.35 -2.24 -0.63 -4.34 114.28 104.16 2gbx n THR 274 Ca -0.05 -0.19 0.05 0.00 -2.27 0.00 0.00 64.05 61.59 2gbx n THR 274 Cb 0.95 0.47 0.48 0.00 -2.10 0.00 0.00 70.33 70.13 2gbx n THR 274 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 2gbx h ARG 275 N 0.00 0.13 -0.52 -0.78 0.11 -0.78 -1.93 114.38 110.61 2gbx h ARG 275 Ca 0.00 -0.02 -0.08 0.00 0.10 0.00 0.00 59.98 59.98 2gbx h ARG 275 Cb 0.68 -0.02 -0.02 0.00 1.11 0.00 0.00 29.97 31.72 2gbx h ARG 275 CO 0.00 0.24 -0.01 0.78 0.10 0.00 0.00 179.97 181.08 2gbx h GLY 276 N 0.53 0.96 1.37 0.08 0.00 -1.80 -1.10 103.07 103.10 2gbx h GLY 276 Ca 0.03 -0.67 -0.19 0.00 0.00 0.00 0.00 47.33 46.50 2gbx h GLY 276 CO 0.01 0.62 -0.67 -2.09 0.00 0.00 0.00 176.54 174.41 2gbx h GLU 277 N 0.82 0.64 -0.28 4.80 4.57 -1.70 -3.01 114.58 120.41 2gbx h GLU 277 Ca 0.15 -0.47 -0.12 0.00 -1.18 0.00 0.00 59.36 57.74 2gbx h GLU 277 Cb 0.50 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.16 2gbx h GLU 277 CO 0.02 1.09 -0.34 0.28 -1.18 0.00 0.00 179.01 178.89 2gbx h VAL 278 N 0.46 1.29 -0.35 0.32 2.07 -1.24 -1.13 116.25 117.66 2gbx h VAL 278 Ca -0.02 -1.46 -0.06 0.00 0.82 0.00 0.00 66.70 65.98 2gbx h VAL 278 Cb 1.26 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 32.45 2gbx h VAL 278 CO 0.13 0.47 -0.04 -0.09 0.02 0.00 0.00 177.57 178.06 2gbx h ARG 279 N 0.51 0.57 -0.02 1.57 2.43 -1.22 -1.09 114.38 117.13 2gbx h ARG 279 Ca 0.06 -0.14 -0.05 0.00 -0.81 0.00 0.00 59.98 59.04 2gbx h ARG 279 Cb 0.82 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 2gbx h ARG 279 CO 0.07 0.62 -0.18 -0.09 -1.51 0.00 0.00 179.97 178.88 2gbx h ARG 280 N 0.54 0.15 0.58 0.20 2.43 -1.37 -2.35 114.38 114.56 2gbx h ARG 280 Ca 0.11 -0.14 -0.03 0.00 -0.81 0.00 0.00 59.98 59.11 2gbx h ARG 280 Cb 0.40 0.03 0.01 0.00 -0.42 0.00 0.00 29.97 29.99 2gbx h ARG 280 CO 0.02 0.84 -0.28 0.87 -1.51 0.00 0.00 179.97 179.91 2gbx h LYS 281 N -0.49 -0.75 -0.55 0.20 1.57 -1.17 -3.36 116.57 112.01 2gbx h LYS 281 Ca -0.02 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2gbx h LYS 281 Cb 0.89 0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.37 2gbx h LYS 281 CO 0.04 -0.50 0.00 1.19 -0.57 0.00 0.00 179.45 179.60 2gbx n PHE 282 N -4.74 0.73 0.00 -1.35 3.72 -0.42 -5.09 117.46 110.32 2gbx n PHE 282 Ca -0.10 -0.49 0.00 0.00 -0.05 0.00 0.00 57.45 56.82 2gbx n PHE 282 Cb 0.31 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 2gbx n PHE 282 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gbx n GLY 283 N 1.15 -1.49 0.16 1.37 0.00 -0.88 -3.94 105.19 101.55 2gbx n GLY 283 Ca 0.19 -1.55 0.13 0.00 0.00 0.00 0.00 46.02 44.79 2gbx n GLY 283 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gbx h PRO 284 N 0.00 0.00 -0.22 1.61 0.13 -1.88 -2.75 132.00 128.89 2gbx h PRO 284 Ca 0.00 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.95 2gbx h PRO 284 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2gbx h PRO 284 CO 0.00 0.00 -0.59 0.93 -0.23 0.00 0.00 178.00 178.11 2gbx h GLU 285 N 0.00 0.73 0.00 0.86 3.07 -1.94 -2.80 114.58 114.49 2gbx h GLU 285 Ca 0.00 -0.49 0.00 0.00 -0.50 0.00 0.00 59.36 58.37 2gbx h GLU 285 Cb 0.74 0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.72 2gbx h GLU 285 CO 0.00 1.11 -0.94 0.00 -1.40 0.00 0.00 179.01 177.78 2gbx h ARG 286 N 0.55 0.00 -0.38 2.33 3.08 -1.68 -3.31 114.38 114.98 2gbx h ARG 286 Ca -0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 2gbx h ARG 286 Cb 1.18 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.22 2gbx h ARG 286 CO 0.12 0.00 -0.12 1.49 -1.07 0.00 0.00 179.97 180.39 2gbx h GLU 287 N 0.00 0.67 -0.79 0.04 4.81 -1.50 -0.64 114.58 117.17 2gbx h GLU 287 Ca 0.00 -0.21 0.13 0.00 -0.13 0.00 0.00 59.36 59.15 2gbx h GLU 287 Cb 0.97 -0.06 -0.09 0.00 0.63 0.00 0.00 28.75 30.20 2gbx h GLU 287 CO 0.00 0.77 0.39 -0.09 -0.73 0.00 0.00 179.01 179.34 2gbx h ARG 288 N 0.61 0.57 -0.26 1.92 2.43 -1.58 -1.61 114.38 116.45 2gbx h ARG 288 Ca 0.11 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.11 2gbx h ARG 288 Cb 0.56 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.98 2gbx h ARG 288 CO 0.03 0.38 -0.37 -0.07 -1.51 0.00 0.00 179.97 178.43 2gbx h LEU 289 N 0.59 0.78 -1.86 3.80 3.38 -1.59 -3.09 115.31 117.31 2gbx h LEU 289 Ca 0.42 -0.51 0.09 0.00 0.09 0.00 0.00 57.88 57.97 2gbx h LEU 289 Cb 0.56 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 2gbx h LEU 289 CO -0.34 1.13 0.29 0.22 0.09 0.00 0.00 178.44 179.83 2gbx h TYR 290 N 0.45 0.16 -0.01 1.13 3.20 -0.34 0.07 116.97 121.64 2gbx h TYR 290 Ca 0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2gbx h TYR 290 Cb 0.96 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.17 2gbx h TYR 290 CO 0.08 0.08 -0.30 1.28 -1.64 0.00 0.00 178.16 177.66 2gbx n LEU 291 N -4.45 1.12 -4.93 2.82 4.77 -0.68 -4.96 117.00 110.69 2gbx n LEU 291 Ca 0.06 -0.31 -0.20 0.00 -0.03 0.00 0.00 56.01 55.53 2gbx n LEU 291 Cb 0.37 -0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 41.33 2gbx n LEU 291 CO 0.35 0.21 -0.01 -0.83 -1.33 0.00 0.00 177.39 175.79 2gbx s GLY 292 N -2.53 1.63 -0.14 -0.72 0.00 0.01 -2.29 107.32 103.28 2gbx s GLY 292 Ca 0.23 -1.52 -0.20 0.00 0.00 0.00 0.00 44.72 43.23 2gbx s GLY 292 CO 0.54 -1.45 0.56 -1.58 0.00 0.00 0.00 173.10 171.18 2gbx s HIS 293 N -2.21 3.47 0.21 1.90 2.46 0.29 -4.37 115.29 117.04 2gbx s HIS 293 Ca 0.42 0.95 0.02 0.00 0.47 0.00 0.00 55.06 56.92 2gbx s HIS 293 Cb -0.08 -2.68 -0.04 0.00 -0.13 0.00 0.00 32.58 29.65 2gbx s HIS 293 CO 0.29 0.02 0.37 -1.58 -2.47 0.00 0.00 174.74 171.38 2gbx s TRP 294 N 1.14 3.48 -0.38 3.88 0.52 -0.47 -0.88 118.94 126.23 2gbx s TRP 294 Ca 0.29 0.20 0.00 0.00 0.02 0.00 0.00 56.10 56.61 2gbx s TRP 294 Cb -0.16 -1.74 0.13 0.00 -1.15 0.00 0.00 33.47 30.55 2gbx s TRP 294 CO 0.12 0.40 0.20 0.54 0.02 0.00 0.00 176.95 178.23 2gbx s ASN 295 N -3.46 3.36 0.07 2.95 4.22 -0.56 -3.46 114.94 118.07 2gbx s ASN 295 Ca 0.37 -2.24 0.03 0.00 -2.14 0.00 0.00 52.86 48.88 2gbx s ASN 295 Cb -0.10 -0.68 -0.04 0.00 1.28 0.00 0.00 41.25 41.71 2gbx s ASN 295 CO 0.30 -0.31 0.06 0.00 -2.04 0.00 0.00 177.10 175.11 2gbx s SER 297 N -2.32 1.50 -0.18 0.00 0.01 -1.03 -1.92 113.70 109.76 2gbx s SER 297 Ca 0.28 -0.17 -0.23 0.00 1.31 0.00 0.00 55.95 57.14 2gbx s SER 297 Cb -0.12 -0.57 -0.02 0.00 0.21 0.00 0.00 66.02 65.52 2gbx s SER 297 CO 0.21 -0.10 0.74 -0.63 0.41 0.00 0.00 173.24 173.87 2gbx s ILE 298 N 1.38 4.94 0.14 1.44 1.01 0.12 -3.32 121.20 126.92 2gbx s ILE 298 Ca -0.03 1.43 -0.32 0.00 0.00 0.00 0.00 60.65 61.73 2gbx s ILE 298 Cb -0.13 -4.05 -0.11 0.00 0.01 0.00 0.00 42.46 38.17 2gbx s ILE 298 CO -0.03 0.06 1.79 0.33 0.00 0.00 0.00 174.94 177.10 2gbx n PHE 299 N 5.15 2.63 -0.07 3.97 7.35 -1.26 -2.35 117.46 132.89 2gbx n PHE 299 Ca 0.02 -0.06 -0.08 0.00 -0.76 0.00 0.00 57.45 56.57 2gbx n PHE 299 Cb 0.49 -2.70 -0.09 0.00 0.35 0.00 0.00 39.48 37.53 2gbx n PHE 299 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 2gbx n PRO 300 N 5.04 1.50 -0.38 -7.13 -0.04 -1.26 -4.81 135.00 127.91 2gbx n PRO 300 Ca 0.17 0.02 0.06 0.00 -0.04 0.00 0.00 63.50 63.72 2gbx n PRO 300 Cb 0.36 -1.33 0.11 0.00 -0.04 0.00 0.00 33.50 32.60 2gbx n PRO 300 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2gbx n ASN 301 N -2.61 1.58 -4.42 3.54 6.94 -1.15 -4.92 115.26 114.22 2gbx n ASN 301 Ca -0.23 -2.89 -0.33 0.00 -0.02 0.00 0.00 54.58 51.11 2gbx n ASN 301 Cb 0.89 -0.38 -0.14 0.00 -2.36 0.00 0.00 39.78 37.79 2gbx n ASN 301 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2gbx s SER 303 N 0.07 2.01 0.11 0.00 0.01 0.66 0.11 113.70 116.66 2gbx s SER 303 Ca -0.05 -0.85 -0.25 0.00 1.31 0.00 0.00 55.95 56.11 2gbx s SER 303 Cb -0.14 -0.06 0.07 0.00 0.21 0.00 0.00 66.02 66.09 2gbx s SER 303 CO 0.04 -0.17 0.61 0.72 0.41 0.00 0.00 173.24 174.85 2gbx s PHE 304 N -2.37 -0.56 -0.34 2.43 -0.71 -0.81 -0.26 117.98 115.37 2gbx s PHE 304 Ca 0.11 0.51 0.01 0.00 -1.04 0.00 0.00 56.93 56.52 2gbx s PHE 304 Cb -0.04 0.51 0.09 0.00 -1.21 0.00 0.00 43.02 42.37 2gbx s PHE 304 CO 0.03 -0.78 0.06 -0.51 -1.34 0.00 0.00 175.22 172.68 2gbx s LEU 305 N -2.36 4.59 0.14 -1.99 1.43 -0.37 -1.33 118.68 118.79 2gbx s LEU 305 Ca -0.02 -1.87 -0.31 0.00 -1.03 0.00 0.00 54.13 50.90 2gbx s LEU 305 Cb -0.01 -1.69 -0.08 0.00 0.03 0.00 0.00 46.19 44.44 2gbx s LEU 305 CO -0.07 -0.38 1.31 -0.47 0.23 0.00 0.00 176.35 176.97 2gbx s TYR 306 N 1.06 3.30 0.00 0.29 5.04 -1.22 0.87 117.35 126.69 2gbx s TYR 306 Ca 0.05 1.15 0.00 0.00 -2.44 0.00 0.00 57.07 55.83 2gbx s TYR 306 Cb -0.20 -3.59 0.00 0.00 0.35 0.00 0.00 41.96 38.52 2gbx s TYR 306 CO -0.05 -1.91 0.00 0.41 -1.34 0.00 0.00 175.55 172.66 2gbx n GLY 307 N 2.94 2.49 0.19 8.97 0.00 -1.26 -1.37 105.19 117.15 2gbx n GLY 307 Ca 0.09 -0.71 0.06 0.00 0.00 0.00 0.00 46.02 45.45 2gbx n GLY 307 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2gbx h THR 308 N 0.00 0.94 -5.24 2.61 2.02 -1.68 -3.43 112.91 108.13 2gbx h THR 308 Ca 0.00 -1.39 -0.31 0.00 0.77 0.00 0.00 66.41 65.48 2gbx h THR 308 Cb 0.00 1.82 0.14 0.00 -1.74 0.00 0.00 68.15 68.37 2gbx h THR 308 CO 0.00 0.35 -0.65 0.59 0.37 0.00 0.00 175.52 176.18 2gbx n ASN 309 N -3.66 -3.31 -4.66 4.18 4.13 0.25 -4.29 115.26 107.90 2gbx n ASN 309 Ca -0.01 -0.52 -0.32 0.00 1.68 0.00 0.00 54.58 55.41 2gbx n ASN 309 Cb 0.46 -4.56 -0.09 0.00 -1.54 0.00 0.00 39.78 34.05 2gbx n ASN 309 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 2gbx s THR 310 N -3.31 3.95 -0.16 3.41 -1.32 -1.17 -3.28 115.64 113.77 2gbx s THR 310 Ca 0.17 -0.80 -0.03 0.00 -1.21 0.00 0.00 61.69 59.82 2gbx s THR 310 Cb -0.08 -2.79 0.06 0.00 -1.51 0.00 0.00 72.50 68.17 2gbx s THR 310 CO 0.64 0.29 0.05 0.12 -2.21 0.00 0.00 174.62 173.51 2gbx s PHE 311 N -1.14 0.63 0.09 9.09 5.36 -0.11 -1.23 117.98 130.66 2gbx s PHE 311 Ca 0.21 -0.52 0.09 0.00 -0.96 0.00 0.00 56.93 55.75 2gbx s PHE 311 Cb -0.11 -0.85 -0.04 0.00 -0.34 0.00 0.00 43.02 41.68 2gbx s PHE 311 CO 0.12 -0.52 -0.23 0.15 -1.46 0.00 0.00 175.22 173.28 2gbx s LYS 312 N 1.99 1.71 -0.08 10.12 1.02 0.64 0.12 119.74 135.26 2gbx s LYS 312 Ca 0.01 -1.19 0.00 0.00 0.02 0.00 0.00 55.97 54.82 2gbx s LYS 312 Cb -0.16 -2.03 0.02 0.00 -0.52 0.00 0.00 37.83 35.15 2gbx s LYS 312 CO -0.08 0.49 -0.06 0.42 -0.92 0.00 0.00 175.35 175.19 2gbx s ILE 313 N -1.01 0.80 -0.52 2.17 1.01 -0.36 -0.25 121.20 123.05 2gbx s ILE 313 Ca 0.15 -0.22 -0.17 0.00 0.00 0.00 0.00 60.65 60.41 2gbx s ILE 313 Cb -0.10 -0.82 0.09 0.00 0.01 0.00 0.00 42.46 41.64 2gbx s ILE 313 CO 0.06 0.31 0.54 0.26 0.00 0.00 0.00 174.94 176.11 2gbx s TRP 314 N 1.29 3.15 -0.44 3.97 0.52 -0.11 -1.84 118.94 125.48 2gbx s TRP 314 Ca -0.04 -0.95 -0.24 0.00 0.02 0.00 0.00 56.10 54.89 2gbx s TRP 314 Cb -0.14 -3.60 0.02 0.00 -1.15 0.00 0.00 33.47 28.61 2gbx s TRP 314 CO -0.03 -1.01 0.81 -1.01 0.02 0.00 0.00 176.95 175.73 2gbx s HIS 315 N 2.06 3.00 0.22 -1.98 3.76 -0.83 -4.84 115.29 116.67 2gbx s HIS 315 Ca 0.08 0.27 -0.30 0.00 -0.15 0.00 0.00 55.06 54.96 2gbx s HIS 315 Cb -0.25 -3.68 -0.09 0.00 1.11 0.00 0.00 32.58 29.67 2gbx s HIS 315 CO 0.07 -0.97 1.38 -1.25 -0.85 0.00 0.00 174.74 173.12 2gbx s PRO 316 N 3.35 4.33 -0.54 8.40 0.04 -1.26 -0.32 135.00 149.00 2gbx s PRO 316 Ca 0.31 2.17 0.07 0.00 0.04 0.00 0.00 61.00 63.60 2gbx s PRO 316 Cb -0.12 -3.16 0.28 0.00 0.04 0.00 0.00 34.50 31.54 2gbx s PRO 316 CO 0.22 -0.34 0.73 0.54 0.04 0.00 0.00 177.00 178.20 2gbx n ARG 317 N 2.56 2.09 0.00 4.56 1.74 0.47 -4.11 116.66 123.97 2gbx n ARG 317 Ca 0.07 -4.24 0.00 0.00 -0.77 0.00 0.00 57.85 52.91 2gbx n ARG 317 Cb 0.41 -1.95 0.00 0.00 -1.02 0.00 0.00 32.46 29.90 2gbx n ARG 317 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2gbx n GLY 318 N 0.70 -0.26 0.24 -0.13 0.00 -1.26 -4.10 105.19 100.37 2gbx n GLY 318 Ca 0.28 -1.86 0.15 0.00 0.00 0.00 0.00 46.02 44.58 2gbx n GLY 318 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gbx h PRO 319 N 0.00 0.00 -0.13 1.61 0.13 -1.90 -3.31 132.00 128.40 2gbx h PRO 319 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2gbx h PRO 319 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2gbx h PRO 319 CO 0.00 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.49 2gbx n HIS 320 N -2.99 0.34 -3.55 1.56 8.25 -1.26 -3.82 115.22 113.76 2gbx n HIS 320 Ca 0.02 -0.79 -0.17 0.00 -0.26 0.00 0.00 57.72 56.52 2gbx n HIS 320 Cb 0.39 -0.16 -0.06 0.00 1.12 0.00 0.00 29.99 31.28 2gbx n HIS 320 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2gbx