#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kez n THR 36 N 0.00 0.00 0.00 2.62 -2.24 -1.26 -5.11 114.28 108.29 3kez n THR 36 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3kez n THR 36 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 3kez n THR 36 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3kez n SER 37 N 0.00 1.58 -4.22 3.42 3.41 -1.26 -4.97 113.62 111.59 3kez n SER 37 Ca 0.00 -0.15 -0.41 0.00 -0.26 0.00 0.00 58.87 58.05 3kez n SER 37 Cb 0.00 0.61 -0.04 0.00 -0.26 0.00 0.00 64.21 64.51 3kez n SER 37 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3kez s ILE 38 N -0.92 4.94 -0.16 -1.33 -1.09 -1.26 -4.80 121.20 116.57 3kez s ILE 38 Ca 0.00 -3.24 0.17 0.00 -2.23 0.00 0.00 60.65 55.35 3kez s ILE 38 Cb 0.00 -4.06 -0.24 0.00 -1.58 0.00 0.00 42.46 36.59 3kez s ILE 38 CO 0.00 -1.06 0.11 0.59 -1.23 0.00 0.00 174.94 173.36 3kez n ASN 39 N 3.05 0.47 -4.21 3.58 5.03 -1.26 -5.02 115.26 116.91 3kez n ASN 39 Ca 0.17 0.00 -0.12 0.00 0.87 0.00 0.00 54.58 55.50 3kez n ASN 39 Cb 0.40 1.07 -0.10 0.00 -1.02 0.00 0.00 39.78 40.14 3kez n ASN 39 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 3kez s VAL 40 N -2.56 0.19 0.56 2.41 -7.23 -1.26 -4.98 120.40 107.53 3kez s VAL 40 Ca -0.09 -1.97 0.28 0.00 -1.81 0.00 0.00 61.98 58.39 3kez s VAL 40 Cb 0.06 -2.35 0.34 0.00 0.56 0.00 0.00 36.38 34.99 3kez s VAL 40 CO 0.76 -0.18 2.22 -0.07 -0.31 0.00 0.00 175.10 177.52 3kez h LEU 41 N 2.66 0.00 -1.37 1.32 3.38 -1.95 -1.06 115.31 118.28 3kez h LEU 41 Ca -0.36 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.57 3kez h LEU 41 Cb 1.23 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.96 3kez h LEU 41 CO 0.57 0.02 -0.01 0.77 0.09 0.00 0.00 178.44 179.88 3kez h SER 42 N 0.00 0.37 0.47 -0.43 4.64 -1.99 -2.05 113.55 114.56 3kez h SER 42 Ca -0.00 -0.06 -0.07 0.00 -0.47 0.00 0.00 61.79 61.19 3kez h SER 42 Cb 0.04 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.03 3kez h SER 42 CO 0.00 0.44 -0.32 0.44 -0.87 0.00 0.00 176.83 176.52 3kez h ASP 43 N 0.39 0.00 -0.02 4.97 3.32 -1.51 -0.65 116.42 122.91 3kez h ASP 43 Ca 0.09 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.92 3kez h ASP 43 Cb 0.27 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.83 3kez h ASP 43 CO 0.01 0.32 -0.80 0.40 -1.72 0.00 0.00 179.24 177.45 3kez h ILE 44 N 0.00 1.30 -0.53 0.35 1.08 -1.41 -1.85 117.51 116.46 3kez h ILE 44 Ca -0.00 -2.05 -0.08 0.00 -0.39 0.00 0.00 64.86 62.34 3kez h ILE 44 Cb 0.64 2.06 -0.02 0.00 -3.07 0.00 0.00 36.82 36.44 3kez h ILE 44 CO 0.04 0.64 0.03 -0.08 -0.69 0.00 0.00 178.15 178.10 3kez h GLU 45 N 0.46 0.91 -0.60 2.37 4.81 -0.85 -0.22 114.58 121.46 3kez h GLU 45 Ca -0.06 -0.27 0.03 0.00 -0.13 0.00 0.00 59.36 58.93 3kez h GLU 45 Cb 1.42 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 30.67 3kez h GLU 45 CO 0.16 0.91 0.36 0.35 -0.73 0.00 0.00 179.01 180.06 3kez h PHE 46 N 0.78 0.67 -0.76 0.92 3.57 -1.14 -0.72 116.94 120.26 3kez h PHE 46 Ca 0.15 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.63 3kez h PHE 46 Cb 0.48 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.97 3kez h PHE 46 CO 0.04 0.38 0.29 1.15 -2.23 0.00 0.00 178.31 177.93 3kez h THR 47 N 0.71 1.26 -0.33 4.41 2.02 -0.85 -1.77 112.91 118.36 3kez h THR 47 Ca 0.24 -0.83 -0.04 0.00 0.77 0.00 0.00 66.41 66.55 3kez h THR 47 Cb 0.03 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 3kez h THR 47 CO -0.11 0.33 0.04 -0.07 0.37 0.00 0.00 175.52 176.09 3kez h LEU 48 N 1.11 0.53 -1.00 2.58 3.38 -0.71 -1.22 115.31 119.97 3kez h LEU 48 Ca 0.25 -0.27 0.09 0.00 0.09 0.00 0.00 57.88 58.04 3kez h LEU 48 Cb 0.23 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.77 3kez h LEU 48 CO -0.02 0.66 0.64 0.78 0.09 0.00 0.00 178.44 180.60 3kez h ASN 49 N 0.37 0.99 -0.73 -0.43 2.35 -0.88 0.20 115.58 117.45 3kez h ASN 49 Ca 0.10 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.84 3kez h ASN 49 Cb 0.36 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.52 3kez h ASN 49 CO 0.01 0.59 0.33 1.23 -1.65 0.00 0.00 177.43 177.94 3kez h GLY 50 N 1.10 1.15 0.90 2.83 0.00 -0.96 -0.79 103.07 107.30 3kez h GLY 50 Ca 0.46 -0.60 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 3kez h GLY 50 CO -0.21 0.57 0.06 -2.22 0.00 0.00 0.00 176.54 174.74 3kez h ILE 51 N 1.04 1.13 -0.85 2.60 2.04 0.07 -1.82 117.51 121.72 3kez h ILE 51 Ca 0.25 -0.37 0.03 0.00 1.00 0.00 0.00 64.86 65.77 3kez h ILE 51 Cb 0.16 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 37.32 3kez h ILE 51 CO -0.03 0.12 0.56 1.88 0.00 0.00 0.00 178.15 180.68 3kez h TYR 52 N 0.09 1.02 -0.69 1.37 0.05 -0.60 -2.35 116.97 115.87 3kez h TYR 52 Ca 0.05 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.83 3kez h TYR 52 Cb 0.13 -0.34 -0.03 0.00 1.01 0.00 0.00 36.73 37.49 3kez h TYR 52 CO -0.03 0.60 0.35 0.77 -1.05 0.00 0.00 178.16 178.81 3kez h SER 53 N 1.07 0.89 0.00 3.88 0.02 -0.87 -2.04 113.55 116.50 3kez h SER 53 Ca 0.33 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 3kez h SER 53 Cb 0.00 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.31 3kez h SER 53 CO -0.09 0.75 0.00 0.41 -1.14 0.00 0.00 176.83 176.76 3kez n THR 54 N -4.47 0.13 0.00 -2.27 -1.04 -0.71 -3.54 114.28 102.38 3kez n THR 54 Ca 0.06 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 3kez n THR 54 Cb 0.11 -0.57 0.00 0.00 -1.82 0.00 0.00 70.33 68.05 3kez n THR 54 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3kez n GLN 56 N 0.96 0.00 -1.71 -2.82 6.02 -0.77 -4.68 117.38 114.38 3kez n GLN 56 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.60 3kez n GLN 56 Cb 0.06 0.00 0.03 0.00 1.02 0.00 0.00 30.24 31.35 3kez n GLN 56 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3kez n SER 57 N 0.00 2.45 0.28 1.08 2.88 -1.23 -4.15 113.62 114.94 3kez n SER 57 Ca 0.00 1.01 0.15 0.00 -1.33 0.00 0.00 58.87 58.70 3kez n SER 57 Cb 0.00 -1.53 0.89 0.00 -0.75 0.00 0.00 64.21 62.82 3kez n SER 57 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 3kez h SER 58 N 1.60 0.00 0.83 -3.46 4.64 -1.84 -0.02 113.55 115.30 3kez h SER 58 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3kez h SER 58 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 3kez h SER 58 CO 0.58 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 177.01 3kez n ASP 59 N -3.88 0.21 0.00 4.97 8.00 -1.26 -1.29 116.55 123.30 3kez n ASP 59 Ca -0.02 0.53 0.00 0.00 0.71 0.00 0.00 54.79 56.01 3kez n ASP 59 Cb 0.11 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 40.63 3kez n ASP 59 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kez n ALA 60 N -1.58 0.00 1.61 2.24 0.00 -0.11 -4.36 120.51 118.31 3kez n ALA 60 Ca 0.05 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.63 3kez n ALA 60 Cb 0.27 0.00 0.62 0.00 0.00 0.00 0.00 19.45 20.34 3kez n ALA 60 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3kez n TYR 61 N 0.00 0.00 1.35 0.00 4.01 -1.17 -1.46 117.16 119.90 3kez n TYR 61 Ca 0.00 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.87 3kez n TYR 61 Cb 0.00 -0.00 0.45 0.00 -0.31 0.00 0.00 39.34 39.48 3kez n TYR 61 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 3kez n SER 62 N -0.11 1.66 0.00 7.72 7.64 -0.64 -4.74 113.62 125.15 3kez n SER 62 Ca 0.20 -1.60 0.00 0.00 1.01 0.00 0.00 58.87 58.48 3kez n SER 62 Cb 0.30 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 3kez n SER 62 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3kez n GLY 63 N 1.17 -0.82 0.36 0.23 0.00 -0.93 -4.37 105.19 100.84 3kez n GLY 63 Ca 0.18 0.48 0.01 0.00 0.00 0.00 0.00 46.02 46.68 3kez n GLY 63 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3kez h ARG 64 N 0.00 1.05 0.00 1.61 3.08 -1.06 0.58 114.38 119.64 3kez h ARG 64 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3kez h ARG 64 Cb 0.00 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 29.81 3kez h ARG 64 CO 0.00 0.69 0.00 -0.07 -1.07 0.00 0.00 179.97 179.52 3kez h LEU 65 N 1.08 0.00 0.00 3.04 3.38 -1.45 -3.06 115.31 118.30 3kez h LEU 65 Ca 0.31 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.14 3kez h LEU 65 Cb -0.08 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3kez h LEU 65 CO -0.07 0.00 -0.95 0.58 0.09 0.00 0.00 178.44 178.09 3kez h VAL 66 N 0.00 0.59 0.00 1.22 2.07 -1.07 -3.41 116.25 115.64 3kez h VAL 66 Ca 0.00 -1.74 -0.01 0.00 0.82 0.00 0.00 66.70 65.77 3kez h VAL 66 Cb 0.49 1.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.66 3kez h VAL 66 CO 0.00 0.20 -0.03 0.10 0.02 0.00 0.00 177.57 177.86 3kez h TYR 67 N -1.00 0.00 -0.59 1.57 -0.00 -1.44 -3.22 116.97 112.28 3kez h TYR 67 Ca -0.21 0.00 0.08 0.00 0.00 0.00 0.00 58.73 58.60 3kez h TYR 67 Cb 0.99 0.00 -0.10 0.00 0.00 0.00 0.00 36.73 37.62 3kez h TYR 67 CO -0.01 0.03 -0.47 -0.92 -0.00 0.00 0.00 178.16 176.78 3kez h TYR 68 N 0.00 -1.42 0.00 0.10 3.20 -1.77 -0.45 116.97 116.63 3kez h TYR 68 Ca -0.00 0.09 0.00 0.00 3.14 0.00 0.00 58.73 61.96 3kez h TYR 68 Cb 0.54 0.70 0.00 0.00 1.54 0.00 0.00 36.73 39.52 3kez h TYR 68 CO 0.00 -0.43 0.00 0.78 -1.64 0.00 0.00 178.16 176.87 3kez h GLY 69 N -0.24 0.00 0.00 1.82 0.00 -1.72 -2.51 103.07 100.43 3kez h GLY 69 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.41 3kez h GLY 69 CO -0.70 0.00 -0.58 -0.55 0.00 0.00 0.00 176.54 174.71 3kez h ASP 70 N 0.00 0.00 1.24 0.19 3.32 -1.31 -3.09 116.42 116.76 3kez h ASP 70 Ca 0.00 -0.39 0.00 0.00 0.02 0.00 0.00 57.03 56.66 3kez h ASP 70 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 3kez h ASP 70 CO 0.00 1.02 0.00 1.33 -1.72 0.00 0.00 179.24 179.87 3kez n VAL 71 N -4.58 0.61 1.25 -1.35 0.24 -0.67 -1.46 118.33 112.36 3kez n VAL 71 Ca -0.15 -0.13 0.11 0.00 -2.04 0.00 0.00 64.34 62.13 3kez n VAL 71 Cb 0.41 -0.73 0.39 0.00 -1.47 0.00 0.00 33.84 32.44 3kez n VAL 71 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3kez n THR 72 N -2.18 0.20 -1.63 3.34 -2.24 -0.95 -3.96 114.28 106.85 3kez n THR 72 Ca 0.05 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 3kez n THR 72 Cb 0.37 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 3kez n THR 72 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kez n GLY 73 N 1.13 2.88 0.10 3.38 0.00 -0.54 -5.01 105.19 107.13 3kez n GLY 73 Ca 0.16 -1.94 0.05 0.00 0.00 0.00 0.00 46.02 44.29 3kez n GLY 73 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3kez n ASP 74 N 0.00 0.81 -1.47 1.61 5.75 -1.26 -4.91 116.55 117.08 3kez n ASP 74 Ca 0.00 -0.90 0.08 0.00 -0.01 0.00 0.00 54.79 53.96 3kez n ASP 74 Cb 0.00 0.78 0.34 0.00 -1.03 0.00 0.00 41.12 41.21 3kez n ASP 74 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3kez n ASP 75 N -0.83 4.81 0.00 -1.12 8.00 -1.26 -4.61 116.55 121.53 3kez n ASP 75 Ca 0.03 -2.74 0.00 0.00 0.71 0.00 0.00 54.79 52.79 3kez n ASP 75 Cb 0.19 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.70 3kez n ASP 75 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kez n GLN 77 N 0.49 0.00 -1.87 -1.24 10.64 0.04 -1.58 117.38 123.87 3kez n GLN 77 Ca 0.25 0.00 -0.41 0.00 -1.83 0.00 0.00 57.00 55.00 3kez n GLN 77 Cb 0.98 0.00 -0.02 0.00 -0.86 0.00 0.00 30.24 30.34 3kez n GLN 77 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3kez s ALA 78 N -2.00 3.67 0.32 2.61 0.00 -1.26 -1.47 121.76 123.62 3kez s ALA 78 Ca 0.00 1.49 0.03 0.00 0.00 0.00 0.00 51.96 53.47 3kez s ALA 78 Cb 0.00 -3.61 0.54 0.00 0.00 0.00 0.00 23.12 20.05 3kez s ALA 78 CO 0.00 -0.91 1.86 0.28 0.00 0.00 0.00 175.76 176.99 3kez h VAL 79 N 3.33 1.21 -3.65 0.00 2.07 -1.49 -3.46 116.25 114.26 3kez h VAL 79 Ca -0.48 -0.79 -0.07 0.00 0.82 0.00 0.00 66.70 66.19 3kez h VAL 79 Cb 1.22 0.86 -0.09 0.00 -1.52 0.00 0.00 31.29 31.76 3kez h VAL 79 CO 0.75 0.28 -0.10 -0.94 0.02 0.00 0.00 177.57 177.58 3kez s SER 80 N -6.69 -0.02 0.47 0.57 1.04 -1.26 -4.94 113.70 102.88 3kez s SER 80 Ca -0.08 -0.97 0.18 0.00 0.48 0.00 0.00 55.95 55.55 3kez s SER 80 Cb 0.15 0.61 1.12 0.00 0.10 0.00 0.00 66.02 68.01 3kez s SER 80 CO 0.78 -1.18 2.02 0.28 0.98 0.00 0.00 173.24 176.11 3kez h SER 81 N 2.23 0.00 -0.05 7.02 0.02 -1.92 -2.75 113.55 118.10 3kez h SER 81 Ca -0.26 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 3kez h SER 81 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 3kez h SER 81 CO 0.35 0.17 0.00 0.35 -1.14 0.00 0.00 176.83 176.56 3kez n THR 82 N -4.15 0.05 -1.19 -2.27 -2.24 -1.26 -4.34 114.28 98.87 3kez n THR 82 Ca -0.02 -0.28 -0.31 0.00 -2.27 0.00 0.00 64.05 61.16 3kez n THR 82 Cb 0.24 0.50 0.10 0.00 -2.10 0.00 0.00 70.33 69.07 3kez n THR 82 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3kez s LYS 83 N -1.95 2.01 0.36 -0.78 -0.14 -1.04 -4.89 119.74 113.31 3kez s LYS 83 Ca 0.37 1.33 0.13 0.00 -1.36 0.00 0.00 55.97 56.44 3kez s LYS 83 Cb 0.20 -1.86 0.97 0.00 -1.68 0.00 0.00 37.83 35.46 3kez s LYS 83 CO 0.32 -1.85 1.77 0.00 -0.76 0.00 0.00 175.35 174.83 3kez h ARG 84 N -1.11 0.51 -0.01 1.68 -0.00 -1.90 -0.77 114.38 112.78 3kez h ARG 84 Ca -0.44 -0.03 0.00 0.00 -0.50 0.00 0.00 59.98 59.01 3kez h ARG 84 Cb 1.25 -0.12 0.00 0.00 0.00 0.00 0.00 29.97 31.10 3kez h ARG 84 CO 0.49 0.34 -0.12 0.25 0.00 0.00 0.00 179.97 180.93 3kez n THR 85 N -4.71 0.00 -0.08 2.04 -2.24 -1.26 -4.43 114.28 103.60 3kez n THR 85 Ca 0.25 -0.14 -0.11 0.00 -2.27 0.00 0.00 64.05 61.78 3kez n THR 85 Cb 0.76 0.23 -0.04 0.00 -2.10 0.00 0.00 70.33 69.18 3kez n THR 85 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3kez h GLY 86 N 4.92 0.43 2.00 3.38 0.00 -1.35 -0.79 103.07 111.66 3kez h GLY 86 Ca 0.00 -0.26 -0.05 0.00 0.00 0.00 0.00 47.33 47.02 3kez h GLY 86 CO 0.00 0.24 -0.24 3.43 0.00 0.00 0.00 176.54 179.98 3kez h ASN 87 N 0.24 0.00 0.13 0.19 2.35 -1.76 -0.69 115.58 116.05 3kez h ASN 87 Ca 0.08 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 3kez h ASN 87 Cb 0.