#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jro n ASP 34 N 0.00 1.66 0.20 4.38 9.92 -1.26 -4.80 116.55 126.65 3jro n ASP 34 Ca 0.00 0.70 0.15 0.00 -0.53 0.00 0.00 54.79 55.11 3jro n ASP 34 Cb 0.00 -1.09 0.57 0.00 -0.64 0.00 0.00 41.12 39.96 3jro n ASP 34 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 3jro h PRO 35 N 9.60 0.00 0.00 -0.24 0.13 -2.00 -3.25 132.00 136.24 3jro h PRO 35 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3jro h PRO 35 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 3jro h PRO 35 CO 1.03 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.99 3jro n PHE 36 N -2.66 0.00 0.10 1.56 3.72 -1.26 -3.04 117.46 115.87 3jro n PHE 36 Ca 0.02 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.44 3jro n PHE 36 Cb 0.28 0.00 0.39 0.00 -0.94 0.00 0.00 39.48 39.21 3jro n PHE 36 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 3jro h ASN 37 N 0.00 0.27 0.10 4.37 2.35 -1.96 0.54 115.58 121.25 3jro h ASN 37 Ca 0.00 -0.05 -0.23 0.00 -0.55 0.00 0.00 56.30 55.47 3jro h ASN 37 Cb 0.00 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.30 3jro h ASN 37 CO 0.00 0.39 -1.16 -0.29 -1.65 0.00 0.00 177.43 174.71 3jro h ILE 38 N 0.28 1.17 -0.59 2.81 2.10 -1.87 -3.36 117.51 118.06 3jro h ILE 38 Ca 0.06 -2.40 0.09 0.00 1.08 0.00 0.00 64.86 63.69 3jro h ILE 38 Cb 0.31 2.81 -0.07 0.00 -1.09 0.00 0.00 36.82 38.79 3jro h ILE 38 CO 0.01 0.66 0.22 0.40 -1.08 0.00 0.00 178.15 178.37 3jro h ILE 39 N -0.45 0.79 -0.60 2.19 2.04 -1.66 0.18 117.51 120.00 3jro h ILE 39 Ca -0.25 -0.14 0.17 0.00 1.00 0.00 0.00 64.86 65.64 3jro h ILE 39 Cb 1.63 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 3jro h ILE 39 CO 0.04 0.07 0.54 0.03 0.00 0.00 0.00 178.15 178.84 3jro h ARG 40 N 0.41 0.00 0.00 2.37 3.08 -0.06 0.33 114.38 120.50 3jro h ARG 40 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 3jro h ARG 40 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.39 3jro h ARG 40 CO -0.29 0.00 -0.73 0.39 -1.07 0.00 0.00 179.97 178.27 3jro n GLU 41 N -3.91 0.18 0.05 0.04 1.02 0.02 -1.62 120.64 116.43 3jro n GLU 41 Ca 0.12 0.03 -0.04 0.00 -0.02 0.00 0.00 57.16 57.24 3jro n GLU 41 Cb 0.77 -1.59 -0.02 0.00 -0.02 0.00 0.00 31.44 30.58 3jro n GLU 41 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 3jro h PHE 42 N 0.00 -0.21 -1.13 -0.32 0.04 -0.09 -3.13 116.94 112.09 3jro h PHE 42 Ca 0.00 -0.00 0.32 0.00 2.80 0.00 0.00 57.97 61.08 3jro h PHE 42 Cb 0.65 0.07 -0.07 0.00 2.20 0.00 0.00 35.95 38.80 3jro h PHE 42 CO 0.00 -0.08 0.78 -0.09 -0.60 0.00 0.00 178.31 178.32 3jro h ARG 43 N -1.05 0.14 -0.03 1.51 2.43 -1.13 0.34 114.38 116.59 3jro h ARG 43 Ca -0.02 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 3jro h ARG 43 Cb 0.23 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3jro h ARG 43 CO 0.04 0.09 -0.01 0.66 -1.51 0.00 0.00 179.97 179.24 3jro h SER 44 N 0.14 0.05 -0.06 -3.80 4.64 -1.41 -2.79 113.55 110.33 3jro h SER 44 Ca 0.58 -0.39 -0.13 0.00 -0.47 0.00 0.00 61.79 61.38 3jro h SER 44 Cb 1.99 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 64.06 3jro h SER 44 CO -0.13 0.43 -0.40 0.00 -0.87 0.00 0.00 176.83 175.86 3jro h ALA 45 N 0.63 0.84 -0.91 5.18 0.00 -1.00 -2.50 119.26 121.50 3jro h ALA 45 Ca 0.01 -0.44 0.08 0.00 0.00 0.00 0.00 54.91 54.56 3jro h ALA 45 Cb 0.41 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.02 3jro h ALA 45 CO 0.00 0.64 0.56 0.00 0.00 0.00 0.00 179.25 180.46 3jro h ALA 46 N 1.08 1.28 -0.12 0.00 0.00 -0.44 -0.03 119.26 121.05 3jro h ALA 46 Ca 0.04 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.75 3jro h ALA 46 Cb 0.90 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3jro h ALA 46 CO 0.08 0.27 -0.75 0.78 0.00 0.00 0.00 179.25 179.62 3jro h GLY 47 N 0.98 0.66 2.00 0.00 0.00 -1.35 -2.97 103.07 102.39 3jro h GLY 47 Ca 0.41 -0.93 0.00 0.00 0.00 0.00 0.00 47.33 46.81 3jro h GLY 47 CO -0.20 0.83 0.00 1.46 0.00 0.00 0.00 176.54 178.63 3jro h GLN 48 N 0.41 0.00 0.00 4.80 4.20 -0.97 -1.70 115.11 121.84 3jro h GLN 48 Ca -0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.67 3jro h GLN 48 Cb 1.36 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.14 3jro h GLN 48 CO 0.14 0.00 -0.20 1.28 -0.67 0.00 0.00 178.83 179.38 3jro n LEU 49 N -2.56 0.45 0.17 1.46 4.77 -0.07 -3.02 117.00 118.20 3jro n LEU 49 Ca 0.02 0.38 0.05 0.00 -0.03 0.00 0.00 56.01 56.44 3jro n LEU 49 Cb 0.31 -0.35 0.22 0.00 -2.33 0.00 0.00 43.42 41.27 3jro n LEU 49 CO 0.25 -0.04 0.62 0.00 -1.33 0.00 0.00 177.39 176.88 3jro h ALA 50 N 2.78 0.85 -0.00 -1.18 0.00 -1.22 -3.26 119.26 117.23 3jro h ALA 50 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3jro h ALA 50 Cb 0.61 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3jro h ALA 50 CO 0.00 0.49 -0.27 1.28 0.00 0.00 0.00 179.25 180.75 3jro n LEU 51 N -3.35 0.48 -0.26 0.00 4.77 -1.17 -3.32 117.00 114.15 3jro n LEU 51 Ca 0.01 0.06 0.15 0.00 -0.03 0.00 0.00 56.01 56.19 3jro n LEU 51 Cb 0.59 -0.26 0.69 0.00 -2.33 0.00 0.00 43.42 42.11 3jro n LEU 51 CO 0.38 0.10 0.95 0.47 -1.33 0.00 0.00 177.39 177.96 3jro n ASP 52 N -1.24 0.83 -0.00 -1.43 9.92 -1.23 -3.69 116.55 119.72 3jro n ASP 52 Ca 0.09 -1.21 -0.22 0.00 -0.53 0.00 0.00 54.79 52.92 3jro n ASP 52 Cb 0.32 -0.00 -0.14 0.00 -0.64 0.00 0.00 41.12 40.66 3jro n ASP 52 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 3jro h LEU 53 N 1.28 0.38 -0.31 0.64 4.07 -1.75 -3.38 115.31 116.23 3jro h LEU 53 Ca 0.00 -0.86 0.06 0.00 0.08 0.00 0.00 57.88 57.16 3jro h LEU 53 Cb 0.30 -0.12 -0.06 0.00 1.08 0.00 0.00 40.66 41.86 3jro h LEU 53 CO 0.00 1.73 -0.05 0.00 -1.08 0.00 0.00 178.44 179.04 3jro h ALA 54 N -0.04 0.23 -3.00 1.53 0.00 -1.74 -0.82 119.26 115.42 3jro h ALA 54 Ca -0.37 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3jro h ALA 54 Cb 1.86 0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.85 3jro h ALA 54 CO 0.05 -0.44 0.00 0.09 0.00 0.00 0.00 179.25 178.95 3jro n ASN 55 N -5.22 0.00 -3.17 0.00 3.02 -1.26 -4.49 115.26 104.14 3jro n ASN 55 Ca 0.00 0.22 -0.27 0.00 -0.03 0.00 0.00 54.58 54.51 3jro n ASN 55 Cb 0.17 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.28 3jro n ASN 55 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 3jro n SER 56 N -0.26 3.88 0.00 6.41 2.88 -1.25 -5.00 113.62 120.28 3jro n SER 56 Ca 0.00 -3.52 0.00 0.00 -1.33 0.00 0.00 58.87 54.02 3jro n SER 56 Cb 0.00 -0.61 0.00 0.00 -0.75 0.00 0.00 64.21 62.85 3jro n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3jro n GLY 57 N 0.31 0.21 3.93 0.46 0.00 -0.31 -4.77 105.19 105.01 3jro n GLY 57 Ca 0.30 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.26 3jro n GLY 57 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3jro n ASP 58 N 0.00 0.00 0.00 1.61 5.75 -1.26 -4.75 116.55 117.90 3jro n ASP 58 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 3jro n ASP 58 Cb 0.00 -1.23 0.00 0.00 -1.03 0.00 0.00 41.12 38.86 3jro n ASP 58 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 3jro n GLU 59 N -2.00 3.96 0.24 0.11 2.13 -1.26 -4.99 120.64 118.83 3jro n GLU 59 Ca 0.00 0.00 0.16 0.00 0.66 0.00 0.00 57.16 57.98 3jro n GLU 59 Cb 0.00 0.00 0.73 0.00 0.27 0.00 0.00 31.44 32.44 3jro n GLU 59 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 3jro h SER 60 N 0.00 0.00 1.69 4.31 4.64 -2.00 -2.96 113.55 119.24 3jro h SER 60 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3jro h SER 60 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3jro h SER 60 CO 0.00 0.00 0.00 -0.55 -0.87 0.00 0.00 176.83 175.41 3jro h ASN 61 N 0.00 0.00 1.44 4.97 7.08 -1.94 -0.15 115.58 126.98 3jro h ASN 61 Ca 0.00 0.00 -0.08 0.00 -3.08 0.00 0.00 56.30 53.14 3jro h ASN 61 Cb 0.31 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.54 3jro h ASN 61 CO 0.00 0.00 -0.40 1.62 -2.08 0.00 0.00 177.43 176.57 3jro h VAL 62 N 0.00 0.73 0.00 6.14 3.04 -1.81 -2.90 116.25 121.44 3jro h VAL 62 Ca 0.00 -1.90 -0.11 0.00 -1.01 0.00 0.00 66.70 63.68 3jro h VAL 62 Cb 0.85 2.26 -0.02 0.00 -2.01 0.00 0.00 31.29 32.37 3jro h VAL 62 CO 0.00 0.39 -0.63 0.40 -1.01 0.00 0.00 177.57 176.72 3jro h ILE 63 N 0.00 1.16 0.00 3.17 2.04 -1.59 -3.25 117.51 119.03 3jro h ILE 63 Ca -0.00 -2.11 -0.01 0.00 1.00 0.00 0.00 64.86 63.74 3jro h ILE 63 Cb 1.23 2.43 -0.00 0.00 -0.74 0.00 0.00 36.82 39.74 3jro h ILE 63 CO 0.05 0.39 -0.06 0.77 0.00 0.00 0.00 178.15 179.31 3jro h SER 64 N -1.00 0.00 -0.00 1.72 4.64 -1.17 -1.35 113.55 116.39 3jro h SER 64 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 3jro h SER 64 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3jro h SER 64 CO -0.10 0.06 -0.02 -1.20 -0.87 0.00 0.00 176.83 174.69 3jro n SER 65 N -3.50 1.71 0.14 4.97 7.64 -1.10 -2.55 113.62 120.93 3jro n SER 65 Ca -0.02 -1.54 0.13 0.00 1.01 0.00 0.00 58.87 58.45 3jro n SER 65 Cb 0.18 0.02 0.39 0.00 -1.01 0.00 0.00 64.21 63.79 3jro n SER 65 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 3jro h LYS 66 N 2.65 0.00 0.09 1.43 1.57 -1.27 -3.05 116.57 117.98 3jro h LYS 66 Ca 0.00 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.52 3jro h LYS 66 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 3jro h LYS 66 CO 0.00 0.00 -1.14 -0.44 -0.57 0.00 0.00 179.45 177.30 3jro h ASP 67 N 0.00 0.47 -0.34 0.86 3.32 -1.58 -3.06 116.42 116.09 3jro h ASP 67 Ca 0.00 -0.45 -0.06 0.00 0.02 0.00 0.00 57.03 56.54 3jro h ASP 67 Cb 0.71 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 3jro h ASP 67 CO 0.00 1.31 -0.03 -0.50 -1.72 0.00 0.00 179.24 178.30 3jro h TRP 68 N 0.13 0.69 0.00 4.55 -0.00 -1.63 -1.32 115.95 118.37 3jro h TRP 68 Ca -0.12 -0.13 -0.01 0.00 -0.00 0.00 0.00 58.89 58.63 3jro h TRP 68 Cb 1.83 -0.17 -0.00 0.00 -0.00 0.00 0.00 29.16 30.81 3jro h TRP 68 CO 0.06 0.75 -0.07 1.49 -0.00 0.00 0.00 178.44 180.68 3jro h GLU 69 N 0.42 0.00 -0.11 0.49 4.22 -1.66 -2.10 114.58 115.84 3jro h GLU 69 Ca 0.09 0.00 -0.23 0.00 0.08 0.00 0.00 59.36 59.31 3jro h GLU 69 Cb 0.50 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.76 3jro h GLU 69 CO 0.02 0.07 -0.84 -0.07 -2.18 0.00 0.00 179.01 176.02 3jro h LEU 70 N 0.00 0.86 0.50 1.64 3.38 -1.39 -2.87 115.31 117.43 3jro h LEU 70 Ca -0.00 -0.59 -0.02 0.00 0.09 0.00 0.00 57.88 57.36 3jro h LEU 70 Cb 0.67 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 3jro h LEU 70 CO 0.01 1.39 -0.28 -0.08 0.09 0.00 0.00 178.44 179.56 3jro h GLU 71 N 0.46 -0.70 -0.77 1.13 4.81 -0.75 -2.01 114.58 116.75 3jro h GLU 71 Ca -0.07 0.05 0.16 0.00 -0.13 0.00 0.00 59.36 59.37 3jro h GLU 71 Cb 1.46 0.16 -0.10 0.00 0.63 0.00 0.00 28.75 30.90 3jro h GLU 71 CO 0.17 -0.47 0.27 0.00 -0.73 0.00 0.00 179.01 178.25 3jro h ALA 72 N -0.26 1.08 0.00 2.92 0.00 -1.48 0.35 119.26 121.87 3jro h ALA 72 Ca -0.06 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 3jro h ALA 72 Cb 0.58 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 3jro h ALA 72 CO 0.08 -0.27 -0.09 0.00 0.00 0.00 0.00 179.25 178.97 3jro h ARG 73 N 0.38 0.00 0.11 0.00 3.08 -1.37 -2.46 114.38 114.13 3jro h ARG 73 Ca 0.43 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 60.30 3jro h ARG 73 Cb 0.71 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.78 3jro h ARG 73 CO -0.45 0.09 -0.81 0.35 -1.07 0.00 0.00 179.97 178.08 3jro h PHE 74 N 0.00 0.59 -0.05 3.04 3.57 0.31 -3.01 116.94 121.39 3jro h PHE 74 Ca -0.00 -0.40 0.02 0.00 3.53 0.00 0.00 57.97 61.11 3jro h PHE 74 Cb 0.55 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.26 3jro h PHE 74 CO 0.00 1.29 0.09 -1.49 -2.23 0.00 0.00 178.31 175.97 3jro h TRP 75 N -0.27 0.00 0.01 0.41 -0.00 -0.51 0.59 115.95 116.19 3jro h TRP 75 Ca -0.13 0.00 -0.00 0.00 -0.00 0.00 0.00 58.89 58.76 3jro h TRP 75 Cb 1.60 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.76 3jro h TRP 75 CO 0.18 0.00 -0.00 1.25 -0.00 0.00 0.00 178.44 179.87 3jro h HIS 76 N 0.00 -0.01 -0.87 0.49 2.76 -1.49 0.06 115.15 116.08 3jro h HIS 76 Ca 0.02 -0.00 0.10 0.00 -2.20 0.00 0.00 60.37 58.29 3jro h HIS 76 Cb 0.21 0.00 -0.06 0.00 1.55 0.00 0.00 27.41 29.11 3jro h HIS 76 CO 0.00 0.80 0.56 1.25 -1.30 0.00 0.00 177.93 179.24 3jro h LEU 77 N -0.94 0.77 0.05 0.26 5.85 -1.26 -0.50 115.31 119.53 3jro h LEU 77 Ca -0.00 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 3jro h LEU 77 Cb 0.82 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.71 3jro h LEU 77 CO 0.00 0.45 -0.02 0.58 -0.34 0.00 0.00 178.44 179.11 3jro h VAL 78 N 0.85 1.15 -0.06 1.05 2.07 -0.98 -2.18 116.25 118.14 3jro h VAL 78 Ca 0.41 -0.66 0.02 0.00 0.82 0.00 0.00 66.70 67.28 3jro h VAL 78 Cb 0.43 1.59 -0.00 0.00 -1.52 0.00 0.00 31.29 31.78 3jro h VAL 78 CO -0.17 0.17 0.09 -0.08 0.02 0.00 0.00 177.57 177.59 3jro h GLU 79 N -0.36 0.00 0.00 1.57 4.81 0.58 -2.88 114.58 118.29 3jro h GLU 79 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3jro h GLU 79 Cb 0.