s GLU 321 N -2.20 1.01 0.09 -0.41 2.12 -0.83 -2.15 118.70 116.32 2gbx s GLU 321 Ca 0.27 0.40 -0.04 0.00 0.36 0.00 0.00 54.97 55.96 2gbx s GLU 321 Cb 0.22 0.48 -0.03 0.00 0.26 0.00 0.00 34.13 35.06 2gbx s GLU 321 CO 0.06 -0.28 0.09 0.96 -0.54 0.00 0.00 175.26 175.55 2gbx s ILE 322 N -0.88 0.15 -0.30 -3.70 -4.36 -0.81 -0.39 121.20 110.91 2gbx s ILE 322 Ca -0.09 -1.60 -0.02 0.00 -0.26 0.00 0.00 60.65 58.67 2gbx s ILE 322 Cb -0.01 -1.62 0.05 0.00 1.25 0.00 0.00 42.46 42.12 2gbx s ILE 322 CO 0.08 -0.70 0.01 -0.70 0.24 0.00 0.00 174.94 173.88 2gbx s GLU 323 N -3.94 2.46 -0.36 0.37 2.12 0.57 -1.55 118.70 118.37 2gbx s GLU 323 Ca 0.11 -1.25 -0.23 0.00 0.36 0.00 0.00 54.97 53.97 2gbx s GLU 323 Cb 0.06 -3.22 0.01 0.00 0.26 0.00 0.00 34.13 31.25 2gbx s GLU 323 CO -0.06 -0.62 0.76 0.08 -0.54 0.00 0.00 175.26 174.87 2gbx s VAL 324 N 1.27 4.76 -0.31 3.70 1.01 0.28 -1.97 120.40 129.15 2gbx s VAL 324 Ca -0.05 0.85 -0.12 0.00 0.00 0.00 0.00 61.98 62.66 2gbx s VAL 324 Cb -0.20 -4.19 -0.03 0.00 0.00 0.00 0.00 36.38 31.96 2gbx s VAL 324 CO -0.01 -0.41 0.23 0.26 0.00 0.00 0.00 175.10 175.18 2gbx s TRP 325 N 3.03 3.22 -0.37 5.22 0.52 -0.77 -2.40 118.94 127.40 2gbx s TRP 325 Ca 0.30 -0.02 -0.05 0.00 0.02 0.00 0.00 56.10 56.36 2gbx s TRP 325 Cb -0.13 -2.45 0.07 0.00 -1.15 0.00 0.00 33.47 29.81 2gbx s TRP 325 CO 0.16 -0.26 0.14 0.99 0.02 0.00 0.00 176.95 178.00 2gbx s THR 326 N 1.77 3.56 0.60 2.01 2.01 -0.94 -1.22 115.64 123.42 2gbx s THR 326 Ca 0.07 -1.51 0.03 0.00 0.31 0.00 0.00 61.69 60.60 2gbx s THR 326 Cb -0.17 -3.18 0.08 0.00 0.01 0.00 0.00 72.50 69.24 2gbx s THR 326 CO 0.11 -0.38 0.83 -0.31 -0.69 0.00 0.00 174.62 174.18 2gbx s TYR 327 N 1.30 2.08 -0.24 4.92 2.02 0.31 -1.88 117.35 125.86 2gbx s TYR 327 Ca 0.01 -0.31 0.02 0.00 -0.37 0.00 0.00 57.07 56.42 2gbx s TYR 327 Cb -0.21 -2.67 0.05 0.00 -0.40 0.00 0.00 41.96 38.73 2gbx s TYR 327 CO -0.00 -1.18 -0.12 0.99 -1.57 0.00 0.00 175.55 173.67 2gbx s THR 328 N -2.82 2.06 0.02 -0.71 2.01 -1.16 -0.94 115.64 114.10 2gbx s THR 328 Ca 0.61 -1.47 -0.27 0.00 0.31 0.00 0.00 61.69 60.87 2gbx s THR 328 Cb -0.07 -2.15 -0.04 0.00 0.01 0.00 0.00 72.50 70.25 2gbx s THR 328 CO 0.40 0.05 0.87 -0.51 -0.69 0.00 0.00 174.62 174.74 2gbx s ILE 329 N 1.17 4.81 0.05 1.82 2.07 -1.21 -0.77 121.20 129.15 2gbx s ILE 329 Ca -0.06 1.83 -0.07 0.00 -1.41 0.00 0.00 60.65 60.94 2gbx s ILE 329 Cb -0.19 -4.21 -0.01 0.00 0.13 0.00 0.00 42.46 38.18 2gbx s ILE 329 CO -0.06 0.26 0.12 0.68 -1.91 0.00 0.00 174.94 174.03 2gbx s VAL 330 N 0.53 0.14 0.44 4.00 -7.23 0.50 -4.73 120.40 114.06 2gbx s VAL 330 Ca 0.45 -1.17 -0.24 0.00 -1.81 0.00 0.00 61.98 59.21 2gbx s VAL 330 Cb -0.21 -1.10 -0.08 0.00 0.56 0.00 0.00 36.38 35.56 2gbx s VAL 330 CO 0.25 -0.65 1.18 -2.84 -0.31 0.00 0.00 175.10 172.73 2gbx s PRO 331 N -3.12 3.85 0.06 4.82 0.02 -1.26 0.43 135.00 139.81 2gbx s PRO 331 Ca -0.01 1.82 -0.20 0.00 0.02 0.00 0.00 61.00 62.63 2gbx s PRO 331 Cb 0.02 -2.50 -0.11 0.00 0.02 0.00 0.00 34.50 31.92 2gbx s PRO 331 CO -0.07 -0.49 1.48 0.00 -0.33 0.00 0.00 177.00 177.59 2gbx h ARG 332 N 2.25 0.33 0.00 5.54 3.08 -1.35 -3.19 114.38 121.04 2gbx h ARG 332 Ca -0.49 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.44 2gbx h ARG 332 Cb 1.24 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.27 2gbx h ARG 332 CO 0.61 0.56 0.00 -0.25 -1.07 0.00 0.00 179.97 179.82 2gbx n ASP 333 N -4.69 0.00 -4.74 7.04 9.92 -1.26 -4.81 116.55 118.01 2gbx n ASP 333 Ca -0.05 0.42 -0.34 0.00 -0.53 0.00 0.00 54.79 54.29 2gbx n ASP 333 Cb 0.24 -0.47 0.07 0.00 -0.64 0.00 0.00 41.12 40.33 2gbx n ASP 333 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2gbx s ALA 334 N -2.94 2.27 0.58 2.24 0.00 -1.21 -4.99 121.76 117.71 2gbx s ALA 334 Ca 0.12 0.82 -0.17 0.00 0.00 0.00 0.00 51.96 52.72 2gbx s ALA 334 Cb 0.15 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 2gbx s ALA 334 CO 0.39 -1.62 1.09 -0.51 0.00 0.00 0.00 175.76 175.11 2gbx s ASP 335 N -2.10 5.68 0.37 0.00 1.11 -1.26 -4.81 116.67 115.66 2gbx s ASP 335 Ca 0.73 1.99 0.10 0.00 0.18 0.00 0.00 52.55 55.54 2gbx s ASP 335 Cb -0.27 -2.56 0.85 0.00 1.07 0.00 0.00 42.92 42.01 2gbx s ASP 335 CO 0.42 -1.24 1.88 -0.65 1.18 0.00 0.00 175.17 176.77 2gbx h PRO 336 N 0.74 0.64 -0.31 8.23 0.11 -1.95 0.99 132.00 140.44 2gbx h PRO 336 Ca -0.48 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 65.45 2gbx h PRO 336 Cb 1.24 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2gbx h PRO 336 CO 0.57 0.42 -0.37 0.00 -0.21 0.00 0.00 178.00 178.41 2gbx h ALA 337 N 1.60 0.76 -0.44 -0.75 0.00 -1.99 -2.35 119.26 116.09 2gbx h ALA 337 Ca 0.43 -0.44 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 2gbx h ALA 337 Cb 0.71 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2gbx h ALA 337 CO -0.18 0.66 -0.29 1.15 0.00 0.00 0.00 179.25 180.58 2gbx h THR 338 N 0.60 1.27 -0.87 0.00 2.02 -1.59 -1.35 112.91 112.99 2gbx h THR 338 Ca 0.06 -1.46 -0.01 0.00 0.77 0.00 0.00 66.41 65.77 2gbx h THR 338 Cb 0.91 1.25 -0.04 0.00 -1.74 0.00 0.00 68.15 68.52 2gbx h THR 338 CO 0.08 0.50 0.52 0.11 0.37 0.00 0.00 175.52 177.10 2gbx h LYS 339 N 0.81 1.18 -0.15 6.66 1.57 -0.83 -0.07 116.57 125.74 2gbx h LYS 339 Ca 0.09 -0.11 -0.12 0.00 -1.87 0.00 0.00 60.65 58.64 2gbx h LYS 339 Cb 0.88 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 2gbx h LYS 339 CO 0.08 0.83 -0.41 0.77 -0.57 0.00 0.00 179.45 180.15 2gbx h SER 340 N 1.20 0.35 -0.18 0.86 0.02 -1.32 -1.83 113.55 112.65 2gbx h SER 340 Ca 0.31 -0.15 -0.08 0.00 -0.84 0.00 0.00 61.79 61.03 2gbx h SER 340 Cb -0.04 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.40 2gbx h SER 340 CO -0.06 0.73 -0.22 -0.03 -1.14 0.00 0.00 176.83 176.12 2gbx h MET 341 N 0.28 0.47 -0.43 3.45 1.85 -0.80 -2.32 114.93 117.42 2gbx h MET 341 Ca 0.02 -0.26 -0.04 0.00 -0.61 0.00 0.00 59.70 58.81 2gbx h MET 341 Cb 0.85 0.02 -0.02 0.00 0.43 0.00 0.00 31.60 32.87 2gbx h MET 341 CO 0.07 0.84 0.09 0.82 -0.40 0.00 0.00 176.91 178.33 2gbx h ILE 342 N 0.12 1.20 -0.11 1.77 2.04 -1.00 -2.23 117.51 119.29 2gbx h ILE 342 Ca 0.02 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.14 2gbx h ILE 342 Cb 0.77 0.78 -0.00 0.00 -0.74 0.00 0.00 36.82 