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.62 3kez h ASN 87 CO -0.00 0.24 -0.06 1.88 -1.65 0.00 0.00 177.43 177.83 3kez h TYR 88 N 0.00 -0.16 -0.61 1.19 -1.99 -1.71 0.17 116.97 113.86 3kez h TYR 88 Ca -0.00 -0.00 0.12 0.00 2.00 0.00 0.00 58.73 60.84 3kez h TYR 88 Cb 0.47 0.05 -0.09 0.00 2.00 0.00 0.00 36.73 39.17 3kez h TYR 88 CO 0.00 0.32 0.14 -0.92 -0.00 0.00 0.00 178.16 177.70 3kez h TYR 89 N -0.83 0.22 -0.00 4.88 3.20 -1.06 -2.13 116.97 121.25 3kez h TYR 89 Ca -0.02 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3kez h TYR 89 Cb 0.55 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.81 3kez h TYR 89 CO 0.10 -0.03 -0.01 0.54 -1.64 0.00 0.00 178.16 177.12 3kez n ARG 90 N -5.12 1.07 -3.94 1.82 1.74 -0.27 -4.85 116.66 107.11 3kez n ARG 90 Ca 0.09 -0.21 -0.28 0.00 -0.77 0.00 0.00 57.85 56.68 3kez n ARG 90 Cb 0.33 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.26 3kez n ARG 90 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3kez n PHE 91 N -0.78 -1.65 0.15 -1.55 3.72 -0.80 -4.76 117.46 111.79 3kez n PHE 91 Ca 0.22 0.66 0.12 0.00 -0.05 0.00 0.00 57.45 58.39 3kez n PHE 91 Cb 0.18 -3.60 0.26 0.00 -0.94 0.00 0.00 39.48 35.38 3kez n PHE 91 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3kez n ASN 92 N -2.89 3.52 -4.88 4.37 5.15 -0.00 -4.97 115.26 115.55 3kez n ASN 92 Ca -0.27 -1.99 -0.30 0.00 -0.60 0.00 0.00 54.58 51.42 3kez n ASN 92 Cb 0.67 -0.32 -0.04 0.00 -0.53 0.00 0.00 39.78 39.55 3kez n ASN 92 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 3kez s PHE 93 N -1.35 3.45 0.40 1.20 0.08 -1.26 -5.04 117.98 115.45 3kez s PHE 93 Ca 0.42 0.89 0.04 0.00 0.12 0.00 0.00 56.93 58.40 3kez s PHE 93 Cb 0.23 -2.30 -0.06 0.00 -0.57 0.00 0.00 43.02 40.33 3kez s PHE 93 CO 0.32 0.08 0.04 0.95 -0.10 0.00 0.00 175.22 176.51 3kez s THR 94 N -2.12 1.41 0.54 0.64 -4.23 -1.26 -4.94 115.64 105.67 3kez s THR 94 Ca 0.48 -2.00 0.41 0.00 -1.18 0.00 0.00 61.69 59.40 3kez s THR 94 Cb -0.11 -2.71 0.42 0.00 1.34 0.00 0.00 72.50 71.45 3kez s THR 94 CO 0.27 0.00 2.28 0.07 -0.54 0.00 0.00 174.62 176.70 3kez h LYS 95 N 1.82 0.00 0.13 3.99 2.10 -1.93 -1.08 116.57 121.60 3kez h LYS 95 Ca -0.42 0.00 -0.34 0.00 -2.00 0.00 0.00 60.65 57.89 3kez h LYS 95 Cb 1.26 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.58 3kez h LYS 95 CO 0.73 0.01 -1.79 -0.44 -2.00 0.00 0.00 179.45 175.96 3kez h ASP 96 N 0.00 0.43 -0.27 7.07 3.32 -1.94 -3.34 116.42 121.70 3kez h ASP 96 Ca -0.00 -0.76 0.00 0.00 0.02 0.00 0.00 57.03 56.29 3kez h ASP 96 Cb 0.11 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.52 3kez h ASP 96 CO 0.00 1.66 0.00 -0.46 -1.72 0.00 0.00 179.24 178.72 3kez n ASN 97 N -3.47 2.70 -4.72 6.45 0.23 -1.12 -4.82 115.26 110.51 3kez n ASN 97 Ca -0.25 -1.85 -0.35 0.00 -0.53 0.00 0.00 54.58 51.60 3kez n ASN 97 Cb 1.06 -0.18 0.09 0.00 -2.08 0.00 0.00 39.78 38.67 3kez n ASN 97 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 3kez s GLY 98 N -1.00 2.49 0.58 4.83 0.00 -0.43 -4.80 107.32 109.00 3kez s GLY 98 Ca 0.22 1.00 -0.18 0.00 0.00 0.00 0.00 44.72 45.76 3kez s GLY 98 CO 0.16 1.42 1.11 2.56 0.00 0.00 0.00 173.10 178.35 3kez s PRO 99 N -3.77 3.21 -0.00 2.90 0.04 -1.26 -4.77 135.00 131.34 3kez s PRO 99 Ca 0.77 1.50 0.08 0.00 0.04 0.00 0.00 61.00 63.39 3kez s PRO 99 Cb -0.32 -2.00 -0.10 0.00 0.04 0.00 0.00 34.50 32.12 3kez s PRO 99 CO 0.45 -0.95 0.32 -1.13 0.04 0.00 0.00 177.00 175.73 3kez n SER 100 N -1.68 0.95 -0.23 6.66 3.41 -1.26 -4.61 113.62 116.87 3kez n SER 100 Ca 0.11 -0.55 -0.07 0.00 -0.26 0.00 0.00 58.87 58.10 3kez n SER 100 Cb 0.51 1.08 0.07 0.00 -0.26 0.00 0.00 64.21 65.62 3kez n SER 100 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3kez h SER 101 N 0.00 1.03 -0.20 4.04 4.64 -1.93 0.09 113.55 121.23 3kez h SER 101 Ca 0.00 -0.23 0.01 0.00 -0.47 0.00 0.00 61.79 61.10 3kez h SER 101 Cb 0.24 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.04 3kez h SER 101 CO 0.00 1.01 0.09 0.45 -0.87 0.00 0.00 176.83 177.51 3kez h HIS 102 N 1.02 0.17 0.04 4.77 3.86 -1.85 0.13 115.15 123.28 3kez h HIS 102 Ca 0.21 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.42 3kez h HIS 102 Cb 0.41 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.83 3kez h HIS 102 CO 0.03 0.09 -0.02 2.35 0.86 0.00 0.00 177.93 181.24 3kez h TRP 103 N 0.20 -0.05 -0.27 2.45 2.91 -1.82 -2.57 115.95 116.80 3kez h TRP 103 Ca 0.08 -0.00 -0.11 0.00 1.13 0.00 0.00 58.89 59.99 3kez h TRP 103 Cb 0.03 0.02 -0.00 0.00 -0.51 0.00 0.00 29.16 28.69 3kez h TRP 103 CO -0.10 0.08 -0.28 0.77 -1.03 0.00 0.00 178.44 177.89 3kez h SER 104 N -0.17 0.70 -0.08 2.65 0.02 -0.76 -1.73 113.55 114.19 3kez h SER 104 Ca -0.01 -0.48 -0.03 0.00 -0.84 0.00 0.00 61.79 60.44 3kez h SER 104 Cb 0.15 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.49 3kez h SER 104 CO 0.01 1.04 -0.07 1.88 -1.14 0.00 0.00 176.83 178.54 3kez h TYR 105 N 0.38 0.23 -0.84 3.45 -1.99 -0.81 -0.92 116.97 116.47 3kez h TYR 105 Ca 0.04 -0.07 -0.02 0.00 2.00 0.00 0.00 58.73 60.69 3kez h TYR 105 Cb 0.84 -0.05 -0.04 0.00 2.00 0.00 0.00 36.73 39.48 3kez h TYR 105 CO 0.07 0.62 0.47 -0.07 -0.00 0.00 0.00 178.16 179.25 3kez h LEU 106 N -0.23 1.05 -0.69 3.88 3.38 -1.47 -1.12 115.31 120.12 3kez h LEU 106 Ca 0.01 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.75 3kez h LEU 106 Cb 0.57 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3kez h LEU 106 CO 0.02 0.84 -0.46 1.88 0.09 0.00 0.00 178.44 180.81 3kez h TYR 107 N 1.17 0.56 -0.52 1.13 0.05 -1.27 -1.41 116.97 116.68 3kez h TYR 107 Ca 0.30 -0.17 0.00 0.00 0.05 0.00 0.00 58.73 58.90 3kez h TYR 107 Cb 0.02 -0.12 -0.03 0.00 1.01 0.00 0.00 36.73 37.62 3kez h TYR 107 CO 0.00 0.84 0.33 1.03 -1.05 0.00 0.00 178.16 179.32 3kez h SER 108 N 0.38 0.61 -0.56 3.88 0.87 -0.80 -1.54 113.55 116.39 3kez h SER 108 Ca 0.02 -0.04 0.03 0.00 -1.23 0.00 0.00 61.79 60.58 3kez h SER 108 Cb 0.95 -0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 62.72 3kez h SER 108 CO 0.08 0.47 0.33 0.40 -0.53 0.00 0.00 176.83 177.58 3kez h ILE 109 N 0.70 1.04 -0.62 2.23 2.04 -1.04 -2.64 117.51 119.21 3kez h ILE 109 Ca 0.19 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 3kez h ILE 109 Cb -0.05 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.34 3kez h ILE 109 CO -0.04 0.12 0.36 0.40 0.00 0.00 0.00 178.15 178.99 3kez h ILE 110 N 0.64 1.19 -0.37 -0.67 2.04 -1.06 -0.81 117.51 118.48 3kez h ILE 110 Ca 0.23 -0.45 0.04 0.00 1.00 0.00 0.00 64.86 65.68 3kez h ILE 110 Cb 0.05 0.36 -0.04 0.00 -0.74 0.00 0.00 36.82 36.45 3kez h ILE 110 CO -0.11 0.20 0.14 1.56 0.00 0.00 0.00 178.15 179.94 3kez h GLN 111 N 0.84 0.29 -0.10 2.37 1.08 -1.05 0.31 115.11 118.86 3kez h GLN 111 Ca 0.22 -0.02 -0.12 0.00 -1.45 0.00 0.00 58.65 57.28 3kez h GLN 111 Cb 0.00 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.36 3kez h GLN 111 CO -0.04 0.19 -0.48 -0.91 -0.95 0.00 0.00 178.83 176.65 3kez h ASN 112 N 0.30 0.27 -0.69 1.46 2.35 -1.14 -0.25 115.58 117.89 3kez h ASN 112 Ca 0.17 -0.13 -0.05 0.00 -0.55 0.00 0.00 56.30 55.73 3kez h ASN 112 Cb 0.13 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.39 3kez h ASN 112 CO -0.16 0.71 0.22 0.00 -1.65 0.00 0.00 177.43 176.55 3kez h ASN 114 N 1.01 0.74 -0.80 0.00 2.35 0.09 0.08 115.58 119.03 3kez h ASN 114 Ca 0.22 -0.16 0.08 0.00 -0.55 0.00 0.00 56.30 55.89 3kez h ASN 114 Cb 0.29 -0.19 -0.07 0.00 0.05 0.00 0.00 38.32 38.41 3kez h ASN 114 CO -0.01 0.70 0.47 0.25 -1.65 0.00 0.00 177.43 177.19 3kez h LEU 115 N 0.73 0.70 -0.16 1.61 5.85 -0.95 -2.27 115.31 120.82 3kez h LEU 115 Ca 0.18 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 3kez h LEU 115 Cb 0.18 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 3kez h LEU 115 CO -0.02 0.43 -0.01 0.40 -0.34 0.00 0.00 178.44 178.91 3kez h ILE 116 N 0.83 1.26 0.00 4.05 2.04 -0.95 -3.19 117.51 121.55 3kez h ILE 116 Ca 0.37 -0.87 -0.06 0.00 1.00 0.00 0.00 64.86 65.30 3kez h ILE 116 Cb 0.27 1.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 3kez h ILE 116 CO -0.21 0.26 -0.06 0.18 0.00 0.00 0.00 178.15 178.31 3kez n LEU 117 N -4.73 3.83 0.00 1.44 4.77 -0.03 -1.00 117.00 121.27 3kez n LEU 117 Ca -0.05 -2.06 0.00 0.00 -0.03 0.00 0.00 56.01 53.87 3kez n LEU 117 Cb 0.22 -0.91 0.00 0.00 -2.33 0.00 0.00 43.42 40.40 3kez n LEU 117 CO 0.36 0.89 0.00 0.59 -1.33 0.00 0.00 177.39 177.91 3kez n ASN 119 N 2.09 0.00 -0.28 -1.43 3.02 -1.21 -4.65 115.26 112.82 3kez n ASN 119 Ca 0.14 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.70 3kez n ASN 119 Cb 0.50 0.00 0.21 0.00 -0.61 0.00 0.00 39.78 39.88 3kez n ASN 119 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 3kez h VAL 120 N 0.00 1.18 0.00 2.41 3.04 -1.35 -1.62 116.25 119.90 3kez h VAL 120 Ca 0.00 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 65.31 3kez h VAL 120 Cb 0.00 -0.02 0.00 0.00 -2.01 0.00 0.00 31.29 29.26 3kez h VAL 120 CO 0.00 0.20 0.00 0.47 -1.01 0.00 0.00 177.57 177.23 3kez n ASP 121 N -4.43 0.13 0.05 3.17 8.00 -1.26 -2.98 116.55 119.23 3kez n ASP 121 Ca 0.10 0.51 0.12 0.00 0.71 0.00 0.00 54.79 56.23 3kez n ASP 121 Cb 0.07 -0.55 0.07 0.00 -0.02 0.00 0.00 41.12 40.69 3kez n ASP 121 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3kez n LYS 122 N -1.62 0.35 -2.21 -1.24 5.02 -0.62 -4.91 118.16 112.93 3kez n LYS 122 Ca 0.07 0.04 -0.42 0.00 -2.02 0.00 0.00 58.31 55.98 3kez n LYS 122 Cb 0.34 -1.66 -0.03 0.00 -0.02 0.00 0.00 35.03 33.66 3kez n LYS 122 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3kez s LEU 123 N -4.29 4.35 0.07 -0.35 1.43 -1.14 -4.98 118.68 113.77 3kez s LEU 123 Ca 0.03 2.22 -0.31 0.00 -1.03 0.00 0.00 54.13 55.05 3kez s LEU 123 Cb 0.13 -3.58 -0.06 0.00 0.03 0.00 0.00 46.19 42.71 3kez s LEU 123 CO 0.77 -0.66 1.25 -0.55 0.23 0.00 0.00 176.35 177.40 3kez s SER 124 N 1.38 7.01 0.05 2.29 0.15 -1.26 -5.01 113.70 118.30 3kez s SER 124 Ca 0.64 2.09 0.02 0.00 0.70 0.00 0.00 55.95 59.39 3kez s SER 124 Cb -0.34 -2.58 -0.03 0.00 -1.71 0.00 0.00 66.02 61.36 3kez s SER 124 CO 0.29 -0.53 -0.07 0.27 1.20 0.00 0.00 173.24 174.40 3kez s ILE 125 N 1.17 0.50 0.59 6.45 -4.36 -1.26 -5.02 121.20 119.27 3kez s ILE 125 Ca 0.60 -1.17 -0.15 0.00 -0.26 0.00 0.00 60.65 59.67 3kez s ILE 125 Cb -0.31 -0.71 -0.04 0.00 1.25 0.00 0.00 42.46 42.65 3kez s ILE 125 CO 0.29 -0.46 1.04 -1.81 0.24 0.00 0.00 174.94 174.24 3kez s ASP 126 N -1.75 5.98 0.24 4.36 1.01 -1.26 -4.97 116.67 120.28 3kez s ASP 126 Ca -0.08 1.70 -0.05 0.00 0.71 0.00 0.00 52.55 54.83 3kez s ASP 126 Cb -0.08 -2.52 0.37 0.00 1.01 0.00 0.00 42.92 41.70 3kez s ASP 126 CO -0.01 -1.03 1.84 -0.08 0.21 0.00 0.00 175.17 176.10 3kez h GLU 127 N 0.36 0.88 0.00 8.23 4.57 -2.02 -0.18 114.58 126.42 3kez h GLU 127 Ca -0.46 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.66 3kez h GLU 127 Cb 1.21 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.60 3kez h GLU 127 CO 0.59 0.58 0.00 -0.40 -1.18 0.00 0.00 179.01 178.60 3kez n ASP 128 N -4.67 0.00 -0.68 1.04 5.68 -1.26 -2.08 116.55 114.58 3kez n ASP 128 Ca 0.13 -0.66 0.13 0.00 -0.50 0.00 0.00 54.79 53.89 3kez n ASP 128 Cb 0.22 -0.01 0.29 0.00 -1.14 0.00 0.00 41.12 40.48 3kez n ASP 128 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3kez n GLU 129 N -1.01 1.87 -0.13 0.11 1.02 -0.08 -4.62 120.64 117.81 3kez n GLU 129 Ca 0.16 -1.37 -0.12 0.00 -0.02 0.00 0.00 57.16 55.82 3kez n GLU 129 Cb 0.08 -1.47 -0.02 0.00 -0.02 0.00 0.00 31.44 30.01 3kez n GLU 129 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3kez h THR 130 N 3.34 1.28 -0.44 2.62 2.02 -1.47 -0.05 112.91 120.21 3kez h THR 130 Ca 0.00 -1.31 -0.03 0.00 0.77 0.00 0.00 66.41 65.84 3kez h THR 130 Cb 0.74 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 3kez h THR 130 CO 0.00 0.44 0.16 -0.08 0.37 0.00 0.00 175.52 176.41 3kez h GLU 131 N 0.64 0.68 -0.07 6.66 4.81 -1.81 0.65 114.58 126.13 3kez h GLU 131 Ca 0.09 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3kez h GLU 131 Cb 0.73 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.01 3kez h GLU 131 CO 0.06 0.64 0.04 -0.92 -0.73 0.00 0.00 179.01 178.10 3kez h TYR 132 N 0.58 0.09 -0.40 0.92 3.20 -1.81 -1.63 116.97 117.92 3kez h TYR 132 Ca 0.15 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.02 3kez h TYR 132 Cb 0.23 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 3kez h TYR 132 CO 0.01 0.08 0.26 -0.22 -1.64 0.00 0.00 178.16 176.65 3kez h LYS 133 N 0.07 0.53 -0.69 1.82 3.11 -0.75 -1.32 116.57 119.35 3kez h LYS 133 Ca 0.03 -0.04 0.03 0.00 -2.81 0.00 0.00 60.65 57.86 3kez h LYS 133 Cb 0.02 -0.12 -0.04 0.00 -1.00 0.00 0.00 32.23 31.08 3kez h LYS 133 CO -0.01 0.37 0.43 -0.91 -2.81 0.00 0.00 179.45 176.52 3kez h ASN 134 N 0.54 0.69 -0.63 4.20 2.35 -0.84 -1.10 115.58 120.79 3kez h ASN 134 Ca 0.15 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.83 3kez h ASN 134 Cb -0.05 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.15 3kez h ASN 134 CO -0.03 0.48 0.11 -0.78 -1.65 0.00 0.00 177.43 175.55 3kez h ASP 135 N 0.83 1.00 -0.47 5.81 3.58 -0.90 0.27 116.42 126.53 3kez h ASP 135 Ca 0.28 -0.26 -0.01 0.00 0.42 0.00 0.00 57.03 57.47 3kez h ASP 135 Cb 0.04 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 40.80 3kez h ASP 135 CO -0.12 1.00 0.27 -0.07 -2.88 