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.71 3jro h GLU 79 CO 0.01 0.00 -1.27 1.47 -0.73 0.00 0.00 179.01 178.49 3jro n LEU 80 N -3.69 0.04 0.09 1.64 -0.00 -0.58 -3.99 117.00 110.51 3jro n LEU 80 Ca -0.01 -0.05 -0.15 0.00 -0.00 0.00 0.00 56.01 55.80 3jro n LEU 80 Cb 0.18 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.46 3jro n LEU 80 CO 0.26 0.01 -0.06 0.25 -0.00 0.00 0.00 177.39 177.84 3jro h LEU 81 N 0.00 0.35 -0.04 1.47 5.85 -1.32 -3.30 115.31 118.33 3jro h LEU 81 Ca 0.00 -0.39 -0.00 0.00 0.84 0.00 0.00 57.88 58.32 3jro h LEU 81 Cb 0.35 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.27 3jro h LEU 81 CO 0.00 1.31 0.01 -0.07 -0.34 0.00 0.00 178.44 179.35 3jro h LEU 82 N 0.06 0.07 -1.79 2.25 3.38 -1.74 -2.33 115.31 115.20 3jro h LEU 82 Ca -0.13 -0.26 0.54 0.00 0.09 0.00 0.00 57.88 58.12 3jro h LEU 82 Cb 1.95 -0.02 -0.09 0.00 0.09 0.00 0.00 40.66 42.59 3jro h LEU 82 CO 0.19 0.31 1.27 0.52 0.09 0.00 0.00 178.44 180.81 3jro n VAL 83 N -4.92 -0.06 -1.77 1.22 0.31 -1.25 -3.76 118.33 108.11 3jro n VAL 83 Ca -0.07 1.51 -0.19 0.00 -0.01 0.00 0.00 64.34 65.58 3jro n VAL 83 Cb 0.15 -2.51 -0.07 0.00 -0.91 0.00 0.00 33.84 30.50 3jro n VAL 83 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 3jro s PHE 84 N -4.88 1.43 0.18 3.52 5.36 -0.88 -4.83 117.98 117.88 3jro s PHE 84 Ca -0.05 1.46 -0.15 0.00 -0.96 0.00 0.00 56.93 57.23 3jro s PHE 84 Cb 0.27 -3.67 0.02 0.00 -0.34 0.00 0.00 43.02 39.30 3jro s PHE 84 CO 0.85 -1.52 0.44 1.03 -1.46 0.00 0.00 175.22 174.56 3jro s ARG 85 N 8.05 1.30 -0.02 10.12 0.52 -1.25 -5.06 118.95 132.61 3jro s ARG 85 Ca 0.82 -0.96 -0.23 0.00 -0.52 0.00 0.00 55.73 54.85 3jro s ARG 85 Cb -0.09 0.47 -0.11 0.00 0.52 0.00 0.00 34.95 35.74 3jro s ARG 85 CO 0.06 -0.53 0.62 -1.71 0.02 0.00 0.00 175.30 173.77 3jro n ASN 86 N -0.29 0.04 -2.82 0.23 5.15 -1.26 -4.94 115.26 111.36 3jro n ASN 86 Ca -0.09 0.66 -0.06 0.00 -0.60 0.00 0.00 54.58 54.48 3jro n ASN 86 Cb 0.63 -0.52 0.00 0.00 -0.53 0.00 0.00 39.78 39.36 3jro n ASN 86 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3jro n ALA 87 N 0.94 -1.41 -3.92 5.20 0.00 -1.26 -4.99 120.51 115.08 3jro n ALA 87 Ca 0.12 -1.25 -0.30 0.00 0.00 0.00 0.00 53.44 52.01 3jro n ALA 87 Cb 0.04 -1.42 -0.00 0.00 0.00 0.00 0.00 19.45 18.07 3jro n ALA 87 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3jro n ASP 88 N 2.86 -2.02 0.20 0.00 8.00 -1.26 -4.86 116.55 119.47 3jro n ASP 88 Ca 0.19 -1.06 0.09 0.00 0.71 0.00 0.00 54.79 54.72 3jro n ASP 88 Cb 0.56 -2.88 0.14 0.00 -0.02 0.00 0.00 41.12 38.92 3jro n ASP 88 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3jro h LEU 89 N -1.94 0.00 0.00 0.64 3.38 -1.98 -3.36 115.31 112.04 3jro h LEU 89 Ca -0.65 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.32 3jro h LEU 89 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 3jro h LEU 89 CO 0.58 0.15 0.00 0.47 0.09 0.00 0.00 178.44 179.73 3jro n ASP 90 N -3.14 0.00 0.06 -0.43 8.00 -1.26 -3.15 116.55 116.63 3jro n ASP 90 Ca 0.03 0.82 0.04 0.00 0.71 0.00 0.00 54.79 56.40 3jro n ASP 90 Cb 0.58 -0.40 0.22 0.00 -0.02 0.00 0.00 41.12 41.51 3jro n ASP 90 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3jro n LEU 91 N -1.69 0.21 -0.25 0.64 4.77 -1.26 -0.77 117.00 118.65 3jro n LEU 91 Ca 0.00 0.59 -0.06 0.00 -0.03 0.00 0.00 56.01 56.51 3jro n LEU 91 Cb 0.00 -0.61 0.05 0.00 -2.33 0.00 0.00 43.42 40.53 3jro n LEU 91 CO 0.00 -0.66 1.07 0.44 -1.33 0.00 0.00 177.39 176.91 3jro h ASP 92 N 0.00 0.91 -0.93 -1.43 5.19 -1.69 -3.50 116.42 114.96 3jro h ASP 92 Ca 0.00 -0.13 -0.05 0.00 -0.62 0.00 0.00 57.03 56.23 3jro h ASP 92 Cb 0.03 -0.23 0.03 0.00 0.18 0.00 0.00 39.33 39.34 3jro h ASP 92 CO 0.00 0.78 -0.02 -0.62 -3.12 0.00 0.00 179.24 176.26 3jro n GLU 93 N -4.44 0.60 0.00 3.56 1.02 0.05 -5.12 120.64 116.31 3jro n GLU 93 Ca 0.06 -0.20 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 3jro n GLU 93 Cb 0.12 -0.68 0.00 0.00 -0.02 0.00 0.00 31.44 30.86 3jro n GLU 93 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3jro n GLU 95 N 0.23 0.00 -0.00 3.49 1.02 -1.26 -5.10 120.64 119.01 3jro n GLU 95 Ca 0.02 0.00 0.14 0.00 -0.02 0.00 0.00 57.16 57.30 3jro n GLU 95 Cb 0.08 0.00 0.72 0.00 -0.02 0.00 0.00 31.44 32.22 3jro n GLU 95 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3jro n LEU 96 N 0.00 0.69 -0.08 -4.62 4.77 -1.26 -4.02 117.00 112.48 3jro n LEU 96 Ca 0.00 -0.24 -0.08 0.00 -0.03 0.00 0.00 56.01 55.66 3jro n LEU 96 Cb 0.00 -0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 40.96 3jro n LEU 96 CO 0.00 0.12 -1.01 0.00 -1.33 0.00 0.00 177.39 175.17 3jro n HIS 97 N -0.44 0.00 -0.59 -1.77 1.44 -1.26 -4.95 115.22 107.65 3jro n HIS 97 Ca 0.21 0.00 -0.28 0.00 -2.01 0.00 0.00 57.72 55.64 3jro n HIS 97 Cb 0.22 -0.76 0.18 0.00 0.12 0.00 0.00 29.99 29.74 3jro n HIS 97 CO 0.00 0.00 0.00 -2.30 -2.81 0.00 0.00 176.34 171.23 3jro n PRO 98 N -2.59 -2.08 0.00 -1.40 -0.02 -1.26 -1.85 135.00 125.80 3jro n PRO 98 Ca -0.26 -0.60 0.00 0.00 -2.02 0.00 0.00 63.50 60.62 3jro n PRO 98 Cb 1.00 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.82 3jro n PRO 98 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 3jro n TYR 99 N -4.56 0.00 -0.31 6.00 4.11 -1.26 -4.80 117.16 116.33 3jro n TYR 99 Ca 0.03 0.00 0.12 0.00 -0.00 0.00 0.00 57.90 58.05 3jro n TYR 99 Cb 0.55 -0.39 0.24 0.00 -0.00 0.00 0.00 39.34 39.73 3jro n TYR 99 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.86 175.15 3jro n ASN 100 N 0.00 -0.15 -2.36 9.48 2.85 -0.77 -4.79 115.26 119.52 3jro n ASN 100 Ca 0.00 1.53 -0.17 0.00 -0.11 0.00 0.00 54.58 55.83 3jro n ASN 100 Cb 0.00 -0.54 -0.01 0.00 1.24 0.00 0.00 39.78 40.47 3jro n ASN 100 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 3jro n SER 101 N -5.34 -5.00 0.25 1.20 3.41 -1.26 -4.86 113.62 102.01 3jro n SER 101 Ca 0.20 0.10 0.16 0.00 -0.26 0.00 0.00 58.87 59.07 3jro n SER 101 Cb 0.64 -4.21 0.58 0.00 -0.26 0.00 0.00 64.21 60.97 3jro n SER 101 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 3jro h ARG 102 N 0.00 0.00 -5.48 4.33 0.11 -1.87 -3.46 114.38 108.01 3jro h ARG 102 Ca -0.40 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 59.46 3jro h ARG 102 Cb 1.29 0.00 0.16 0.00 1.11 0.00 0.00 29.97 32.53 3jro h ARG 102 CO 0.48 0.00 -0.72 0.41 0.10 0.00 0.00 179.97 180.25 3jro n GLY 103 N 0.22 -1.18 0.66 0.08 0.00 -1.26 -4.51 105.19 99.20 3jro n GLY 103 Ca 0.01 0.56 -0.03 0.00 0.00 0.00 0.00 46.02 46.57 3jro n GLY 103 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3jro n LEU 104 N -3.01 -0.43 0.00 0.99 7.94 -1.26 -3.26 117.00 117.96 3jro n LEU 104 Ca -0.06 -1.03 0.04 0.00 -1.11 0.00 0.00 56.01 53.86 3jro n LEU 104 Cb 0.60 0.00 0.25 0.00 0.53 0.00 0.00 43.42 44.79 3jro n LEU 104 CO 0.58 1.01 0.54 0.49 -1.11 0.00 0.00 177.39 178.90 3jro n PHE 105 N 0.00 0.00 -0.31 1.96 3.01 -1.26 -3.50 117.46 117.35 3jro n PHE 105 Ca -0.12 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.46 3jro n PHE 105 Cb 0.46 0.00 0.29 0.00 -0.01 0.00 0.00 39.48 40.22 3jro n PHE 105 CO 0.00 0.00 0.00 1.05 1.01 0.00 0.00 176.76 178.82 3jro h GLU 106 N 0.00 0.53 -0.57 -1.08 4.11 -1.94 0.40 114.58 116.03 3jro h GLU 106 Ca 0.00 -0.03 0.04 0.00 0.07 0.00 0.00 59.36 59.44 3jro h GLU 106 Cb 0.00 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 3jro h GLU 106 CO 0.00 0.35 0.38 -0.22 0.07 0.00 0.00 179.01 179.59 3jro h LYS 107 N 0.55 0.60 0.00 1.06 3.64 -2.02 -3.20 116.57 117.20 3jro h LYS 107 Ca 0.54 -0.04 -0.21 0.00 -1.27 0.00 0.00 60.65 59.68 3jro h LYS 107 Cb 0.93 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.58 3jro h LYS 107 CO -0.45 0.40 -1.19 -0.22 -2.27 0.00 0.00 179.45 175.72 3jro h LYS 108 N 0.62 0.00 -2.35 1.90 3.64 -1.13 -3.33 116.57 115.92 3jro h LYS 108 Ca 0.24 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.44 3jro h LYS 108 Cb 0.17 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.94 3jro h LYS 108 CO -0.07 0.89 0.15 1.28 -2.27 0.00 0.00 179.45 179.43 3jro n LEU 109 N -4.45 4.16 0.00 5.20 4.77 0.11 -0.90 117.00 125.90 3jro n LEU 109 Ca -0.30 -2.60 0.00 0.00 -0.03 0.00 0.00 56.01 53.09 3jro n LEU 109 Cb 0.64 -1.08 0.00 0.00 -2.33 0.00 0.00 43.42 40.65 3jro n LEU 109 CO 0.18 1.15 0.00 1.67 -1.33 0.00 0.00 177.39 179.06 3jro n GLN 111 N 2.75 0.00 -0.01 3.23 7.27 -1.25 -4.43 117.38 124.93 3jro n GLN 111 Ca 0.35 0.00 -0.18 0.00 0.07 0.00 0.00 57.00 57.24 3jro n GLN 111 Cb 0.64 0.00 -0.14 0.00 2.41 0.00 0.00 30.24 33.15 3jro n GLN 111 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 3jro n ASP 112 N 0.00 1.77 -4.42 1.69 8.00 -0.08 -4.58 116.55 118.93 3jro n ASP 112 Ca 0.00 0.22 -0.44 0.00 0.71 0.00 0.00 54.79 55.28 3jro n ASP 112 Cb 0.00 -0.59 -0.00 0.00 -0.02 0.00 0.00 41.12 40.50 3jro n ASP 112 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3jro s ASN 113 N -6.74 7.11 0.61 -2.24 0.01 -1.26 -4.86 114.94 107.57 3jro s ASN 113 Ca -0.19 -3.11 0.30 0.00 -0.71 0.00 0.00 52.86 49.16 3jro s ASN 113 Cb 0.07 -2.34 1.68 0.00 0.41 0.00 0.00 41.25 41.07 3jro s ASN 113 CO 0.77 -0.62 2.04 0.11 -1.51 0.00 0.00 177.10 177.89 3jro h LYS 114 N 7.14 0.00 0.43 -0.60 1.57 -1.95 -1.83 116.57 121.33 3jro h LYS 114 Ca 0.26 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.01 3jro h LYS 114 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.20 3jro h LYS 114 CO 1.15 0.00 -0.21 1.96 -0.57 0.00 0.00 179.45 181.78 3jro h GLN 115 N 0.00 -0.56 -0.62 3.15 4.20 -1.98 -2.36 115.11 116.93 3jro h GLN 115 Ca 0.09 0.04 0.04 0.00 0.06 0.00 0.00 58.65 58.87 3jro h GLN 115 Cb 0.64 0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.50 3jro h GLN 115 CO -0.00 -0.29 0.37 -0.07 -0.67 0.00 0.00 178.83 178.17 3jro h LEU 116 N -0.77 0.58 -1.55 1.46 3.38 -1.73 -1.36 115.31 115.33 3jro h LEU 116 Ca -0.06 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 3jro h LEU 116 Cb 0.53 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3jro h LEU 116 CO 0.10 0.40 0.14 0.22 0.09 0.00 0.00 178.44 179.39 3jro h TYR 117 N 0.71 0.43 0.03 1.13 3.20 -1.54 -1.76 116.97 119.17 3jro h TYR 117 Ca 0.26 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.12 3jro h TYR 117 Cb 0.07 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.20 3jro h TYR 117 CO -0.06 0.33 -0.02 0.37 -1.64 0.00 0.00 178.16 177.14 3jro h GLN 118 N 0.44 -0.04 -0.75 1.82 4.15 -0.70 -0.58 115.11 119.44 3jro h GLN 118 Ca 0.11 0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.61 3jro h GLN 118 Cb 0.07 0.01 -0.10 0.00 0.21 0.00 0.00 27.48 27.67 3jro h GLN 118 CO -0.01 0.00 -0.55 0.82 -1.93 0.00 0.00 178.83 177.16 3jro h ILE 119 N -0.08 0.00 -0.63 2.39 2.04 -0.91 -2.02 117.51 118.30 3jro h ILE 119 Ca -0.00 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.99 3jro h ILE 119 Cb 0.06 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.04 3jro h ILE 119 CO 0.01 0.00 -0.00 -0.25 0.00 0.00 0.00 178.15 177.90 3jro h TRP 120 N -0.14 -0.05 -0.88 1.37 2.91 -0.74 0.13 115.95 118.55 3jro h TRP 120 Ca 0.12 0.05 0.20 0.00 1.13 0.00 0.00 58.89 60.38 3jro h TRP 120 Cb 0.46 0.12 -0.06 0.00 -0.51 0.00 0.00 29.16 29.16 3jro h TRP 120 CO -0.92 -0.17 0.58 0.82 -1.03 0.00 0.00 178.44 177.72 3jro h ILE 121 N 0.11 0.69 0.00 2.65 2.04 -0.38 -1.70 117.51 120.92 3jro h ILE 121 Ca 0.33 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 66.05 3jro h ILE 121 Cb 0.53 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 3jro h ILE 121 CO -0.54 0.07 0.00 0.52 0.00 0.00 0.00 178.15 178.20 3jro n VAL 122 N -4.50 0.14 0.00 1.67 0.31 0.46 -2.71 118.33 113.69 3jro n VAL 122 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 3jro n VAL 122 Cb 0.68 -0.37 0.00 0.00 -0.91 0.00 0.00 33.84 33.23 3jro n VAL 122 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 3jro n VAL 124 N 0.44 0.00 -0.17 2.52 3.14 -0.64 -0.42 118.33 123.20 3jro n VAL 124 Ca 0.00 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.27 3jro n VAL 124 Cb 0.14 0.00 0.01 0.00 -1.06 0.00 0.00 33.84 32.93 3jro n VAL 124 CO 0.00 0.00 0.00 -0.25 -6.46 0.00 0.00 176.83 170.12 3jro h TRP 125 N 0.00 1.15 -0.42 1.45 7.01 -1.76 -2.62 115.95 120.76 3jro h TRP 125 Ca 0.00 -0.26 -0.13 0.00 2.11 0.00 0.00 58.89 60.61 3jro h TRP 125 Cb 0.00 -0.27 -0.01 0.00 -2.10 0.00 0.00 29.16 26.77 3jro h TRP 125 CO 0.00 1.09 -0.24 -0.07 -2.79 0.00 0.00 178.44 176.43 3jro h LEU 126 N 0.88 0.89 -0.54 0.65 3.38 -1.04 -3.20 115.31 116.32 3jro h LEU 126 Ca 0.12 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 3jro h LEU 126 Cb 0.75 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 3jro h LEU 126 CO 0.06 1.09 0.34 0.11 0.09 0.00 0.00 178.44 180.12 3jro h LYS 127 N 0.75 0.73 -0.07 1.13 1.57 -1.79 -0.52 116.57 118.37 3jro h LYS 127 Ca 0.10 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3jro h LYS 127 Cb 0.79 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.94 3jro h LYS 127 CO 0.07 0.51 0.00 0.39 -0.57 0.00 0.00 179.45 179.85 3jro n GLU 128 N -4.68 0.42 0.00 3.15 1.02 -1.00 -2.22 120.64 117.34 3jro n GLU 128 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 3jro n GLU 128 Cb 0.04 -1.03 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 3jro n GLU 128 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3jro