37.62 2gbx h ILE 342 CO 0.05 0.27 0.03 -0.61 0.00 0.00 0.00 178.15 177.88 2gbx h GLN 343 N 0.64 0.18 -0.59 2.37 4.15 -1.27 -0.41 115.11 120.18 2gbx h GLN 343 Ca 0.14 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.51 2gbx h GLN 343 Cb 0.27 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.91 2gbx h GLN 343 CO 0.00 0.35 0.33 0.00 -1.93 0.00 0.00 178.83 177.58 2gbx h ARG 344 N -0.02 0.81 -0.12 1.69 3.08 -1.29 -1.64 114.38 116.87 2gbx h ARG 344 Ca 0.03 -0.09 -0.14 0.00 0.07 0.00 0.00 59.98 59.86 2gbx h ARG 344 Cb 0.25 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2gbx h ARG 344 CO 0.00 0.61 -0.54 0.93 -1.07 0.00 0.00 179.97 179.90 2gbx h GLU 345 N 0.79 0.36 -0.31 0.04 4.39 -1.38 -1.28 114.58 117.18 2gbx h GLU 345 Ca 0.21 -0.22 -0.15 0.00 0.34 0.00 0.00 59.36 59.53 2gbx h GLU 345 Cb 0.02 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.69 2gbx h GLU 345 CO -0.04 0.81 -0.40 0.00 -1.16 0.00 0.00 179.01 178.22 2gbx h ALA 346 N 1.15 0.47 -0.09 3.43 0.00 -0.90 -2.60 119.26 120.72 2gbx h ALA 346 Ca 0.01 -0.46 -0.21 0.00 0.00 0.00 0.00 54.91 54.25 2gbx h ALA 346 Cb 1.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2gbx h ALA 346 CO 0.09 0.58 -0.80 0.82 0.00 0.00 0.00 179.25 179.94 2gbx h ILE 347 N 0.60 1.34 -0.03 0.00 2.04 -1.30 0.31 117.51 120.48 2gbx h ILE 347 Ca 0.04 -2.13 -0.04 0.00 1.00 0.00 0.00 64.86 63.72 2gbx h ILE 347 Cb 0.99 2.13 -0.01 0.00 -0.74 0.00 0.00 36.82 39.19 2gbx h ILE 347 CO 0.09 0.65 -0.18 -0.09 0.00 0.00 0.00 178.15 178.63 2gbx h ARG 348 N 0.37 0.05 0.00 2.37 2.43 -1.26 0.41 114.38 118.75 2gbx h ARG 348 Ca -0.05 -0.01 -0.31 0.00 -0.81 0.00 0.00 59.98 58.80 2gbx h ARG 348 Cb 1.41 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.91 2gbx h ARG 348 CO 0.15 0.23 -1.69 0.25 -1.51 0.00 0.00 179.97 177.39 2gbx n THR 349 N -4.31 1.54 -2.39 0.20 -2.24 -0.98 -0.66 114.28 105.44 2gbx n THR 349 Ca -0.02 -0.15 -0.18 0.00 -2.27 0.00 0.00 64.05 61.42 2gbx n THR 349 Cb 0.25 -1.98 0.02 0.00 -2.10 0.00 0.00 70.33 66.52 2gbx n THR 349 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2gbx n PHE 350 N -4.35 2.45 -2.11 4.78 3.72 0.11 -1.38 117.46 120.68 2gbx n PHE 350 Ca -0.39 -2.54 0.00 0.00 -0.05 0.00 0.00 57.45 54.46 2gbx n PHE 350 Cb 0.76 -0.25 0.00 0.00 -0.94 0.00 0.00 39.48 39.05 2gbx n PHE 350 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gbx n GLY 351 N -0.53 1.78 0.23 1.37 0.00 0.13 -4.76 105.19 103.41 2gbx n GLY 351 Ca 0.31 -2.04 -0.10 0.00 0.00 0.00 0.00 46.02 44.19 2gbx n GLY 351 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2gbx h THR 352 N -0.01 1.26 -1.47 2.61 2.02 -1.93 -2.92 112.91 112.46 2gbx h THR 352 Ca 0.00 -0.99 -0.69 0.00 0.77 0.00 0.00 66.41 65.50 2gbx h THR 352 Cb 0.00 1.02 -0.32 0.00 -1.74 0.00 0.00 68.15 67.11 2gbx h THR 352 CO 0.00 0.34 0.47 0.00 0.37 0.00 0.00 175.52 176.70 2gbx n ALA 353 N -2.41 6.04 -1.78 6.16 0.00 -1.26 -4.76 120.51 122.50 2gbx n ALA 353 Ca 0.00 -3.93 -0.35 0.00 0.00 0.00 0.00 53.44 49.16 2gbx n ALA 353 Cb 0.28 -1.47 -0.02 0.00 0.00 0.00 0.00 19.45 18.24 2gbx n ALA 353 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2gbx s GLY 354 N -2.04 2.64 0.41 0.00 0.00 -1.11 -4.89 107.32 102.33 2gbx s GLY 354 Ca 0.55 0.76 0.20 0.00 0.00 0.00 0.00 44.72 46.22 2gbx s GLY 354 CO -0.20 1.13 1.82 -0.91 0.00 0.00 0.00 173.10 174.94 2gbx h THR 355 N 1.61 0.86 0.00 0.90 1.35 -0.56 -2.67 112.91 114.39 2gbx h THR 355 Ca -0.49 -1.25 -0.45 0.00 -0.55 0.00 0.00 66.41 63.66 2gbx h THR 355 Cb 1.24 1.76 -0.07 0.00 -1.73 0.00 0.00 68.15 69.35 2gbx h THR 355 CO 0.59 0.31 -2.50 0.18 -0.25 0.00 0.00 175.52 173.85 2gbx n LEU 356 N -3.64 1.96 -0.15 3.87 4.32 -0.48 -4.60 117.00 118.28 2gbx n LEU 356 Ca -0.01 0.34 0.19 0.00 -0.02 0.00 0.00 56.01 56.51 2gbx n LEU 356 Cb 0.43 -0.82 0.57 0.00 -1.62 0.00 0.00 43.42 41.99 2gbx n LEU 356 CO 0.35 0.55 1.22 -0.08 -1.22 0.00 0.00 177.39 178.21 2gbx h GLU 357 N -1.00 0.27 0.00 3.23 4.57 -1.57 0.76 114.58 120.83 2gbx h GLU 357 Ca -0.69 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 57.46 2gbx h GLU 357 Cb 1.60 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 30.13 2gbx h GLU 357 CO -0.42 0.18 -0.07 0.77 -1.18 0.00 0.00 179.01 178.29 2gbx h SER 358 N 0.27 0.00 0.50 1.04 0.02 -1.72 -2.84 113.55 110.82 2gbx h SER 358 Ca 0.38 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 61.11 2gbx h SER 358 Cb 1.09 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.62 2gbx h SER 358 CO -0.10 0.07 -0.95 0.44 -1.14 0.00 0.00 176.83 175.15 2gbx h ASP 359 N 0.00 0.38 1.28 3.07 3.32 -1.09 -3.30 116.42 120.07 2gbx h ASP 359 Ca -0.00 -0.32 0.00 0.00 0.02 0.00 0.00 57.03 56.73 2gbx h ASP 359 Cb 0.39 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.82 2gbx h ASP 359 CO 0.01 1.14 0.00 0.44 -1.72 0.00 0.00 179.24 179.11 2gbx h ASP 360 N 0.15 0.00 -0.75 6.45 3.32 -1.53 -3.38 116.42 120.68 2gbx h ASP 360 Ca -0.07 0.00 0.11 0.00 0.02 0.00 0.00 57.03 57.09 2gbx h ASP 360 Cb 1.60 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 41.03 2gbx h ASP 360 CO 0.15 0.00 -0.42 1.23 -1.72 0.00 0.00 179.24 178.49 2gbx h GLY 361 N 3.75 -0.27 1.69 2.75 0.00 -1.64 -1.16 103.07 108.19 2gbx h GLY 361 Ca 0.00 0.55 -0.18 0.00 0.00 0.00 0.00 47.33 47.70 2gbx h GLY 361 CO 0.00 -0.16 -0.75 -2.09 0.00 0.00 0.00 176.54 173.54 2gbx h GLU 362 N -0.12 0.30 -0.33 4.80 4.81 -1.85 -3.06 114.58 119.13 2gbx h GLU 362 Ca 0.24 -0.26 0.03 0.00 -0.13 0.00 0.00 59.36 59.24 2gbx h GLU 362 Cb 0.56 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.98 2gbx h GLU 362 CO -0.80 0.92 0.22 -0.91 -0.73 0.00 0.00 179.01 177.70 2gbx h ASN 363 N 0.20 0.28 0.10 1.04 4.21 -1.45 0.27 115.58 120.23 2gbx h ASN 363 Ca -0.03 -0.00 -0.14 0.00 1.21 0.00 0.00 56.30 57.34 2gbx h ASN 363 Cb 1.32 -0.07 0.02 0.00 -1.12 0.00 0.00 38.32 38.47 2gbx h ASN 363 CO 0.12 0.20 -0.61 0.24 -1.29 0.00 0.00 177.43 176.09 2gbx h MET 364 N 0.33 0.23 -0.16 0.81 2.86 -1.38 -3.31 114.93 114.31 2gbx h MET 364 Ca 0.13 -0.38 -0.13 0.00 -2.06 0.00 0.00 59.70 57.26 2gbx h MET 364 Cb 0.13 0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2gbx h MET 364 CO -0.03 1.18 -0.41 1.03 1.06 0.00 0.00 176.91 179.74 2gbx