0.00 0.00 179.24 177.44 3kez h LEU 136 N 0.96 0.58 -0.39 2.28 3.38 -0.94 -0.17 115.31 121.00 3kez h LEU 136 Ca 0.19 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 3kez h LEU 136 Cb 0.42 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 3kez h LEU 136 CO 0.01 0.49 0.24 0.50 0.09 0.00 0.00 178.44 179.77 3kez h LYS 137 N 0.63 0.54 -0.98 1.13 3.64 -0.97 -2.43 116.57 118.13 3kez h LYS 137 Ca 0.17 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.54 3kez h LYS 137 Cb 0.03 -0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 31.68 3kez h LYS 137 CO -0.03 0.40 0.64 0.78 -2.27 0.00 0.00 179.45 178.97 3kez h GLY 138 N 0.52 1.43 1.00 5.01 0.00 -0.09 -0.37 103.07 110.56 3kez h GLY 138 Ca 0.14 -0.48 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 3kez h GLY 138 CO -0.03 0.40 0.33 1.46 0.00 0.00 0.00 176.54 178.71 3kez h GLN 139 N 1.22 0.92 -0.59 4.80 4.20 -0.84 -0.01 115.11 124.81 3kez h GLN 139 Ca 0.39 -0.12 -0.03 0.00 0.06 0.00 0.00 58.65 58.95 3kez h GLN 139 Cb 0.03 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.61 3kez h GLN 139 CO -0.13 0.71 0.25 0.00 -0.67 0.00 0.00 178.83 179.00 3kez h ALA 140 N 1.16 0.76 -0.25 3.87 0.00 -0.84 -1.42 119.26 122.54 3kez h ALA 140 Ca 0.23 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3kez h ALA 140 Cb 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3kez h ALA 140 CO -0.03 0.36 -0.06 -0.07 0.00 0.00 0.00 179.25 179.45 3kez h LEU 141 N 0.81 0.48 -0.72 0.00 3.38 -0.95 -1.02 115.31 117.28 3kez h LEU 141 Ca 0.20 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 3kez h LEU 141 Cb 0.17 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 3kez h LEU 141 CO -0.02 0.73 0.31 0.00 0.09 0.00 0.00 178.44 179.55 3kez h ALA 142 N 0.76 0.94 -0.35 1.53 0.00 -0.86 -0.71 119.26 120.57 3kez h ALA 142 Ca 0.06 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.67 3kez h ALA 142 Cb 0.52 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3kez h ALA 142 CO 0.02 0.53 -0.30 0.82 0.00 0.00 0.00 179.25 180.33 3kez h ILE 143 N 1.03 1.29 -0.71 0.00 2.04 -1.20 -2.66 117.51 117.29 3kez h ILE 143 Ca 0.24 -1.46 -0.03 0.00 1.00 0.00 0.00 64.86 64.61 3kez h ILE 143 Cb 0.17 1.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 3kez h ILE 143 CO -0.02 0.48 0.32 -0.09 0.00 0.00 0.00 178.15 178.84 3kez h ARG 144 N 0.61 1.02 -0.58 2.37 2.43 -0.96 -0.32 114.38 118.95 3kez h ARG 144 Ca 0.06 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 3kez h ARG 144 Cb 0.88 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.24 3kez h ARG 144 CO 0.08 0.80 0.00 0.41 -1.51 0.00 0.00 179.97 179.75 3kez n GLY 145 N -1.05 0.39 1.09 2.80 0.00 -0.29 -1.48 105.19 106.64 3kez n GLY 145 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3kez n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kez n ALA 147 N 0.49 0.00 -0.02 4.61 0.00 -0.13 -0.99 120.51 124.47 3kez n ALA 147 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 3kez n ALA 147 Cb 0.07 0.00 0.16 0.00 0.00 0.00 0.00 19.45 19.68 3kez n ALA 147 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3kez h LEU 148 N 0.00 0.59 0.01 0.00 5.85 -1.50 -1.52 115.31 118.74 3kez h LEU 148 Ca 0.00 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 3kez h LEU 148 Cb 0.00 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.87 3kez h LEU 148 CO 0.00 0.82 -0.00 0.15 -0.34 0.00 0.00 178.44 179.07 3kez h PHE 149 N 0.52 -0.01 -0.55 1.25 3.57 -1.30 -0.48 116.94 119.94 3kez h PHE 149 Ca 0.07 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.60 3kez h PHE 149 Cb 0.69 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.40 3kez h PHE 149 CO 0.03 0.02 0.34 -0.44 -2.23 0.00 0.00 178.31 176.02 3kez h ASP 150 N -0.04 0.55 -0.78 0.41 3.32 -1.78 -0.76 116.42 117.35 3kez h ASP 150 Ca -0.00 0.00 0.05 0.00 0.02 0.00 0.00 57.03 57.10 3kez h ASP 150 Cb 0.03 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.42 3kez h ASP 150 CO 0.00 0.39 0.51 -0.07 -1.72 0.00 0.00 179.24 178.35 3kez h LEU 151 N 0.67 0.79 -0.16 1.55 3.38 -1.11 -1.36 115.31 119.07 3kez h LEU 151 Ca 0.22 -0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.98 3kez h LEU 151 Cb 0.00 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 40.59 3kez h LEU 151 CO -0.09 0.53 -0.70 0.74 0.09 0.00 0.00 178.44 179.01 3kez h THR 152 N 0.90 1.29 0.00 0.22 2.02 -0.47 -1.48 112.91 115.40 3kez h THR 152 Ca 0.32 -1.91 -0.11 0.00 0.77 0.00 0.00 66.41 65.48 3kez h THR 152 Cb 0.13 1.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.51 3kez h THR 152 CO -0.10 0.60 -0.52 0.08 0.37 0.00 0.00 175.52 175.95 3kez h ARG 153 N 0.47 0.00 0.07 6.66 0.11 -0.96 -0.58 114.38 120.15 3kez h ARG 153 Ca -0.04 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 59.82 3kez h ARG 153 Cb 1.33 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.43 3kez h ARG 153 CO 0.15 0.48 -0.91 0.82 0.10 0.00 0.00 179.97 180.61 3kez h ILE 154 N 0.00 1.38 -0.02 0.08 2.04 -1.22 -3.38 117.51 116.39 3kez h ILE 154 Ca -0.01 -2.31 0.00 0.00 1.00 0.00 0.00 64.86 63.54 3kez h ILE 154 Cb 1.38 2.72 0.00 0.00 -0.74 0.00 0.00 36.82 40.18 3kez h ILE 154 CO 0.06 0.68 -0.21 0.49 0.00 0.00 0.00 178.15 179.18 3kez n PHE 155 N -4.02 0.00 -4.30 1.37 3.72 -0.56 -1.99 117.46 111.68 3kez n PHE 155 Ca -0.12 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.10 3kez n PHE 155 Cb 0.83 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 39.23 3kez n PHE 155 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3kez s GLY 156 N -1.81 0.49 0.56 1.37 0.00 -0.22 -4.85 107.32 102.86 3kez s GLY 156 Ca 0.17 -0.49 -0.21 0.00 0.00 0.00 0.00 44.72 44.19 3kez s GLY 156 CO 0.35 -0.45 1.30 -1.72 0.00 0.00 0.00 173.10 172.57 3kez n TYR 157 N 2.52 2.06 -1.69 1.90 4.01 -1.26 -4.53 117.16 120.17 3kez n TYR 157 Ca -0.15 0.43 -0.42 0.00 -0.16 0.00 0.00 57.90 57.60 3kez n TYR 157 Cb 0.56 -2.32 0.00 0.00 -0.31 0.00 0.00 39.34 37.27 3kez n TYR 157 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 3kez n PRO 158 N -1.11 1.98 -0.26 -0.72 -0.04 -1.26 -4.88 135.00 128.70 3kez n PRO 158 Ca 0.12 0.70 0.05 0.00 -0.04 0.00 0.00 63.50 64.32 3kez n PRO 158 Cb 0.45 -2.31 0.14 0.00 -0.04 0.00 0.00 33.50 31.75 3kez n PRO 158 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 3kez h TYR 159 N 2.30 -0.17 0.00 0.54 5.03 -1.90 -1.51 116.97 121.26 3kez h TYR 159 Ca -0.46 0.06 0.00 0.00 2.58 0.00 0.00 58.73 60.91 3kez h TYR 159 Cb 1.29 0.20 0.00 0.00 1.55 0.00 0.00 36.73 39.77 3kez h TYR 159 CO 0.49 -0.28 0.00 1.28 -1.32 0.00 0.00 178.16 178.33 3kez n LEU 160 N -5.41 0.00 -0.32 2.82 4.77 -1.26 -0.36 117.00 117.25 3kez n LEU 160 Ca 0.13 0.46 0.03 0.00 -0.03 0.00 0.00 56.01 56.60 3kez n LEU 160 Cb 0.46 -0.46 0.17 0.00 -2.33 0.00 0.00 43.42 41.26 3kez n LEU 160 CO 0.02 -0.13 1.19 0.50 -1.33 0.00 0.00 177.39 177.63 3kez h LYS 161 N 0.00 0.91 0.00 3.23 3.64 -1.59 -3.37 116.57 119.39 3kez h LYS 161 Ca 0.00 -0.05 -0.14 0.00 -1.27 0.00 0.00 60.65 59.19 3kez h LYS 161 Cb 0.32 -0.20 -0.19 0.00 -0.41 0.00 0.00 32.23 31.75 3kez h LYS 161 CO 0.00 0.60 -0.46 -0.40 -2.27 0.00 0.00 179.45 176.92 3kez n ASP 162 N -4.65 -0.49 -3.97 4.20 5.68 -0.95 -4.99 116.55 111.37 3kez n ASP 162 Ca 0.14 -1.98 -0.28 0.00 -0.50 0.00 0.00 54.79 52.18 3kez n ASP 162 Cb 0.24 0.15 -0.01 0.00 -1.14 0.00 0.00 41.12 40.36 3kez n ASP 162 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3kez n ASN 163 N 0.12 -1.60 -1.17 -1.12 3.02 0.52 -2.42 115.26 112.60 3kez n ASN 163 Ca -0.19 -0.96 -0.14 0.00 -0.03 0.00 0.00 54.58 53.27 3kez n ASN 163 Cb 0.80 -3.22 -0.05 0.00 -0.61 0.00 0.00 39.78 36.70 3kez n ASN 163 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kez n GLY 164 N -1.78 1.10 0.21 7.41 0.00 0.21 -4.63 105.19 107.71 3kez n GLY 164 Ca -0.18 -0.36 0.10 0.00 0.00 0.00 0.00 46.02 45.58 3kez n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kez h ALA 165 N 0.14 0.94 -2.31 4.61 0.00 -1.76 0.17 119.26 121.05 3kez h ALA 165 Ca -0.29 -0.18 -0.45 0.00 0.00 0.00 0.00 54.91 53.99 3kez h ALA 165 Cb 0.97 -0.03 0.17 0.00 0.00 0.00 0.00 17.79 18.90 3kez h ALA 165 CO 0.41 0.24 0.15 -1.12 0.00 0.00 0.00 179.25 178.93 3kez s SER 166 N -6.16 2.22 0.11 0.00 0.01 -1.26 -4.77 113.70 103.84 3kez s SER 166 Ca 0.03 1.26 -0.30 0.00 1.31 0.00 0.00 55.95 58.24 3kez s SER 166 Cb 0.08 -1.95 -0.06 0.00 0.21 0.00 0.00 66.02 64.30 3kez s SER 166 CO 0.65 -3.39 1.04 -0.76 0.41 0.00 0.00 173.24 171.18 3kez s LEU 167 N -6.64 4.46 0.00 2.44 1.43 -1.26 -0.75 118.68 118.35 3kez s LEU 167 Ca 0.66 1.89 0.00 0.00 -1.03 0.00 0.00 54.13 55.65 3kez s LEU 167 Cb -0.20 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.43 3kez s LEU 167 CO 0.59 -0.20 0.00 0.61 0.23 0.00 0.00 176.35 177.59 3kez n GLY 168 N 2.43 0.52 3.38 -3.19 0.00 0.16 -4.35 105.19 104.14 3kez n GLY 168 Ca 0.04 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.86 3kez n GLY 168 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kez s VAL 169 N 2.52 0.70 0.19 1.61 -7.23 -1.24 -4.71 120.40 112.24 3kez s VAL 169 Ca 0.00 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 57.86 3kez s VAL 169 Cb 0.00 -2.62 -0.10 0.00 0.56 0.00 0.00 36.38 34.22 3kez s VAL 169 CO 0.00 0.00 1.52 -2.84 -0.31 0.00 0.00 175.10 173.47 3kez s PRO 170 N -3.91 4.23 -0.27 4.82 0.02 -1.26 -1.82 135.00 136.81 3kez s PRO 170 Ca 0.35 2.33 -0.27 0.00 0.02 0.00 0.00 61.00 63.43 3kez s PRO 170 Cb 0.07 -3.15 0.01 0.00 0.02 0.00 0.00 34.50 31.45 3kez s PRO 170 CO 0.15 -0.55 0.97 0.42 -0.33 0.00 0.00 177.00 177.66 3kez s ILE 171 N 0.81 4.68 -0.22 2.83 1.01 -1.26 -4.89 121.20 124.17 3kez s ILE 171 Ca 0.67 1.73 0.02 0.00 0.00 0.00 0.00 60.65 63.06 3kez s ILE 171 Cb -0.43 -4.27 0.05 0.00 0.01 0.00 0.00 42.46 37.82 3kez s ILE 171 CO 0.35 -0.25 -0.11 -0.69 0.00 0.00 0.00 174.94 174.24 3kez s VAL 172 N 3.21 1.87 -0.50 2.92 1.01 -1.26 -4.98 120.40 122.66 3kez s VAL 172 Ca 0.41 -1.25 0.04 0.00 0.00 0.00 0.00 61.98 61.18 3kez s VAL 172 Cb -0.14 -1.94 0.04 0.00 0.00 0.00 0.00 36.38 34.33 3kez s VAL 172 CO 0.10 0.12 0.65 0.29 0.00 0.00 0.00 175.10 176.25 3kez n LYS 173 N 4.59 -0.29 -1.23 2.72 5.02 -1.26 -4.91 118.16 122.80 3kez n LYS 173 Ca -0.15 -0.78 0.00 0.00 -2.02 0.00 0.00 58.31 55.36 3kez n LYS 173 Cb 0.45 -1.08 0.00 0.00 -0.02 0.00 0.00 35.03 34.38 3kez n LYS 173 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3kez n GLU 174 N 0.21 2.16 -3.49 1.97 1.02 -1.26 -4.81 120.64 116.45 3kez n GLU 174 Ca 0.02 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.79 3kez n GLU 174 Cb 0.11 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.45 3kez n GLU 174 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3kez s LEU 175 N 0.00 4.15 0.56 -4.62 1.43 -1.26 -4.88 118.68 114.06 3kez s LEU 175 Ca 0.00 0.38 -0.18 0.00 -1.03 0.00 0.00 54.13 53.29 3kez s LEU 175 Cb 0.00 -2.36 -0.05 0.00 0.03 0.00 0.00 46.19 43.81 3kez s LEU 175 CO 0.00 -0.01 1.11 -0.44 0.23 0.00 0.00 176.35 177.23 3kez s SER 176 N 1.00 5.68 0.32 2.29 0.01 -1.26 -5.06 113.70 116.68 3kez s SER 176 Ca 0.15 2.08 0.05 0.00 1.31 0.00 0.00 55.95 59.55 3kez s SER 176 Cb -0.14 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.50 3kez s SER 176 CO 0.06 -1.24 0.19 0.35 0.41 0.00 0.00 173.24 173.01 3kez n THR 177 N -1.53 0.00 0.31 1.44 -2.24 -1.26 -5.02 114.28 105.98 3kez n THR 177 Ca 0.11 -2.11 0.12 0.00 -2.27 0.00 0.00 64.05 59.90 3kez n THR 177 Cb 0.51 0.92 0.53 0.00 -2.10 0.00 0.00 70.33 70.19 3kez n THR 177 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 3kez n ILE 178 N -0.67 0.90 0.80 2.28 -5.35 -1.26 -1.75 119.36 114.32 3kez n ILE 178 Ca 0.01 0.41 0.13 0.00 -0.27 0.00 0.00 62.75 63.04 3kez n ILE 178 Cb 0.53 -1.37 0.40 0.00 -1.74 0.00 0.00 39.64 37.46 3kez n ILE 178 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 3kez n ASP 179 N -2.26 0.47 -4.64 7.28 2.03 -1.26 -4.86 116.55 113.31 3kez n ASP 179 Ca 0.01 0.32 -0.43 0.00 0.52 0.00 0.00 54.79 55.20 3kez n ASP 179 Cb 0.16 -0.33 -0.02 0.00 -0.72 0.00 0.00 41.12 40.21 3kez n ASP 179 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 3kez s SER 180 N -3.70 6.88 -0.43 1.67 0.01 -0.72 -4.93 113.70 112.48 3kez s SER 180 Ca 0.11 1.07 0.09 0.00 1.31 0.00 0.00 55.95 58.53 3kez s SER 180 Cb 0.16 -2.54 0.31 0.00 0.21 0.00 0.00 66.02 64.16 3kez s SER 180 CO 0.62 -0.92 0.71 0.29 0.41 0.00 0.00 173.24 174.34 3kez n LYS 181 N 6.97 1.39 -2.44 12.44 4.76 -1.26 -4.91 118.16 135.11 3kez n LYS 181 Ca 0.12 -3.68 -0.37 0.00 -2.87 0.00 0.00 58.31 51.51 3kez n LYS 181 Cb 0.47 -1.70 -0.03 0.00 -1.84 0.00 0.00 35.03 31.93 3kez n LYS 181 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 3kez s PRO 182 N -2.25 4.13 0.61 1.97 0.04 -1.26 -4.67 135.00 133.56 3kez s PRO 182 Ca 0.40 1.66 -0.10 0.00 0.04 0.00 0.00 61.00 63.00 3kez s PRO 182 Cb 0.27 -2.63 -0.03 0.00 0.04 0.00 0.00 34.50 32.16 3kez s PRO 182 CO -0.09 -0.20 0.99 0.00 0.04 0.00 0.00 177.00 177.73 3kez s ALA 183 N -1.53 3.14 0.17 8.56 0.00 -1.26 -4.80 121.76 126.04 3kez s ALA 183 Ca 0.57 -0.25 -0.31 0.00 0.00 0.00 0.00 51.96 51.97 3kez s ALA 183 Cb -0.26 -2.94 -0.09 0.00 0.00 0.00 0.00 23.12 19.83 3kez s ALA 183 CO 0.33 -0.71 1.42 1.03 0.00 0.00 0.00 175.76 177.83 3kez s ARG 184 N -5.11 4.30 0.75 0.00 0.52 -1.26 -4.17 118.95 113.98 3kez s ARG 184 Ca 0.54 2.19 -0.12 0.00 -0.52 0.00 0.00 55.73 57.82 3kez s ARG 184 Cb -0.11 -3.18 0.04 0.00 0.52 0.00 0.00 34.95 32.22 3kez s ARG 184 CO 0.51 -0.43 1.11 -0.80 0.02 0.00 0.00 175.30 175.71 3kez s ASN 185 N 0.78 5.00 