n ASN 129 N -0.37 0.57 -4.82 1.62 5.15 -0.21 -5.06 115.26 112.14 3jro n ASN 129 Ca 0.00 -0.82 -0.30 0.00 -0.60 0.00 0.00 54.58 52.86 3jro n ASN 129 Cb 0.02 0.26 0.08 0.00 -0.53 0.00 0.00 39.78 39.61 3jro n ASN 129 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3jro s THR 130 N -0.26 3.13 0.00 -0.44 2.01 -0.94 -5.04 115.64 114.10 3jro s THR 130 Ca 0.00 0.37 0.00 0.00 0.31 0.00 0.00 61.69 62.37 3jro s THR 130 Cb 0.00 -3.15 0.00 0.00 0.01 0.00 0.00 72.50 69.36 3jro s THR 130 CO 0.00 -0.48 0.18 0.00 -0.69 0.00 0.00 174.62 173.63 3jro n TYR 131 N -3.37 0.00 0.00 4.92 9.36 -1.26 -4.99 117.16 121.82 3jro n TYR 131 Ca 0.07 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.29 3jro n TYR 131 Cb 0.56 -0.37 0.00 0.00 -0.63 0.00 0.00 39.34 38.90 3jro n TYR 131 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 3jro n VAL 132 N -1.62 -0.80 -3.65 2.97 0.31 -1.26 -5.15 118.33 109.13 3jro n VAL 132 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.31 3jro n VAL 132 Cb 0.00 -0.16 -0.06 0.00 -0.91 0.00 0.00 33.84 32.70 3jro n VAL 132 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 3jro s GLU 134 N -5.47 0.32 0.02 5.55 2.12 -1.26 -5.16 118.70 114.82 3jro s GLU 134 Ca 0.00 0.55 0.01 0.00 0.36 0.00 0.00 54.97 55.89 3jro s GLU 134 Cb 0.00 0.07 -0.02 0.00 0.26 0.00 0.00 34.13 34.44 3jro s GLU 134 CO 0.00 -0.07 -0.03 1.03 -0.54 0.00 0.00 175.26 175.65 3jro s ARG 135 N 1.25 0.30 0.10 4.30 0.52 -1.26 -5.24 118.95 118.92 3jro s ARG 135 Ca -0.08 -0.49 -0.31 0.00 -0.52 0.00 0.00 55.73 54.33 3jro s ARG 135 Cb -0.03 -0.02 -0.08 0.00 0.52 0.00 0.00 34.95 35.33 3jro s ARG 135 CO -0.14 -0.01 1.50 -2.14 0.02 0.00 0.00 175.30 174.53 3jro s PRO 136 N -1.11 4.26 0.00 3.54 0.02 -1.26 -5.10 135.00 135.35 3jro s PRO 136 Ca -0.11 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.11 3jro s PRO 136 Cb -0.08 -3.34 0.00 0.00 0.02 0.00 0.00 34.50 31.11 3jro s PRO 136 CO -0.00 -0.57 0.00 -2.30 -0.33 0.00 0.00 177.00 173.80 3jro n PRO 140 N 4.50 0.00 -1.52 5.54 -0.02 -1.26 -5.15 135.00 137.09 3jro n PRO 140 Ca 0.13 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.57 3jro n PRO 140 Cb 0.41 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 33.90 3jro n PRO 140 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3jro n THR 141 N 0.00 0.00 -2.13 3.45 -2.24 -1.26 -4.65 114.28 107.44 3jro n THR 141 Ca 0.00 -0.44 -0.20 0.00 -2.27 0.00 0.00 64.05 61.14 3jro n THR 141 Cb 0.00 -0.83 -0.03 0.00 -2.10 0.00 0.00 70.33 67.37 3jro n THR 141 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3jro n SER 142 N -2.73 -5.63 0.00 3.42 7.64 -1.22 -4.82 113.62 110.28 3jro n SER 142 Ca 0.03 0.14 0.00 0.00 1.01 0.00 0.00 58.87 60.05 3jro n SER 142 Cb 0.14 -4.73 0.00 0.00 -1.01 0.00 0.00 64.21 58.61 3jro n SER 142 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 3jro n LYS 143 N -2.77 0.00 -2.75 1.43 2.85 -0.46 -3.66 118.16 112.81 3jro n LYS 143 Ca -0.23 0.00 -0.43 0.00 -1.05 0.00 0.00 58.31 56.61 3jro n LYS 143 Cb 0.67 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 35.03 3jro n LYS 143 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 3jro s TRP 144 N 0.00 2.86 0.00 5.58 0.52 -1.26 -4.87 118.94 121.76 3jro s TRP 144 Ca 0.00 -1.18 0.00 0.00 0.02 0.00 0.00 56.10 54.94 3jro s TRP 144 Cb 0.00 -4.49 0.00 0.00 -1.15 0.00 0.00 33.47 27.83 3jro s TRP 144 CO 0.00 -1.70 0.00 1.28 0.02 0.00 0.00 176.95 176.55 3jro n LEU 145 N 7.63 0.32 0.21 2.99 4.77 -1.24 -3.92 117.00 127.77 3jro n LEU 145 Ca 0.29 0.42 0.15 0.00 -0.03 0.00 0.00 56.01 56.85 3jro n LEU 145 Cb 0.50 -0.44 0.66 0.00 -2.33 0.00 0.00 43.42 41.80 3jro n LEU 145 CO 0.59 -0.44 0.94 -0.55 -1.33 0.00 0.00 177.39 176.60 3jro h ASN 146 N 0.00 0.00 0.89 -1.43 7.08 -1.93 -2.76 115.58 117.42 3jro h ASN 146 Ca 0.00 0.00 -0.23 0.00 -3.08 0.00 0.00 56.30 52.99 3jro h ASN 146 Cb 0.00 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 36.22 3jro h ASN 146 CO 0.00 0.00 -1.07 0.77 -2.08 0.00 0.00 177.43 175.05 3jro h SER 147 N 0.00 0.13 -0.00 6.14 4.64 -1.98 -3.16 113.55 119.31 3jro h SER 147 Ca 0.00 -0.13 -0.07 0.00 -0.47 0.00 0.00 61.79 61.12 3jro h SER 147 Cb 0.32 -0.04 0.01 0.00 -0.31 0.00 0.00 62.40 62.38 3jro h SER 147 CO 0.00 1.10 -0.27 0.40 -0.87 0.00 0.00 176.83 177.20 3jro h ILE 148 N 0.02 1.53 -0.88 0.95 2.04 -1.61 0.82 117.51 120.39 3jro h ILE 148 Ca -0.05 -1.94 0.09 0.00 1.00 0.00 0.00 64.86 63.97 3jro h ILE 148 Cb 1.83 2.74 -0.06 0.00 -0.74 0.00 0.00 36.82 40.58 3jro h ILE 148 CO 0.15 0.53 0.57 0.71 0.00 0.00 0.00 178.15 180.11 3jro h THR 149 N -0.47 0.97 0.00 -0.27 1.35 -1.66 -3.33 112.91 109.50 3jro h THR 149 Ca -0.03 -0.30 -0.37 0.00 -0.55 0.00 0.00 66.41 65.16 3jro h THR 149 Cb 1.02 0.02 -0.06 0.00 -1.73 0.00 0.00 68.15 67.40 3jro h THR 149 CO 0.05 0.16 -2.23 -1.54 -0.25 0.00 0.00 175.52 171.71 3jro n SER 150 N -4.52 1.62 -4.77 5.36 3.41 -1.19 -5.03 113.62 108.49 3jro n SER 150 Ca 0.15 0.28 -0.36 0.00 -0.26 0.00 0.00 58.87 58.68 3jro n SER 150 Cb 0.30 -0.67 0.00 0.00 -0.26 0.00 0.00 64.21 63.58 3jro n SER 150 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3jro s GLY 151 N -5.39 2.69 0.00 5.00 0.00 0.28 -4.86 107.32 105.04 3jro s GLY 151 Ca -0.32 0.89 0.00 0.00 0.00 0.00 0.00 44.72 45.30 3jro s GLY 151 CO 0.40 1.28 0.60 0.61 0.00 0.00 0.00 173.10 176.00 3jro n GLY 152 N 0.30 -0.44 0.00 0.20 0.00 -1.26 -3.59 105.19 100.40 3jro n GLY 152 Ca 0.11 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.14 3jro n GLY 152 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3jro n LEU 153 N -0.41 0.00 0.04 0.99 4.77 -1.26 -2.37 117.00 118.76 3jro n LEU 153 Ca 0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 3jro n LEU 153 Cb 0.02 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.21 3jro n LEU 153 CO 0.00 0.00 0.51 0.11 -1.33 0.00 0.00 177.39 176.68 3jro h LYS 154 N 0.00 0.40 -0.22 3.23 1.57 -1.87 1.92 116.57 121.61 3jro h LYS 154 Ca 0.00 -0.25 -0.06 0.00 -1.87 0.00 0.00 60.65 58.48 3jro h LYS 154 Cb 0.00 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 3jro h LYS 154 CO 0.00 0.84 -0.08 0.66 -0.57 0.00 0.00 179.45 180.29 3jro h SER 155 N 0.31 0.45 0.75 0.86 4.64 -1.82 -3.25 113.55 115.49 3jro h SER 155 Ca 0.01 -0.39 -0.04 0.00 -0.47 0.00 0.00 61.79 60.90 3jro h SER 155 Cb 1.05 -0.12 0.01 0.00 -0.31 0.00 0.00 62.40 63.02 3jro h SER 155 CO 0.09 0.74 -0.36 0.00 -0.87 0.00 0.00 176.83 176.44 3jro n ASP 157 N -4.76 0.00 -4.62 0.00 -0.08 0.65 -4.80 116.55 102.94 3jro n ASP 157 Ca -0.12 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 52.85 3jro n ASP 157 Cb 0.40 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.77 3jro n ASP 157 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3jro s LEU 158 N 0.00 3.22 0.06 -2.67 1.43 -1.26 -4.99 118.68 114.46 3jro s LEU 158 Ca 0.00 -0.29 -0.14 0.00 -1.03 0.00 0.00 54.13 52.67 3jro s LEU 158 Cb 0.00 -1.97 -0.05 0.00 0.03 0.00 0.00 46.19 44.20 3jro s LEU 158 CO 0.00 0.18 1.23 -2.24 0.23 0.00 0.00 176.35 175.76 3jro h ASP 159 N 3.61 -0.80 -0.62 2.29 2.03 -2.00 -2.43 116.42 118.51 3jro h ASP 159 Ca -0.48 0.11 0.10 0.00 -0.73 0.00 0.00 57.03 56.03 3jro h ASP 159 Cb 1.17 0.33 -0.12 0.00 -0.83 0.00 0.00 39.33 39.88 3jro h ASP 159 CO 0.55 -0.17 -0.36 0.15 -1.03 0.00 0.00 179.24 178.38 3jro h PHE 160 N -0.16 -1.02 0.00 4.15 3.57 -1.97 0.22 116.94 121.73 3jro h PHE 160 Ca 0.03 0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.61 3jro h PHE 160 Cb 0.25 0.54 0.00 0.00 2.79 0.00 0.00 35.95 39.52 3jro h PHE 160 CO -0.67 -0.39 0.00 -2.30 -2.23 0.00 0.00 178.31 172.71 3jro n PRO 161 N -5.43 0.27 -0.09 6.41 -0.02 -0.94 -3.20 135.00 131.99 3jro n PRO 161 Ca 0.04 0.00 -0.23 0.00 -2.02 0.00 0.00 63.50 61.29 3jro n PRO 161 Cb 0.36 -1.20 -0.12 0.00 -0.02 0.00 0.00 33.50 32.52 3jro n PRO 161 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3jro n LEU 162 N -0.70 2.37 0.22 2.45 7.94 0.76 -4.23 117.00 125.81 3jro n LEU 162 Ca 0.03 0.21 0.07 0.00 -1.11 0.00 0.00 56.01 55.21 3jro n LEU 162 Cb 0.01 -0.96 0.40 0.00 0.53 0.00 0.00 43.42 43.40 3jro n LEU 162 CO 0.02 0.67 0.89 0.03 -1.11 0.00 0.00 177.39 177.89 3jro h ARG 163 N -0.47 0.00 0.00 1.96 3.08 -1.61 0.85 114.38 118.19 3jro h ARG 163 Ca -0.52 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.53 3jro h ARG 163 Cb 1.72 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.77 3jro h ARG 163 CO -0.16 0.00 0.00 -1.91 -1.07 0.00 0.00 179.97 176.83 3jro n GLU 164 N -2.26 0.07 0.00 0.04 0.00 -1.26 -3.49 120.64 113.73 3jro n GLU 164 Ca -0.01 0.15 0.00 0.00 0.00 0.00 0.00 57.16 57.30 3jro n GLU 164 Cb 0.45 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.39 3jro n GLU 164 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3jro n ASN 165 N -1.45 1.31 0.00 4.31 3.02 0.30 -5.06 115.26 117.69 3jro n ASN 165 Ca 0.06 -1.33 0.00 0.00 -0.03 0.00 0.00 54.58 53.28 3jro n ASN 165 Cb 0.21 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.38 3jro n ASN 165 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3jro n THR 166 N -0.16 0.00 -1.99 3.41 -2.24 -1.23 -3.99 114.28 108.08 3jro n THR 166 Ca 0.00 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3jro n THR 166 Cb 0.09 0.00 0.12 0.00 -2.10 0.00 0.00 70.33 68.44 3jro n THR 166 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3jro n ASN 167 N 3.38 2.13 -1.60 3.42 3.02 -1.26 -4.68 115.26 119.66 3jro n ASN 167 Ca 0.00 -3.28 0.08 0.00 -0.03 0.00 0.00 54.58 51.35 3jro n ASN 167 Cb 0.00 -0.44 0.36 0.00 -0.61 0.00 0.00 39.78 39.09 3jro n ASN 167 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 3jro n VAL 168 N -0.63 2.25 -2.70 2.41 3.14 -1.26 -4.84 118.33 116.70 3jro n VAL 168 Ca 0.20 -1.36 -0.42 0.00 -2.96 0.00 0.00 64.34 59.79 3jro n VAL 168 Cb 0.86 -0.07 -0.03 0.00 -1.06 0.00 0.00 33.84 33.54 3jro n VAL 168 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 3jro s LEU 169 N -2.31 4.24 0.00 6.55 1.43 -1.26 -4.92 118.68 122.40 3jro s LEU 169 Ca 0.51 1.50 -0.09 0.00 -1.03 0.00 0.00 54.13 55.02 3jro s LEU 169 Cb 0.36 -3.53 0.13 0.00 0.03 0.00 0.00 46.19 43.18 3jro s LEU 169 CO 0.19 -0.45 0.62 -0.90 0.23 0.00 0.00 176.35 176.05 3jro n ASP 170 N 5.04 -0.66 0.00 2.29 5.68 -1.26 -4.95 116.55 122.68 3jro n ASP 170 Ca 0.08 -1.06 0.00 0.00 -0.50 0.00 0.00 54.79 53.31 3jro n ASP 170 Cb 0.49 -0.51 0.00 0.00 -1.14 0.00 0.00 41.12 39.95 3jro n ASP 170 CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 3jro n VAL 171 N -3.27 0.00 -0.31 2.12 0.31 -1.26 -3.40 118.33 112.52 3jro n VAL 171 Ca 0.08 0.22 0.22 0.00 -0.01 0.00 0.00 64.34 64.85 3jro n VAL 171 Cb 0.30 -0.58 0.41 0.00 -0.91 0.00 0.00 33.84 33.06 3jro n VAL 171 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3jro n LYS 172 N -0.10 -0.06 -0.05 5.55 5.02 -1.26 0.43 118.16 127.69 3jro n LYS 172 Ca 0.00 1.33 -0.10 0.00 -2.02 0.00 0.00 58.31 57.52 3jro n LYS 172 Cb 0.00 -2.25 -0.04 0.00 -0.02 0.00 0.00 35.03 32.72 3jro n LYS 172 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 3jro h ASP 173 N 0.00 0.26 0.11 4.39 3.58 -1.96 -0.72 116.42 122.08 3jro h ASP 173 Ca 0.68 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 58.03 3jro h ASP 173 Cb 1.64 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 42.62 3jro h ASP 173 CO -0.79 0.28 0.00 1.17 -2.88 0.00 0.00 179.24 177.03 3jro n LYS 174 N -4.88 0.01 -0.11 0.28 4.81 0.17 -1.26 118.16 117.17 3jro n LYS 174 Ca -0.03 0.45 -0.17 0.00 -0.87 0.00 0.00 58.31 57.69 3jro n LYS 174 Cb 0.08 -1.52 -0.10 0.00 0.02 0.00 0.00 35.03 33.51 3jro n LYS 174 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3jro n GLU 175 N -1.53 0.54 0.26 1.64 1.02 -0.82 -3.51 120.64 118.23 3jro n GLU 175 Ca 0.01 0.14 0.11 0.00 -0.02 0.00 0.00 57.16 57.39 3jro n GLU 175 Cb 0.04 -1.42 0.69 0.00 -0.02 0.00 0.00 31.44 30.73 3jro n GLU 175 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3jro h GLU 176 N -0.14 0.00 0.02 3.49 5.08 -0.50 0.12 114.58 122.65 3jro h GLU 176 Ca -0.51 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 57.64 3jro h GLU 176 Cb 1.72 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.95 3jro h GLU 176 CO -0.12 0.11 -0.99 -0.44 -1.00 0.00 0.00 179.01 176.56 3jro h ASP 177 N 0.00 0.10 0.59 1.42 5.19 -1.38 -3.22 116.42 119.12 3jro h ASP 177 Ca -0.00 -0.10 -0.03 0.00 -0.62 0.00 0.00 57.03 56.28 3jro h ASP 177 Cb 0.25 -0.03 0.01 0.00 0.18 0.00 0.00 39.33 39.73 3jro h ASP 177 CO 0.01 1.03 -0.28 -0.74 -3.12 0.00 0.00 179.24 176.14 3jro h HIS 178 N 0.03 -0.73 -0.99 4.55 2.76 -1.05 -2.32 115.15 117.40 3jro h HIS 178 Ca -0.03 -0.02 0.26 0.00 -2.20 0.00 0.00 60.37 58.37 3jro h HIS 178 Cb 1.71 0.24 -0.07 0.00 1.55 0.00 0.00 27.41 30.85 3jro h HIS 178 CO 0.01 -0.40 0.67 0.82 -1.30 0.00 0.00 177.93 177.73 3jro h ILE 179 N -1.06 0.56 0.45 6.26 2.04 -1.46 -1.08 117.51 123.22 3jro h ILE 179 Ca -0.08 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 3jro h ILE 179 Cb 0.66 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 3jro h ILE 179 CO 0.13 0.05 -0.22 0.15 