h SER 365 N -0.53 0.63 -0.93 1.22 0.87 -1.39 -3.26 113.55 110.16 2gbx h SER 365 Ca -0.11 -0.58 0.02 0.00 -1.23 0.00 0.00 61.79 59.89 2gbx h SER 365 Cb 1.48 -0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 63.20 2gbx h SER 365 CO 0.11 1.10 0.61 -1.28 -0.53 0.00 0.00 176.83 176.84 2gbx h SER 366 N 0.20 1.05 0.01 6.23 0.87 -0.66 -0.79 113.55 120.45 2gbx h SER 366 Ca -0.01 -0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.50 2gbx h SER 366 Cb 1.02 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.72 2gbx h SER 366 CO 0.09 0.74 -0.09 0.00 -0.53 0.00 0.00 176.83 177.05 2gbx h ALA 367 N 1.36 1.62 0.00 6.23 0.00 -1.65 -2.28 119.26 124.54 2gbx h ALA 367 Ca 0.35 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 2gbx h ALA 367 Cb -0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2gbx h ALA 367 CO -0.09 0.28 -0.39 1.15 0.00 0.00 0.00 179.25 180.20 2gbx h THR 368 N 0.19 0.96 0.00 0.00 2.02 -1.45 -3.39 112.91 111.24 2gbx h THR 368 Ca 0.04 -1.84 0.00 0.00 0.77 0.00 0.00 66.41 65.38 2gbx h THR 368 Cb 0.28 1.93 0.00 0.00 -1.74 0.00 0.00 68.15 68.62 2gbx h THR 368 CO 0.01 0.32 0.00 -1.22 0.37 0.00 0.00 175.52 175.01 2gbx n TYR 369 N -4.60 0.00 0.23 3.16 4.01 -0.36 -2.43 117.16 117.17 2gbx n TYR 369 Ca -0.13 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.70 2gbx n TYR 369 Cb 0.40 -0.44 0.52 0.00 -0.31 0.00 0.00 39.34 39.52 2gbx n TYR 369 CO 0.00 0.00 0.00 0.97 -0.46 0.00 0.00 176.86 177.37 2gbx h ILE 370 N 0.00 0.75 0.00 -0.72 6.09 -1.60 -2.89 117.51 119.14 2gbx h ILE 370 Ca 0.00 -0.99 0.00 0.00 -1.37 0.00 0.00 64.86 62.50 2gbx h ILE 370 Cb 0.42 1.61 0.00 0.00 0.47 0.00 0.00 36.82 39.32 2gbx h ILE 370 CO 0.00 0.23 0.00 0.59 -3.07 0.00 0.00 178.15 175.90 2gbx n ASN 371 N -3.65 0.08 0.21 2.19 3.02 -1.02 -3.35 115.26 112.75 2gbx n ASN 371 Ca -0.01 -1.70 0.05 0.00 -0.03 0.00 0.00 54.58 52.88 2gbx n ASN 371 Cb 0.36 -0.04 0.45 0.00 -0.61 0.00 0.00 39.78 39.94 2gbx n ASN 371 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 2gbx h ARG 372 N 0.01 0.00 -6.89 3.52 2.43 -1.72 -3.41 114.38 108.33 2gbx h ARG 372 Ca 0.00 0.00 -0.49 0.00 -0.81 0.00 0.00 59.98 58.68 2gbx h ARG 372 Cb 0.04 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2gbx h ARG 372 CO 0.00 0.28 0.41 0.20 -1.51 0.00 0.00 179.97 179.34 2gbx s GLY 373 N -4.25 2.87 0.13 2.80 0.00 -1.21 -4.99 107.32 102.67 2gbx s GLY 373 Ca -0.03 0.70 -0.09 0.00 0.00 0.00 0.00 44.72 45.30 2gbx s GLY 373 CO 0.70 1.19 1.37 -0.24 0.00 0.00 0.00 173.10 176.12 2gbx h VAL 374 N 2.60 1.30 -0.05 1.40 3.04 -1.93 -2.86 116.25 119.75 2gbx h VAL 374 Ca -0.47 -1.96 -0.16 0.00 -1.01 0.00 0.00 66.70 63.11 2gbx h VAL 374 Cb 1.21 1.93 -0.01 0.00 -2.01 0.00 0.00 31.29 32.41 2gbx h VAL 374 CO 0.65 0.61 -0.66 0.40 -1.01 0.00 0.00 177.57 177.56 2gbx h ILE 375 N 0.50 1.41 0.22 3.17 1.08 -1.96 -3.17 117.51 118.76 2gbx h ILE 375 Ca -0.03 -2.11 -0.01 0.00 -0.39 0.00 0.00 64.86 62.31 2gbx h ILE 375 Cb 1.32 2.10 0.00 0.00 -3.07 0.00 0.00 36.82 37.17 2gbx h ILE 375 CO 0.14 0.62 -0.11 0.74 -0.69 0.00 0.00 178.15 178.86 2gbx h THR 376 N 0.16 0.84 0.00 -0.27 2.02 -1.89 -3.27 112.91 110.50 2gbx h THR 376 Ca -0.01 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.45 2gbx h THR 376 Cb 1.19 1.24 0.00 0.00 -1.74 0.00 0.00 68.15 68.84 2gbx h THR 376 CO 0.10 0.15 0.00 0.08 0.37 0.00 0.00 175.52 176.22 2gbx h ARG 377 N -0.69 0.00 0.00 6.66 0.11 -1.58 -0.46 114.38 118.42 2gbx h ARG 377 Ca -0.03 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.05 2gbx h ARG 377 Cb 0.48 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.56 2gbx h ARG 377 CO 0.05 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.21 2gbx n ASN 378 N -2.38 0.74 -2.71 0.08 4.13 -1.20 -3.53 115.26 110.38 2gbx n ASN 378 Ca 0.01 0.62 0.00 0.00 1.68 0.00 0.00 54.58 56.89 2gbx n ASN 378 Cb 0.22 -0.80 0.00 0.00 -1.54 0.00 0.00 39.78 37.66 2gbx n ASN 378 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2gbx n GLY 379 N 0.70 -1.91 3.22 7.41 0.00 -0.18 -4.88 105.19 109.54 2gbx n GLY 379 Ca 0.04 -1.50 -0.12 0.00 0.00 0.00 0.00 46.02 44.43 2gbx n GLY 379 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gbx s ARG 380 N -1.91 1.08 0.08 1.61 0.52 -1.26 -2.91 118.95 116.16 2gbx s ARG 380 Ca 0.00 -1.53 0.07 0.00 -0.52 0.00 0.00 55.73 53.75 2gbx s ARG 380 Cb 0.00 -0.07 -0.04 0.00 0.52 0.00 0.00 34.95 35.36 2gbx s ARG 380 CO 0.00 -0.20 -0.12 -1.64 0.02 0.00 0.00 175.30 173.36 2gbx s MET 381 N -3.98 2.14 -0.17 3.54 -1.94 0.24 -4.86 119.30 114.26 2gbx s MET 381 Ca 0.26 -0.99 -0.06 0.00 -1.71 0.00 0.00 55.69 53.19 2gbx s MET 381 Cb 0.07 -2.29 -0.04 0.00 2.01 0.00 0.00 34.83 34.58 2gbx s MET 381 CO 0.04 0.52 0.03 1.21 -0.01 0.00 0.00 175.02 176.82 2gbx s ASN 382 N -1.93 5.35 -0.39 3.03 3.84 -1.26 -2.29 114.94 121.28 2gbx s ASN 382 Ca 0.19 0.02 0.10 0.00 0.21 0.00 0.00 52.86 53.38 2gbx s ASN 382 Cb -0.11 -1.89 0.32 0.00 -0.55 0.00 0.00 41.25 39.02 2gbx s ASN 382 CO 0.11 0.18 0.68 -1.54 -2.79 0.00 0.00 177.10 173.74 2gbx n SER 383 N 3.47 0.88 -0.31 -4.21 3.41 -0.88 -4.94 113.62 111.05 2gbx n SER 383 Ca -0.17 -2.96 0.09 0.00 -0.26 0.00 0.00 58.87 55.57 2gbx n SER 383 Cb 0.52 -0.62 0.17 0.00 -0.26 0.00 0.00 64.21 64.02 2gbx n SER 383 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2gbx n THR 384 N 0.57 1.99 -2.47 6.66 -2.24 -1.25 -4.72 114.28 112.82 2gbx n THR 384 Ca 0.24 -2.13 -0.42 0.00 -2.27 0.00 0.00 64.05 59.47 2gbx n THR 384 Cb 0.61 -0.23 -0.02 0.00 -2.10 0.00 0.00 70.33 68.58 2gbx n THR 384 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 2gbx s MET 385 N -2.83 3.46 0.00 -0.78 1.75 -1.26 -3.03 119.30 116.61 2gbx s MET 385 Ca 0.34 0.47 0.00 0.00 -1.25 0.00 0.00 55.69 55.25 2gbx s MET 385 Cb 0.29 -4.05 0.00 0.00 2.84 0.00 0.00 34.83 33.91 2gbx s MET 385 CO 0.05 -1.74 0.00 0.41 -0.65 0.00 0.00 175.02 173.09 2gbx n GLY 386 N 5.13 1.35 3.71 2.11 0.00 -1.26 -0.83 105.19 115.40 2gbx n GLY 386 Ca 0.12 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2gbx n GLY 386 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2gbx s VAL 387 N -2.00 4.03 0.00 1.61 -7.23 -1.17 -2.96 120.40 112.68 2gbx s VAL 387 Ca 0.00 1.45 0.00 0.00 -1.81 0.00 0.00 61.98 