0.63 0.23 -0.87 -0.76 -4.85 114.94 115.11 3kez s ASN 185 Ca 0.63 1.10 -0.14 0.00 -1.57 0.00 0.00 52.86 52.88 3kez s ASN 185 Cb -0.39 -1.82 -0.02 0.00 -0.02 0.00 0.00 41.25 38.99 3kez s ASN 185 CO 0.35 -1.62 1.05 0.42 -2.57 0.00 0.00 177.10 174.73 3kez s THR 186 N -3.35 3.95 0.24 1.60 -4.23 -1.26 0.37 115.64 112.96 3kez s THR 186 Ca 0.60 0.80 -0.06 0.00 -1.18 0.00 0.00 61.69 61.85 3kez s THR 186 Cb -0.12 -3.41 0.20 0.00 1.34 0.00 0.00 72.50 70.51 3kez s THR 186 CO 0.52 -0.67 1.73 0.58 -0.54 0.00 0.00 174.62 176.24 3kez h VAL 187 N -0.02 0.68 -0.56 2.29 2.07 -0.86 -1.14 116.25 118.71 3kez h VAL 187 Ca -0.46 -0.15 0.04 0.00 0.82 0.00 0.00 66.70 66.96 3kez h VAL 187 Cb 1.21 0.21 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 3kez h VAL 187 CO 0.57 0.08 0.30 0.00 0.02 0.00 0.00 177.57 178.55 3kez h ALA 188 N 1.52 0.73 -0.89 1.67 0.00 -0.92 0.02 119.26 121.39 3kez h ALA 188 Ca 0.39 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.32 3kez h ALA 188 Cb 0.56 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 3kez h ALA 188 CO -0.38 -0.02 0.58 0.93 0.00 0.00 0.00 179.25 180.36 3kez h GLU 189 N 0.58 1.18 -0.52 0.00 5.08 -1.67 -1.96 114.58 117.27 3kez h GLU 189 Ca 0.24 -0.08 -0.06 0.00 -1.00 0.00 0.00 59.36 58.47 3kez h GLU 189 Cb 0.12 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 3kez h GLU 189 CO -0.15 0.79 0.10 0.00 -1.00 0.00 0.00 179.01 178.75 3kez h TYR 191 N 0.74 0.74 -0.78 0.00 -1.99 -0.64 0.30 116.97 115.35 3kez h TYR 191 Ca 0.16 0.02 0.13 0.00 2.00 0.00 0.00 58.73 61.04 3kez h TYR 191 Cb 0.39 -0.24 -0.09 0.00 2.00 0.00 0.00 36.73 38.78 3kez h TYR 191 CO 0.03 0.44 0.36 1.15 -0.00 0.00 0.00 178.16 180.13 3kez h THR 192 N 0.79 0.71 -0.26 -2.88 2.02 -1.25 -0.53 112.91 111.50 3kez h THR 192 Ca 0.25 -0.18 -0.20 0.00 0.77 0.00 0.00 66.41 67.05 3kez h THR 192 Cb -0.01 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.54 3kez h THR 192 CO -0.09 0.10 -0.60 -0.33 0.37 0.00 0.00 175.52 174.97 3kez h GLU 193 N 0.53 0.87 -0.36 6.66 4.39 -1.17 -1.90 114.58 123.60 3kez h GLU 193 Ca 0.42 -0.58 -0.01 0.00 0.34 0.00 0.00 59.36 59.53 3kez h GLU 193 Cb 0.59 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.31 3kez h GLU 193 CO -0.37 1.21 0.20 0.82 -1.16 0.00 0.00 179.01 179.72 3kez h ILE 194 N 0.65 1.14 -0.32 3.13 2.04 -0.65 -1.85 117.51 121.65 3kez h ILE 194 Ca -0.00 -0.34 -0.06 0.00 1.00 0.00 0.00 64.86 65.45 3kez h ILE 194 Cb 1.22 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 38.00 3kez h ILE 194 CO 0.13 0.14 -0.04 0.40 0.00 0.00 0.00 178.15 178.78 3kez h ILE 195 N 0.46 1.27 -0.23 -0.67 2.04 -1.10 -0.90 117.51 118.38 3kez h ILE 195 Ca 0.13 -1.05 0.03 0.00 1.00 0.00 0.00 64.86 64.97 3kez h ILE 195 Cb 0.04 1.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 3kez h ILE 195 CO -0.02 0.34 0.04 -1.28 0.00 0.00 0.00 178.15 177.22 3kez h SER 196 N 0.37 -0.00 0.04 1.72 0.87 -1.27 0.56 113.55 115.83 3kez h SER 196 Ca 0.08 0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.68 3kez h SER 196 Cb 0.51 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 3kez h SER 196 CO 0.02 0.03 -0.02 0.44 -0.53 0.00 0.00 176.83 176.78 3kez h ASP 197 N 0.12 -0.04 -0.53 6.23 3.32 -1.24 -0.34 116.42 123.95 3kez h ASP 197 Ca 0.10 -0.27 -0.08 0.00 0.02 0.00 0.00 57.03 56.81 3kez h ASP 197 Cb 0.11 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 3kez h ASP 197 CO -0.14 0.25 0.03 -0.07 -1.72 0.00 0.00 179.24 177.59 3kez h LEU 198 N -0.33 0.88 -0.14 1.55 3.38 -0.97 0.59 115.31 120.27 3kez h LEU 198 Ca -0.01 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 3kez h LEU 198 Cb 0.31 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3kez h LEU 198 CO 0.01 0.95 0.04 0.50 0.09 0.00 0.00 178.44 180.03 3kez h LYS 199 N 0.78 0.23 -0.86 1.13 3.64 0.20 -1.53 116.57 120.15 3kez h LYS 199 Ca 0.15 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.53 3kez h LYS 199 Cb 0.48 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.21 3kez h LYS 199 CO 0.02 0.38 0.54 -0.97 -2.27 0.00 0.00 179.45 177.15 3kez h ASN 200 N 0.03 0.87 -0.78 4.20 -1.24 -0.93 -1.86 115.58 115.87 3kez h ASN 200 Ca 0.04 0.01 0.08 0.00 0.71 0.00 0.00 56.30 57.14 3kez h ASN 200 Cb 0.25 -0.18 -0.05 0.00 0.73 0.00 0.00 38.32 39.07 3kez h ASN 200 CO 0.00 0.57 0.51 0.77 -1.29 0.00 0.00 177.43 178.00 3kez h SER 201 N 1.01 0.70 0.66 1.15 4.64 -0.35 -1.60 113.55 119.77 3kez h SER 201 Ca 0.37 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 3kez h SER 201 Cb 0.11 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 3kez h SER 201 CO -0.15 0.44 0.00 0.71 -0.87 0.00 0.00 176.83 176.96 3kez h THR 202 N 0.79 0.00 0.00 2.95 1.35 -0.42 -1.00 112.91 116.59 3kez h THR 202 Ca 0.35 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.97 3kez h THR 202 Cb 0.33 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 67.74 3kez h THR 202 CO -0.13 0.00 -0.96 -0.62 -0.25 0.00 0.00 175.52 173.57 3kez n GLU 203 N -2.41 0.18 -0.04 4.72 1.02 -0.61 -4.58 120.64 118.92 3kez n GLU 203 Ca 0.01 -0.01 -0.06 0.00 -0.02 0.00 0.00 57.16 57.09 3kez n GLU 203 Cb 0.21 -1.55 -0.05 0.00 -0.02 0.00 0.00 31.44 30.03 3kez n GLU 203 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3kez n LEU 204 N -1.78 1.79 -4.77 -4.62 4.77 -0.83 -5.03 117.00 106.53 3kez n LEU 204 Ca 0.03 -0.03 -0.40 0.00 -0.03 0.00 0.00 56.01 55.57 3kez n LEU 204 Cb 0.40 -0.13 -0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3kez n LEU 204 CO 0.40 0.47 1.05 -0.76 -1.33 0.00 0.00 177.39 177.22 3kez s LEU 205 N -5.17 4.29 0.54 2.23 1.43 -0.44 -2.94 118.68 118.62 3kez s LEU 205 Ca -0.09 2.85 -0.21 0.00 -1.03 0.00 0.00 54.13 55.65 3kez s LEU 205 Cb 0.03 -3.75 -0.05 0.00 0.03 0.00 0.00 46.19 42.44 3kez s LEU 205 CO 0.26 -0.83 1.26 -0.55 0.23 0.00 0.00 176.35 176.73 3kez s SER 206 N -0.42 5.49 0.00 2.29 0.15 -1.26 -4.54 113.70 115.41 3kez s SER 206 Ca 0.54 2.54 0.30 0.00 0.70 0.00 0.00 55.95 60.03 3kez s SER 206 Cb -0.42 -2.62 1.51 0.00 -1.71 0.00 0.00 66.02 62.78 3kez s SER 206 CO 0.56 -1.40 2.01 0.61 1.20 0.00 0.00 173.24 176.22 3kez n GLY 207 N 0.60 -0.69 3.77 9.45 0.00 -1.26 -1.38 105.19 115.68 3kez n GLY 207 Ca 0.10 -0.29 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 3kez n GLY 207 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3kez s ASP 208 N -2.11 5.32 0.31 1.61 1.01 -1.26 -4.83 116.67 116.72 3kez s ASP 208 Ca 0.41 2.10 -0.29 0.00 0.71 0.00 0.00 52.55 55.47 3kez s ASP 208 Cb 0.21 -2.57 -0.12 0.00 1.01 0.00 0.00 42.92 41.46 3kez s ASP 208 CO 0.38 -1.49 1.51 0.33 0.21 0.00 0.00 175.17 176.11 3kez n PHE 209 N -1.96 2.75 -3.33 4.23 7.35 -1.26 -4.84 117.46 120.40 3kez n PHE 209 Ca 0.11 0.36 -0.12 0.00 -0.76 0.00 0.00 57.45 57.04 3kez n PHE 209 Cb 0.51 -2.54 -0.07 0.00 0.35 0.00 0.00 39.48 37.73 3kez n PHE 209 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 3kez s ASN 210 N 0.22 0.68 -0.08 -2.13 2.47 -1.26 -4.99 114.94 109.85 3kez s ASN 210 Ca 0.61 -0.87 -0.32 0.00 0.42 0.00 0.00 52.86 52.70 3kez s ASN 210 Cb -0.52 0.91 -0.10 0.00 -1.45 0.00 0.00 41.25 40.09 3kez s ASN 210 CO 0.54 -0.31 1.98 1.17 -3.72 0.00 0.00 177.10 176.76 3kez n LYS 211 N 4.91 2.34 -1.09 0.43 3.00 -1.26 -1.62 118.16 124.87 3kez n LYS 211 Ca 0.04 0.82 -0.03 0.00 -0.00 0.00 0.00 58.31 59.15 3kez n LYS 211 Cb 0.48 -2.85 -0.01 0.00 0.00 0.00 0.00 35.03 32.65 3kez n LYS 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3kez n GLY 212 N 4.78 0.61 3.18 3.14 0.00 -1.26 -5.01 105.19 110.64 3kez n GLY 212 Ca 0.24 -0.41 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 3kez n GLY 212 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kez s LYS 213 N -1.57 0.86 0.22 1.61 1.02 -0.64 -4.81 119.74 116.42 3kez s LYS 213 Ca 0.00 -1.29 -0.30 0.00 0.02 0.00 0.00 55.97 54.40 3kez s LYS 213 Cb 0.00 -0.34 -0.08 0.00 -0.52 0.00 0.00 37.83 36.89 3kez s LYS 213 CO 0.00 0.02 1.00 0.08 -0.92 0.00 0.00 175.35 175.53 3kez s VAL 214 N -3.24 3.99 0.37 3.17 1.01 -1.26 -4.71 120.40 119.73 3kez s VAL 214 Ca 0.10 1.88 0.03 0.00 0.00 0.00 0.00 61.98 64.00 3kez s VAL 214 Cb 0.02 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 3kez s VAL 214 CO -0.03 0.40 0.10 -0.46 0.00 0.00 0.00 175.10 175.12 3kez n ASN 215 N 1.80 1.56 -0.27 3.32 6.94 -1.26 -4.82 115.26 122.54 3kez n ASN 215 Ca -0.00 -2.90 0.00 0.00 -0.02 0.00 0.00 54.58 51.66 3kez n ASN 215 Cb 0.47 0.79 0.12 0.00 -2.36 0.00 0.00 39.78 38.80 3kez n ASN 215 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 3kez h ARG 216 N 0.00 0.76 -0.09 -3.83 2.43 -1.46 -1.22 114.38 110.96 3kez h ARG 216 Ca -0.29 -0.05 -0.20 0.00 -0.81 0.00 0.00 59.98 58.63 3kez h ARG 216 Cb 1.07 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 3kez h ARG 216 CO 0.47 0.50 -0.76 -1.49 -1.51 0.00 0.00 179.97 177.18 3kez h TRP 217 N 0.78 0.70 -0.52 2.20 -0.00 -1.90 -2.75 115.95 114.47 3kez h TRP 217 Ca 0.34 -0.32 -0.02 0.00 -0.00 0.00 0.00 58.89 58.90 3kez h TRP 217 Cb 0.22 -0.11 -0.02 0.00 -0.00 0.00 0.00 29.16 29.25 3kez h TRP 217 CO -0.06 1.10 0.26 0.00 -0.00 0.00 0.00 178.44 179.73 3kez h ALA 218 N 0.81 0.67 0.00 1.49 0.00 -1.70 -1.10 119.26 119.43 3kez h ALA 218 Ca -0.04 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3kez h ALA 218 Cb 1.36 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3kez h ALA 218 CO 0.14 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.61 3kez n ALA 219 N -2.31 1.58 0.00 0.00 0.00 -0.50 -0.94 120.51 118.35 3kez n ALA 219 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3kez n ALA 219 Cb 0.11 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.56 3kez n ALA 219 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3kez n THR 221 N 0.62 0.00 -0.10 0.00 -1.04 -0.42 0.11 114.28 113.44 3kez n THR 221 Ca 0.00 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.92 3kez n THR 221 Cb 0.10 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 68.60 3kez n THR 221 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3kez h LEU 222 N 0.00 0.39 -0.90 -4.42 5.85 -1.30 -2.15 115.31 112.79 3kez h LEU 222 Ca 0.00 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.77 3kez h LEU 222 Cb 0.00 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 40.87 3kez h LEU 222 CO 0.00 0.28 0.57 0.25 -0.34 0.00 0.00 178.44 179.20 3kez h LEU 223 N 0.46 0.91 -1.27 2.25 5.85 -0.58 -1.36 115.31 121.57 3kez h LEU 223 Ca 0.13 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.90 3kez h LEU 223 Cb -0.05 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 3kez h LEU 223 CO -0.03 0.59 0.51 0.77 -0.34 0.00 0.00 178.44 179.94 3kez h SER 224 N 1.05 0.80 -0.35 1.25 4.64 -1.65 -1.45 113.55 117.84 3kez h SER 224 Ca 0.39 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.69 3kez h SER 224 Cb 0.14 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.03 3kez h SER 224 CO -0.16 0.54 0.19 -0.09 -0.87 0.00 0.00 176.83 176.44 3kez h ARG 225 N 0.93 0.50 -0.57 4.77 2.43 -0.78 -2.21 114.38 119.45 3kez h ARG 225 Ca 0.32 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.39 3kez h ARG 225 Cb 0.10 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 3kez h ARG 225 CO -0.10 0.43 0.23 0.28 -1.51 0.00 0.00 179.97 179.30 3kez h VAL 226 N 0.44 1.22 -0.58 0.20 2.07 -0.59 -1.55 116.25 117.48 3kez h VAL 226 Ca 0.12 -0.70 0.08 0.00 0.82 0.00 0.00 66.70 67.02 3kez h VAL 226 Cb 0.08 0.62 -0.06 0.00 -1.52 0.00 0.00 31.29 30.41 3kez h VAL 226 CO -0.02 0.27 0.24 1.88 0.02 0.00 0.00 177.57 179.96 3kez h TYR 227 N 0.78 0.42 -0.49 1.57 0.05 -1.19 -1.57 116.97 116.54 3kez h TYR 227 Ca 0.19 0.03 0.04 0.00 0.05 0.00 0.00 58.73 59.03 3kez h TYR 227 Cb 0.20 -0.10 -0.04 0.00 1.01 0.00 0.00 36.73 37.80 3kez h TYR 227 CO 0.01 0.14 0.26 -0.07 -1.05 0.00 0.00 178.16 177.46 3kez h LEU 228 N 0.44 0.40 -1.37 3.88 3.38 -0.80 0.13 115.31 121.36 3kez h LEU 228 Ca 0.28 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.25 3kez h LEU 228 Cb 0.30 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3kez h LEU 228 CO -0.26 0.28 0.17 1.88 0.09 0.00 0.00 178.44 180.60 3kez h TYR 229 N 0.52 0.59 -0.00 1.13 -1.99 -0.75 -1.91 116.97 114.56 3kez h TYR 229 Ca 0.21 -0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.92 3kez h TYR 229 Cb 0.09 -0.18 0.00 0.00 2.00 0.00 0.00 36.73 38.63 3kez h TYR 229 CO -0.09 0.46 -0.10 1.17 -0.00 0.00 0.00 178.16 179.60 3kez n LYS 230 N -4.37 0.29 -1.03 4.88 4.81 -0.64 -4.19 118.16 117.91 3kez n LYS 230 Ca 0.03 -0.06 -0.01 0.00 -0.87 0.00 0.00 58.31 57.39 3kez n LYS 230 Cb 0.15 -1.50 -0.00 0.00 0.02 0.00 0.00 35.03 33.69 3kez n LYS 230 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3kez n GLY 231 N 1.39 0.48 3.09 3.14 0.00 -0.40 -4.90 105.19 108.00 3kez n GLY 231 Ca 0.11 -0.82 -0.43 0.00 0.00 0.00 0.00 46.02 44.87 3kez n GLY 231 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kez n GLU 232 N -2.92 3.78 -0.13 1.61 1.02 0.31 -4.87 120.64 119.45 3kez n GLU 232 Ca -0.01 -3.98 -0.08 0.00 -0.02 0.00 0.00 57.16 53.06 3kez n GLU 232 Cb 0.04 -2.80 0.06 0.00 -0.02 0.00 0.00 31.44 28.73 3kez n GLU 232 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 3kez h TYR 233 N 6.09 0.99 -0.44 -0.32 0.05 -1.93 -0.47 116.97 120.93 3kez h TYR 233 Ca 0.30 -0.21 0.03 0.00 0.05 0.00 0.00 58.73 58.90 3kez h TYR 233 Cb 0.71 -0.24 -0.04 0.00 1.01 0.00 0.00 36.73 38.17 3kez h TYR 233 CO 1.09 0.97 0.23 -0.91 -1.05 0.00 0.00 178.16 178.49 3kez h ASN 234 N 0.77 0.33 -0.32 3.88 2.35 -1.89 -0.93 115.58 119.78 3kez h ASN 234 Ca 