0.00 0.00 0.00 178.15 178.26 3jro h PHE 180 N 0.26 -0.57 0.00 1.37 3.57 -1.49 -1.52 116.94 118.56 3jro h PHE 180 Ca 0.52 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 62.00 3jro h PHE 180 Cb 1.55 0.19 0.00 0.00 2.79 0.00 0.00 35.95 40.48 3jro h PHE 180 CO -0.00 -0.36 0.00 1.19 -2.23 0.00 0.00 178.31 176.91 3jro n PHE 181 N -5.36 0.00 0.06 0.41 3.72 -0.50 -1.28 117.46 114.50 3jro n PHE 181 Ca -0.11 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.21 3jro n PHE 181 Cb 0.26 -0.48 -0.12 0.00 -0.94 0.00 0.00 39.48 38.20 3jro n PHE 181 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 3jro h LYS 182 N 0.00 0.01 0.00 -1.08 3.64 -0.90 -1.77 116.57 116.46 3jro h LYS 182 Ca 0.00 -0.01 -0.20 0.00 -1.27 0.00 0.00 60.65 59.17 3jro h LYS 182 Cb 0.35 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 3jro h LYS 182 CO 0.00 0.98 -0.95 -0.92 -2.27 0.00 0.00 179.45 176.29 3jro h TYR 183 N 0.00 0.00 0.15 1.91 3.20 -0.16 -2.76 116.97 119.31 3jro h TYR 183 Ca -0.03 0.00 -0.21 0.00 3.14 0.00 0.00 58.73 61.63 3jro h TYR 183 Cb 1.79 0.00 0.02 0.00 1.54 0.00 0.00 36.73 40.08 3jro h TYR 183 CO 0.00 0.95 -0.96 0.82 -1.64 0.00 0.00 178.16 177.33 3jro h ILE 184 N 0.00 1.43 -0.72 1.81 2.04 -1.25 -1.90 117.51 118.92 3jro h ILE 184 Ca -0.01 -2.54 -0.00 0.00 1.00 0.00 0.00 64.86 63.31 3jro h ILE 184 Cb 1.69 3.13 -0.04 0.00 -0.74 0.00 0.00 36.82 40.86 3jro h ILE 184 CO 0.12 0.73 0.44 0.22 0.00 0.00 0.00 178.15 179.66 3jro h TYR 185 N -0.31 0.95 -0.48 1.37 3.20 -1.44 0.63 116.97 120.89 3jro h TYR 185 Ca -0.18 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.66 3jro h TYR 185 Cb 1.71 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 39.65 3jro h TYR 185 CO 0.18 0.64 0.16 1.49 -1.64 0.00 0.00 178.16 178.99 3jro h GLU 186 N 0.99 0.74 0.00 1.82 4.22 -1.58 -2.47 114.58 118.28 3jro h GLU 186 Ca 0.26 -0.15 -0.06 0.00 0.08 0.00 0.00 59.36 59.49 3jro h GLU 186 Cb -0.04 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 3jro h GLU 186 CO -0.05 0.69 -0.26 1.25 -2.18 0.00 0.00 179.01 178.46 3jro h LEU 187 N 0.64 0.00 -0.06 1.64 5.85 -0.72 -2.98 115.31 119.68 3jro h LEU 187 Ca 0.16 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.63 3jro h LEU 187 Cb 0.25 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.29 3jro h LEU 187 CO -0.01 0.26 -1.05 0.40 -0.34 0.00 0.00 178.44 177.70 3jro h ILE 188 N 0.00 1.40 -0.71 4.05 1.08 0.28 -2.03 117.51 121.58 3jro h ILE 188 Ca -0.00 -2.56 0.04 0.00 -0.39 0.00 0.00 64.86 61.95 3jro h ILE 188 Cb 1.19 2.56 -0.05 0.00 -3.07 0.00 0.00 36.82 37.45 3jro h ILE 188 CO 0.03 0.76 0.43 0.25 -0.69 0.00 0.00 178.15 178.94 3jro h LEU 189 N 0.21 0.68 0.00 1.44 5.85 -1.41 0.12 115.31 122.20 3jro h LEU 189 Ca -0.11 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.62 3jro h LEU 189 Cb 1.71 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.61 3jro h LEU 189 CO 0.18 0.45 0.00 0.00 -0.34 0.00 0.00 178.44 178.74 3jro n ALA 190 N -2.33 1.89 -2.32 1.25 0.00 -1.13 -4.67 120.51 113.20 3jro n ALA 190 Ca 0.08 -0.07 -0.13 0.00 0.00 0.00 0.00 53.44 53.32 3jro n ALA 190 Cb 0.13 -1.29 -0.00 0.00 0.00 0.00 0.00 19.45 18.29 3jro n ALA 190 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jro n GLY 191 N 0.25 -0.14 1.72 0.00 0.00 0.43 -4.46 105.19 102.99 3jro n GLY 191 Ca 0.07 -0.33 -0.14 0.00 0.00 0.00 0.00 46.02 45.62 3jro n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jro n ALA 192 N -1.82 4.39 -0.27 4.61 0.00 -0.77 -4.70 120.51 121.94 3jro n ALA 192 Ca -0.14 -1.62 -0.00 0.00 0.00 0.00 0.00 53.44 51.68 3jro n ALA 192 Cb 0.61 -1.28 0.03 0.00 0.00 0.00 0.00 19.45 18.81 3jro n ALA 192 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3jro n ILE 193 N -0.26 -0.37 -0.02 0.00 5.41 -1.26 -0.35 119.36 122.51 3jro n ILE 193 Ca 0.32 1.68 -0.10 0.00 1.00 0.00 0.00 62.75 65.66 3jro n ILE 193 Cb 1.02 -2.22 -0.06 0.00 -0.71 0.00 0.00 39.64 37.66 3jro n ILE 193 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 3jro h ASP 194 N 0.00 -1.14 0.24 4.38 3.32 -1.96 0.12 116.42 121.37 3jro h ASP 194 Ca 0.26 0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.44 3jro h ASP 194 Cb 0.43 0.45 0.00 0.00 0.22 0.00 0.00 39.33 40.43 3jro h ASP 194 CO -0.71 -0.31 0.00 -0.62 -1.72 0.00 0.00 179.24 175.88 3jro n GLU 195 N -4.43 0.08 -0.04 3.56 1.02 0.53 -2.74 120.64 118.62 3jro n GLU 195 Ca -0.04 0.47 -0.14 0.00 -0.02 0.00 0.00 57.16 57.44 3jro n GLU 195 Cb 0.24 -1.70 -0.11 0.00 -0.02 0.00 0.00 31.44 29.85 3jro n GLU 195 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3jro h ALA 196 N 2.15 0.01 0.00 0.62 0.00 0.11 -3.25 119.26 118.90 3jro h ALA 196 Ca 0.00 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 3jro h ALA 196 Cb 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3jro h ALA 196 CO 0.00 -0.10 -0.20 -0.07 0.00 0.00 0.00 179.25 178.87 3jro h LEU 197 N -0.67 0.00 0.00 0.00 4.07 -1.23 -1.75 115.31 115.73 3jro h LEU 197 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3jro h LEU 197 Cb 0.76 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.50 3jro h LEU 197 CO 0.01 0.20 0.00 -0.62 -1.08 0.00 0.00 178.44 176.95 3jro n GLU 198 N -3.51 0.03 -0.06 1.13 1.02 -1.19 -2.44 120.64 115.63 3jro n GLU 198 Ca -0.01 0.21 -0.08 0.00 -0.02 0.00 0.00 57.16 57.25 3jro n GLU 198 Cb 0.36 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.23 3jro n GLU 198 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3jro n GLU 199 N -1.47 0.29 0.01 3.49 1.02 -0.86 -3.93 120.64 119.20 3jro n GLU 199 Ca 0.05 0.07 0.03 0.00 -0.02 0.00 0.00 57.16 57.29 3jro n GLU 199 Cb 0.18 -1.22 0.16 0.00 -0.02 0.00 0.00 31.44 30.54 3jro n GLU 199 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3jro n ALA 200 N -2.88 1.24 -0.02 0.62 0.00 -0.72 -1.30 120.51 117.45 3jro n ALA 200 Ca -0.21 -0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.04 3jro n ALA 200 Cb 0.72 -1.11 -0.14 0.00 0.00 0.00 0.00 19.45 18.92 3jro n ALA 200 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3jro n LYS 201 N -1.57 0.73 0.32 0.00 5.02 -1.02 -2.62 118.16 119.01 3jro n LYS 201 Ca 0.01 0.24 0.21 0.00 -2.02 0.00 0.00 58.31 56.75 3jro n LYS 201 Cb 0.07 -1.68 1.06 0.00 -0.02 0.00 0.00 35.03 34.46 3jro n LYS 201 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3jro h LEU 202 N 0.05 0.00 -1.92 -0.35 3.38 -1.32 0.22 115.31 115.37 3jro h LEU 202 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 3jro h LEU 202 Cb 2.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.77 3jro h LEU 202 CO 0.06 0.01 0.00 -1.54 0.09 0.00 0.00 178.44 177.05 3jro n SER 203 N -3.15 2.81 0.00 -0.43 3.41 -1.02 -4.62 113.62 110.63 3jro n SER 203 Ca -0.02 -1.97 0.00 0.00 -0.26 0.00 0.00 58.87 56.62 3jro n SER 203 Cb 0.13 -0.32 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 3jro n SER 203 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3jro n ASP 204 N 1.04 -5.28 -2.06 4.04 8.00 0.77 -1.35 116.55 121.71 3jro n ASP 204 Ca 0.18 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.54 3jro n ASP 204 Cb 0.46 -2.91 -0.14 0.00 -0.02 0.00 0.00 41.12 38.52 3jro n ASP 204 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3jro n ASN 205 N -0.79 5.50 -0.17 -2.24 3.02 -1.08 -4.65 115.26 114.85 3jro n ASN 205 Ca 0.00 -2.62 -0.04 0.00 -0.03 0.00 0.00 54.58 51.88 3jro n ASN 205 Cb 0.39 -1.36 0.14 0.00 -0.61 0.00 0.00 39.78 38.34 3jro n ASN 205 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 3jro h ILE 206 N 1.93 1.24 -1.00 2.41 2.04 -1.86 -2.30 117.51 119.97 3jro h ILE 206 Ca 0.22 -0.90 0.14 0.00 1.00 0.00 0.00 64.86 65.33 3jro h ILE 206 Cb 1.33 0.65 -0.09 0.00 -0.74 0.00 0.00 36.82 37.97 3jro h ILE 206 CO 0.35 0.34 0.62 0.28 0.00 0.00 0.00 178.15 179.73 3jro h SER 207 N 0.89 0.87 0.84 1.72 0.02 -1.92 -2.25 113.55 113.72 3jro h SER 207 Ca 0.19 0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 61.16 3jro h SER 207 Cb 0.34 -0.10 0.01 0.00 0.14 0.00 0.00 62.40 62.79 3jro h SER 207 CO 0.00 0.42 -0.40 0.40 -1.14 0.00 0.00 176.83 176.11 3jro h ILE 208 N 0.91 0.03 0.00 3.27 2.04 -1.79 -3.30 117.51 118.68 3jro h ILE 208 Ca 0.52 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 66.22 3jro h ILE 208 Cb 0.63 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.74 3jro h ILE 208 CO -0.31 0.00 0.00 0.00 0.00 0.00 0.00 178.15 177.85 3jro n ILE 211 N 0.61 0.00 0.61 0.00 5.41 -1.24 -3.42 119.36 121.33 3jro n ILE 211 Ca 0.00 0.00 0.01 0.00 1.00 0.00 0.00 62.75 63.76 3jro n ILE 211 Cb 0.00 0.00 0.04 0.00 -0.71 0.00 0.00 39.64 38.97 3jro n ILE 211 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3jro n LEU 212 N 0.00 0.00 -0.00 1.39 4.77 -1.19 -1.38 117.00 120.59 3jro n LEU 212 Ca 0.00 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.08 3jro n LEU 212 Cb 0.00 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 40.97 3jro n LEU 212 CO 0.00 0.00 -0.19 0.00 -1.33 0.00 0.00 177.39 175.87 3jro h GLY 214 N 4.60 0.00 0.75 0.00 0.00 -1.58 -3.15 103.07 103.70 3jro h GLY 214 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 46.97 3jro h GLY 214 CO 0.00 0.00 -1.89 0.16 0.00 0.00 0.00 176.54 174.81 3jro h ILE 215 N 0.00 0.76 -0.13 2.60 3.07 -1.70 -0.33 117.51 121.77 3jro h ILE 215 Ca 0.00 -2.43 -0.16 0.00 1.55 0.00 0.00 64.86 63.82 3jro h ILE 215 Cb 0.97 2.61 -0.01 0.00 -0.27 0.00 0.00 36.82 40.12 3jro h ILE 215 CO 0.00 0.88 -0.61 -0.61 -1.05 0.00 0.00 178.15 176.75 3jro h GLN 216 N 0.08 0.45 0.03 0.16 4.15 -1.69 -3.34 115.11 114.97 3jro h GLN 216 Ca -0.39 -0.31 -0.38 0.00 0.77 0.00 0.00 58.65 58.34 3jro h GLN 216 Cb 2.06 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 29.75 3jro h GLN 216 CO 0.12 0.93 -2.16 0.39 -1.93 0.00 0.00 178.83 176.18 3jro n GLU 217 N -3.91 0.65 -1.42 1.69 -0.58 -1.19 -4.95 120.64 110.93 3jro n GLU 217 Ca -0.03 0.28 0.00 0.00 -0.42 0.00 0.00 57.16 56.98 3jro n GLU 217 Cb 0.64 -1.60 0.00 0.00 -0.57 0.00 0.00 31.44 29.91 3jro n GLU 217 CO 0.00 0.00 0.00 2.48 -0.48 0.00 0.00 177.13 179.13 3jro n TYR 218 N -3.75 -1.18 0.00 -0.32 4.11 -0.13 -4.72 117.16 111.16 3jro n TYR 218 Ca -0.42 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.48 3jro n TYR 218 Cb 0.93 -0.81 0.00 0.00 -0.00 0.00 0.00 39.34 39.46 3jro n TYR 218 CO 0.00 0.00 0.00 1.47 -0.00 0.00 0.00 176.86 178.33 3jro n LEU 219 N -1.37 0.00 -4.36 -3.48 -0.00 -1.25 -4.77 117.00 101.77 3jro n LEU 219 Ca 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 56.01 55.62 3jro n LEU 219 Cb 0.19 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 43.49 3jro n LEU 219 CO 0.00 0.00 -0.21 0.21 -0.00 0.00 0.00 177.39 177.39 3jro s ASN 220 N 0.00 5.51 -0.23 1.45 3.04 -1.20 -2.54 114.94 120.97 3jro s ASN 220 Ca 0.00 -0.89 -0.10 0.00 0.04 0.00 0.00 52.86 51.92 3jro s ASN 220 Cb 0.00 -1.96 -0.05 0.00 -1.54 0.00 0.00 41.25 37.70 3jro s ASN 220 CO 0.00 -0.31 0.14 -2.84 -3.04 0.00 0.00 177.10 171.05 3jro s PRO 221 N 1.52 4.01 0.00 0.43 0.02 -1.26 -4.56 135.00 135.17 3jro s PRO 221 Ca 0.02 -0.30 0.00 0.00 0.02 0.00 0.00 61.00 60.73 3jro s PRO 221 Cb -0.18 -3.47 0.00 0.00 0.02 0.00 0.00 34.50 30.87 3jro s PRO 221 CO 0.05 0.07 0.00 1.33 -0.33 0.00 0.00 177.00 178.12 3jro n VAL 222 N 4.24 0.00 -0.81 3.83 0.24 -1.26 -2.91 118.33 121.66 3jro n VAL 222 Ca -0.15 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.00 3jro n VAL 222 Cb 0.52 0.00 0.03 0.00 -1.47 0.00 0.00 33.84 32.92 3jro n VAL 222 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 3jro n ILE 223 N 0.00 2.65 -2.87 1.34 -5.35 -1.26 -4.80 119.36 109.06 3jro n ILE 223 Ca 0.00 -1.48 -0.42 0.00 -0.27 0.00 0.00 62.75 60.58 3jro n ILE 223 Cb 0.00 -1.34 -0.04 0.00 -1.74 0.00 0.00 39.64 36.52 3jro n ILE 223 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 3jro s ASP 224 N 0.40 6.82 0.02 7.28 1.01 -1.26 -4.99 116.67 125.95 3jro s ASP 224 Ca 0.27 0.98 -0.05 0.00 0.71 0.00 0.00 52.55 54.46 3jro s ASP 224 Cb 0.21 -2.44 -0.02 0.00 1.01 0.00 0.00 42.92 41.68 3jro s ASP 224 CO -0.00 -0.56 1.08 0.71 0.21 0.00 0.00 175.17 176.60 3jro h THR 225 N 5.48 0.00 0.00 -1.27 1.35 -1.97 -2.56 112.91 113.94 3jro h THR 225 Ca -0.23 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 3jro h THR 225 Cb 1.09 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.51 3jro h THR 225 CO 0.89 0.00 0.15 0.00 -0.25 0.00 0.00 175.52 176.31 3jro n GLN 226 N -2.96 0.00 0.00 4.72 3.00 -1.26 -1.19 117.38 119.68 3jro n GLN 226 Ca -0.01 0.32 0.02 0.00 -0.01 0.00 0.00 57.00 57.33 3jro n GLN 226 Cb 0.05 -1.65 0.01 0.00 0.00 0.00 0.00 30.24 28.65 3jro n GLN 226 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 3jro n ILE 227 N -1.31 0.00 0.04 5.09 5.41 -0.98 -4.66 119.36 122.94 3jro n ILE 227 Ca 0.00 -0.48 0.02 0.00 1.00 0.00 0.00 62.75 63.30 3jro n ILE 227 Cb 0.15 1.08 0.12 0.00 -0.71 0.00 0.00 39.64 40.28 3jro n ILE 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3jro n ALA 228 N -0.05 0.95 1.43 -1.39 0.00 -0.34 -1.63 120.51 119.47 3jro n ALA 228 Ca 0.02 0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.64 