61.62 2gbx s VAL 387 Cb 0.00 -3.93 0.00 0.00 0.56 0.00 0.00 36.38 33.01 2gbx s VAL 387 CO 0.00 0.11 0.00 0.61 -0.31 0.00 0.00 175.10 175.51 2gbx n GLY 388 N 3.22 2.86 2.65 2.32 0.00 -1.26 -4.92 105.19 110.06 2gbx n GLY 388 Ca 0.09 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 2gbx n GLY 388 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2gbx n TYR 389 N 0.00 2.66 -3.53 1.61 4.01 -1.15 -4.78 117.16 115.97 2gbx n TYR 389 Ca 0.00 -2.66 -0.12 0.00 -0.16 0.00 0.00 57.90 54.96 2gbx n TYR 389 Cb 0.00 -1.45 -0.04 0.00 -0.31 0.00 0.00 39.34 37.53 2gbx n TYR 389 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 2gbx s GLU 390 N -2.85 0.84 0.00 -0.72 -1.05 -1.26 -3.91 118.70 109.76 2gbx s GLU 390 Ca 0.43 0.02 0.00 0.00 -0.15 0.00 0.00 54.97 55.27 2gbx s GLU 390 Cb 0.17 0.39 0.00 0.00 -0.44 0.00 0.00 34.13 34.25 2gbx s GLU 390 CO -0.08 -0.30 0.00 0.41 0.95 0.00 0.00 175.26 176.24 2gbx n GLY 391 N 0.45 -1.85 3.68 -3.83 0.00 -1.14 -4.42 105.19 98.09 2gbx n GLY 391 Ca -0.13 -1.16 -0.42 0.00 0.00 0.00 0.00 46.02 44.30 2gbx n GLY 391 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2gbx s PRO 392 N -1.69 4.28 0.22 1.61 0.04 -1.26 -1.50 135.00 136.71 2gbx s PRO 392 Ca 0.00 1.92 -0.24 0.00 0.04 0.00 0.00 61.00 62.72 2gbx s PRO 392 Cb 0.00 -3.61 -0.09 0.00 0.04 0.00 0.00 34.50 30.84 2gbx s PRO 392 CO 0.00 -0.59 0.81 -1.58 0.04 0.00 0.00 177.00 175.68 2gbx s HIS 393 N 2.57 3.79 0.23 0.56 2.46 -1.24 -4.62 115.29 119.04 2gbx s HIS 393 Ca 0.63 1.62 -0.08 0.00 0.47 0.00 0.00 55.06 57.70 2gbx s HIS 393 Cb -0.30 -2.78 0.22 0.00 -0.13 0.00 0.00 32.58 29.59 2gbx s HIS 393 CO 0.25 0.39 1.90 -1.00 -2.47 0.00 0.00 174.74 173.81 2gbx h PRO 394 N 3.79 1.21 0.00 2.88 0.13 -1.95 -3.35 132.00 134.71 2gbx h PRO 394 Ca -0.47 -0.09 -0.04 0.00 -0.87 0.00 0.00 66.00 64.54 2gbx h PRO 394 Cb 1.20 -0.26 -0.01 0.00 0.13 0.00 0.00 31.00 32.06 2gbx h PRO 394 CO 0.66 0.82 -0.56 0.28 -0.23 0.00 0.00 178.00 178.97 2gbx h VAL 395 N 1.24 0.17 -3.43 1.56 2.07 -2.01 -3.47 116.25 112.38 2gbx h VAL 395 Ca 0.33 -1.20 -0.52 0.00 0.82 0.00 0.00 66.70 66.13 2gbx h VAL 395 Cb -0.10 0.39 0.02 0.00 -1.52 0.00 0.00 31.29 30.08 2gbx h VAL 395 CO -0.07 0.06 0.56 -0.31 0.02 0.00 0.00 177.57 177.83 2gbx s TYR 396 N -2.19 3.42 0.75 1.57 2.02 -1.26 -5.03 117.35 116.64 2gbx s TYR 396 Ca -0.15 1.39 -0.11 0.00 -0.37 0.00 0.00 57.07 57.82 2gbx s TYR 396 Cb 0.02 -3.44 0.04 0.00 -0.40 0.00 0.00 41.96 38.19 2gbx s TYR 396 CO 0.26 -1.26 1.09 -1.25 -1.57 0.00 0.00 175.55 172.82 2gbx s PRO 397 N -0.02 2.46 3.01 -1.71 0.04 -1.26 -3.67 135.00 133.85 2gbx s PRO 397 Ca 0.54 0.61 0.00 0.00 0.04 0.00 0.00 61.00 62.19 2gbx s PRO 397 Cb -0.32 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.25 2gbx s PRO 397 CO 0.35 -1.35 0.00 0.41 0.04 0.00 0.00 177.00 176.45 2gbx n GLY 398 N -2.41 -0.14 3.72 0.56 0.00 -1.26 -4.80 105.19 100.86 2gbx n GLY 398 Ca 0.07 -1.00 -0.35 0.00 0.00 0.00 0.00 46.02 44.74 2gbx n GLY 398 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gbx s ILE 399 N 0.00 4.52 -0.01 -0.61 -1.09 -0.67 -3.93 121.20 119.41 2gbx s ILE 399 Ca 0.00 -0.19 0.05 0.00 -2.23 0.00 0.00 60.65 58.28 2gbx s ILE 399 Cb 0.00 -2.92 -0.01 0.00 -1.58 0.00 0.00 42.46 37.95 2gbx s ILE 399 CO 0.00 0.59 -0.15 -0.69 -1.23 0.00 0.00 174.94 173.46 2gbx s VAL 400 N -0.92 1.21 0.20 2.92 1.01 -0.56 -1.46 120.40 122.79 2gbx s VAL 400 Ca 0.14 -0.68 0.04 0.00 0.00 0.00 0.00 61.98 61.49 2gbx s VAL 400 Cb -0.11 -1.01 -0.03 0.00 0.00 0.00 0.00 36.38 35.22 2gbx s VAL 400 CO 0.03 0.33 0.29 -0.83 0.00 0.00 0.00 175.10 174.92 2gbx s GLY 401 N -0.40 1.49 0.32 4.51 0.00 0.11 -2.90 107.32 110.45 2gbx s GLY 401 Ca 0.06 -1.17 0.17 0.00 0.00 0.00 0.00 44.72 43.78 2gbx s GLY 401 CO -0.00 -1.18 1.58 0.16 0.00 0.00 0.00 173.10 173.65 2gbx h ILE 402 N 1.49 0.89 -3.96 0.90 3.07 -1.86 -2.87 117.51 115.17 2gbx h ILE 402 Ca -0.50 -1.93 -0.27 0.00 1.55 0.00 0.00 64.86 63.71 2gbx h ILE 402 Cb 1.21 2.21 -0.21 0.00 -0.27 0.00 0.00 36.82 39.76 2gbx h ILE 402 CO 0.64 0.45 -0.73 -0.55 -1.05 0.00 0.00 178.15 176.91 2gbx s SER 403 N -6.44 0.85 0.30 2.16 0.15 -1.26 -4.42 113.70 105.05 2gbx s SER 403 Ca 0.02 -0.57 0.11 0.00 0.70 0.00 0.00 55.95 56.21 2gbx s SER 403 Cb 0.09 0.04 0.44 0.00 -1.71 0.00 0.00 66.02 64.88 2gbx s SER 403 CO 0.72 -0.22 1.66 2.19 1.20 0.00 0.00 173.24 178.79 2gbx h PHE 404 N 4.43 0.00 -1.12 3.44 -0.00 -1.68 -3.32 116.94 118.69 2gbx h PHE 404 Ca -0.36 0.00 -0.68 0.00 -0.00 0.00 0.00 57.97 56.93 2gbx h PHE 404 Cb 1.20 0.00 -0.10 0.00 -0.00 0.00 0.00 35.95 37.05 2gbx h PHE 404 CO 0.65 0.56 1.98 0.42 -0.00 0.00 0.00 178.31 181.91 2gbx s ILE 405 N -3.72 4.25 0.23 0.88 1.01 -1.26 -3.94 121.20 118.65 2gbx s ILE 405 Ca -0.01 -1.91 -0.23 0.00 0.00 0.00 0.00 60.65 58.50 2gbx s ILE 405 Cb 0.13 -5.13 0.04 0.00 0.01 0.00 0.00 42.46 37.50 2gbx s ILE 405 CO 0.75 -1.95 0.80 -0.83 0.00 0.00 0.00 174.94 173.72 2gbx s GLY 406 N 4.07 -0.16 -0.30 6.18 0.00 -1.25 -4.90 107.32 110.96 2gbx s GLY 406 Ca 0.51 -0.11 0.08 0.00 0.00 0.00 0.00 44.72 45.20 2gbx s GLY 406 CO 0.05 -0.04 1.18 1.18 0.00 0.00 0.00 173.10 175.47 2gbx n GLU 407 N -0.46 3.51 -0.00 2.90 1.02 -0.01 -4.67 120.64 122.93 2gbx n GLU 407 Ca -0.05 -4.15 -0.17 0.00 -0.02 0.00 0.00 57.16 52.76 2gbx n GLU 407 Cb 0.60 -2.24 -0.07 0.00 -0.02 0.00 0.00 31.44 29.71 2gbx n GLU 407 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2gbx h THR 408 N 2.38 1.29 -0.29 2.62 2.02 -1.92 -2.81 112.91 116.20 2gbx h THR 408 Ca 0.34 -2.05 -0.10 0.00 0.77 0.00 0.00 66.41 65.37 2gbx h THR 408 Cb 1.49 2.08 -0.01 0.00 -1.74 0.00 0.00 68.15 69.97 2gbx h THR 408 CO 0.73 0.64 -0.24 0.28 0.37 0.00 0.00 175.52 177.31 2gbx h SER 409 N 0.48 0.56 0.34 4.18 0.02 -1.83 -2.07 113.55 115.24 2gbx h SER 409 Ca -0.07 -0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 60.68 2gbx h SER 409 Cb 1.46 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 63.84 2gbx h SER 409 CO 0.17 0.79 -0.21 1.88 -1.14 0.00 0.00 176.83 178.32 2gbx h TYR 410 N 0.50 -0.54 -0.37 3.45 0.05 -1.87 -0.57 116.97 117.61 2gbx h TYR 410 Ca 0.07 -0.01 0.03 0.00 0.05 0.00 0.00 58.73 58.88 2gbx h TYR 410 Cb 0.68 0.19 -0.03 0.00 1.01 0.00 0.00 