0.11 0.02 -0.18 0.00 -0.55 0.00 0.00 56.30 55.71 3kez h ASN 234 Cb 0.70 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 39.02 3kez h ASN 234 CO 0.05 0.24 -0.49 -0.33 -1.65 0.00 0.00 177.43 175.25 3kez h GLU 235 N 0.45 0.90 -0.54 0.81 3.07 -1.92 -2.17 114.58 115.18 3kez h GLU 235 Ca 0.19 -0.54 0.08 0.00 -0.50 0.00 0.00 59.36 58.59 3kez h GLU 235 Cb 0.08 0.05 -0.06 0.00 -0.84 0.00 0.00 28.75 27.97 3kez h GLU 235 CO -0.12 1.18 0.19 0.00 -1.40 0.00 0.00 179.01 178.85 3kez h ALA 236 N 0.72 0.67 -0.03 3.43 0.00 -0.89 -2.94 119.26 120.21 3kez h ALA 236 Ca 0.03 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3kez h ALA 236 Cb 1.10 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 3kez h ALA 236 CO 0.11 -0.22 0.02 1.25 0.00 0.00 0.00 179.25 180.41 3kez h LEU 237 N 0.36 0.04 -1.02 0.00 5.85 -1.00 -0.92 115.31 118.62 3kez h LEU 237 Ca 0.27 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.90 3kez h LEU 237 Cb 0.31 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.33 3kez h LEU 237 CO -0.28 0.12 0.00 0.41 -0.34 0.00 0.00 178.44 178.35 3kez n THR 238 N -5.02 0.00 0.00 1.05 -1.04 -0.83 -0.94 114.28 107.50 3kez n THR 238 Ca -0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 3kez n THR 238 Cb 0.07 -0.01 0.00 0.00 -1.82 0.00 0.00 70.33 68.57 3kez n THR 238 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3kez n ALA 240 N 0.41 0.00 -0.23 2.41 0.00 -0.35 -1.43 120.51 121.33 3kez n ALA 240 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 3kez n ALA 240 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 3kez n ALA 240 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3kez h GLU 241 N 0.00 1.00 -0.53 0.00 5.08 -1.29 -1.28 114.58 117.57 3kez h GLU 241 Ca 0.00 -0.24 -0.11 0.00 -1.00 0.00 0.00 59.36 58.01 3kez h GLU 241 Cb 0.00 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 3kez h GLU 241 CO 0.00 0.90 -0.11 -0.91 -1.00 0.00 0.00 179.01 177.90 3kez h ASN 242 N 0.93 1.02 -0.18 1.42 2.35 -1.48 -1.74 115.58 117.90 3kez h ASN 242 Ca 0.20 -0.35 0.04 0.00 -0.55 0.00 0.00 56.30 55.64 3kez h ASN 242 Cb 0.34 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.39 3kez h ASN 242 CO -0.00 1.13 -0.08 0.00 -1.65 0.00 0.00 177.43 176.83 3kez h ALA 243 N 0.92 0.07 -0.09 -0.83 0.00 -1.74 0.18 119.26 117.77 3kez h ALA 243 Ca 0.14 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.15 3kez h ALA 243 Cb 0.68 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 3kez h ALA 243 CO 0.05 -0.52 -0.08 0.82 0.00 0.00 0.00 179.25 179.53 3kez h ILE 244 N -0.06 0.78 -0.36 0.00 2.04 -1.13 0.17 117.51 118.95 3kez h ILE 244 Ca 0.10 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.90 3kez h ILE 244 Cb 0.21 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 3kez h ILE 244 CO -0.22 0.00 0.01 0.11 0.00 0.00 0.00 178.15 178.05 3kez h LYS 245 N -0.09 0.62 -0.05 2.37 1.57 -1.10 -0.79 116.57 119.10 3kez h LYS 245 Ca 0.06 -0.19 0.01 0.00 -1.87 0.00 0.00 60.65 58.66 3kez h LYS 245 Cb 0.18 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 3kez h LYS 245 CO -0.15 0.73 0.01 0.78 -0.57 0.00 0.00 179.45 180.25 3kez h GLY 246 N 0.44 0.05 0.92 3.86 0.00 -0.53 -2.05 103.07 105.76 3kez h GLY 246 Ca 0.10 -0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.45 3kez h GLY 246 CO 0.02 -0.00 0.42 0.00 0.00 0.00 0.00 176.54 176.98 3kez h ALA 247 N 1.04 0.85 -0.20 3.60 0.00 -0.56 -2.11 119.26 121.88 3kez h ALA 247 Ca 0.02 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 3kez h ALA 247 Cb 0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3kez h ALA 247 CO -0.03 0.20 -0.48 0.93 0.00 0.00 0.00 179.25 179.88 3kez h GLU 248 N 0.84 0.54 -0.50 0.00 5.08 -1.06 -1.71 114.58 117.76 3kez h GLU 248 Ca 0.26 -0.30 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 3kez h GLU 248 Cb -0.02 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 3kez h GLU 248 CO -0.09 0.90 0.17 -0.22 -1.00 0.00 0.00 179.01 178.77 3kez h LYS 249 N 0.43 0.73 0.00 2.33 3.64 -1.16 -1.24 116.57 121.29 3kez h LYS 249 Ca 0.02 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 3kez h LYS 249 Cb 0.99 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 3kez h LYS 249 CO 0.09 0.62 0.00 -1.91 -2.27 0.00 0.00 179.45 175.98 3kez n GLU 250 N -4.33 0.21 0.00 1.90 4.07 -0.81 -4.90 120.64 116.79 3kez n GLU 250 Ca 0.04 0.38 0.00 0.00 -0.06 0.00 0.00 57.16 57.52 3kez n GLU 250 Cb 0.18 -1.87 0.00 0.00 -0.06 0.00 0.00 31.44 29.69 3kez n GLU 250 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3kez n GLY 251 N 0.27 1.01 3.76 8.31 0.00 -0.47 -4.94 105.19 113.13 3kez n GLY 251 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 3kez n GLY 251 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kez s TYR 252 N -2.00 2.48 -0.09 1.61 1.51 -0.70 -4.51 117.35 115.64 3kez s TYR 252 Ca 0.00 1.52 -0.21 0.00 -1.01 0.00 0.00 57.07 57.37 3kez s TYR 252 Cb 0.00 -3.44 0.05 0.00 -0.11 0.00 0.00 41.96 38.45 3kez s TYR 252 CO 0.00 -2.05 0.50 0.00 -1.11 0.00 0.00 175.55 172.89 3kez s ALA 253 N -1.62 -1.27 0.30 3.71 0.00 -0.83 -4.11 121.76 117.94 3kez s ALA 253 Ca 0.75 1.06 -0.30 0.00 0.00 0.00 0.00 51.96 53.47 3kez s ALA 253 Cb -0.29 -0.30 -0.12 0.00 0.00 0.00 0.00 23.12 22.40 3kez s ALA 253 CO 0.32 -0.29 1.45 1.28 0.00 0.00 0.00 175.76 178.52 3kez n LEU 254 N 1.75 3.80 -4.73 0.00 4.77 -1.26 -3.24 117.00 118.09 3kez n LEU 254 Ca -0.18 1.17 -0.42 0.00 -0.03 0.00 0.00 56.01 56.55 3kez n LEU 254 Cb 0.56 -1.52 -0.01 0.00 -2.33 0.00 0.00 43.42 40.12 3kez n LEU 254 CO 0.18 -0.21 1.13 0.79 -1.33 0.00 0.00 177.39 177.94 3kez n TRP 255 N 1.42 2.64 -1.27 -1.77 8.01 -1.26 -4.95 117.44 120.26 3kez n TRP 255 Ca 0.08 0.36 -0.30 0.00 -1.31 0.00 0.00 57.50 56.32 3kez n TRP 255 Cb 0.35 -2.53 0.11 0.00 -2.01 0.00 0.00 31.31 27.23 3kez n TRP 255 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.69 177.63 3kez s THR 256 N -0.31 3.04 0.29 -0.99 -4.23 -1.26 -4.78 115.64 107.40 3kez s THR 256 Ca 0.62 0.34 0.03 0.00 -1.18 0.00 0.00 61.69 61.50 3kez s THR 256 Cb -0.54 -2.85 0.29 0.00 1.34 0.00 0.00 72.50 70.74 3kez s THR 256 CO 0.53 -0.44 1.69 -1.13 -0.54 0.00 0.00 174.62 174.73 3kez h ASN 257 N -1.30 0.30 0.23 3.99 -0.73 -1.93 0.02 115.58 116.18 3kez h ASN 257 Ca -0.46 0.15 -0.17 0.00 1.87 0.00 0.00 56.30 57.69 3kez h ASN 257 Cb 1.26 0.14 -0.01 0.00 0.27 0.00 0.00 38.32 39.98 3kez h ASN 257 CO 0.54 -0.01 -0.68 -0.08 -0.37 0.00 0.00 177.43 176.83 3kez h GLU 258 N 0.39 0.40 0.00 6.67 4.81 -1.91 -3.23 114.58 121.71 3kez h GLU 258 Ca 0.55 -0.31 -0.13 0.00 -0.13 0.00 0.00 59.36 59.34 3kez h GLU 258 Cb 1.04 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 3kez h GLU 258 CO -0.53 0.94 -0.61 0.93 -0.73 0.00 0.00 179.01 179.00 3kez h GLU 259 N 0.29 0.00 -0.65 1.92 5.08 -1.69 -3.40 114.58 116.14 3kez h GLU 259 Ca -0.02 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.43 3kez h GLU 259 Cb 1.24 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.42 3kez h GLU 259 CO 0.12 0.61 0.29 -0.92 -1.00 0.00 0.00 179.01 178.11 3kez h TYR 260 N 0.00 0.51 -0.69 4.33 5.03 -1.04 0.89 116.97 126.00 3kez h TYR 260 Ca -0.01 0.03 0.06 0.00 2.58 0.00 0.00 58.73 61.39 3kez h TYR 260 Cb 1.33 -0.13 -0.04 0.00 1.55 0.00 0.00 36.73 39.44 3kez h TYR 260 CO 0.00 0.17 0.46 -1.35 -1.32 0.00 0.00 178.16 176.12 3kez h PRO 261 N 0.51 0.70 -0.00 1.82 0.11 -1.79 -3.19 132.00 130.15 3kez h PRO 261 Ca 0.32 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.39 3kez h PRO 261 Cb 0.35 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.30 3kez h PRO 261 CO -0.27 0.46 -0.02 0.25 -0.21 0.00 0.00 178.00 178.21 3kez n THR 262 N -4.48 0.00 0.21 -1.15 -2.24 -0.98 -4.70 114.28 100.94 3kez n THR 262 Ca 0.10 -0.49 0.04 0.00 -2.27 0.00 0.00 64.05 61.43 3kez n THR 262 Cb 0.22 1.07 0.44 0.00 -2.10 0.00 0.00 70.33 69.96 3kez n THR 262 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kez h ALA 263 N 0.71 1.55 -0.85 6.98 0.00 -0.82 -2.28 119.26 124.54 3kez h ALA 263 Ca 0.00 -0.25 0.22 0.00 0.00 0.00 0.00 54.91 54.89 3kez h ALA 263 Cb 0.15 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 3kez h ALA 263 CO 0.00 0.34 0.59 -1.49 0.00 0.00 0.00 179.25 178.69 3kez h TRP 264 N 0.00 0.24 -0.02 0.00 4.06 -1.84 0.07 115.95 118.46 3kez h TRP 264 Ca -0.00 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.95 3kez h TRP 264 Cb 0.48 -0.07 0.00 0.00 -1.00 0.00 0.00 29.16 28.57 3kez h TRP 264 CO 0.00 0.06 -0.00 0.41 -3.56 0.00 0.00 178.44 175.35 3kez n GLY 265 N -1.62 0.02 3.69 1.49 0.00 -0.86 -4.43 105.19 103.49 3kez n GLY 265 Ca 0.18 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.43 3kez n GLY 265 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3kez s ASN 266 N -2.00 3.31 -0.53 1.61 0.01 0.01 -4.18 114.94 113.17 3kez s ASN 266 Ca 0.38 2.17 0.00 0.00 -0.71 0.00 0.00 52.86 54.70 3kez s ASN 266 Cb 0.21 -2.57 0.14 0.00 0.41 0.00 0.00 41.25 39.44 3kez s ASN 266 CO 0.33 -2.85 0.31 -0.62 -1.51 0.00 0.00 177.10 172.77 3kez s ASP 267 N -2.67 4.90 0.56 -1.22 2.15 -1.26 -4.84 116.67 114.30 3kez s ASP 267 Ca 0.67 -2.71 -0.21 0.00 0.43 0.00 0.00 52.55 50.73 3kez s ASP 267 Cb -0.23 -1.76 -0.04 0.00 -0.30 0.00 0.00 42.92 40.59 3kez s ASP 267 CO 0.56 -0.35 1.30 0.00 -0.17 0.00 0.00 175.17 176.51 3kez s ALA 268 N 0.14 2.71 0.23 3.66 0.00 -1.26 -5.03 121.76 122.20 3kez s ALA 268 Ca 0.15 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.34 3kez s ALA 268 Cb -0.22 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.33 3kez s ALA 268 CO -0.03 -1.32 0.14 -1.54 0.00 0.00 0.00 175.76 173.01 3kez s SER 269 N -1.18 0.56 0.32 0.00 1.04 -0.89 -4.98 113.70 108.57 3kez s SER 269 Ca 0.74 -1.43 0.03 0.00 0.48 0.00 0.00 55.95 55.77 3kez s SER 269 Cb -0.37 0.36 0.62 0.00 0.10 0.00 0.00 66.02 66.73 3kez s SER 269 CO 0.43 -0.84 1.89 0.00 0.98 0.00 0.00 173.24 175.69 3kez h ALA 270 N 2.51 1.61 0.00 5.32 0.00 -1.96 -0.93 119.26 125.80 3kez h ALA 270 Ca -0.35 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.46 3kez h ALA 270 Cb 1.25 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 3kez h ALA 270 CO 0.53 0.21 -0.47 0.66 0.00 0.00 0.00 179.25 180.18 3kez h SER 271 N 0.92 0.00 -2.15 0.00 4.64 -1.97 -3.38 113.55 111.60 3kez h SER 271 Ca 0.42 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.17 3kez h SER 271 Cb 0.39 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.09 3kez h SER 271 CO -0.18 0.47 -1.03 0.59 -0.87 0.00 0.00 176.83 175.81 3kez n ASN 272 N -3.39 0.22 0.20 4.97 3.02 -0.61 -5.00 115.26 114.69 3kez n ASN 272 Ca 0.01 -2.64 0.09 0.00 -0.03 0.00 0.00 54.58 52.00 3kez n ASN 272 Cb 0.63 -0.62 0.33 0.00 -0.61 0.00 0.00 39.78 39.52 3kez n ASN 272 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 3kez h PRO 273 N 4.57 0.00 0.00 3.52 0.11 -1.41 -2.37 132.00 136.42 3kez h PRO 273 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 3kez h PRO 273 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 3kez h PRO 273 CO 0.46 0.25 0.00 0.41 -0.21 0.00 0.00 178.00 178.91 3kez n GLY 274 N 0.51 0.99 0.49 -0.55 0.00 -1.26 -4.07 105.19 101.30 3kez n GLY 274 Ca 0.01 -0.64 0.07 0.00 0.00 0.00 0.00 46.02 45.46 3kez n GLY 274 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3kez n GLU 275 N 0.64 1.22 -2.56 1.61 0.28 -1.20 -1.96 120.64 118.67 3kez n GLU 275 Ca 0.00 -1.16 -0.43 0.00 -0.16 0.00 0.00 57.16 55.41 3kez n GLU 275 Cb 0.00 -1.25 -0.02 0.00 1.43 0.00 0.00 31.44 31.60 3kez n GLU 275 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 3kez s ILE 276 N -1.31 4.25 0.05 3.84 1.01 -1.26 -0.48 121.20 127.30 3kez s ILE 276 Ca 0.15 1.34 -0.01 0.00 0.00 0.00 0.00 60.65 62.13 3kez s ILE 276 Cb 0.11 -4.46 -0.26 0.00 0.01 0.00 0.00 42.46 37.86 3kez s ILE 276 CO 0.22 -0.78 1.05 -0.07 0.00 0.00 0.00 174.94 175.36 3kez h LEU 277 N 10.98 0.30 -7.50 2.97 3.38 -0.54 -3.44 115.31 121.46 3kez h LEU 277 Ca -0.23 -0.36 -0.42 0.00 0.09 0.00 0.00 57.88 56.96 3kez h LEU 277 Cb 1.07 -0.10 -0.37 0.00 0.09 0.00 0.00 40.66 41.35 3kez h LEU 277 CO 1.09 1.29 -0.76 0.12 0.09 0.00 0.00 178.44 180.27 3kez s PHE 278 N -2.65 0.58 -0.09 1.13 5.36 -0.84 -4.53 117.98 116.94 3kez s PHE 278 Ca -0.05 -0.11 0.03 0.00 -0.96 0.00 0.00 56.93 55.84 3kez s PHE 278 Cb 0.08 -0.72 -0.01 0.00 -0.34 0.00 0.00 43.02 42.03 3kez s PHE 278 CO 0.86 -0.28 -0.19 -2.00 -1.46 0.00 0.00 175.22 172.15 3kez s GLU 279 N 1.78 2.99 -0.38 10.12 2.12 -1.26 -1.82 118.70 132.24 3kez s GLU 279 Ca 0.02 -0.80 -0.25 0.00 0.36 0.00 0.00 54.97 54.30 3kez s GLU 279 Cb -0.13 -2.39 0.01 0.00 0.26 0.00 0.00 34.13 31.89 3kez s GLU 279 CO -0.04 0.29 0.89 0.42 -0.54 0.00 0.00 175.26 176.28 3kez s ILE 280 N 0.10 4.61 -0.20 -3.70 -1.09 -0.46 -4.04 121.20 116.40 3kez s ILE 280 Ca -0.09 1.07 -0.17 0.00 -2.23 0.00 0.00 60.65 59.23 3kez s ILE 280 Cb -0.15 -4.31 -0.04 0.00 -1.58 0.00 0.00 42.46 36.38 3kez s ILE 280 CO 0.06 -0.54 0.44 -0.69 -1.23 0.00 0.00 174.94 172.98 3kez s VAL 281 N 3.41 5.16 -0.09 2.92 1.01 -1.26 -1.21 120.40 130.33 3kez s VAL 281 Ca 0.36 0.79 0.04 0.00 0.00 0.00 0.00 61.98 63.17 3kez s VAL 281 Cb -0.12 -3.77 -0.00 0.00 0.00 0.00 0.00 36.38 32.49 3kez s VAL 281 CO 0.19 0.22 -0.24 0.20 0.00 0.00 0.00 175.10 175.47 3kez s ASN 282 N 1.12 3.05 0.18 3.32 0.01 -1.26 -4.98 114.94 116.37 3kez s ASN 282 Ca 0.21 -0.55 0.09 0.00 -0.71 0.00 0.00 52.86 51.90 3kez s ASN 282 Cb -0.15 -1.32 -0.04 0.00 0.41 0.00 0.00 41.25 40.14 3kez s ASN 282 CO 0.09 0.17 -0.19 -0.76 -1.51 0.00 0.00 177.10 174.89 3kez s LEU 283 N 0.28 2.46 