3jro n ALA 228 Cb 0.11 -1.00 0.47 0.00 0.00 0.00 0.00 19.45 19.03 3jro n ALA 228 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3jro n ASN 229 N -1.64 1.52 0.02 0.00 3.02 -1.26 -4.19 115.26 112.73 3jro n ASN 229 Ca -0.00 -1.44 -0.02 0.00 -0.03 0.00 0.00 54.58 53.09 3jro n ASN 229 Cb 0.04 0.02 -0.01 0.00 -0.61 0.00 0.00 39.78 39.23 3jro n ASN 229 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3jro n GLU 230 N 0.12 0.09 -0.03 3.52 1.02 -0.65 -4.91 120.64 119.80 3jro n GLU 230 Ca 0.18 0.04 -0.14 0.00 -0.02 0.00 0.00 57.16 57.21 3jro n GLU 230 Cb 0.37 -0.66 -0.11 0.00 -0.02 0.00 0.00 31.44 31.02 3jro n GLU 230 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 3jro h PHE 231 N -0.17 0.18 0.00 -0.32 -1.00 -1.78 -3.47 116.94 110.38 3jro h PHE 231 Ca -0.00 -0.09 0.00 0.00 2.81 0.00 0.00 57.97 60.69 3jro h PHE 231 Cb 0.19 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 39.73 3jro h PHE 231 CO -0.07 0.83 0.00 0.09 -1.61 0.00 0.00 178.31 177.55 3jro n ASN 232 N -4.60 0.00 -3.88 2.17 3.02 -1.26 -4.88 115.26 105.83 3jro n ASN 232 Ca -0.09 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.37 3jro n ASN 232 Cb 0.43 -0.32 -0.05 0.00 -0.61 0.00 0.00 39.78 39.24 3jro n ASN 232 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3jro s THR 233 N -1.53 0.02 -0.51 3.41 -4.23 -1.26 -5.11 115.64 106.43 3jro s THR 233 Ca 0.00 -1.14 -0.29 0.00 -1.18 0.00 0.00 61.69 59.08 3jro s THR 233 Cb 0.00 -1.89 0.03 0.00 1.34 0.00 0.00 72.50 71.98 3jro s THR 233 CO 0.00 -0.10 1.18 0.00 -0.54 0.00 0.00 174.62 175.16 3jro s GLN 234 N -3.95 3.63 -0.46 3.99 -2.07 -1.26 -4.75 119.66 114.80 3jro s GLN 234 Ca 0.16 0.48 0.07 0.00 -1.82 0.00 0.00 55.36 54.24 3jro s GLN 234 Cb -0.00 -3.96 0.24 0.00 -1.09 0.00 0.00 33.01 28.20 3jro s GLN 234 CO 0.03 -1.51 0.56 1.04 -1.32 0.00 0.00 175.29 174.09 3jro n GLN 235 N 8.09 1.16 -3.30 9.60 1.13 -1.15 -5.04 117.38 127.88 3jro n GLN 235 Ca 0.11 -3.62 -0.07 0.00 -1.94 0.00 0.00 57.00 51.49 3jro n GLN 235 Cb 0.49 -1.54 0.02 0.00 0.11 0.00 0.00 30.24 29.32 3jro n GLN 235 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3jro n GLY 236 N 1.40 1.11 2.70 1.08 0.00 -1.26 -4.65 105.19 105.57 3jro n GLY 236 Ca 0.24 -1.20 -0.28 0.00 0.00 0.00 0.00 46.02 44.77 3jro n GLY 236 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3jro s ILE 237 N -2.25 0.50 1.23 -0.61 -4.36 -1.05 -4.78 121.20 109.89 3jro s ILE 237 Ca 0.14 -0.77 -0.18 0.00 -0.26 0.00 0.00 60.65 59.58 3jro s ILE 237 Cb -0.04 -1.16 0.26 0.00 1.25 0.00 0.00 42.46 42.77 3jro s ILE 237 CO 0.09 -0.40 0.62 0.29 0.24 0.00 0.00 174.94 175.78 3jro n LYS 238 N 5.04 -2.96 -2.86 0.37 5.02 -1.26 -3.64 118.16 117.86 3jro n LYS 238 Ca -0.07 -0.86 -0.17 0.00 -2.02 0.00 0.00 58.31 55.19 3jro n LYS 238 Cb 0.45 -1.88 -0.00 0.00 -0.02 0.00 0.00 35.03 33.59 3jro n LYS 238 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3jro n LYS 239 N -4.03 -2.93 0.08 1.97 5.02 -1.26 -4.85 118.16 112.16 3jro n LYS 239 Ca 0.05 0.55 -0.03 0.00 -2.02 0.00 0.00 58.31 56.87 3jro n LYS 239 Cb 0.55 -5.22 0.22 0.00 -0.02 0.00 0.00 35.03 30.56 3jro n LYS 239 CO 0.00 0.00 0.00 1.12 -0.52 0.00 0.00 177.40 178.00 3jro h HIS 240 N -0.50 0.34 0.00 2.13 2.07 -1.86 0.70 115.15 118.03 3jro h HIS 240 Ca -0.36 -0.09 -0.00 0.00 -2.85 0.00 0.00 60.37 57.07 3jro h HIS 240 Cb 1.25 -0.08 -0.00 0.00 2.57 0.00 0.00 27.41 31.15 3jro h HIS 240 CO 0.68 0.64 -0.00 0.66 -3.07 0.00 0.00 177.93 176.84 3jro h SER 241 N 0.25 0.00 0.21 3.10 4.64 -1.89 0.70 113.55 120.56 3jro h SER 241 Ca 0.03 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.00 3jro h SER 241 Cb 0.80 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.86 3jro h SER 241 CO 0.06 0.00 -1.91 0.25 -0.87 0.00 0.00 176.83 174.37 3jro h LEU 242 N 0.00 0.34 -0.75 5.97 6.46 -1.30 -3.37 115.31 122.67 3jro h LEU 242 Ca -0.00 -0.75 -0.12 0.00 -0.12 0.00 0.00 57.88 56.89 3jro h LEU 242 Cb 0.01 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 39.82 3jro h LEU 242 CO 0.00 1.67 -0.29 -0.25 -0.62 0.00 0.00 178.44 178.95 3jro h TRP 243 N 0.06 0.72 0.07 1.25 7.01 0.13 -3.17 115.95 122.03 3jro h TRP 243 Ca -0.39 -0.18 0.02 0.00 2.11 0.00 0.00 58.89 60.46 3jro h TRP 243 Cb 2.03 -0.17 -0.05 0.00 -2.10 0.00 0.00 29.16 28.88 3jro h TRP 243 CO 0.06 0.85 -0.35 -0.09 -2.79 0.00 0.00 178.44 176.13 3jro h ARG 244 N 0.54 -0.53 0.00 2.65 2.43 0.19 0.80 114.38 120.47 3jro h ARG 244 Ca 0.07 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3jro h ARG 244 Cb 0.77 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.44 3jro h ARG 244 CO 0.06 -0.35 0.00 0.54 -1.51 0.00 0.00 179.97 178.71 3jro n ARG 245 N -5.43 0.00 -0.07 0.20 1.74 -1.20 -1.63 116.66 110.27 3jro n ARG 245 Ca -0.06 0.39 -0.06 0.00 -0.77 0.00 0.00 57.85 57.35 3jro n ARG 245 Cb 0.34 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.25 3jro n ARG 245 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 3jro h THR 246 N 0.00 0.18 -0.46 0.55 2.02 -0.88 -3.24 112.91 111.08 3jro h THR 246 Ca 0.00 -1.19 0.13 0.00 0.77 0.00 0.00 66.41 66.12 3jro h THR 246 Cb 0.00 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 3jro h THR 246 CO 0.00 0.06 0.33 0.58 0.37 0.00 0.00 175.52 176.86 3jro h VAL 247 N -1.00 0.78 -0.55 3.16 2.07 -0.54 0.43 116.25 120.60 3jro h VAL 247 Ca -0.04 -0.01 -0.09 0.00 0.82 0.00 0.00 66.70 67.37 3jro h VAL 247 Cb 0.50 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 3jro h VAL 247 CO -0.02 0.01 -0.03 0.22 0.02 0.00 0.00 177.57 177.76 3jro h TYR 248 N 0.03 1.05 0.00 1.57 3.20 -1.48 -1.11 116.97 120.24 3jro h TYR 248 Ca 0.22 -0.18 -0.00 0.00 3.14 0.00 0.00 58.73 61.91 3jro h TYR 248 Cb 0.84 -0.27 -0.00 0.00 1.54 0.00 0.00 36.73 38.83 3jro h TYR 248 CO -0.00 0.95 -0.00 0.66 -1.64 0.00 0.00 178.16 178.13 3jro h SER 249 N 0.88 0.00 0.34 -2.11 4.64 -0.18 -1.22 113.55 115.91 3jro h SER 249 Ca 0.16 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.15 3jro h SER 249 Cb 0.56 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.66 3jro h SER 249 CO 0.03 0.00 -1.54 0.25 -0.87 0.00 0.00 176.83 174.70 3jro h LEU 250 N 0.00 0.62 -1.42 5.97 5.85 -0.60 -3.32 115.31 122.42 3jro h LEU 250 Ca -0.00 -0.77 -0.02 0.00 0.84 0.00 0.00 57.88 57.93 3jro h LEU 250 Cb 0.12 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 40.94 3jro h LEU 250 CO 0.00 1.62 -0.11 0.77 -0.34 0.00 0.00 178.44 180.38 3jro h SER 251 N 0.11 0.00 -0.40 1.25 4.64 -0.07 -3.07 113.55 116.00 3jro h SER 251 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3jro h SER 251 Cb 2.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.18 3jro h SER 251 CO 0.21 0.11 0.00 1.67 -0.87 0.00 0.00 176.83 177.96 3jro n GLN 252 N -3.29 2.40 0.07 4.77 7.27 -0.95 -4.28 117.38 123.36 3jro n GLN 252 Ca -0.00 -2.18 -0.10 0.00 0.07 0.00 0.00 57.00 54.79 3jro n GLN 252 Cb 0.34 -1.44 -0.13 0.00 2.41 0.00 0.00 30.24 31.43 3jro n GLN 252 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 3jro h GLN 253 N 3.66 0.08 0.00 3.69 4.20 -1.63 -3.47 115.11 121.63 3jro h GLN 253 Ca 0.00 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.58 3jro h GLN 253 Cb 0.87 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.70 3jro h GLN 253 CO 0.00 1.03 0.00 0.00 -0.67 0.00 0.00 178.83 179.19 3jro n ALA 254 N -2.42 0.00 0.25 3.87 0.00 -1.26 -4.75 120.51 116.19 3jro n ALA 254 Ca -0.04 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.50 3jro n ALA 254 Cb 0.97 -0.24 0.65 0.00 0.00 0.00 0.00 19.45 20.83 3jro n ALA 254 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3jro h GLY 255 N 0.00 0.00 -1.68 0.00 0.00 -1.92 -3.45 103.07 96.02 3jro h GLY 255 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 3jro h GLY 255 CO 0.00 0.00 -0.19 0.48 0.00 0.00 0.00 176.54 176.83 3jro s LEU 256 N -7.87 3.07 0.29 3.11 2.34 -1.26 -5.03 118.68 113.31 3jro s LEU 256 Ca -0.03 -0.91 -0.26 0.00 0.06 0.00 0.00 54.13 52.99 3jro s LEU 256 Cb 0.14 -1.64 -0.16 0.00 -0.56 0.00 0.00 46.19 43.98 3jro s LEU 256 CO 0.63 -1.16 0.47 -0.67 -1.06 0.00 0.00 176.35 174.56 3jro n ASP 257 N -2.01 -1.33 0.09 1.48 -0.08 -1.26 -4.68 116.55 108.76 3jro n ASP 257 Ca 0.09 1.03 -0.13 0.00 -1.51 0.00 0.00 54.79 54.27 3jro n ASP 257 Cb 0.62 -0.99 -0.07 0.00 2.34 0.00 0.00 41.12 43.02 3jro n ASP 257 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3jro h PRO 258 N 0.91 -0.19 0.44 -0.67 0.11 -1.96 0.14 132.00 130.79 3jro h PRO 258 Ca -0.33 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.77 3jro h PRO 258 Cb 1.43 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.58 3jro h PRO 258 CO 0.54 -0.13 -0.21 1.88 -0.21 0.00 0.00 178.00 179.87 3jro h TYR 259 N -0.20 -0.55 -0.64 0.65 0.05 -1.90 -2.05 116.97 112.34 3jro h TYR 259 Ca -0.00 -0.01 0.13 0.00 0.05 0.00 0.00 58.73 58.89 3jro h TYR 259 Cb 0.18 0.18 -0.12 0.00 1.01 0.00 0.00 36.73 37.98 3jro h TYR 259 CO -0.10 -0.24 -0.18 1.49 -1.05 0.00 0.00 178.16 178.08 3jro h GLU 260 N -0.84 -0.02 -0.20 4.88 4.81 -1.76 0.68 114.58 122.13 3jro h GLU 260 Ca -0.06 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.23 3jro h GLU 260 Cb 0.56 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 3jro h GLU 260 CO 0.10 -0.01 0.17 -0.09 -0.73 0.00 0.00 179.01 178.44 3jro h ARG 261 N -0.02 0.00 0.09 1.92 2.43 -0.90 -2.62 114.38 115.28 3jro h ARG 261 Ca 0.30 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.31 3jro h ARG 261 Cb 0.49 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 30.05 3jro h ARG 261 CO -0.67 0.00 -0.69 0.00 -1.51 0.00 0.00 179.97 177.09 3jro h ALA 262 N 1.86 -0.04 -0.55 2.80 0.00 0.11 -3.25 119.26 120.19 3jro h ALA 262 Ca 0.09 -0.64 0.03 0.00 0.00 0.00 0.00 54.91 54.40 3jro h ALA 262 Cb 0.42 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3jro h ALA 262 CO -0.00 0.34 0.36 -0.84 0.00 0.00 0.00 179.25 179.11 3jro h ILE 263 N -0.33 1.06 0.52 0.00 3.07 -0.77 -2.35 117.51 118.70 3jro h ILE 263 Ca -0.11 -0.21 -0.02 0.00 1.55 0.00 0.00 64.86 66.06 3jro h ILE 263 Cb 1.50 0.38 0.00 0.00 -0.27 0.00 0.00 36.82 38.43 3jro h ILE 263 CO 0.13 0.11 -0.26 1.88 -1.05 0.00 0.00 178.15 178.97 3jro h TYR 264 N 0.62 -0.67 -0.77 0.16 0.05 -1.60 -3.02 116.97 111.74 3jro h TYR 264 Ca 0.22 -0.01 0.14 0.00 0.05 0.00 0.00 58.73 59.13 3jro h TYR 264 Cb 0.11 0.22 -0.09 0.00 1.01 0.00 0.00 36.73 37.98 3jro h TYR 264 CO -0.00 -0.41 0.32 0.66 -1.05 0.00 0.00 178.16 177.68 3jro h SER 265 N -0.71 0.31 -0.60 3.88 4.64 -1.46 -1.51 113.55 118.10 3jro h SER 265 Ca -0.07 0.11 0.11 0.00 -0.47 0.00 0.00 61.79 61.46 3jro h SER 265 Cb 0.55 0.08 -0.12 0.00 -0.31 0.00 0.00 62.40 62.60 3jro h SER 265 CO 0.11 0.12 -0.33 0.22 -0.87 0.00 0.00 176.83 176.08 3jro h TYR 266 N 0.46 -0.90 0.00 4.77 3.20 -1.36 1.31 116.97 124.45 3jro h TYR 266 Ca 0.42 0.07 -0.01 0.00 3.14 0.00 0.00 58.73 62.36 3jro h TYR 266 Cb 0.63 0.48 -0.00 0.00 1.54 0.00 0.00 36.73 39.39 3jro h TYR 266 CO -0.16 -0.38 -0.03 -0.07 -1.64 0.00 0.00 178.16 175.88 3jro h LEU 267 N -0.15 0.00 0.00 2.82 3.38 -1.25 -3.28 115.31 116.83 3jro h LEU 267 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 3jro h LEU 267 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 3jro h LEU 267 CO -0.69 0.03 -0.24 -1.54 0.09 0.00 0.00 178.44 176.10 3jro n SER 268 N -3.51 0.48 -3.57 -0.43 3.41 0.43 -5.03 113.62 105.40 3jro n SER 268 Ca -0.02 0.10 -0.14 0.00 -0.26 0.00 0.00 58.87 58.55 3jro n SER 268 Cb 0.14 -0.56 -0.06 0.00 -0.26 0.00 0.00 64.21 63.46 3jro n SER 268 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3jro s GLY 269 N -3.44 1.42 -1.11 5.00 0.00 0.42 -4.93 107.32 104.68 3jro s GLY 269 Ca -0.07 -1.51 -0.04 0.00 0.00 0.00 0.00 44.72 43.10 3jro s GLY 269 CO 0.10 -1.07 1.65 0.00 0.00 0.00 0.00 173.10 173.79 3jro n ALA 270 N -0.49 5.48 -2.44 3.20 0.00 -1.26 -3.16 120.51 121.84 3jro n ALA 270 Ca 0.02 -4.67 -0.18 0.00 0.00 0.00 0.00 53.44 48.60 3jro n ALA 270 Cb 0.62 -2.42 0.02 0.00 0.00 0.00 0.00 19.45 17.67 3jro n ALA 270 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3jro n ILE 271 N 1.32 1.97 -1.66 0.00 5.41 -1.26 -4.86 119.36 120.28 3jro n ILE 271 Ca 0.34 -4.04 -0.44 0.00 1.00 0.00 0.00 62.75 59.60 3jro n ILE 271 Cb 0.32 -0.45 -0.02 0.00 -0.71 0.00 0.00 39.64 38.78 3jro n ILE 271 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3jro n PRO 272 N -0.48 1.92 -1.54 0.38 -0.02 -1.26 -4.80 135.00 129.20 3jro n PRO 272 Ca 0.30 0.68 -0.53 0.00 -2.02 0.00 0.00 63.50 61.93 3jro n PRO 272 Cb 0.80 -2.26 -0.06 0.00 -0.02 0.00 0.00 33.50 31.96 3jro n PRO 272 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3jro n ASN 273 N 1.57 0.75 0.12 2.55 4.05 -1.26 -4.75 115.26 118.29 3jro n ASN 273 Ca 0.09 1.14 0.12 0.00 0.45 0.00 0.00 54.58 56.38 3jro n ASN 273 Cb 0.33 -1.09 0.61 0.00 1.23 0.00 0.00 39.78 40.86 3jro n ASN 273 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 177.26 175.77 3jro h GLN 274 N 3.32 0.11 0.00 1.20 4.20 -1.98 0.37 115.11 122.33 3jro h GLN 274 Ca -0.45 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.25 3jro h GLN 274 