36.73 38.57 2gbx h TYR 410 CO 0.03 -0.32 0.17 0.00 -1.05 0.00 0.00 178.16 176.98 2gbx h ARG 411 N -0.52 0.35 -0.06 4.88 3.08 -1.44 -2.03 114.38 118.62 2gbx h ARG 411 Ca -0.04 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 2gbx h ARG 411 Cb 0.43 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2gbx h ARG 411 CO 0.04 0.23 -0.25 0.78 -1.07 0.00 0.00 179.97 179.69 2gbx h GLY 412 N 0.36 0.12 0.59 0.04 0.00 -1.33 -0.31 103.07 102.54 2gbx h GLY 412 Ca 0.16 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 2gbx h GLY 412 CO -0.13 0.08 -0.06 -2.75 0.00 0.00 0.00 176.54 173.68 2gbx h PHE 413 N 0.10 -0.15 0.00 5.60 3.57 -0.71 -2.94 116.94 122.41 2gbx h PHE 413 Ca 0.02 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2gbx h PHE 413 Cb 0.51 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.30 2gbx h PHE 413 CO 0.00 0.23 0.00 1.88 -2.23 0.00 0.00 178.31 178.19 2gbx h TYR 414 N -0.58 0.00 -0.04 0.41 0.05 -1.29 -1.52 116.97 114.00 2gbx h TYR 414 Ca -0.02 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.73 2gbx h TYR 414 Cb 0.45 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.19 2gbx h TYR 414 CO 0.05 0.00 -0.11 -0.09 -1.05 0.00 0.00 178.16 176.96 2gbx h ARG 415 N 0.00 0.14 -0.21 4.88 2.43 -1.09 -0.85 114.38 119.69 2gbx h ARG 415 Ca 0.00 -0.10 -0.10 0.00 -0.81 0.00 0.00 59.98 58.96 2gbx h ARG 415 Cb 0.68 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.23 2gbx h ARG 415 CO 0.00 0.73 -0.31 0.35 -1.51 0.00 0.00 179.97 179.22 2gbx h PHE 416 N -0.41 0.49 -0.15 2.20 3.57 -1.49 -1.52 116.94 119.62 2gbx h PHE 416 Ca -0.00 -0.11 0.02 0.00 3.53 0.00 0.00 57.97 61.40 2gbx h PHE 416 Cb 0.74 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.34 2gbx h PHE 416 CO 0.13 0.69 0.04 2.35 -2.23 0.00 0.00 178.31 179.30 2gbx h TRP 417 N 0.37 0.07 -0.97 0.41 7.01 -1.29 -0.26 115.95 121.29 2gbx h TRP 417 Ca 0.05 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.06 2gbx h TRP 417 Cb 0.73 -0.01 -0.05 0.00 -2.10 0.00 0.00 29.16 27.74 2gbx h TRP 417 CO 0.02 0.03 0.60 -0.22 -2.79 0.00 0.00 178.44 176.08 2gbx h LYS 418 N 0.11 1.30 -0.43 2.65 3.64 -0.93 -0.15 116.57 122.75 2gbx h LYS 418 Ca 0.07 -0.11 -0.05 0.00 -1.27 0.00 0.00 60.65 59.29 2gbx h LYS 418 Cb 0.05 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 31.57 2gbx h LYS 418 CO -0.08 0.89 0.07 1.49 -2.27 0.00 0.00 179.45 179.55 2gbx h GLU 419 N 1.33 0.72 -0.48 1.90 4.81 -1.00 -0.39 114.58 121.47 2gbx h GLU 419 Ca 0.35 -0.19 -0.09 0.00 -0.13 0.00 0.00 59.36 59.30 2gbx h GLU 419 Cb -0.09 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.19 2gbx h GLU 419 CO -0.07 0.75 -0.03 0.52 -0.73 0.00 0.00 179.01 179.45 2gbx h MET 420 N 0.58 0.88 -0.19 1.92 2.86 -0.78 -0.73 114.93 119.46 2gbx h MET 420 Ca 0.13 -0.29 -0.12 0.00 -2.06 0.00 0.00 59.70 57.35 2gbx h MET 420 Cb 0.38 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 2gbx h MET 420 CO 0.01 0.93 -0.41 0.82 1.06 0.00 0.00 176.91 179.32 2gbx h ILE 421 N 0.73 1.31 0.19 -1.22 1.08 -0.95 -3.24 117.51 115.41 2gbx h ILE 421 Ca 0.13 -1.56 -0.31 0.00 -0.39 0.00 0.00 64.86 62.73 2gbx h ILE 421 Cb 0.55 1.61 0.03 0.00 -3.07 0.00 0.00 36.82 35.94 2gbx h ILE 421 CO 0.03 0.48 -1.36 0.44 -0.69 0.00 0.00 178.15 177.06 2gbx h ASP 422 N 0.36 0.76 -3.71 1.72 5.19 -1.01 -3.46 116.42 116.27 2gbx h ASP 422 Ca 0.03 -0.78 -0.51 0.00 -0.62 0.00 0.00 57.03 55.15 2gbx h ASP 422 Cb 0.87 -0.25 0.03 0.00 0.18 0.00 0.00 39.33 40.16 2gbx h ASP 422 CO 0.07 1.60 0.54 0.00 -3.12 0.00 0.00 179.24 178.33 2gbx s ALA 423 N -2.74 3.44 0.00 3.45 0.00 -0.29 -4.96 121.76 120.67 2gbx s ALA 423 Ca -0.08 0.99 0.14 0.00 0.00 0.00 0.00 51.96 53.01 2gbx s ALA 423 Cb 0.05 -3.39 0.16 0.00 0.00 0.00 0.00 23.12 19.94 2gbx s ALA 423 CO 0.93 -0.33 1.48 -1.00 0.00 0.00 0.00 175.76 176.84 2gbx h PRO 424 N 4.20 0.00 -3.68 0.00 0.13 -1.89 -3.47 132.00 127.29 2gbx h PRO 424 Ca -0.46 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.51 2gbx h PRO 424 Cb 1.21 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.29 2gbx h PRO 424 CO 0.69 0.59 -0.03 0.16 -0.23 0.00 0.00 178.00 179.19 2gbx s ASP 425 N -6.53 0.44 0.40 1.44 -4.77 -1.26 -5.05 116.67 101.34 2gbx s ASP 425 Ca 0.02 -1.26 0.13 0.00 -3.30 0.00 0.00 52.55 48.14 2gbx s ASP 425 Cb 0.09 0.71 0.84 0.00 -1.09 0.00 0.00 42.92 43.47 2gbx s ASP 425 CO 0.75 -1.39 1.90 -0.50 0.70 0.00 0.00 175.17 176.64 2gbx h TRP 426 N 2.10 0.03 -0.88 2.11 4.06 -1.93 -2.92 115.95 118.52 2gbx h TRP 426 Ca -0.29 -0.00 0.04 0.00 2.06 0.00 0.00 58.89 60.70 2gbx h TRP 426 Cb 1.24 -0.01 -0.05 0.00 -1.00 0.00 0.00 29.16 29.34 2gbx h TRP 426 CO 1.23 0.30 0.58 0.00 -3.56 0.00 0.00 178.44 176.98 2gbx h ALA 427 N 1.71 1.47 -0.09 1.49 0.00 -1.96 0.48 119.26 122.35 2gbx h ALA 427 Ca 0.00 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 2gbx h ALA 427 Cb 0.49 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2gbx h ALA 427 CO 0.04 0.43 -0.63 0.77 0.00 0.00 0.00 179.25 179.86 2gbx h SER 428 N 1.07 0.38 -0.03 0.00 0.02 -1.94 -2.55 113.55 110.50 2gbx h SER 428 Ca 0.36 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2gbx h SER 428 Cb 0.07 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.50 2gbx h SER 428 CO -0.11 0.91 -0.04 0.58 -1.14 0.00 0.00 176.83 177.02 2gbx h VAL 429 N 0.24 1.41 0.00 2.27 2.07 -1.24 -3.22 116.25 117.79 2gbx h VAL 429 Ca -0.01 -1.29 -0.00 0.00 0.82 0.00 0.00 66.70 66.22 2gbx h VAL 429 Cb 1.15 2.22 -0.00 0.00 -1.52 0.00 0.00 31.29 33.15 2gbx h VAL 429 CO 0.10 0.34 -0.01 0.11 0.02 0.00 0.00 177.57 178.13 2gbx h LYS 430 N -0.44 0.00 0.00 1.57 1.57 -0.12 -1.54 116.57 117.62 2gbx h LYS 430 Ca 0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2gbx h LYS 430 Cb 0.58 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 2gbx h LYS 430 CO 0.01 0.01 -0.19 0.00 -0.57 0.00 0.00 179.45 178.71 2gbx h ALA 431 N 1.99 1.21 -0.83 3.86 0.00 -1.46 -3.13 119.26 120.90 2gbx h ALA 431 Ca -0.00 -0.18 -0.34 0.00 0.00 0.00 0.00 54.91 54.39 2gbx h ALA 431 Cb 0.06 -0.03 -0.20 0.00 0.00 0.00 0.00 17.79 17.62 2gbx h ALA 431 CO 0.00 0.24 0.44 0.09 0.00 0.00 0.00 179.25 180.02 2gbx n ASN 432 N -3.63 4.28 0.08 0.00 3.02 -0.58 -4.53 115.26 113.90 2gbx n