0.39 0.60 1.43 -1.02 -4.66 118.68 118.15 3kez s LEU 283 Ca -0.17 -0.89 0.10 0.00 -1.03 0.00 0.00 54.13 52.14 3kez s LEU 283 Cb -0.17 -0.91 0.87 0.00 0.03 0.00 0.00 46.19 46.01 3kez s LEU 283 CO 0.08 -0.01 1.94 0.74 0.23 0.00 0.00 176.35 179.34 3kez h THR 284 N 3.12 0.92 -0.04 5.49 2.02 -1.98 0.15 112.91 122.59 3kez h THR 284 Ca -0.43 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.55 3kez h THR 284 Cb 1.21 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 3kez h THR 284 CO 0.52 0.11 0.00 0.35 0.37 0.00 0.00 175.52 176.87 3kez n THR 285 N -4.49 0.04 -2.84 3.16 -2.24 -1.26 -4.23 114.28 102.42 3kez n THR 285 Ca 0.12 -0.15 -0.11 0.00 -2.27 0.00 0.00 64.05 61.65 3kez n THR 285 Cb 0.35 0.02 0.03 0.00 -2.10 0.00 0.00 70.33 68.64 3kez n THR 285 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3kez n ASP 286 N -0.34 -2.21 -4.85 3.42 2.03 0.46 -5.13 116.55 109.94 3kez n ASP 286 Ca 0.19 -3.25 -0.37 0.00 0.52 0.00 0.00 54.79 51.88 3kez n ASP 286 Cb 0.22 1.36 -0.06 0.00 -0.72 0.00 0.00 41.12 41.92 3kez n ASP 286 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 3kez s SER 287 N -1.58 6.73 0.00 1.67 0.15 -0.78 -2.45 113.70 117.44 3kez s SER 287 Ca 0.32 0.87 0.29 0.00 0.70 0.00 0.00 55.95 58.13 3kez s SER 287 Cb 0.23 -2.21 1.28 0.00 -1.71 0.00 0.00 66.02 63.60 3kez s SER 287 CO -0.20 0.31 1.93 -0.81 1.20 0.00 0.00 173.24 175.67 3kez n PRO 288 N 1.68 0.16 -0.01 5.44 -0.04 -1.26 -5.03 135.00 135.94 3kez n PRO 288 Ca -0.14 -0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 3kez n PRO 288 Cb 0.53 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.49 3kez n PRO 288 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3kez n GLY 289 N 1.43 -2.14 0.00 0.55 0.00 -1.26 -4.21 105.19 99.55 3kez n GLY 289 Ca 0.09 -1.46 0.13 0.00 0.00 0.00 0.00 46.02 44.79 3kez n GLY 289 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kez n LYS 290 N -0.39 0.63 -0.24 1.61 5.02 -1.26 -2.02 118.16 121.51 3kez n LYS 290 Ca 0.00 0.02 0.09 0.00 -2.02 0.00 0.00 58.31 56.40 3kez n LYS 290 Cb 0.01 -1.50 0.25 0.00 -0.02 0.00 0.00 35.03 33.77 3kez n LYS 290 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3kez n GLU 291 N -1.14 2.22 0.00 1.97 1.02 -1.26 -4.34 120.64 119.11 3kez n GLU 291 Ca 0.17 -1.88 0.00 0.00 -0.02 0.00 0.00 57.16 55.42 3kez n GLU 291 Cb 0.15 -1.43 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 3kez n GLU 291 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3kez n SER 292 N 1.04 0.00 0.00 1.62 3.41 -0.86 -4.66 113.62 114.17 3kez n SER 292 Ca 0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 3kez n SER 292 Cb 0.46 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 3kez n SER 292 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kez n GLY 294 N 2.43 0.00 0.12 5.00 0.00 -1.26 -0.86 105.19 110.61 3kez n GLY 294 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 3kez n GLY 294 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3kez h TYR 295 N 0.00 0.38 -0.39 1.61 3.20 -1.83 -3.37 116.97 116.58 3kez h TYR 295 Ca 0.00 -0.28 -0.08 0.00 3.14 0.00 0.00 58.73 61.51 3kez h TYR 295 Cb 0.00 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 3kez h TYR 295 CO 0.00 1.48 -0.08 -0.07 -1.64 0.00 0.00 178.16 177.86 3kez h LEU 296 N 0.06 0.65 -4.56 2.82 3.38 -1.20 0.77 115.31 117.23 3kez h LEU 296 Ca -0.33 -0.17 -0.72 0.00 0.09 0.00 0.00 57.88 56.75 3kez h LEU 296 Cb 2.03 -0.17 -0.29 0.00 0.09 0.00 0.00 40.66 42.31 3kez h LEU 296 CO 0.12 0.77 0.81 0.59 0.09 0.00 0.00 178.44 180.81 3kez n ASN 297 N -4.20 7.31 -3.71 -0.43 3.02 -1.26 -1.77 115.26 114.22 3kez n ASN 297 Ca 0.01 -3.81 -0.14 0.00 -0.03 0.00 0.00 54.58 50.62 3kez n ASN 297 Cb 0.33 -0.97 -0.09 0.00 -0.61 0.00 0.00 39.78 38.44 3kez n ASN 297 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3kez s SER 298 N -1.61 -0.45 0.00 6.41 0.15 -1.24 -4.45 113.70 112.51 3kez s SER 298 Ca 0.56 0.79 0.22 0.00 0.70 0.00 0.00 55.95 58.22 3kez s SER 298 Cb 0.46 0.82 1.01 0.00 -1.71 0.00 0.00 66.02 66.60 3kez s SER 298 CO -0.24 -0.23 1.72 0.00 1.20 0.00 0.00 173.24 175.69 3kez n TYR 299 N 2.50 0.00 0.49 3.44 0.18 -1.26 -1.86 117.16 120.64 3kez n TYR 299 Ca -0.15 0.00 0.10 0.00 1.88 0.00 0.00 57.90 59.73 3kez n TYR 299 Cb 0.57 -0.43 0.27 0.00 -0.38 0.00 0.00 39.34 39.36 3kez n TYR 299 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 3kez n ASN 300 N -1.43 2.84 0.00 9.48 3.02 -1.26 -4.77 115.26 123.14 3kez n ASN 300 Ca 0.07 -1.93 0.00 0.00 -0.03 0.00 0.00 54.58 52.69 3kez n ASN 300 Cb 0.23 -0.27 0.00 0.00 -0.61 0.00 0.00 39.78 39.13 3kez n ASN 300 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kez n GLY 301 N 1.37 1.78 0.97 7.41 0.00 -0.78 -5.00 105.19 110.94 3kez n GLY 301 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 3kez n GLY 301 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3kez n TYR 302 N 0.00 0.47 -4.01 1.61 4.01 0.26 -4.97 117.16 114.53 3kez n TYR 302 Ca 0.00 -0.24 -0.29 0.00 -0.16 0.00 0.00 57.90 57.21 3kez n TYR 302 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.02 3kez n TYR 302 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3kez n ASP 303 N 1.10 -1.97 -0.17 7.72 9.92 -0.80 -5.00 116.55 127.35 3kez n ASP 303 Ca 0.18 -0.96 0.12 0.00 -0.53 0.00 0.00 54.79 53.60 3kez n ASP 303 Cb 0.50 -3.16 0.14 0.00 -0.64 0.00 0.00 41.12 37.97 3kez n ASP 303 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 3kez n ASP 304 N -2.87 1.07 0.00 -2.24 -0.08 -0.73 -4.59 116.55 107.12 3kez n ASP 304 Ca -0.14 -0.86 0.00 0.00 -1.51 0.00 0.00 54.79 52.28 3kez n ASP 304 Cb 0.60 0.45 0.00 0.00 2.34 0.00 0.00 41.12 44.51 3kez n ASP 304 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3kez s ILE 307 N -2.00 3.56 0.72 0.00 -4.36 -1.00 -0.78 121.20 117.34 3kez s ILE 307 Ca 0.00 1.08 -0.11 0.00 -0.26 0.00 0.00 60.65 61.36 3kez s ILE 307 Cb 0.00 -3.50 0.02 0.00 1.25 0.00 0.00 42.46 40.23 3kez s ILE 307 CO 0.00 -0.10 1.07 0.42 0.24 0.00 0.00 174.94 176.57 3kez s THR 308 N -1.76 3.77 0.27 8.37 -4.23 -0.61 -4.76 115.64 116.69 3kez s THR 308 Ca 0.64 0.58 -0.01 0.00 -1.18 0.00 0.00 61.69 61.72 3kez s THR 308 Cb -0.22 -3.32 0.10 0.00 1.34 0.00 0.00 72.50 70.40 3kez s THR 308 CO 0.26 -0.75 1.74 0.00 -0.54 0.00 0.00 174.62 175.33 3kez h SER 310 N 0.63 0.84 -0.32 0.00 4.64 -1.84 -0.78 113.55 116.72 3kez h SER 310 Ca 0.11 -0.19 -0.17 0.00 -0.47 0.00 0.00 61.79 61.08 3kez h SER 310 Cb 0.53 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3kez h SER 310 CO 0.03 0.86 -0.47 0.15 -0.87 0.00 0.00 176.83 176.54 3kez h PHE 311 N 0.84 1.09 -0.51 4.77 3.57 -1.71 -0.30 116.94 124.69 3kez h PHE 311 Ca 0.17 -0.36 0.07 0.00 3.53 0.00 0.00 57.97 61.38 3kez h PHE 311 Cb 0.40 -0.22 -0.06 0.00 2.79 0.00 0.00 35.95 38.86 3kez h PHE 311 CO 0.02 1.18 0.20 -0.92 -2.23 0.00 0.00 178.31 176.56 3kez h TYR 312 N 0.71 0.35 -0.37 0.41 3.20 -1.09 0.37 116.97 120.56 3kez h TYR 312 Ca 0.04 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.82 3kez h TYR 312 Cb 1.06 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.24 3kez h TYR 312 CO 0.07 0.12 -0.22 1.96 -1.64 0.00 0.00 178.16 178.45 3kez h GLN 313 N 0.38 0.72 -0.21 1.82 4.20 -0.99 0.93 115.11 121.96 3kez h GLN 313 Ca 0.24 -0.28 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 3kez h GLN 313 Cb 0.24 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 3kez h GLN 313 CO -0.23 0.88 0.11 1.25 -0.67 0.00 0.00 178.83 180.17 3kez h LEU 314 N 0.63 0.26 -0.81 1.46 5.85 -0.46 -2.19 115.31 120.05 3kez h LEU 314 Ca 0.09 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 3kez h LEU 314 Cb 0.71 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 3kez h LEU 314 CO 0.05 0.28 0.24 0.25 -0.34 0.00 0.00 178.44 178.92 3kez h LEU 315 N 0.23 1.05 -2.16 2.25 5.85 -0.66 -2.73 115.31 119.14 3kez h LEU 315 Ca 0.07 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.60 3kez h LEU 315 Cb 0.08 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 40.83 3kez h LEU 315 CO -0.01 0.97 -0.02 0.11 -0.34 0.00 0.00 178.44 179.14 3kez h LYS 316 N 1.08 0.00 -1.02 1.25 1.57 -0.66 -2.97 116.57 115.82 3kez h LYS 316 Ca 0.24 0.00 0.27 0.00 -1.87 0.00 0.00 60.65 59.29 3kez h LYS 316 Cb 0.28 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.53 3kez h LYS 316 CO -0.01 0.02 0.70 0.87 -0.57 0.00 0.00 179.45 180.46 3kez h LYS 317 N 0.00 0.22 -4.46 3.15 1.57 -1.07 -3.06 116.57 112.92 3kez h LYS 317 Ca -0.00 -0.01 -0.70 0.00 -1.87 0.00 0.00 60.65 58.07 3kez h LYS 317 Cb 0.27 -0.05 -0.34 0.00 0.08 0.00 0.00 32.23 32.20 3kez h LYS 317 CO 0.00 0.14 -0.53 0.34 -0.57 0.00 0.00 179.45 178.84 3kez s ASP 318 N -5.38 5.31 0.00 0.86 2.15 -1.12 -4.97 116.67 113.52 3kez s ASP 318 Ca -0.07 -2.02 0.12 0.00 0.43 0.00 0.00 52.55 51.02 3kez s ASP 318 Cb 0.24 -1.85 0.53 0.00 -0.30 0.00 0.00 42.92 41.53 3kez s ASP 318 CO 0.79 -0.56 1.39 -0.81 -0.17 0.00 0.00 175.17 175.81 3kez n PRO 319 N 4.63 0.00 -0.20 4.34 -0.04 -1.16 -1.42 135.00 141.16 3kez n PRO 319 Ca -0.03 0.28 0.11 0.00 -0.04 0.00 0.00 63.50 63.82 3kez n PRO 319 Cb 0.41 -1.50 0.27 0.00 -0.04 0.00 0.00 33.50 32.64 3kez n PRO 319 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3kez n LYS 320 N -1.49 2.29 -1.67 0.54 5.02 -1.26 -4.93 118.16 116.66 3kez n LYS 320 Ca 0.03 -1.97 -0.42 0.00 -2.02 0.00 0.00 58.31 53.93 3kez n LYS 320 Cb 0.14 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 33.65 3kez n LYS 320 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3kez n ASP 321 N 1.15 4.14 0.27 4.39 -0.08 -0.51 -4.64 116.55 121.28 3kez n ASP 321 Ca 0.19 0.92 0.13 0.00 -1.51 0.00 0.00 54.79 54.52 3kez n ASP 321 Cb 0.51 -1.53 0.77 0.00 2.34 0.00 0.00 41.12 43.21 3kez n ASP 321 CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 3kez h VAL 322 N 5.46 0.56 0.00 5.18 3.04 -1.43 -2.22 116.25 126.84 3kez h VAL 322 Ca -0.49 -0.41 -0.03 0.00 -1.01 0.00 0.00 66.70 64.75 3kez h VAL 322 Cb 1.24 1.27 -0.00 0.00 -2.01 0.00 0.00 31.29 31.78 3kez h VAL 322 CO 0.94 0.09 -0.17 0.03 -1.01 0.00 0.00 177.57 177.46 3kez h ARG 323 N 0.00 0.00 -0.52 4.17 3.08 -1.89 0.39 114.38 119.61 3kez h ARG 323 Ca -0.00 0.00 0.15 0.00 0.07 0.00 0.00 59.98 60.19 3kez h ARG 323 Cb 0.26 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 3kez h ARG 323 CO 0.01 0.17 0.37 -0.07 -1.07 0.00 0.00 179.97 179.38 3kez h LEU 324 N 0.00 0.03 0.00 3.04 3.38 -1.76 -1.88 115.31 118.12 3kez h LEU 324 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3kez h LEU 324 Cb 0.40 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3kez h LEU 324 CO 0.02 0.02 0.00 0.29 0.09 0.00 0.00 178.44 178.86 3kez n LYS 325 N -4.39 0.19 -0.30 1.13 5.02 0.13 -2.45 118.16 117.48 3kez n LYS 325 Ca 0.09 0.14 0.08 0.00 -2.02 0.00 0.00 58.31 56.60 3kez n LYS 325 Cb 0.57 -1.50 0.24 0.00 -0.02 0.00 0.00 35.03 34.32 3kez n LYS 325 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 3kez n ILE 326 N -1.35 1.18 -2.94 -0.18 -6.64 -0.71 -4.89 119.36 103.83 3kez n ILE 326 Ca 0.07 -1.08 -0.40 0.00 -1.77 0.00 0.00 62.75 59.57 3kez n ILE 326 Cb 0.16 0.41 -0.04 0.00 -1.44 0.00 0.00 39.64 38.73 3kez n ILE 326 CO 0.00 0.00 0.00 -0.76 -1.77 0.00 0.00 176.55 174.02 3kez s LEU 327 N -1.21 4.38 -0.24 7.28 1.43 -1.03 0.08 118.68 129.37 3kez s LEU 327 Ca 0.36 1.39 -0.05 0.00 -1.03 0.00 0.00 54.13 54.80 3kez s LEU 327 Cb 0.20 -3.25 -0.01 0.00 0.03 0.00 0.00 46.19 43.16 3kez s LEU 327 CO 0.22 -0.10 0.01 -0.55 0.23 0.00 0.00 176.35 176.15 3kez s SER 328 N 0.54 4.66 -0.25 2.29 0.15 0.12 -4.90 113.70 116.31 3kez s SER 328 Ca 0.41 -0.39 -0.13 0.00 0.70 0.00 0.00 55.95 56.55 3kez s SER 328 Cb -0.19 -1.81 -0.04 0.00 -1.71 0.00 0.00 66.02 62.26 3kez s SER 328 CO 0.22 -0.05 0.27 -0.36 1.20 0.00 0.00 173.24 174.53 3kez s PHE 329 N 1.52 3.29 -0.65 3.44 0.40 -1.26 0.21 117.98 124.92 3kez s PHE 329 Ca 0.05 0.33 -0.27 0.00 -0.60 0.00 0.00 56.93 56.44 3kez s PHE 329 Cb -0.15 -2.43 0.02 0.00 0.51 0.00 0.00 43.02 40.97 3kez s PHE 329 CO -0.01 -0.08 1.35 0.34 0.70 0.00 0.00 175.22 177.53 3kez s ASP 330 N 1.37 6.12 0.53 1.36 2.15 -0.25 -4.90 116.67 123.05 3kez s ASP 330 Ca 0.12 -0.08 0.00 0.00 0.43 0.00 0.00 52.55 53.02 3kez s ASP 330 Cb -0.15 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.92 3kez s ASP 330 CO 0.08 -1.79 0.00 0.29 -0.17 0.00 0.00 175.17 173.58 3kez n LYS 331 N 8.99 0.00 -1.82 4.34 4.76 -1.26 -0.07 118.16 133.10 3kez n LYS 331 Ca 0.08 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.29 3kez n LYS 331 Cb 0.49 0.00 0.04 0.00 -1.84 0.00 0.00 35.03 33.73 3kez n LYS 331 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3kez n LYS 332 N 14.00 3.34 -0.07 1.97 5.02 -1.26 -4.81 118.16 136.35 3kez n LYS 332 Ca 0.00 -3.98 -0.15 0.00 -2.02 0.00 0.00 58.31 52.16 3kez n LYS 332 Cb 0.00 -2.23 -0.05 0.00 -0.02 0.00 0.00 35.03 32.73 3kez n LYS 332 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3kez n TYR 333 N -0.77 0.00 -3.89 2.13 4.01 0.89 -0.23 117.16 119.30 3kez n TYR 333 Ca 0.45 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 58.10 3kez n TYR 333 Cb 0.92 -0.51 -0.08 0.00 -0.31 0.00 0.00 39.34 39.36 3kez n TYR 333 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 3kez s TYR 334 N -2.32 0.21 -0.10 -0.72 2.02 -1.19 -1.40 117.35 113.85 3kez s TYR 334 Ca -0.21 -0.66 0.01 0.00 -0.37 0.00 0.00 57.07 55.84 3kez s TYR 334 Cb 0.07 -0.11 0.02 0.00 -0.40 0.00 0.00 41.96 41.55 3kez s TYR 334 CO 0.27 -0.53 -0.11 0.00 -1.57 0.00 0.00 175.55 173.61 3kez s ALA 335 N -3.87 1.40 0.06 