Cb 1.38 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.13 3jro h GLN 274 CO 0.69 0.07 0.00 0.39 -0.67 0.00 0.00 178.83 179.31 3jro n GLU 275 N -4.48 0.06 0.00 1.46 1.02 -1.26 -1.41 120.64 116.03 3jro n GLU 275 Ca 0.03 0.46 0.04 0.00 -0.02 0.00 0.00 57.16 57.67 3jro n GLU 275 Cb 0.27 -1.66 0.03 0.00 -0.02 0.00 0.00 31.44 30.06 3jro n GLU 275 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3jro n VAL 276 N -1.78 0.00 0.54 2.62 0.31 0.13 -4.50 118.33 115.64 3jro n VAL 276 Ca 0.01 -0.49 0.12 0.00 -0.01 0.00 0.00 64.34 63.97 3jro n VAL 276 Cb 0.08 1.15 0.19 0.00 -0.91 0.00 0.00 33.84 34.36 3jro n VAL 276 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 3jro n LEU 277 N 0.32 3.28 -0.03 7.52 7.94 -0.50 -4.39 117.00 131.14 3jro n LEU 277 Ca 0.04 -1.33 -0.01 0.00 -1.11 0.00 0.00 56.01 53.61 3jro n LEU 277 Cb 0.20 -0.18 -0.01 0.00 0.53 0.00 0.00 43.42 43.96 3jro n LEU 277 CO 0.06 0.66 0.50 1.56 -1.11 0.00 0.00 177.39 179.06 3jro h GLN 278 N 4.48 -0.02 -6.64 1.96 4.20 -1.79 -3.38 115.11 113.92 3jro h GLN 278 Ca 0.00 0.00 -0.55 0.00 0.06 0.00 0.00 58.65 58.16 3jro h GLN 278 Cb 0.98 0.00 0.07 0.00 0.30 0.00 0.00 27.48 28.83 3jro h GLN 278 CO 0.00 -0.01 0.88 0.66 -0.67 0.00 0.00 178.83 179.69 3jro n TYR 279 N -3.14 2.57 -2.78 2.96 0.53 -1.26 -4.94 117.16 111.10 3jro n TYR 279 Ca -0.00 0.20 -0.08 0.00 -1.02 0.00 0.00 57.90 57.00 3jro n TYR 279 Cb 0.03 -2.60 0.03 0.00 -1.03 0.00 0.00 39.34 35.77 3jro n TYR 279 CO 0.00 0.00 0.00 -1.13 -1.02 0.00 0.00 176.86 174.71 3jro n SER 280 N 3.20 -2.94 0.00 7.72 3.41 -1.26 -4.78 113.62 118.97 3jro n SER 280 Ca 0.14 -3.13 0.00 0.00 -0.26 0.00 0.00 58.87 55.63 3jro n SER 280 Cb 0.33 1.66 0.00 0.00 -0.26 0.00 0.00 64.21 65.94 3jro n SER 280 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3jro n ASP 281 N 2.13 0.00 -1.31 4.04 2.03 -1.26 -4.49 116.55 117.68 3jro n ASP 281 Ca 0.13 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.48 3jro n ASP 281 Cb 0.60 0.00 0.05 0.00 -0.72 0.00 0.00 41.12 41.05 3jro n ASP 281 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 3jro n TRP 282 N 0.00 0.00 0.08 -0.67 7.02 -1.26 -4.84 117.44 117.76 3jro n TRP 282 Ca 0.00 -0.66 -0.06 0.00 -1.02 0.00 0.00 57.50 55.76 3jro n TRP 282 Cb 0.00 -0.16 0.11 0.00 -2.42 0.00 0.00 31.31 28.84 3jro n TRP 282 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 3jro h GLU 283 N 0.97 0.28 0.00 -0.99 4.39 -1.92 -1.32 114.58 115.99 3jro h GLU 283 Ca -0.18 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.33 3jro h GLU 283 Cb 1.73 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 30.41 3jro h GLU 283 CO 0.08 0.79 0.00 0.66 -1.16 0.00 0.00 179.01 179.38 3jro h SER 284 N 0.21 0.00 0.00 1.42 4.64 -1.86 0.25 113.55 118.20 3jro h SER 284 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3jro h SER 284 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 3jro h SER 284 CO 0.10 0.00 0.00 -0.67 -0.87 0.00 0.00 176.83 175.39 3jro n ASP 285 N -2.72 0.00 -0.65 4.97 -0.08 -0.55 -2.73 116.55 114.79 3jro n ASP 285 Ca -0.02 0.54 0.49 0.00 -1.51 0.00 0.00 54.79 54.29 3jro n ASP 285 Cb 0.06 -0.45 0.77 0.00 2.34 0.00 0.00 41.12 43.83 3jro n ASP 285 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 3jro n LEU 286 N -1.85 0.02 -0.10 -2.67 7.94 -0.67 -1.62 117.00 118.05 3jro n LEU 286 Ca 0.00 0.99 -0.17 0.00 -1.11 0.00 0.00 56.01 55.72 3jro n LEU 286 Cb 0.00 -0.49 -0.08 0.00 0.53 0.00 0.00 43.42 43.38 3jro n LEU 286 CO 0.00 -1.01 -0.64 1.41 -1.11 0.00 0.00 177.39 176.04 3jro n HIS 287 N -3.92 0.73 0.33 1.96 -0.00 -0.01 -3.04 115.22 111.27 3jro n HIS 287 Ca 0.42 0.32 0.16 0.00 -0.00 0.00 0.00 57.72 58.62 3jro n HIS 287 Cb 1.87 -0.93 0.87 0.00 -0.00 0.00 0.00 29.99 31.80 3jro n HIS 287 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.34 177.16 3jro h ILE 288 N -1.00 0.01 0.02 1.59 2.04 -1.23 0.22 117.51 119.16 3jro h ILE 288 Ca -0.27 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.55 3jro h ILE 288 Cb 1.09 0.71 -0.00 0.00 -0.74 0.00 0.00 36.82 37.88 3jro h ILE 288 CO -0.17 0.00 -0.20 0.45 0.00 0.00 0.00 178.15 178.23 3jro h HIS 289 N 0.00 0.07 -1.08 1.37 3.86 -1.44 -3.25 115.15 114.67 3jro h HIS 289 Ca 0.01 -0.05 0.30 0.00 -1.16 0.00 0.00 60.37 59.47 3jro h HIS 289 Cb 0.59 -0.00 -0.07 0.00 1.06 0.00 0.00 27.41 28.99 3jro h HIS 289 CO 0.00 1.08 0.74 1.25 0.86 0.00 0.00 177.93 181.86 3jro h LEU 290 N -0.92 0.20 0.00 2.43 5.85 -0.93 0.36 115.31 122.30 3jro h LEU 290 Ca -0.05 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.72 3jro h LEU 290 Cb 1.10 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 3jro h LEU 290 CO 0.00 0.04 -0.14 -1.13 -0.34 0.00 0.00 178.44 176.87 3jro h ASN 291 N 0.17 -0.43 -0.20 1.25 -1.24 -1.23 -1.79 115.58 112.11 3jro h ASN 291 Ca 0.56 0.05 0.04 0.00 0.71 0.00 0.00 56.30 57.66 3jro h ASN 291 Cb 1.86 0.16 -0.01 0.00 0.73 0.00 0.00 38.32 41.06 3jro h ASN 291 CO -0.14 -0.14 0.14 -0.61 -1.29 0.00 0.00 177.43 175.40 3jro h GLN 292 N -0.18 0.10 0.14 6.67 4.15 -0.40 -2.78 115.11 122.82 3jro h GLN 292 Ca 0.00 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 3jro h GLN 292 Cb 0.19 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.86 3jro h GLN 292 CO -0.09 0.07 -0.07 0.97 -1.93 0.00 0.00 178.83 177.78 3jro h ILE 293 N 0.11 0.15 0.00 2.39 2.10 -0.94 -2.92 117.51 118.39 3jro h ILE 293 Ca 0.09 -0.95 0.00 0.00 1.08 0.00 0.00 64.86 65.08 3jro h ILE 293 Cb 0.23 0.27 0.00 0.00 -1.09 0.00 0.00 36.82 36.23 3jro h ILE 293 CO -0.01 0.05 0.00 0.18 -1.08 0.00 0.00 178.15 177.29 3jro n LEU 294 N -4.90 0.00 -0.08 2.19 4.77 -0.69 -1.11 117.00 117.18 3jro n LEU 294 Ca -0.03 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.85 3jro n LEU 294 Cb 0.11 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.16 3jro n LEU 294 CO 0.09 0.00 -0.51 0.00 -1.33 0.00 0.00 177.39 175.64 3jro n GLN 295 N -0.76 0.49 -0.29 3.23 6.02 -1.05 -3.22 117.38 121.80 3jro n GLN 295 Ca 0.05 0.45 0.03 0.00 -0.01 0.00 0.00 57.00 57.52 3jro n GLN 295 Cb 0.02 -1.63 0.16 0.00 1.02 0.00 0.00 30.24 29.81 3jro n GLN 295 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.06 177.84 3jro h THR 296 N -1.00 0.91 -0.35 5.09 1.35 -1.28 0.66 112.91 118.29 3jro h THR 296 Ca -0.09 -0.27 0.07 0.00 -0.55 0.00 0.00 66.41 65.57 3jro h THR 296 Cb 0.80 0.06 -0.09 0.00 -1.73 0.00 0.00 68.15 67.19 3jro h THR 296 CO -0.06 0.14 -0.36 -0.08 -0.25 0.00 0.00 175.52 174.92 3jro h GLU 297 N 0.79 -0.29 0.48 4.72 4.22 -1.31 0.43 114.58 123.61 3jro h GLU 297 Ca 0.39 0.02 -0.02 0.00 0.08 0.00 0.00 59.36 59.83 3jro h GLU 297 Cb 0.35 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.67 3jro h GLU 297 CO -0.24 -0.19 -0.23 0.82 -2.18 0.00 0.00 179.01 176.99 3jro h ILE 298 N -0.30 0.52 0.00 2.32 2.04 -0.85 -2.17 117.51 119.07 3jro h ILE 298 Ca 0.15 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.84 3jro h ILE 298 Cb 0.56 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 3jro h ILE 298 CO -0.52 0.03 0.04 -0.62 0.00 0.00 0.00 178.15 177.08 3jro n GLU 299 N -5.33 0.12 -0.06 2.37 1.02 0.21 -1.59 120.64 117.38 3jro n GLU 299 Ca -0.11 0.61 -0.05 0.00 -0.02 0.00 0.00 57.16 57.59 3jro n GLU 299 Cb 0.29 -1.92 -0.03 0.00 -0.02 0.00 0.00 31.44 29.76 3jro n GLU 299 CO 0.00 0.00 0.00 -0.97 1.18 0.00 0.00 177.13 177.34 3jro h ASN 300 N 0.00 0.00 0.21 1.62 -0.73 0.45 -2.44 115.58 114.68 3jro h ASN 300 Ca 0.00 -0.13 0.00 0.00 1.87 0.00 0.00 56.30 58.04 3jro h ASN 300 Cb 0.08 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.67 3jro h ASN 300 CO 0.00 0.71 0.00 0.00 -0.37 0.00 0.00 177.43 177.77 3jro n TYR 301 N -4.68 0.00 0.03 0.67 0.18 -0.88 -0.39 117.16 112.09 3jro n TYR 301 Ca -0.06 0.00 -0.21 0.00 1.88 0.00 0.00 57.90 59.51 3jro n TYR 301 Cb 0.19 -0.49 -0.14 0.00 -0.38 0.00 0.00 39.34 38.52 3jro n TYR 301 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 3jro h LEU 302 N 0.00 0.45 -1.97 -3.48 3.38 -1.40 -3.24 115.31 109.05 3jro h LEU 302 Ca 0.00 -0.90 0.02 0.00 0.09 0.00 0.00 57.88 57.09 3jro h LEU 302 Cb 0.10 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 3jro h LEU 302 CO 0.00 1.52 0.08 -0.07 0.09 0.00 0.00 178.44 180.06 3jro h LEU 303 N -0.31 0.04 -0.28 1.67 3.38 -0.20 -1.50 115.31 118.10 3jro h LEU 303 Ca -0.23 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.74 3jro h LEU 303 Cb 1.73 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.47 3jro h LEU 303 CO 0.11 0.02 -0.33 -0.62 0.09 0.00 0.00 178.44 177.71 3jro n GLU 304 N -4.51 0.50 -2.32 1.13 1.02 -0.87 -4.92 120.64 110.66 3jro n GLU 304 Ca -0.01 -0.28 -0.13 0.00 -0.02 0.00 0.00 57.16 56.72 3jro n GLU 304 Cb 0.16 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.08 3jro n GLU 304 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3jro n ASN 305 N -1.01 -4.09 -0.09 1.62 3.02 -0.57 -4.85 115.26 109.29 3jro n ASN 305 Ca 0.10 0.19 -0.12 0.00 -0.03 0.00 0.00 54.58 54.71 3jro n ASN 305 Cb 0.34 -3.50 -0.15 0.00 -0.61 0.00 0.00 39.78 35.86 3jro n ASN 305 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3jro n ASN 306 N -1.68 0.64 0.00 6.41 3.02 -1.22 -4.66 115.26 117.77 3jro n ASN 306 Ca -0.16 0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.41 3jro n ASN 306 Cb 0.60 0.48 0.00 0.00 -0.61 0.00 0.00 39.78 40.25 3jro n ASN 306 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 3jro n GLN 307 N -2.93 5.41 -4.69 3.52 7.27 -1.24 -4.38 117.38 120.33 3jro n GLN 307 Ca -0.34 0.00 -0.32 0.00 0.07 0.00 0.00 57.00 56.41 3jro n GLN 307 Cb 1.10 -0.43 -0.17 0.00 2.41 0.00 0.00 30.24 33.16 3jro n GLN 307 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 3jro s VAL 308 N -0.85 1.99 0.35 1.69 1.01 -1.26 -4.79 120.40 118.53 3jro s VAL 308 Ca 0.00 -0.94 -0.20 0.00 0.00 0.00 0.00 61.98 60.84 3jro s VAL 308 Cb 0.00 -1.76 -0.10 0.00 0.00 0.00 0.00 36.38 34.52 3jro s VAL 308 CO 0.00 0.54 0.86 -0.83 0.00 0.00 0.00 175.10 175.66 3jro s GLY 309 N 0.79 2.47 0.14 4.51 0.00 -1.26 -4.88 107.32 109.09 3jro s GLY 309 Ca -0.08 0.29 -0.16 0.00 0.00 0.00 0.00 44.72 44.76 3jro s GLY 309 CO -0.01 0.58 1.72 -0.91 0.00 0.00 0.00 173.10 174.48 3jro h THR 310 N 2.16 1.17 0.00 0.90 1.35 -2.00 -2.76 112.91 113.73 3jro h THR 310 Ca -0.48 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 64.90 3jro h THR 310 Cb 1.18 0.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.37 3jro h THR 310 CO 0.64 0.18 0.00 -0.90 -0.25 0.00 0.00 175.52 175.19 3jro n ASP 311 N -4.70 0.00 0.13 5.36 5.68 -1.26 -3.16 116.55 118.59 3jro n ASP 311 Ca -0.00 -1.77 0.12 0.00 -0.50 0.00 0.00 54.79 52.64 3jro n ASP 311 Cb 0.11 0.00 0.05 0.00 -1.14 0.00 0.00 41.12 40.14 3jro n ASP 311 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3jro h GLU 312 N 0.00 0.00 -5.75 0.11 5.08 -1.89 -3.43 114.58 108.70 3jro h GLU 312 Ca 0.00 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.75 3jro h GLU 312 Cb 0.00 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.13 3jro h GLU 312 CO 0.00 0.00 0.87 -0.51 -1.00 0.00 0.00 179.01 178.37 3jro s LEU 313 N -5.44 3.99 -0.12 1.33 1.43 -1.19 -4.49 118.68 114.19 3jro s LEU 313 Ca 0.02 -1.03 -0.06 0.00 -1.03 0.00 0.00 54.13 52.02 3jro s LEU 313 Cb 0.09 -2.48 -0.04 0.00 0.03 0.00 0.00 46.19 43.79 3jro s LEU 313 CO 0.76 -1.52 0.02 0.40 0.23 0.00 0.00 176.35 176.24 3jro h ILE 314 N 6.08 0.19 -3.22 -0.59 2.04 -1.88 -3.46 117.51 116.67 3jro h ILE 314 Ca -0.16 -1.16 -0.59 0.00 1.00 0.00 0.00 64.86 63.95 3jro h ILE 314 Cb 1.05 0.37 -0.08 0.00 -0.74 0.00 0.00 36.82 37.43 3jro h ILE 314 CO 1.23 0.06 -0.21 -0.76 0.00 0.00 0.00 178.15 178.48 3jro s LEU 315 N -8.40 4.33 0.54 1.44 1.43 -1.26 -5.07 118.68 111.69 3jro s LEU 315 Ca -0.07 0.77 -0.22 0.00 -1.03 0.00 0.00 54.13 53.59 3jro s LEU 315 Cb 0.01 -2.57 -0.05 0.00 0.03 0.00 0.00 46.19 43.60 3jro s LEU 315 CO 0.14 0.13 1.29 -2.65 0.23 0.00 0.00 176.35 175.49 3jro n PRO 316 N 3.09 1.59 -3.67 1.29 -0.02 -1.26 -4.89 135.00 131.12 3jro n PRO 316 Ca -0.10 0.58 -0.08 0.00 -2.02 0.00 0.00 63.50 61.87 3jro n PRO 316 Cb 0.52 -2.49 -0.09 0.00 -0.02 0.00 0.00 33.50 31.41 3jro n PRO 316 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3jro s LEU 317 N -3.08 -0.50 0.40 2.45 1.43 -1.26 -5.09 118.68 113.03 3jro s LEU 317 Ca 0.71 1.14 -0.23 0.00 -1.03 0.00 0.00 54.13 54.72 3jro s LEU 317 Cb -0.43 1.72 -0.10 0.00 0.03 0.00 0.00 46.19 47.41 3jro s LEU 317 CO 0.49 -0.21 0.98 -2.84 0.23 0.00 0.00 176.35 175.00 3jro s PRO 318 N 1.75 4.27 -1.11 1.29 0.02 -1.26 -4.99 135.00 134.97 3jro s PRO 318 Ca -0.08 1.31 -0.14 0.00 0.02 0.00 0.00 61.00 62.11 3jro s PRO 318 Cb -0.08 -2.44 0.19 0.00 0.02 0.00 0.00 34.50 32.19 3jro s PRO 318 CO -0.15 -0.01 1.25 -1.54 -0.33 0.00 0.00 177.00 176.22 3jro s SER 319 N -1.83 7.02 -0.15 2.53 1.04 -1.26 -5.01 113.70 116.04 3jro s SER 319 Ca 0.58 -2.93 -0.29 0.00 0.48 0.00 0.00 55.95 53.78 3jro s SER 319 Cb -0.16 -2.34 -0.02 0.00 0.10 0.00 0.00 66.02 63.59 3jro s SER 319 CO 0.21 -0.69 1.36 -1.00 0.98 0.00 0.00 173.24 174.10 3jro s HIS 320 N 1.04 2.63 -1.50 5.02 3.76 -1.26 -4.92 115.29 120.05 3jro s HIS 320 Ca 0.36 0.81 -0.12 0.00 -0.15 0.00 0.00 55.06 55.96 3jro s HIS 320 Cb -0.05 -3.62 0.00 0.00 1.11 0.00 0.00 32.58 30.02 3jro s HIS 320 CO -0.04 -2.21 2.50 0.00 -0.85 0.00 0.00 174.74 174.13 3jro n ALA 321 N 6.82 6.39 -1.44 -1.40 0.00 -1.26 -4.86 120.51 124.76 3jro n ALA 321 Ca 0.15 -3.79 -0.40 0.00 0.00 0.00 0.00 53.44 49.40 3jro n ALA 321 Cb 0.44 -3.39 -0.02 0.00 0.00 0.00 0.00 19.45 16.48 3jro n ALA 321 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3jro n LEU 322 N 4.71 8.27 -4.65 0.00 4.77 -1.26 -4.95 117.00 123.89 3jro n LEU 322 Ca 0.62 -4.33 -0.61 0.00 -0.03 0.00 0.00 56.01 51.67 3jro n LEU 322 Cb 0.32 -1.58 -0.08 0.00 -2.33 0.00 0.00 43.42 39.75 3jro n LEU 322 CO 0.87 1.83 1.01 0.35 -1.33 0.00 0.00 177.39 180.12 3jro n THR 323 N 3.91 0.08 -0.34 -5.08 -2.24 -1.26 -4.56 114.28 104.78 3jro n THR 323 Ca 0.72 -0.01 0.26 0.00 -2.27 0.00 0.00 64.05 62.75 3jro n THR 323 Cb 0.27 -0.61 0.51 0.00 -2.10 0.00 0.00 70.33 68.41 3jro n THR 323 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 3jro h VAL 324 N 4.28 0.24 0.00 2.28 2.07 -1.98 0.85 116.25 124.00 3jro h VAL 324 Ca -0.47 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 3jro h VAL 324 Cb 1.37 -0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.10 3jro h VAL 324 CO 0.86 0.05 -0.11 -0.61 0.02 0.00 0.00 177.57 177.78 3jro h GLN 325 N 0.25 0.00 0.00 1.57 4.15 -1.97 -0.43 115.11 118.68 3jro h GLN 325 Ca 0.76 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 60.17 3jro h GLN 325 Cb 1.84 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 29.53 3jro h GLN 325 CO -0.60 0.11 -1.15 0.39 -1.93 0.00 0.00 178.83 175.65 3jro n GLU 326 N -3.55 0.61 0.08 1.69 1.02 0.29 -3.80 120.64 116.98 3jro n GLU 326 Ca -0.02 0.09 -0.15 0.00 -0.02 0.00 0.00 57.16 57.07 3jro n GLU 326 Cb 0.25 -1.79 -0.14 0.00 -0.02 0.00 0.00 31.44 29.74 3jro n GLU 326 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3jro h VAL 327 N 0.00 1.38 0.00 2.62 2.07 -0.21 -2.14 116.25 119.96 3jro h VAL 327 Ca -0.01 -3.00 0.00 0.00 0.82 0.00 0.00 66.70 64.51 3jro h VAL 327 Cb 1.03 2.85 0.00 0.00 -1.52 0.00 0.00 31.29 33.65 3jro h VAL 327 CO 0.00 0.86 0.00 -0.07 0.02 0.00 0.00 177.57 178.38 3jro h LEU 328 N 0.06 0.00 0.14 2.57 3.38 -1.29 -2.34 115.31 117.83 3jro h LEU 328 Ca -0.16 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.47 3jro h LEU 328 Cb 1.96 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.71 3jro h LEU 328 CO 0.17 0.00 -1.78 0.78 0.09 0.00 0.00 178.44 177.71 3jro h ASN 329 N 0.00 0.47 0.98 -0.43 2.35 -1.62 -2.87 115.58 114.45 3jro h ASN 329 Ca 0.00 -0.91 -0.06 0.00 -0.55 0.00 0.00 56.30 54.78 3jro h ASN 329 Cb 0.44 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 3jro h ASN 329 CO 0.00 1.78 -0.28 0.03 -1.65 0.00 0.00 177.43 177.31 3jro h ARG 330 N -0.02 0.00 0.00 0.81 3.08 -1.40 -1.58 114.38 115.26 3jro h ARG 330 Ca -0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.68 3jro h ARG 330 Cb 1.98 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.03 3jro h ARG 330 CO 0.11 0.28 0.00 0.28 -1.07 0.00 0.00 179.97 179.57 3jro n VAL 331 N -3.41 0.47 0.40 2.04 0.31 -0.88 -3.57 118.33 113.70 3jro n VAL 331 Ca 0.00 -0.22 0.13 0.00 -0.01 0.00 0.00 64.34 64.25 3jro n VAL 331 Cb 0.48 -0.57 0.43 0.00 -0.91 0.00 0.00 33.84 33.26 3jro n VAL 331 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3jro h ALA 332 N 2.62 1.00 -0.00 3.52 0.00 -1.04 -2.11 119.26 123.25 3jro h ALA 332 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3jro h ALA 332 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3jro h ALA 332 CO 0.00 0.00 -0.27 -1.13 0.00 0.00 0.00 179.25 177.85 3jro n SER 333 N -2.62 0.31 -0.87 0.00 3.41 -1.23 -3.11 113.62 109.50 3jro n SER 333 Ca 0.03 0.01 0.07 0.00 -0.26 0.00 0.00 58.87 58.73 3jro n SER 333 Cb 0.38 -0.07 0.21 0.00 -0.26 0.00 0.00 64.21 64.47 3jro n SER 333 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3jro n ARG 334 N -1.45 2.87 -3.22 4.33 1.74 -0.81 -4.81 116.66 115.30 3jro n ARG 334 Ca 0.07 -2.27 -0.46 0.00 -0.77 0.00 0.00 57.85 54.41 3jro n ARG 334 Cb 0.33 -1.39 -0.03 0.00 -1.02 0.00 0.00 32.46 30.35 3jro n ARG 334 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3jro s HIS 335 N -1.09 3.44 -0.76 -1.55 3.76 -1.07 -4.95 115.29 113.06 3jro s HIS 335 Ca 0.32 -1.59 -0.27 0.00 -0.15 0.00 0.00 55.06 53.37 3jro s HIS 335 Cb 0.17 -3.92 -0.26 0.00 1.11 0.00 0.00 32.58 29.68 3jro s HIS 335 CO 0.21 -1.13 1.92 -2.30 -0.85 0.00 0.00 174.74 172.59 3jro n PRO 336 N 5.02 0.06 -3.19 8.40 -0.02 -1.26 -2.93 135.00 141.08 3jro n PRO 336 Ca 0.06 -1.44 -0.20 0.00 -2.02 0.00 0.00 63.50 59.90 3jro n PRO 336 Cb 0.45 -3.44 -0.01 0.00 -0.02 0.00 0.00 33.50 30.48 3jro n PRO 336 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3jro n SER 337 N 16.53 -3.37 0.01 2.55 3.41 -1.26 -4.79 113.62 126.69 3jro n SER 337 Ca 0.40 -0.25 0.11 0.00 -0.26 0.00 0.00 58.87 58.88 3jro n SER 337 Cb 0.46 -2.83 0.13 0.00 -0.26 0.00 0.00 64.21 61.71 3jro n SER 337 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3jro n GLU 338 N -3.47 0.06 -0.83 4.33 1.02 -1.15 -3.46 120.64 117.14 3jro n GLU 338 Ca -0.03 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.19 3jro n GLU 338 Cb 0.54 -1.53 0.38 0.00 -0.02 0.00 0.00 31.44 30.82 3jro n GLU 338 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3jro n SER 339 N -1.61 5.46 -0.06 1.62 3.41 -1.26 -4.31 113.62 116.87 3jro n SER 339 Ca 0.04 -2.96 -0.09 0.00 -0.26 0.00 0.00 58.87 55.61 3jro n SER 339 Cb 0.36 -0.67 -0.06 0.00 -0.26 0.00 0.00 64.21 63.58 3jro n SER 339 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3jro n GLU 340 N 0.43 0.30 -1.26 4.33 -0.58 -1.22 -4.68 120.64 117.96 3jro n GLU 340 Ca 0.27 0.08 -0.42 0.00 -0.42 0.00 0.00 57.16 56.67 3jro n GLU 340 Cb 1.16 -1.21 -0.01 0.00 -0.57 0.00 0.00 31.44 30.81 3jro n GLU 340 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23 3jro n HIS 341 N -2.95 -1.46 -0.01 -0.32 -0.00 -1.25 -4.66 115.22 104.57 3jro n HIS 341 Ca -0.22 0.71 -0.09 0.00 0.46 0.00 0.00 57.72 58.57 3jro n HIS 341 Cb 0.73 -1.74 -0.03 0.00 -0.12 0.00 0.00 29.99 28.82 3jro n HIS 341 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3jro h PRO 342 N 0.53 -0.26 0.00 1.57 0.11 -1.96 -2.26 132.00 129.73 3jro h PRO 342 Ca -0.32 0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.74 3jro h PRO 342 Cb 1.37 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.53 3jro h PRO 342 CO 0.48 -0.17 -0.30 0.82 -0.21 0.00 0.00 178.00 178.61 3jro h ILE 343 N -0.27 1.07 0.00 4.15 2.04 -1.97 -2.70 117.51 119.83 3jro h ILE 343 Ca 0.11 -1.09 0.00 0.00 1.00 0.00 0.00 64.86 64.88 3jro h ILE 343 Cb 0.43 1.61 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 3jro h ILE 343 CO -0.31 0.30 -0.32 0.54 0.00 0.00 0.00 178.15 178.35 3jro n ARG 344 N -3.96 0.12 0.08 2.37 1.74 -0.93 -2.79 116.66 113.29 3jro n ARG 344 Ca -0.02 0.06 -0.07 0.00 -0.77 0.00 0.00 57.85 57.05 3jro n ARG 344 Cb 0.37 -1.60 -0.06 0.00 -1.02 0.00 0.00 32.46 30.14 3jro n ARG 344 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3jro h VAL 345 N 0.00 1.62 -0.01 1.55 2.07 -1.08 -3.20 116.25 117.19 3jro h VAL 345 Ca 0.00 -3.06 -0.01 0.00 0.82 0.00 0.00 66.70 64.45 3jro h VAL 345 Cb 0.61 2.69 -0.00 0.00 -1.52 0.00 0.00 31.29 33.07 3jro h VAL 345 CO 0.00 0.88 0.01 0.18 0.02 0.00 0.00 177.57 178.66 3jro n LEU 346 N -3.49 3.47 0.00 2.57 4.77 -1.12 -2.89 117.00 120.32 3jro n LEU 346 Ca -0.02 -1.69 0.00 0.00 -0.03 0.00 0.00 56.01 54.27 3jro n LEU 346 Cb 0.88 -0.62 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3jro n LEU 346 CO 0.47 0.60 0.00 0.00 -1.33 0.00 0.00 177.39 177.13 3jro n ALA 348 N 0.65 0.00 0.01 -1.18 0.00 -1.21 -1.33 120.51 117.46 3jro n ALA 348 Ca 0.01 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.27 3jro n ALA 348 Cb 0.51 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.83 3jro n ALA 348 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3jro h SER 349 N 0.00 0.38 -1.16 0.00 4.64 -1.85 -3.09 113.55 112.46 3jro h SER 349 Ca 0.00 -0.90 0.33 0.00 -0.47 0.00 0.00 61.79 60.75 3jro h SER 349 Cb 0.00 -0.12 -0.06 0.00 -0.31 0.00 0.00 62.40 61.91 3jro h SER 349 CO 0.00 1.24 0.82 0.58 -0.87 0.00 0.00 176.83 178.60 3jro h VAL 350 N -0.42 0.42 0.00 0.95 2.07 -1.52 0.75 116.25 118.51 3jro h VAL 350 Ca -0.09 -0.03 -0.19 0.00 0.82 0.00 0.00 66.70 67.21 3jro h VAL 350 Cb 1.40 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 3jro h VAL 350 CO 0.11 0.02 -0.85 0.40 0.02 0.00 0.00 177.57 177.26 3jro h ILE 351 N 0.09 1.54 -0.29 4.57 1.08 -1.80 -3.30 117.51 119.41 3jro h ILE 351 Ca 0.58 -2.72 0.00 0.00 -0.39 0.00 0.00 64.86 62.33 3jro h ILE 351 Cb 2.11 2.50 0.00 0.00 -3.07 0.00 0.00 36.82 38.36 3jro h ILE 351 CO -0.09 0.78 0.00 0.18 -0.69 0.00 0.00 178.15 178.34 3jro n LEU 352 N -3.61 3.01 0.00 1.44 4.77 0.24 -4.93 117.00 117.92 3jro n LEU 352 Ca -0.02 -1.25 0.00 0.00 -0.03 0.00 0.00 56.01 54.71 3jro n LEU 352 Cb 0.80 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 3jro n LEU 352 CO 0.46 0.62 0.00 0.47 -1.33 0.00 0.00 177.39 177.62 3jro n ASP 353 N 1.22 -4.80 -1.78 -1.43 9.92 0.16 -4.79 116.55 115.05 3jro n ASP 353 Ca 0.18 0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 54.32 3jro n ASP 353 Cb 0.55 -3.23 0.16 0.00 -0.64 0.00 0.00 41.12 37.96 3jro n ASP 353 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 3jro n SER 354 N -0.72 3.69 -0.02 -2.24 3.41 -1.19 -4.49 113.62 112.07 3jro n SER 354 Ca 0.00 -3.02 0.05 0.00 -0.26 0.00 0.00 58.87 55.64 3jro n SER 354 Cb 0.40 -0.72 0.43 0.00 -0.26 0.00 0.00 64.21 64.07 3jro n SER 354 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3jro h LEU 355 N 1.37 0.46 0.55 1.04 5.85 -1.87 -3.15 115.31 119.57 3jro h LEU 355 Ca 0.35 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 59.04 3jro h LEU 355 Cb 2.15 -0.11 0.01 0.00 0.37 0.00 0.00 40.66 43.08 3jro h LEU 355 CO 0.69 0.33 -0.26 -0.65 -0.34 0.00 0.00 178.44 178.20 3jro h PRO 356 N 0.54 -0.71 -0.11 5.25 0.11 -1.96 -2.95 132.00 132.17 3jro h PRO 356 Ca 0.17 0.05 0.03 0.00 0.11 0.00 0.00 66.00 66.36 3jro h PRO 356 Cb 0.02 0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.29 3jro h PRO 356 CO -0.04 -0.42 0.25 0.66 -0.21 0.00 0.00 178.00 178.24 3jro h SER 357 N -0.90 0.00 -0.20 -2.05 4.64 -1.92 0.18 113.55 113.31 3jro h SER 357 Ca -0.08 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.16 3jro h SER 357 Cb 0.62 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.71 3jro h SER 357 CO 0.12 0.00 -0.20 0.58 -0.87 0.00 0.00 176.83 176.46 3jro h VAL 358 N 0.00 1.33 0.00 0.95 2.07 -1.48 -0.43 116.25 118.69 3jro h VAL 358 Ca 0.05 -1.37 -0.07 0.00 0.82 0.00 0.00 66.70 66.13 3jro h VAL 358 Cb 0.54 1.77 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 3jro h VAL 358 CO -0.00 0.42 -0.31 0.40 0.02 0.00 0.00 177.57 178.09 3jro h ILE 359 N 0.16 0.94 0.02 4.57 2.04 -0.82 -1.75 117.51 122.67 3jro h ILE 359 Ca 0.03 -1.20 -0.27 0.00 1.00 0.00 0.00 64.86 64.42 3jro h ILE 359 Cb 0.75 1.70 -0.04 0.00 -0.74 0.00 0.00 36.82 38.50 3jro h ILE 359 CO 0.05 0.31 -1.45 -0.74 0.00 0.00 0.00 178.15 176.31 3jro h HIS 360 N 0.00 0.06 0.00 1.37 2.76 -1.36 -2.86 115.15 115.12 3jro h HIS 360 Ca -0.00 -0.05 -0.00 0.00 -2.20 0.00 0.00 60.37 58.12 3jro h HIS 360 Cb 0.68 -0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.64 3jro h HIS 360 CO 0.00 1.06 -0.01 0.66 -1.30 0.00 0.00 177.93 178.34 3jro h SER 361 N 0.01 0.00 0.09 3.26 4.64 -0.93 -3.21 113.55 117.42 3jro h SER 361 Ca -0.19 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.97 3jro h SER 361 Cb 1.93 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 64.03 3jro h SER 361 CO 0.11 0.01 -0.77 0.77 -0.87 0.00 0.00 176.83 176.07 3jro h SER 362 N 0.00 0.31 -0.97 4.97 4.64 -1.36 -3.30 113.55 117.85 3jro h SER 362 Ca -0.00 -0.92 0.20 0.00 -0.47 0.00 0.00 61.79 60.60 3jro h SER 362 Cb 0.74 -0.10 -0.09 0.00 -0.31 0.00 0.00 62.40 62.64 3jro h SER 362 CO 0.00 1.35 0.61 0.58 -0.87 0.00 0.00 176.83 178.51 3jro h VAL 363 N -0.54 0.70 0.00 0.95 2.07 -1.56 -2.74 116.25 115.12 3jro h VAL 363 Ca -0.16 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.16 3jro h VAL 363 Cb 1.50 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 3jro h VAL 363 CO 0.07 0.11 0.00 -0.62 0.02 0.00 0.00 177.57 177.16 3jro n GLU 364 N -4.64 0.00 0.00 1.57 1.02 -1.21 -1.13 120.64 116.25 3jro n GLU 364 Ca 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 3jro n GLU 364 Cb 0.63 -0.77 0.00 0.00 -0.02 0.00 0.00 31.44 31.28 3jro n GLU 364 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3jro n LEU 366 N 0.18 0.00 0.03 -4.62 4.77 -1.03 -2.19 117.00 114.15 3jro n LEU 366 Ca 0.00 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.80 3jro n LEU 366 Cb 0.00 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 40.95 3jro n LEU 366 CO 0.00 0.00 -0.57 -0.07 -1.33 0.00 0.00 177.39 175.42 3jro h LEU 367 N 0.00 0.39 0.23 2.23 3.38 -1.42 -3.39 115.31 116.74 3jro h LEU 367 Ca 0.00 -0.68 -0.01 0.00 0.09 0.00 0.00 57.88 57.27 3jro h LEU 367 Cb 0.00 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.63 3jro h LEU 367 CO 0.00 1.59 -0.11 0.44 0.09 0.00 0.00 178.44 180.45 3jro h ASP 368 N 0.07 -0.26 -5.31 -0.43 3.32 -1.70 -3.46 116.42 108.65 3jro h ASP 368 Ca -0.33 -0.19 -0.41 0.00 0.02 0.00 0.00 57.03 56.11 3jro h ASP 368 Cb 2.04 0.07 0.01 0.00 0.22 0.00 0.00 39.33 41.67 3jro h ASP 368 CO 0.13 0.06 -0.63 0.52 -1.72 0.00 0.00 179.24 177.60 3jro n VAL 369 N -5.10 -1.85 -3.41 -1.35 0.31 -1.26 -5.25 118.33 100.42 3jro n VAL 369 Ca -0.09 0.00 -0.24 0.00 -0.01 0.00 0.00 64.34 64.00 3jro n VAL 369 Cb 0.23 -2.95 -0.10 0.00 -0.91 0.00 0.00 33.84 30.11 3jro n VAL 369 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3jro s VAL 370 N -3.15 -0.03 0.00 2.52 1.01 -1.26 -5.15 120.40 114.33 3jro s VAL 370 Ca 0.44 -1.51 0.00 0.00 0.00 0.00 0.00 61.98 60.91 3jro s VAL 370 Cb -0.21 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.22 3jro s VAL 370 CO 0.55 -0.85 0.00 -0.67 0.00 0.00 0.00 175.10 174.13 3jro n ASP 381 N 4.00 0.00 -3.66 3.32 -0.08 -1.26 -5.16 116.55 113.71 3jro n ASP 381 Ca 0.13 0.00 -0.21 0.00 -1.51 0.00 0.00 54.79 53.20 3jro n ASP 381 Cb 0.41 0.00 -0.18 0.00 2.34 0.00 0.00 41.12 43.69 3jro n ASP 381 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 3jro s LYS 382 N 0.68 -0.03 0.47 -0.67 1.02 -1.26 -5.02 119.74 114.92 3jro s LYS 382 Ca 0.00 0.29 0.32 0.00 0.02 0.00 0.00 55.97 56.60 3jro s LYS 382 Cb 0.00 -0.75 1.59 0.00 -0.52 0.00 0.00 37.83 38.15 3jro s LYS 382 CO 0.00 -0.39 1.96 -1.35 -0.92 0.00 0.00 175.35 174.66 3jro h PRO 383 N 8.43 0.00 -0.95 -1.68 0.11 -2.03 -2.83 132.00 133.06 3jro h PRO 383 Ca -0.13 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.92 3jro h PRO 383 Cb 1.12 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 3jro h PRO 383 CO 0.18 0.00 0.08 0.66 -0.21 0.00 0.00 178.00 178.71 3jro n TYR 384 N -2.68 0.64 -0.44 0.65 4.01 -1.26 -2.18 117.16 115.91 3jro n TYR 384 Ca -0.01 -0.50 0.03 0.00 -0.16 0.00 0.00 57.90 57.26 3jro n TYR 384 Cb 0.13 -0.31 0.04 0.00 -0.31 0.00 0.00 39.34 38.89 3jro n TYR 384 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3jro n LEU 385 N 0.12 1.96 -4.67 7.72 4.77 -1.07 -4.91 117.00 120.93 3jro n LEU 385 Ca 0.11 -2.22 -0.39 0.00 -0.03 0.00 0.00 56.01 53.49 3jro n LEU 385 Cb 0.64 -0.14 -0.07 0.00 -2.33 0.00 0.00 43.42 41.52 3jro n LEU 385 CO 0.12 0.53 0.17 -0.76 -1.33 0.00 0.00 177.39 176.12 3jro s LEU 386 N -1.52 4.15 0.18 2.23 1.43 -0.93 -4.96 118.68 119.27 3jro s LEU 386 Ca 0.10 0.60 0.05 0.00 -1.03 0.00 0.00 54.13 53.85 3jro s LEU 386 Cb 0.09 -2.62 0.28 0.00 0.03 0.00 0.00 46.19 43.97 3jro s LEU 386 CO 0.01 -0.13 0.95 0.54 0.23 0.00 0.00 176.35 177.95 3jro n ARG 387 N 4.64 0.04 -0.06 1.70 1.74 -1.26 -2.22 116.66 121.24 3jro n ARG 387 Ca -0.06 0.39 -0.03 0.00 -0.77 0.00 0.00 57.85 57.38 3jro n ARG 387 Cb 0.51 -1.98 -0.12 0.00 -1.02 0.00 0.00 32.46 29.84 3jro n ARG 387 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 3jro n ILE 388 N -1.62 0.74 0.07 0.55 3.06 -1.26 -4.64 119.36 116.26 3jro n ILE 388 Ca -0.00 -0.56 -0.10 0.00 -2.50 0.00 0.00 62.75 59.58 3jro n ILE 388 Cb 0.37 -0.39 -0.00 0.00 0.54 0.00 0.00 39.64 40.15 3jro n ILE 388 CO 0.00 0.00 0.00 0.58 -2.50 0.00 0.00 176.55 174.63 3jro h VAL 389 N 0.00 1.44 0.00 9.51 2.07 -1.75 -3.30 116.25 124.22 3jro h VAL 389 Ca -0.29 -2.45 -0.07 0.00 0.82 0.00 0.00 66.70 64.71 3jro h VAL 389 Cb 1.59 2.36 -0.01 0.00 -1.52 0.00 0.00 31.29 33.71 3jro h VAL 389 CO 0.02 0.72 -0.34 0.74 0.02 0.00 0.00 177.57 178.72 3jro h THR 390 N 0.17 0.76 0.00 2.57 2.02 -1.82 -1.83 112.91 114.78 3jro h THR 390 Ca -0.05 -1.50 0.00 0.00 0.77 0.00 0.00 66.41 65.63 3jro h THR 390 Cb 1.46 1.96 0.00 0.00 -1.74 0.00 0.00 68.15 69.83 3jro h THR 390 CO 0.14 0.34 0.00 1.41 0.37 0.00 0.00 175.52 177.77 3jro n HIS 391 N -3.43 0.02 0.73 3.16 -0.00 -1.24 -1.30 115.22 113.17 3jro n HIS 391 Ca 0.00 0.01 0.08 0.00 -0.00 0.00 0.00 57.72 57.81 3jro n HIS 391 Cb 0.52 -0.52 -0.09 0.00 -0.00 0.00 0.00 29.99 29.90 3jro n HIS 391 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 3jro n LEU 392 N -1.52 0.73 0.18 2.41 4.77 -0.70 -3.87 117.00 119.00 3jro n LEU 392 Ca 0.02 -0.48 0.06 0.00 -0.03 0.00 0.00 56.01 55.58 3jro n LEU 392 Cb 0.11 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.43 3jro n LEU 392 CO 0.09 0.18 0.63 0.00 -1.33 0.00 0.00 177.39 176.96 3jro h ALA 393 N 2.28 0.86 0.00 -1.18 0.00 -1.06 -2.89 119.26 117.27 3jro h ALA 393 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3jro h ALA 393 Cb 0.40 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3jro h ALA 393 CO 0.00 0.47 -0.12 0.44 0.00 0.00 0.00 179.25 180.04 3jro n ILE 394 N -3.34 0.22 0.09 0.00 -5.35 -1.20 -2.88 119.36 106.91 3jro n ILE 394 Ca 0.01 -0.11 -0.13 0.00 -0.27 0.00 0.00 62.75 62.25 3jro n ILE 394 Cb 0.59 -0.40 -0.08 0.00 -1.74 0.00 0.00 39.64 38.00 3jro n ILE 394 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3jro n LEU 396 N -5.08 0.00 -0.04 0.00 4.77 -1.14 -2.03 117.00 113.47 3jro n LEU 396 Ca -0.09 0.17 0.01 0.00 -0.03 0.00 0.00 56.01 56.07 3jro n LEU 396 Cb 0.18 -0.17 -0.15 0.00 -2.33 0.00 0.00 43.42 40.94 3jro n LEU 396 CO 0.33 -0.09 -0.88 0.47 -1.33 0.00 0.00 177.39 175.89 3jro n ASP 397 N -1.17 0.10 -0.02 -1.43 8.00 -1.04 -3.92 116.55 117.07 3jro n ASP 397 Ca 0.09 0.04 0.07 0.00 0.71 0.00 0.00 54.79 55.70 3jro n ASP 397 Cb 0.09 1.35 -0.15 0.00 -0.02 0.00 0.00 41.12 42.39 3jro n ASP 397 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3jro n ILE 398 N -2.55 0.18 -0.04 0.53 3.06 -0.98 -4.56 119.36 114.99 3jro n ILE 398 Ca -0.17 -0.50 -0.02 0.00 -2.50 0.00 0.00 62.75 59.55 3jro n ILE 398 Cb 0.86 -0.03 -0.01 0.00 0.54 0.00 0.00 39.64 41.00 3jro n ILE 398 CO 0.00 0.00 0.00 0.40 -2.50 0.00 0.00 176.55 174.45 3jro h ILE 399 N 0.00 0.00 -0.73 9.51 2.04 -1.61 -3.31 117.51 123.41 3jro h ILE 399 Ca -0.07 -0.71 0.10 0.00 1.00 0.00 0.00 64.86 65.18 3jro h ILE 399 Cb 1.09 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 37.05 3jro h ILE 399 CO 0.00 0.00 -0.47 0.78 0.00 0.00 0.00 178.15 178.46 3jro h ASN 400 N -0.71 -1.67 -0.87 1.72 -0.26 -1.81 0.47 115.58 112.45 3jro h ASN 400 Ca 0.00 0.28 0.00 0.00 -0.56 0.00 0.00 56.30 56.02 3jro h ASN 400 Cb 0.22 0.76 -0.04 0.00 -1.06 0.00 0.00 38.32 38.20 3jro h ASN 400 CO 0.00 -0.31 0.56 1.55 -1.06 0.00 0.00 177.43 178.17 3jro h PRO 401 N -0.15 1.16 0.35 0.81 0.13 -1.80 0.68 132.00 133.18 3jro h PRO 401 Ca 0.20 -0.08 -0.02 0.00 -0.87 0.00 0.00 66.00 65.23 3jro h PRO 401 Cb 0.54 -0.26 0.00 0.00 0.13 0.00 0.00 31.00 31.42 3jro h PRO 401 CO -0.79 0.78 -0.17 0.78 -0.23 0.00 0.00 178.00 178.37 3jro h GLY 402 N 1.19 -0.50 0.47 1.56 0.00 -0.36 -3.10 103.07 102.33 3jro h GLY 402 Ca 0.32 0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.81 3jro h GLY 402 CO -0.07 -0.18 -0.22 1.48 0.00 0.00 0.00 176.54 177.55 3jro h SER 403 N -0.76 -0.52 0.00 0.19 4.64 -0.45 -3.42 113.55 113.23 3jro h SER 403 Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 3jro h SER 403 Cb 0.51 0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 3jro h SER 403 CO 0.08 -0.10 -0.03 0.52 -0.87 0.00 0.00 176.83 176.43 3jro n VAL 404 N -5.19 0.00 -3.62 0.95 0.31 -1.12 -5.01 118.33 104.66 3jro n VAL 404 Ca -0.08 -0.31 -0.20 0.00 -0.01 0.00 0.00 64.34 63.74 3jro n VAL 404 Cb 0.25 0.96 0.05 0.00 -0.91 0.00 0.00 33.84 34.19 3jro n VAL 404 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 3jro n GLU 405 N -0.67 -5.31 -0.84 5.55 0.00 0.23 -4.91 120.64 114.70 3jro n GLU 405 Ca 0.00 0.68 -0.06 0.00 0.00 0.00 0.00 57.16 57.79 3jro n GLU 405 Cb 0.00 -5.36 0.21 0.00 0.00 0.00 0.00 31.44 26.28 3jro n GLU 405 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 3jro n GLU 406 N -4.22 2.04 -4.04 3.44 0.28 -1.19 -4.92 120.64 112.03 3jro n GLU 406 Ca -0.29 -3.13 -0.18 0.00 -0.16 0.00 0.00 57.16 53.39 3jro n GLU 406 Cb 0.67 -1.88 -0.16 0.00 1.43 0.00 0.00 31.44 31.50 3jro n GLU 406 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 3jro s VAL 407 N -3.21 0.35 0.40 3.84 1.01 -1.26 -5.04 120.40 116.49 3jro s VAL 407 Ca 0.46 -0.01 -0.24 0.00 0.00 0.00 0.00 61.98 62.19 3jro s VAL 407 Cb 0.41 -0.41 -0.12 0.00 0.00 0.00 0.00 36.38 36.27 3jro s VAL 407 CO 0.02 0.18 0.82 0.47 0.00 0.00 0.00 175.10 176.59 3jro n ASP 408 N 4.08 0.36 0.00 3.32 8.00 -1.26 -4.85 116.55 126.20 3jro n ASP 408 Ca -0.26 1.00 0.11 0.00 0.71 0.00 0.00 54.79 56.35 3jro n ASP 408 Cb 0.51 -1.24 0.52 0.00 -0.02 0.00 0.00 41.12 40.88 3jro n ASP 408 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3jro n LYS 409 N 0.38 0.11 -0.09 -1.24 5.02 -1.26 -2.21 118.16 118.87 3jro n LYS 409 Ca 0.11 0.10 -0.21 0.00 -2.02 0.00 0.00 58.31 56.28 3jro n LYS 409 Cb 0.38 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.77 3jro n LYS 409 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3jro h SER 410 N 0.00 0.04 -0.98 4.39 4.64 -1.98 -2.33 113.55 117.32 3jro h SER 410 Ca 0.00 -0.59 0.02 0.00 -0.47 0.00 0.00 61.79 60.75 3jro h SER 410 Cb 0.34 -0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 62.36 3jro h SER 410 CO 0.00 1.47 0.65 0.11 -0.87 0.00 0.00 176.83 178.19 3jro h LYS 411 N -0.91 1.26 0.00 4.77 1.79 -1.93 -1.85 116.57 119.70 3jro h LYS 411 Ca -0.32 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.07 3jro h LYS 411 Cb 1.34 -0.28 0.00 0.00 -1.58 0.00 0.00 32.23 31.71 3jro h LYS 411 CO -0.16 0.83 0.00 1.28 -1.08 0.00 0.00 179.45 180.32 3jro n LEU 412 N -4.42 0.03 -0.32 2.94 4.77 -0.94 -3.49 117.00 115.58 3jro n LEU 412 Ca 0.12 0.87 0.12 0.00 -0.03 0.00 0.00 56.01 57.10 3jro n LEU 412 Cb 0.04 -0.47 0.26 0.00 -2.33 0.00 0.00 43.42 40.92 3jro n LEU 412 CO 0.36 -0.47 0.83 0.40 -1.33 0.00 0.00 177.39 177.17 3jro h ILE 413 N 0.00 0.14 -0.50 -0.08 2.04 -1.27 0.55 117.51 118.39 3jro h ILE 413 Ca 0.00 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 3jro h ILE 413 Cb 0.00 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.13 3jro h ILE 413 CO 0.00 0.01 0.25 0.71 0.00 0.00 0.00 178.15 179.13 3jro h THR 414 N 0.06 1.18 0.00 -0.27 1.35 -1.49 -2.18 112.91 111.57 3jro h THR 414 Ca 0.55 -0.50 0.00 0.00 -0.55 0.00 0.00 66.41 65.90 3jro h THR 414 Cb 1.09 0.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 3jro h THR 414 CO -0.82 0.20 0.00 0.35 -0.25 0.00 0.00 175.52 175.00 3jro n THR 415 N -4.63 0.03 0.00 6.82 -2.24 0.14 -1.44 114.28 112.98 3jro n THR 415 Ca 0.02 0.01 -0.20 0.00 -2.27 0.00 0.00 64.05 61.61 3jro n THR 415 Cb 0.10 -0.56 -0.14 0.00 -2.10 0.00 0.00 70.33 67.63 3jro n THR 415 CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 3jro h TYR 416 N 0.00 0.39 0.34 4.78 0.05 -0.92 -3.32 116.97 118.29 3jro h TYR 416 Ca 0.00 -0.29 -0.02 0.00 0.05 0.00 0.00 58.73 58.48 3jro h TYR 416 Cb 0.07 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 37.80 3jro h TYR 416 CO 0.00 1.41 -0.16 0.82 -1.05 0.00 0.00 178.16 179.17 3jro h ILE 417 N -0.46 0.00 -1.05 -2.88 2.04 -1.02 -2.49 117.51 111.64 3jro h ILE 417 Ca -0.22 -0.06 0.27 0.00 1.00 0.00 0.00 64.86 65.85 3jro h ILE 417 Cb 1.60 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 37.59 3jro h ILE 417 CO 0.06 0.00 0.68 0.77 0.00 0.00 0.00 178.15 179.66 3jro h SER 418 N -0.52 0.42 0.61 1.72 4.64 -1.47 -0.39 113.55 118.56 3jro h SER 418 Ca -0.05 0.08 -0.03 0.00 -0.47 0.00 0.00 61.79 61.32 3jro h SER 418 Cb 0.35 0.01 0.01 0.00 -0.31 0.00 0.00 62.40 62.46 3jro h SER 418 CO 0.08 0.07 -0.30 -0.07 -0.87 0.00 0.00 176.83 175.75 3jro h LEU 419 N 0.37 -0.70 0.00 5.97 3.38 -1.65 -1.77 115.31 120.91 3jro h LEU 419 Ca 0.60 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.59 3jro h LEU 419 Cb 1.56 0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.49 3jro h LEU 419 CO -0.29 -0.43 0.01 -0.11 0.09 0.00 0.00 178.44 177.71 3jro n LEU 420 N -4.59 0.00 -0.05 1.67 7.94 -0.69 -2.37 117.00 118.91 3jro n LEU 420 Ca -0.10 0.43 -0.01 0.00 -1.11 0.00 0.00 56.01 55.22 3jro n LEU 420 Cb 0.33 -0.43 -0.00 0.00 0.53 0.00 0.00 43.42 43.85 3jro n LEU 420 CO 0.25 -0.43 -0.06 0.11 -1.11 0.00 0.00 177.39 176.16 3jro h LYS 421 N 0.00 0.00 -3.25 1.96 1.57 -0.72 -3.42 116.57 112.72 3jro h LYS 421 Ca 0.00 0.00 -0.78 0.00 -1.87 0.00 0.00 60.65 58.00 3jro h LYS 421 Cb 0.03 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 32.13 3jro h LYS 421 CO 0.00 0.00 1.50 1.28 -0.57 0.00 0.00 179.45 181.66 3jro n LEU 422 N -4.47 6.57 -4.60 2.94 4.77 -0.70 -4.97 117.00 116.53 3jro n LEU 422 Ca -0.01 -4.89 -0.24 0.00 -0.03 0.00 0.00 56.01 50.84 3jro n LEU 422 Cb 0.04 -1.39 -0.08 0.00 -2.33 0.00 0.00 43.42 39.66 3jro n LEU 422 CO 0.02 1.52 -0.37 -1.10 -1.33 0.00 0.00 177.39 176.13 3jro s GLN 423 N -0.98 2.15 0.00 3.23 -1.52 -1.26 -4.97 119.66 116.31 3jro s GLN 423 Ca 0.36 -1.43 0.00 0.00 -1.95 0.00 0.00 55.36 52.34 3jro s GLN 423 Cb 0.08 -2.11 0.00 0.00 -0.22 0.00 0.00 33.01 30.76 3jro s GLN 423 CO 0.05 0.38 0.12 0.41 -0.25 0.00 0.00 175.29 176.00