ASN 432 Ca -0.01 -3.34 0.01 0.00 -0.03 0.00 0.00 54.58 51.21 2gbx n ASN 432 Cb 0.33 -0.78 0.33 0.00 -0.61 0.00 0.00 39.78 39.04 2gbx n ASN 432 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2gbx h ASP 433 N 1.83 0.30 0.06 6.41 3.32 -1.68 -2.99 116.42 123.68 2gbx h ASP 433 Ca 0.42 -0.07 -0.09 0.00 0.02 0.00 0.00 57.03 57.31 2gbx h ASP 433 Cb 2.52 -0.08 0.01 0.00 0.22 0.00 0.00 39.33 42.00 2gbx h ASP 433 CO 0.88 0.49 -0.38 0.44 -1.72 0.00 0.00 179.24 178.94 2gbx h ASP 434 N 0.29 0.21 -2.23 6.45 5.19 -1.88 -3.39 116.42 121.06 2gbx h ASP 434 Ca 0.06 -0.98 -0.70 0.00 -0.62 0.00 0.00 57.03 54.78 2gbx h ASP 434 Cb 0.46 -0.07 -0.34 0.00 0.18 0.00 0.00 39.33 39.56 2gbx h ASP 434 CO 0.03 1.18 0.25 0.35 -3.12 0.00 0.00 179.24 177.93 2gbx n THR 435 N -4.39 4.57 -0.06 0.35 -2.24 -1.22 -4.65 114.28 106.64 2gbx n THR 435 Ca -0.12 -5.71 -0.15 0.00 -2.27 0.00 0.00 64.05 55.80 2gbx n THR 435 Cb 0.64 -1.46 -0.14 0.00 -2.10 0.00 0.00 70.33 67.27 2gbx n THR 435 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 2gbx n TRP 436 N -0.18 0.54 -1.26 4.78 4.27 -1.13 -4.47 117.44 119.99 2gbx n TRP 436 Ca 0.40 0.14 -0.24 0.00 -3.89 0.00 0.00 57.50 53.91 2gbx n TRP 436 Cb 0.33 -1.08 0.17 0.00 -1.36 0.00 0.00 31.31 29.37 2gbx n TRP 436 CO 0.00 0.00 0.00 -0.40 -2.29 0.00 0.00 177.69 175.00 2gbx n ASP 437 N -3.16 4.20 0.22 -0.67 5.75 -1.26 -4.39 116.55 117.24 2gbx n ASP 437 Ca -0.34 -3.64 0.11 0.00 -0.01 0.00 0.00 54.79 50.91 2gbx n ASP 437 Cb 1.06 -0.84 0.38 0.00 -1.03 0.00 0.00 41.12 40.69 2gbx n ASP 437 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2gbx h SER 438 N 1.14 0.00 0.68 -1.12 4.64 -1.92 -3.00 113.55 113.97 2gbx h SER 438 Ca 0.61 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.93 2gbx h SER 438 Cb 2.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.63 2gbx h SER 438 CO 1.13 0.17 0.00 1.33 -0.87 0.00 0.00 176.83 178.60 2gbx n VAL 439 N -3.24 0.70 -3.26 0.95 0.24 -1.26 -4.23 118.33 108.23 2gbx n VAL 439 Ca 0.01 0.16 -0.46 0.00 -2.04 0.00 0.00 64.34 62.02 2gbx n VAL 439 Cb 0.47 -0.86 -0.04 0.00 -1.47 0.00 0.00 33.84 31.94 2gbx n VAL 439 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2gbx s PHE 440 N -3.03 3.41 0.12 6.34 0.08 -1.13 -4.89 117.98 118.88 2gbx s PHE 440 Ca 0.09 -1.53 -0.12 0.00 0.12 0.00 0.00 56.93 55.49 2gbx s PHE 440 Cb 0.12 -3.88 -0.08 0.00 -0.57 0.00 0.00 43.02 38.61 2gbx s PHE 440 CO 0.36 -1.09 1.42 -1.00 -0.10 0.00 0.00 175.22 174.81 2gbx h PRO 441 N 8.49 0.86 -5.99 0.24 0.13 -1.85 -3.41 132.00 130.46 2gbx h PRO 441 Ca -0.10 -0.51 -0.47 0.00 -0.87 0.00 0.00 66.00 64.05 2gbx h PRO 441 Cb 1.07 0.05 -0.05 0.00 0.13 0.00 0.00 31.00 32.19 2gbx h PRO 441 CO 0.94 1.15 1.17 1.21 -0.23 0.00 0.00 178.00 182.24 2gbx s ASN 442 N -6.85 5.49 -0.14 1.44 3.84 -1.26 -4.81 114.94 112.64 2gbx s ASN 442 Ca -0.11 -0.18 -0.23 0.00 0.21 0.00 0.00 52.86 52.56 2gbx s ASN 442 Cb 0.10 -2.54 -0.20 0.00 -0.55 0.00 0.00 41.25 38.05 2gbx s ASN 442 CO 0.88 -2.30 0.52 0.03 -2.79 0.00 0.00 177.10 173.44 2gbx h ARG 443 N 12.85 0.00 -2.65 0.43 2.47 -1.86 -3.38 114.38 122.24 2gbx h ARG 443 Ca -0.14 0.00 -0.73 0.00 -1.26 0.00 0.00 59.98 57.85 2gbx h ARG 443 Cb 1.09 0.00 -0.11 0.00 -1.65 0.00 0.00 29.97 29.31 2gbx h ARG 443 CO 1.24 0.81 2.55 0.09 0.56 0.00 0.00 179.97 185.22 2gbx n ASN 444 N -4.61 8.12 -0.10 7.04 5.03 -1.26 -4.46 115.26 125.02 2gbx n ASN 444 Ca -0.12 -3.08 -0.15 0.00 0.87 0.00 0.00 54.58 52.10 2gbx n ASN 444 Cb 0.43 -1.38 -0.06 0.00 -1.02 0.00 0.00 39.78 37.75 2gbx n ASN 444 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 2gbx n PHE 445 N 1.92 0.54 0.22 3.10 7.35 -1.26 -4.03 117.46 125.30 2gbx n PHE 445 Ca 0.64 0.24 0.10 0.00 -0.76 0.00 0.00 57.45 57.67 2gbx n PHE 445 Cb 0.25 -0.84 0.41 0.00 0.35 0.00 0.00 39.48 39.65 2gbx n PHE 445 CO 0.00 0.00 0.00 -1.49 -0.76 0.00 0.00 176.76 174.51 2gbx h TRP 446 N -1.00 0.00 -0.30 -5.13 4.06 -1.82 -0.46 115.95 111.30 2gbx h TRP 446 Ca -0.24 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 60.66 2gbx h TRP 446 Cb 1.06 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.21 2gbx h TRP 446 CO -0.16 0.22 -0.04 -0.91 -3.56 0.00 0.00 178.44 173.99 2gbx h ASN 447 N 0.00 0.56 0.61 -3.49 4.21 -1.88 -1.63 115.58 113.96 2gbx h ASN 447 Ca -0.00 -0.34 -0.19 0.00 1.21 0.00 0.00 56.30 56.98 2gbx h ASN 447 Cb 0.81 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 37.85 2gbx h ASN 447 CO 0.03 0.76 -0.86 -0.33 -1.29 0.00 0.00 177.43 175.74 2gbx h GLU 448 N 0.34 0.17 -0.10 0.81 5.08 -1.66 -2.98 114.58 116.24 2gbx h GLU 448 Ca 0.08 -0.18 -0.07 0.00 -1.00 0.00 0.00 59.36 58.19 2gbx h GLU 448 Cb 0.50 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2gbx h GLU 448 CO 0.02 0.93 -0.19 -0.22 -1.00 0.00 0.00 179.01 178.55 2gbx h LYS 449 N 0.10 0.31 0.00 2.33 1.63 -1.08 -2.01 116.57 117.84 2gbx h LYS 449 Ca -0.04 -0.20 -0.11 0.00 -0.85 0.00 0.00 60.65 59.46 2gbx h LYS 449 Cb 1.48 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 33.12 2gbx h LYS 449 CO 0.13 0.79 -0.52 -0.07 -3.45 0.00 0.00 179.45 176.32 2gbx h LEU 450 N -0.13 0.00 -0.46 5.20 3.38 -1.41 -1.87 115.31 120.02 2gbx h LEU 450 Ca 0.01 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 2gbx h LEU 450 Cb 0.77 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 2gbx h LEU 450 CO 0.04 0.52 -0.59 0.78 0.09 0.00 0.00 178.44 179.28 2gbx h ASN 451 N 0.00 0.65 -0.57 -0.43 4.21 -1.55 -3.19 115.58 114.70 2gbx h ASN 451 Ca -0.01 -0.36 -0.09 0.00 1.21 0.00 0.00 56.30 57.05 2gbx h ASN 451 Cb 0.92 -0.19 -0.02 0.00 -1.12 0.00 0.00 38.32 37.92 2gbx h ASN 451 CO 0.07 1.09 0.01 0.00 -1.29 0.00 0.00 177.43 177.31 2gbx h ALA 452 N 0.91 0.77 -2.40 -0.83 0.00 -1.18 -3.44 119.26 113.09 2gbx h ALA 452 Ca -0.00 -0.30 -0.49 0.00 0.00 0.00 0.00 54.91 54.12 2gbx h ALA 452 Cb 1.15 -0.21 0.11 0.00 0.00 0.00 0.00 17.79 18.84 2gbx h ALA 452 CO 0.11 0.60 0.34 0.00 0.00 0.00 0.00 179.25 180.30 2gbx s ALA 453 N -5.03 2.27 0.00 0.00 0.00 -0.72 -5.11 121.76 113.17 2gbx s ALA 453 Ca -0.12 -0.18 0.00 0.00 0.00 0.00 0.00 51.96 51.66 2gbx s ALA 453 Cb 0.13 -3.12 0.00 0.00 0.00 0.00 0.00 23.12 20.13 2gbx s ALA 453 CO 0.85 -1.70 0.00 -0.85 0.00 0.00 0.00 175.76 174.05