3.71 0.00 -1.26 -1.09 121.76 120.70 3kez s ALA 335 Ca 0.06 -0.56 -0.01 0.00 0.00 0.00 0.00 51.96 51.44 3kez s ALA 335 Cb 0.05 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 3kez s ALA 335 CO -0.10 -0.18 0.23 0.71 0.00 0.00 0.00 175.76 176.41 3kez s TYR 336 N 1.23 3.52 -0.55 0.00 2.02 0.13 -2.38 117.35 121.32 3kez s TYR 336 Ca -0.03 0.32 -0.24 0.00 -0.37 0.00 0.00 57.07 56.75 3kez s TYR 336 Cb -0.14 -1.81 0.04 0.00 -0.40 0.00 0.00 41.96 39.65 3kez s TYR 336 CO -0.03 0.58 0.94 0.08 -1.57 0.00 0.00 175.55 175.54 3kez s VAL 337 N -1.49 4.40 -0.30 0.71 1.01 -1.26 0.11 120.40 123.58 3kez s VAL 337 Ca 0.34 0.24 -0.04 0.00 0.00 0.00 0.00 61.98 62.52 3kez s VAL 337 Cb -0.13 -4.54 -0.03 0.00 0.00 0.00 0.00 36.38 31.68 3kez s VAL 337 CO 0.25 -1.12 2.98 -3.20 0.00 0.00 0.00 175.10 174.01 3kez n ASN 338 N 7.45 6.06 0.13 3.32 5.15 0.11 -4.40 115.26 133.08 3kez n ASN 338 Ca 0.01 -2.96 0.08 0.00 -0.60 0.00 0.00 54.58 51.12 3kez n ASN 338 Cb 0.47 -1.28 0.04 0.00 -0.53 0.00 0.00 39.78 38.48 3kez n ASN 338 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 3kez h LYS 339 N 2.86 0.00 -2.78 1.20 1.57 -1.91 -3.40 116.57 114.12 3kez h LYS 339 Ca 0.32 0.00 -0.79 0.00 -1.87 0.00 0.00 60.65 58.31 3kez h LYS 339 Cb 0.98 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 33.07 3kez h LYS 339 CO 0.65 0.14 1.40 0.66 -0.57 0.00 0.00 179.45 181.73 3kez n TYR 340 N -2.93 2.58 -3.04 -1.35 4.01 -1.26 -4.76 117.16 110.40 3kez n TYR 340 Ca -0.00 -2.65 -0.39 0.00 -0.16 0.00 0.00 57.90 54.69 3kez n TYR 340 Cb 0.63 -1.47 -0.05 0.00 -0.31 0.00 0.00 39.34 38.13 3kez n TYR 340 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3kez s GLN 341 N -2.35 4.46 0.49 -0.72 -0.21 -1.26 -4.64 119.66 115.42 3kez s GLN 341 Ca 0.39 1.00 -0.22 0.00 0.02 0.00 0.00 55.36 56.55 3kez s GLN 341 Cb 0.12 -3.33 -0.07 0.00 1.00 0.00 0.00 33.01 30.73 3kez s GLN 341 CO -0.02 0.38 1.13 -1.25 -2.12 0.00 0.00 175.29 173.42 3kez s PRO 342 N -0.36 3.65 1.04 2.91 0.04 -1.26 -4.29 135.00 136.72 3kez s PRO 342 Ca 0.36 1.67 -0.13 0.00 0.04 0.00 0.00 61.00 62.93 3kez s PRO 342 Cb -0.20 -2.25 0.21 0.00 0.04 0.00 0.00 34.50 32.29 3kez s PRO 342 CO 0.22 -0.62 1.10 -0.65 0.04 0.00 0.00 177.00 177.09 3kez s GLN 343 N -2.93 0.13 0.08 4.56 1.11 -1.26 -4.68 119.66 116.67 3kez s GLN 343 Ca 0.67 0.41 -0.34 0.00 0.01 0.00 0.00 55.36 56.10 3kez s GLN 343 Cb -0.25 -1.71 -0.14 0.00 -1.01 0.00 0.00 33.01 29.90 3kez s GLN 343 CO 0.30 -2.91 1.62 0.94 0.01 0.00 0.00 175.29 175.26 3kez n GLN 344 N -4.28 2.00 -0.32 2.91 0.00 -1.26 -1.42 117.38 115.01 3kez n GLN 344 Ca 0.06 0.72 0.00 0.00 -0.00 0.00 0.00 57.00 57.78 3kez n GLN 344 Cb 0.58 -2.49 0.00 0.00 0.00 0.00 0.00 30.24 28.32 3kez n GLN 344 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3kez n GLY 345 N 3.56 1.67 3.92 1.69 0.00 -1.26 -5.02 105.19 109.74 3kez n GLY 345 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 3kez n GLY 345 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kez s GLU 346 N -0.24 3.57 0.48 1.61 2.02 -0.51 -5.09 118.70 120.54 3kez s GLU 346 Ca 0.00 -0.09 -0.21 0.00 0.02 0.00 0.00 54.97 54.70 3kez s GLU 346 Cb 0.00 -2.61 -0.08 0.00 0.10 0.00 0.00 34.13 31.53 3kez s GLU 346 CO 0.00 0.13 1.04 1.21 0.02 0.00 0.00 175.26 177.66 3kez s ASN 347 N -3.61 6.36 0.53 -0.19 3.84 -1.26 -4.81 114.94 115.80 3kez s ASN 347 Ca 0.43 1.95 0.28 0.00 0.21 0.00 0.00 52.86 55.73 3kez s ASN 347 Cb -0.10 -2.56 1.43 0.00 -0.55 0.00 0.00 41.25 39.46 3kez s ASN 347 CO 0.34 -0.77 1.93 0.16 -2.79 0.00 0.00 177.10 175.97 3kez h ILE 348 N 1.60 0.63 -0.63 -5.21 3.07 -1.92 -0.94 117.51 114.11 3kez h ILE 348 Ca -0.49 -0.01 0.17 0.00 1.55 0.00 0.00 64.86 66.08 3kez h ILE 348 Cb 1.22 0.61 -0.03 0.00 -0.27 0.00 0.00 36.82 38.35 3kez h ILE 348 CO 0.59 0.00 0.45 0.71 -1.05 0.00 0.00 178.15 178.85 3kez h THR 349 N 0.02 0.71 -0.45 0.16 1.35 -1.90 -2.31 112.91 110.50 3kez h THR 349 Ca 0.36 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 66.20 3kez h THR 349 Cb 1.42 0.64 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 3kez h THR 349 CO -0.01 0.01 0.00 0.47 -0.25 0.00 0.00 175.52 175.74 3kez n ASP 350 N -4.37 4.71 -4.66 5.36 8.00 -0.36 -4.59 116.55 120.64 3kez n ASP 350 Ca 0.12 -2.85 -0.44 0.00 0.71 0.00 0.00 54.79 52.33 3kez n ASP 350 Cb 0.66 -0.59 -0.01 0.00 -0.02 0.00 0.00 41.12 41.16 3kez n ASP 350 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kez n ALA 351 N 0.23 0.73 -1.05 2.24 0.00 -0.87 -4.43 120.51 117.36 3kez n ALA 351 Ca 0.24 0.38 -0.30 0.00 0.00 0.00 0.00 53.44 53.76 3kez n ALA 351 Cb 0.99 -2.18 0.15 0.00 0.00 0.00 0.00 19.45 18.41 3kez n ALA 351 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3kez s ASN 352 N -0.27 3.28 -0.22 0.00 0.01 -1.26 -4.65 114.94 111.83 3kez s ASN 352 Ca 0.59 1.68 -0.04 0.00 -0.71 0.00 0.00 52.86 54.38 3kez s ASN 352 Cb -0.63 -2.32 -0.01 0.00 0.41 0.00 0.00 41.25 38.69 3kez s ASN 352 CO 0.59 -2.79 -0.02 -0.63 -1.51 0.00 0.00 177.10 172.74 3kez s ILE 353 N -2.82 3.59 -1.31 0.60 -1.09 -0.35 -4.80 121.20 115.02 3kez s ILE 353 Ca 0.64 -0.42 -0.14 0.00 -2.23 0.00 0.00 60.65 58.50 3kez s ILE 353 Cb -0.19 -2.63 0.12 0.00 -1.58 0.00 0.00 42.46 38.17 3kez s ILE 353 CO 0.58 0.42 1.80 -0.81 -1.23 0.00 0.00 174.94 175.69 3kez n PRO 354 N 4.68 3.28 -0.02 2.79 -0.04 -1.26 -1.36 135.00 143.06 3kez n PRO 354 Ca -0.18 -3.35 -0.17 0.00 -0.04 0.00 0.00 63.50 59.76 3kez n PRO 354 Cb 0.51 -3.19 -0.08 0.00 -0.04 0.00 0.00 33.50 30.71 3kez n PRO 354 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3kez h LEU 355 N 10.06 0.91 -7.77 1.53 5.85 -1.73 -3.40 115.31 120.76 3kez h LEU 355 Ca 0.43 -0.64 -0.55 0.00 0.84 0.00 0.00 57.88 57.96 3kez h LEU 355 Cb 0.76 -0.27 -0.36 0.00 0.37 0.00 0.00 40.66 41.16 3kez h LEU 355 CO 1.53 1.40 -0.81 -0.63 -0.34 0.00 0.00 178.44 179.59 3kez s ILE 356 N -3.71 1.18 0.12 4.05 1.01 -0.83 -4.97 121.20 118.04 3kez s ILE 356 Ca -0.11 -0.39 0.07 0.00 0.00 0.00 0.00 60.65 60.23 3kez s ILE 356 Cb 0.08 -1.16 -0.04 0.00 0.01 0.00 0.00 42.46 41.35 3kez s ILE 356 CO 0.90 0.39 -0.07 -0.13 0.00 0.00 0.00 174.94 176.03 3kez s ARG 357 N 1.60 2.21 0.45 2.79 0.52 -1.26 0.24 118.95 125.49 3kez s ARG 357 Ca 0.04 -1.04 0.15 0.00 -0.52 0.00 0.00 55.73 54.36 3kez s ARG 357 Cb -0.13 -2.33 1.07 0.00 0.52 0.00 0.00 34.95 34.09 3kez s ARG 357 CO -0.08 0.49 1.98 1.25 0.02 0.00 0.00 175.30 178.96 3kez h LEU 358 N 3.36 0.32 -1.40 2.53 5.85 -1.15 -0.57 115.31 124.25 3kez h LEU 358 Ca -0.48 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.30 3kez h LEU 358 Cb 1.18 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.11 3kez h LEU 358 CO 0.54 0.19 0.46 0.28 -0.34 0.00 0.00 178.44 179.57 3kez h SER 359 N 0.36 0.65 -0.63 1.25 0.02 -1.96 -1.73 113.55 111.51 3kez h SER 359 Ca 0.27 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.17 3kez h SER 359 Cb 0.59 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.97 3kez h SER 359 CO -0.07 0.42 0.19 -0.08 -1.14 0.00 0.00 176.83 176.15 3kez h GLU 360 N 0.74 1.01 -1.00 3.45 4.81 -1.50 -1.79 114.58 120.30 3kez h GLU 360 Ca 0.30 -0.21 0.01 0.00 -0.13 0.00 0.00 59.36 59.33 3kez h GLU 360 Cb 0.23 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.41 3kez h GLU 360 CO -0.09 0.88 0.66 0.00 -0.73 0.00 0.00 179.01 179.73 3kez h ALA 361 N 1.23 1.28 -0.27 2.92 0.00 -1.33 0.46 119.26 123.55 3kez h ALA 361 Ca 0.21 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3kez h ALA 361 Cb 0.30 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3kez h ALA 361 CO -0.01 0.65 0.10 1.88 0.00 0.00 0.00 179.25 181.87 3kez h TYR 362 N 1.35 0.41 -0.42 0.00 -1.99 -1.13 -0.52 116.97 114.67 3kez h TYR 362 Ca 0.37 -0.03 -0.06 0.00 2.00 0.00 0.00 58.73 61.01 3kez h TYR 362 Cb -0.14 -0.12 -0.02 0.00 2.00 0.00 0.00 36.73 38.45 3kez h TYR 362 CO -0.00 0.42 0.02 -0.07 -0.00 0.00 0.00 178.16 178.53 3kez h LEU 363 N 0.28 0.62 -0.30 3.88 3.38 -0.57 0.37 115.31 122.97 3kez h LEU 363 Ca 0.09 -0.13 -0.15 0.00 0.09 0.00 0.00 57.88 57.78 3kez h LEU 363 Cb 0.19 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3kez h LEU 363 CO -0.01 0.68 -0.39 0.78 0.09 0.00 0.00 178.44 179.60 3kez h ASN 364 N 0.63 0.87 -0.33 -0.43 2.35 0.07 -1.75 115.58 116.99 3kez h ASN 364 Ca 0.13 -0.49 -0.00 0.00 -0.55 0.00 0.00 56.30 55.38 3kez h ASN 364 Cb 0.36 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 3kez h ASN 364 CO 0.01 1.19 0.19 0.00 -1.65 0.00 0.00 177.43 177.17 3kez h ALA 365 N 0.70 0.42 -0.33 -0.83 0.00 -0.57 -0.95 119.26 117.71 3kez h ALA 365 Ca 0.04 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.94 3kez h ALA 365 Cb 0.98 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.59 3kez h ALA 365 CO 0.09 -0.07 0.05 0.00 0.00 0.00 0.00 179.25 179.32 3kez h ALA 366 N 1.06 0.33 -0.34 0.00 0.00 -0.86 0.05 119.26 119.50 3kez h ALA 366 Ca 0.12 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3kez h ALA 366 Cb 0.04 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3kez h ALA 366 CO -0.02 -0.36 0.13 1.49 0.00 0.00 0.00 179.25 180.49 3kez h GLU 367 N 0.16 0.52 -0.77 0.00 4.81 -1.18 -1.45 114.58 116.67 3kez h GLU 367 Ca 0.15 -0.10 -0.03 0.00 -0.13 0.00 0.00 59.36 59.26 3kez h GLU 367 Cb 0.18 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 3kez h GLU 367 CO -0.22 0.53 0.38 0.00 -0.73 0.00 0.00 179.01 178.97 3kez h ALA 368 N 0.97 0.99 -0.65 2.92 0.00 -0.93 -0.89 119.26 121.67 3kez h ALA 368 Ca 0.11 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3kez h ALA 368 Cb 0.21 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3kez h ALA 368 CO -0.01 0.54 0.25 0.00 0.00 0.00 0.00 179.25 180.04 3kez h ALA 369 N 1.20 0.85 -0.02 0.00 0.00 -0.85 0.15 119.26 120.58 3kez h ALA 369 Ca 0.27 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3kez h ALA 369 Cb 0.10 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3kez h ALA 369 CO -0.04 0.48 0.01 0.28 0.00 0.00 0.00 179.25 179.98 3kez h VAL 370 N 0.92 1.02 0.00 0.00 2.07 -0.90 0.31 116.25 119.67 3kez h VAL 370 Ca 0.22 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.68 3kez h VAL 370 Cb 0.22 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3kez h VAL 370 CO -0.02 0.02 0.00 1.56 0.02 0.00 0.00 177.57 179.15 3kez h GLN 371 N 0.01 0.00 -0.55 1.57 1.08 -0.87 -2.04 115.11 114.31 3kez h GLN 371 Ca 0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 3kez h GLN 371 Cb 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 3kez h GLN 371 CO -0.00 0.00 0.00 0.25 -0.95 0.00 0.00 178.83 178.13 3kez n THR 372 N -2.78 0.72 -1.12 -0.54 -2.24 0.50 -4.96 114.28 103.85 3kez n THR 372 Ca 0.01 -0.84 -0.04 0.00 -2.27 0.00 0.00 64.05 60.91 3kez n THR 372 Cb 0.28 0.72 -0.02 0.00 -2.10 0.00 0.00 70.33 69.21 3kez n THR 372 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kez n GLY 373 N 1.56 0.70 3.28 3.38 0.00 -0.77 -4.99 105.19 108.35 3kez n GLY 373 Ca 0.22 -0.73 -0.44 0.00 0.00 0.00 0.00 46.02 45.07 3kez n GLY 373 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3kez s ASP 374 N -2.82 6.75 0.23 1.61 -1.08 0.10 -4.88 116.67 116.58 3kez s ASP 374 Ca 0.00 -3.25 -0.02 0.00 -0.52 0.00 0.00 52.55 48.76 3kez s ASP 374 Cb 0.00 -2.13 0.23 0.00 -1.46 0.00 0.00 42.92 39.56 3kez s ASP 374 CO 0.00 -0.37 1.61 -1.13 0.52 0.00 0.00 175.17 175.80 3kez h ASN 375 N 6.96 0.63 -0.81 -0.34 -1.24 -1.92 -2.03 115.58 116.84 3kez h ASN 375 Ca 0.14 -0.26 0.05 0.00 0.71 0.00 0.00 56.30 56.93 3kez h ASN 375 Cb 0.93 -0.17 -0.05 0.00 0.73 0.00 0.00 38.32 39.75 3kez h ASN 375 CO 0.87 0.92 0.50 0.00 -1.29 0.00 0.00 177.43 178.44 3kez h ALA 376 N 1.11 1.09 -0.46 1.57 0.00 -1.95 -0.68 119.26 119.94 3kez h ALA 376 Ca 0.05 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 3kez h ALA 376 Cb 0.84 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3kez h ALA 376 CO 0.07 0.28 -0.17 0.87 0.00 0.00 0.00 179.25 180.30 3kez h LYS 377 N 0.95 0.93 -0.59 0.00 1.57 -1.90 -1.25 116.57 116.28 3kez h LYS 377 Ca 0.34 -0.38 0.05 0.00 -1.87 0.00 0.00 60.65 58.78 3kez h LYS 377 Cb 0.09 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 3kez h LYS 377 CO -0.14 1.04 0.32 0.00 -0.57 0.00 0.00 179.45 180.10 3kez h ALA 378 N 0.86 0.77 -0.18 3.86 0.00 -0.70 -1.12 119.26 122.75 3kez h ALA 378 Ca 0.11 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3kez h ALA 378 Cb 0.73 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3kez h ALA 378 CO 0.06 0.00 0.10 0.28 0.00 0.00 0.00 179.25 179.69 3kez h VAL 379 N 0.62 1.11 -0.11 0.00 2.07 -1.04 -1.14 116.25 117.75 3kez h VAL 379 Ca 0.26 -0.29 0.03 0.00 0.82 0.00 0.00 66.70 67.52 3kez h VAL 379 Cb 0.13 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 3kez h VAL 379 CO -0.16 0.10 -0.11 0.50 0.02 0.00 0.00 177.57 177.92 3kez h LYS 380 N 0.19 -0.13 -0.10 1.57 3.64 -0.63 0.59 116.57 121.70 3kez h LYS 380 Ca 0.06 0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.31 3kez h LYS 380 Cb 0.07 0.03 0.01 0.00 -0.41 0.00 0.00 32.23 31.93 3kez h LYS 380 CO -0.01 -0.09 -0.48 1.88 -2.27 0.00 0.00 179.45 178.48 3kez h TYR 381 N -0.14 0.67 -0.63 1.91 0.05 -1.16 -3.22 116.97 114.45 3kez h TYR 381 Ca 0.08 -0.30 -0.07 0.00 0.05 0.00 0.00 58.73 58.49 3kez h TYR 381 Cb 0.25 -0.10 -0.03 0.00 1.01 0.00 0.00 36.73 37.86 3kez h TYR 381 CO -0.22 1.07 0.10 1.25 -1.05 0.00 0.00 178.16 179.31 3kez h LEU 382 N 0.08 0.98 -1.61 3.88 5.85 -1.13 -2.55 115.31 120.81 3kez h LEU 382 Ca -0.03 -0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.44 3kez h LEU 382 Cb 1.13 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 3kez h LEU 382 CO 0.10 0.97 -0.05 -1.13 -0.34 0.00 0.00 178.44 177.99 3kez h ASN 383 N 0.96 0.17 -0.82 1.25 -1.24 -0.93 -0.70 115.58 114.27 3kez h ASN 383 Ca 0.19 -0.02 0.06 0.00 0.71 0.00 0.00 56.30 57.24 3kez h ASN 383 Cb 0.41 -0.04 -0.05 0.00 0.73 0.00 0.00 38.32 39.37 3kez h ASN 383 CO 0.01 0.25 0.54 0.28 -1.29 0.00 0.00 177.43 177.22 3kez h SER 384 N 0.18 0.82 0.07 1.15 0.02 -1.46 0.92 113.55 115.25 3kez h SER 384 Ca 0.04 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.84 3kez h SER 384 Cb 0.21 -0.18 0.02 0.00 0.14 0.00 0.00 62.40 62.59 3kez h SER 384 CO 0.01 0.54 -0.64 0.40 -1.14 0.00 0.00 176.83 176.00 3kez h ILE 385 N 0.94 1.50 -0.23 3.27 1.08 -1.22 -2.82 117.51 120.03 3kez h ILE 385 Ca 0.35 -2.31 0.03 0.00 -0.39 0.00 0.00 64.86 62.54 3kez h ILE 385 Cb 0.17 2.96 -0.03 0.00 -3.07 0.00 0.00 36.82 36.85 3kez h ILE 385 CO -0.12 0.65 0.05 0.58 -0.69 0.00 0.00 178.15 178.63 3kez h VAL 386 N -0.33 0.91 0.00 1.67 2.07 -1.15 -2.19 116.25 117.23 3kez h VAL 386 Ca -0.10 -0.05 -0.12 0.00 0.82 0.00 0.00 66.70 67.25 3kez h VAL 386 Cb 1.43 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 3kez h VAL 386 CO 0.12 0.03 -0.55 1.56 0.02 0.00 0.00 177.57 178.74 3kez h GLN 387 N 0.15 0.00 -0.37 1.57 4.20 -0.92 -2.01 115.11 117.72 3kez h GLN 387 Ca 0.10 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.74 3kez h GLN 387 Cb 0.09 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 3kez h GLN 387 CO -0.13 0.55 -0.09 -0.09 -0.67 0.00 0.00 178.83 178.41 3kez h ARG 388 N 0.00 0.63 -0.18 1.46 1.12 -1.26 -2.25 114.38 113.91 3kez h ARG 388 Ca -0.01 -0.18 -0.20 0.00 -1.11 0.00 0.00 59.98 58.48 3kez h ARG 388 Cb 1.12 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 31.01 3kez h ARG 388 CO 0.07 0.72 -0.69 0.00 -3.11 0.00 0.00 179.97 176.96 3kez h ALA 389 N 1.32 0.45 -1.31 2.80 0.00 -0.98 -3.33 119.26 118.20 3kez h ALA 389 Ca 0.11 -0.57 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 3kez h ALA 389 Cb 0.50 -0.05 -0.24 0.00 0.00 0.00 0.00 17.79 18.01 3kez h ALA 389 CO 0.03 0.70 -0.35 1.21 0.00 0.00 0.00 179.25 180.83 3kez s ASN 390 N -7.03 -0.82 0.00 0.00 3.84 -0.79 -1.09 114.94 109.06 3kez s ASN 390 Ca -0.09 0.58 0.11 0.00 0.21 0.00 0.00 52.86 53.67 3kez s ASN 390 Cb 0.10 1.78 0.48 0.00 -0.55 0.00 0.00 41.25 43.06 3kez s ASN 390 CO 0.88 -0.28 1.31 -0.81 -2.79 0.00 0.00 177.10 175.41 3kez n PRO 391 N 5.41 0.05 0.16 0.43 -0.04 -0.85 -1.62 135.00 138.53 3kez n PRO 391 Ca -0.01 0.28 0.13 0.00 -0.04 0.00 0.00 63.50 63.85 3kez n PRO 391 Cb 0.51 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.75 3kez n PRO 391 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3kez h GLU 392 N 0.00 0.00 -7.00 0.54 5.08 -1.94 -3.46 114.58 107.81 3kez h GLU 392 Ca 0.00 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.86 3kez h GLU 392 Cb 0.16 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.44 3kez h GLU 392 CO 0.00 0.00 0.19 -0.80 -1.00 0.00 0.00 179.01 177.40 3kez s ASN 393 N -5.38 6.35 -0.20 1.42 0.01 -0.64 -5.10 114.94 111.40 3kez s ASN 393 Ca 0.09 1.12 -0.27 0.00 -0.71 0.00 0.00 52.86 53.08 3kez s ASN 393 Cb 0.09 -2.33 0.08 0.00 0.41 0.00 0.00 41.25 39.50 3kez s ASN 393 CO 0.64 -0.58 0.75 -0.55 -1.51 0.00 0.00 177.10 175.84 3kez s SER 394 N -3.79 -0.68 0.00 -1.22 0.15 -1.26 -4.54 113.70 102.37 3kez s SER 394 Ca 0.51 1.14 0.18 0.00 0.70 0.00 0.00 55.95 58.47 3kez s SER 394 Cb -0.10 1.09 0.43 0.00 -1.71 0.00 0.00 66.02 65.72 3kez s SER 394 CO 0.42 -0.35 1.35 1.33 1.20 0.00 0.00 173.24 177.18 3kez n VAL 395 N 2.03 0.79 -1.68 4.45 0.24 -1.26 -4.99 118.33 117.91 3kez n VAL 395 Ca -0.15 -0.89 -0.44 0.00 -2.04 0.00 0.00 64.34 60.81 3kez n VAL 395 Cb 0.56 0.69 -0.02 0.00 -1.47 0.00 0.00 33.84 33.59 3kez n VAL 395 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3kez n GLU 396 N 1.14 2.08 -0.62 7.34 1.02 -1.26 -1.70 120.64 128.64 3kez n GLU 396 Ca 0.17 0.74 0.00 0.00 -0.02 0.00 0.00 57.16 58.05 3kez n GLU 396 Cb 0.52 -2.40 0.00 0.00 -0.02 0.00 0.00 31.44 29.54 3kez n GLU 396 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3kez n GLY 397 N 2.04 1.12 3.89 0.62 0.00 -1.26 -5.04 105.19 106.56 3kez n GLY 397 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 3kez n GLY 397 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kez s LYS 398 N -0.25 3.67 -0.52 1.61 -0.14 -0.69 -5.05 119.74 118.38 3kez s LYS 398 Ca 0.00 0.03 -0.17 0.00 -1.36 0.00 0.00 55.97 54.46 3kez s LYS 398 Cb 0.00 -2.77 0.08 0.00 -1.68 0.00 0.00 37.83 33.47 3kez s LYS 398 CO 0.00 0.40 0.55 0.99 -0.76 0.00 0.00 175.35 176.53 3kez s THR 399 N -1.74 5.02 0.38 2.17 2.01 -1.26 -4.96 115.64 117.26 3kez s THR 399 Ca 0.43 -0.94 -0.25 0.00 0.31 0.00 0.00 61.69 61.24 3kez s THR 399 Cb -0.12 -4.30 -0.09 0.00 0.01 0.00 0.00 72.50 68.00 3kez s THR 399 CO 0.24 -0.82 1.05 -0.76 -0.69 0.00 0.00 174.62 173.64 3kez s LEU 400 N 2.18 4.22 0.34 4.42 1.43 -1.26 -5.06 118.68 124.95 3kez s LEU 400 Ca 0.09 2.06 0.09 0.00 -1.03 0.00 0.00 54.13 55.34 3kez s LEU 400 Cb -0.24 -4.09 -0.05 0.00 0.03 0.00 0.00 46.19 41.84 3kez s LEU 400 CO 0.08 -0.41 0.02 0.42 0.23 0.00 0.00 176.35 176.69 3kez s THR 401 N -1.58 2.67 0.19 5.49 -4.23 -1.26 -4.94 115.64 111.98 3kez s THR 401 Ca 0.55 -1.95 -0.11 0.00 -1.18 0.00 0.00 61.69 58.99 3kez s THR 401 Cb -0.23 -2.81 0.11 0.00 1.34 0.00 0.00 72.50 70.91 3kez s THR 401 CO 0.29 -0.20 1.80 0.25 -0.54 0.00 0.00 174.62 176.22 3kez h LEU 402 N 1.79 0.45 -1.04 4.79 5.85 -1.95 -2.37 115.31 122.84 3kez h LEU 402 Ca -0.43 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.36 3kez h LEU 402 Cb 1.25 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 42.17 3kez h LEU 402 CO 0.66 0.30 0.64 -0.08 -0.34 0.00 0.00 178.44 179.63 3kez h GLU 403 N 0.58 1.19 -0.42 1.25 4.81 -1.98 -0.16 114.58 119.86 3kez h GLU 403 Ca 0.26 -0.07 0.06 0.00 -0.13 0.00 0.00 59.36 59.48 3kez h GLU 403 Cb 0.15 -0.27 -0.05 0.00 0.63 0.00 0.00 28.75 29.21 3kez h GLU 403 CO -0.17 0.79 0.10 -0.91 -0.73 0.00 0.00 179.01 178.10 3kez h ASN 404 N 1.23 0.06 -0.22 1.04 -0.26 -1.84 0.04 115.58 115.63 3kez h ASN 404 Ca 0.40 0.06 -0.06 0.00 -0.56 0.00 0.00 56.30 56.14 3kez h ASN 404 Cb 0.03 0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.36 3kez h ASN 404 CO -0.13 0.07 -0.11 0.58 -1.06 0.00 0.00 177.43 176.78 3kez h VAL 405 N 0.25 1.31 0.00 2.81 2.07 -0.86 -2.40 116.25 119.42 3kez h VAL 405 Ca 0.20 -1.19 -0.04 0.00 0.82 0.00 0.00 66.70 66.49 3kez h VAL 405 Cb 0.23 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 3kez h VAL 405 CO -0.24 0.36 -0.20 -0.07 0.02 0.00 0.00 177.57 177.44 3kez h LEU 406 N 0.16 0.00 -0.68 2.57 3.38 -0.87 0.22 115.31 120.09 3kez h LEU 406 Ca 0.05 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 3kez h LEU 406 Cb 0.61 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 3kez h LEU 406 CO 0.03 0.20 -0.61 0.44 0.09 0.00 0.00 178.44 178.59 3kez h ASP 407 N 0.00 0.00 0.05 -0.43 3.32 -0.81 -0.55 116.42 118.00 3kez h ASP 407 Ca -0.00 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.78 3kez h ASP 407 Cb 0.38 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.95 3kez h ASP 407 CO 0.03 0.61 -1.08 -0.08 -1.72 0.00 0.00 179.24 176.99 3kez h GLU 408 N 0.00 0.65 -0.97 3.56 4.57 -0.83 -3.27 114.58 118.29 3kez h GLU 408 Ca -0.01 -0.76 0.05 0.00 -1.18 0.00 0.00 59.36 57.46 3kez h GLU 408 Cb 1.14 0.23 -0.06 0.00 -0.16 0.00 0.00 28.75 29.90 3kez h GLU 408 CO 0.08 1.33 0.63 -0.09 -1.18 0.00 0.00 179.01 179.78 3kez h ARG 409 N 0.30 1.14 -0.04 1.92 2.43 -0.33 -1.39 114.38 118.41 3kez h ARG 409 Ca -0.15 -0.07 -0.12 0.00 -0.81 0.00 0.00 59.98 58.83 3kez h ARG 409 Cb 1.75 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 31.03 3kez h ARG 409 CO 0.21 0.76 -0.52 0.07 -1.51 0.00 0.00 179.97 178.97 3kez h ARG 410 N 1.18 0.10 -0.21 0.20 0.11 -1.20 0.14 114.38 114.69 3kez h ARG 410 Ca 0.41 -0.06 -0.19 0.00 0.10 0.00 0.00 59.98 60.24 3kez h ARG 410 Cb 0.10 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.19 3kez h ARG 410 CO -0.15 0.60 -0.59 0.87 0.10 0.00 0.00 179.97 180.80 3kez h LYS 411 N 0.08 0.78 -0.02 0.08 1.57 -1.50 -3.01 116.57 114.54 3kez h LYS 411 Ca -0.00 -0.55 -0.20 0.00 -1.87 0.00 0.00 60.65 58.02 3kez h LYS 411 Cb 0.95 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.34 3kez h LYS 411 CO 0.07 1.17 -0.85 1.49 -0.57 0.00 0.00 179.45 180.76 3kez h GLU 412 N 0.52 0.35 -0.32 3.15 4.57 -0.53 -3.35 114.58 118.97 3kez h GLU 412 Ca -0.01 -0.35 0.00 0.00 -1.18 0.00 0.00 59.36 57.82 3kez h GLU 412 Cb 1.21 0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.89 3kez h GLU 412 CO 0.13 1.02 0.00 1.28 -1.18 0.00 0.00 179.01 180.26 3kez n LEU 413 N -3.76 2.98 -4.66 1.64 4.77 0.42 -5.01 117.00 113.38 3kez n LEU 413 Ca -0.05 -2.11 -0.45 0.00 -0.03 0.00 0.00 56.01 53.36 3kez n LEU 413 Cb 0.78 -0.25 -0.03 0.00 -2.33 0.00 0.00 43.42 41.59 3kez n LEU 413 CO 0.49 0.71 0.98 0.55 -1.33 0.00 0.00 177.39 178.80 3kez n VAL 414 N 0.34 0.93 -1.01 4.08 3.14 -1.14 -1.52 118.33 123.16 3kez n VAL 414 Ca 0.12 -0.23 -0.00 0.00 -2.96 0.00 0.00 64.34 61.27 3kez n VAL 414 Cb 0.47 -1.40 -0.00 0.00 -1.06 0.00 0.00 33.84 31.85 3kez n VAL 414 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3kez n ALA 415 N 1.88 -0.00 -0.18 1.55 0.00 -1.26 -4.87 120.51 117.63 3kez n ALA 415 Ca 0.12 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.60 3kez n ALA 415 Cb 0.31 -0.64 0.11 0.00 0.00 0.00 0.00 19.45 19.22 3kez n ALA 415 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3kez n GLU 416 N -1.39 2.88 -0.70 0.00 1.02 -0.58 -4.87 120.64 117.01 3kez n GLU 416 Ca -0.00 -1.92 0.00 0.00 -0.02 0.00 0.00 57.16 55.22 3kez n GLU 416 Cb 0.21 -1.21 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 3kez n GLU 416 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3kez n GLY 417 N 0.09 0.98 0.08 0.62 0.00 -1.22 -4.96 105.19 100.78 3kez n GLY 417 Ca 0.08 -0.46 -0.09 0.00 0.00 0.00 0.00 46.02 45.55 3kez n GLY 417 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3kez n HIS 418 N -2.43 0.00 0.00 1.61 8.25 -1.26 -4.14 115.22 117.24 3kez n HIS 418 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3kez n HIS 418 Cb 0.12 -0.71 0.00 0.00 1.12 0.00 0.00 29.99 30.52 3kez n HIS 418 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 3kez n ARG 419 N -2.71 0.00 0.00 -0.41 3.00 -1.17 -1.51 116.66 113.86 3kez n ARG 419 Ca -0.27 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.58 3kez n ARG 419 Cb 0.93 -0.93 0.00 0.00 0.00 0.00 0.00 32.46 32.45 3kez n ARG 419 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 3kez n TYR 421 N 0.30 0.00 -0.03 -0.14 4.01 -1.26 -2.02 117.16 118.02 3kez n TYR 421 Ca 0.00 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.62 3kez n TYR 421 Cb 0.00 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.04 3kez n TYR 421 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 3kez h ASP 422 N 0.00 0.77 0.29 7.72 3.32 -1.66 -0.73 116.42 126.13 3kez h ASP 422 Ca 0.00 -0.42 -0.01 0.00 0.02 0.00 0.00 57.03 56.62 3kez h ASP 422 Cb 0.00 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.33 3kez h ASP 422 CO 0.00 1.17 -0.14 0.58 -1.72 0.00 0.00 179.24 179.13 3kez h VAL 423 N 0.52 0.73 -0.55 -1.35 2.07 -1.69 -3.32 116.25 112.67 3kez h VAL 423 Ca 0.01 -0.60 -0.08 0.00 0.82 0.00 0.00 66.70 66.85 3kez h VAL 423 Cb 1.14 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 3kez h VAL 423 CO 0.11 0.12 0.03 0.40 0.02 0.00 0.00 177.57 178.25 3kez h ILE 424 N -0.72 1.25 0.00 4.57 1.08 -1.80 -2.85 117.51 119.04 3kez h ILE 424 Ca -0.04 -1.03 0.00 0.00 -0.39 0.00 0.00 64.86 63.40 3kez h ILE 424 Cb 0.49 0.79 0.00 0.00 -3.07 0.00 0.00 36.82 35.03 3kez h ILE 424 CO 0.06 0.37 0.00 0.08 -0.69 0.00 0.00 178.15 177.98 3kez h ARG 425 N 0.86 0.00 -0.57 2.37 0.11 -1.26 -2.05 114.38 113.84 3kez h ARG 425 Ca 0.17 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.25 3kez h ARG 425 Cb 0.46 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.54 3kez h ARG 425 CO 0.02 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.18 3kez n ASN 426 N -2.87 3.10 -2.00 0.08 3.02 -1.07 -4.64 115.26 110.87 3kez n ASN 426 Ca 0.01 -2.03 -0.01 0.00 -0.03 0.00 0.00 54.58 52.52 3kez n ASN 426 Cb 0.31 -0.39 0.01 0.00 -0.61 0.00 0.00 39.78 39.09 3kez n ASN 426 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kez n GLY 427 N 1.36 -0.38 2.79 7.41 0.00 -0.77 -5.11 105.19 110.48 3kez n GLY 427 Ca 0.19 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.03 3kez n GLY 427 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kez s THR 429 N -3.03 0.16 0.00 2.61 2.01 -1.26 -4.98 115.64 111.15 3kez s THR 429 Ca 0.04 0.13 -0.30 0.00 0.31 0.00 0.00 61.69 61.86 3kez s THR 429 Cb -0.00 -0.28 -0.05 0.00 0.01 0.00 0.00 72.50 72.17 3kez s THR 429 CO 0.23 0.16 1.25 -0.69 -0.69 0.00 0.00 174.62 174.88 3kez s VAL 430 N 1.26 4.03 -0.32 3.82 1.01 0.38 -4.88 120.40 125.71 3kez s VAL 430 Ca -0.06 1.41 0.00 0.00 0.00 0.00 0.00 61.98 63.33 3kez s VAL 430 Cb -0.13 -3.91 0.10 0.00 0.00 0.00 0.00 36.38 32.44 3kez s VAL 430 CO -0.02 0.04 0.08 -0.54 0.00 0.00 0.00 175.10 174.66 3kez s LYS 431 N 1.84 0.92 0.20 2.72 1.02 -1.26 -1.02 119.74 124.15 3kez s LYS 431 Ca 0.59 -1.28 -0.30 0.00 0.02 0.00 0.00 55.97 55.00 3kez s LYS 431 Cb -0.28 -2.31 -0.09 0.00 -0.52 0.00 0.00 37.83 34.63 3kez s LYS 431 CO 0.26 -0.97 1.27 1.03 -0.92 0.00 0.00 175.35 176.02 3kez s ARG 432 N 1.43 4.42 -0.17 1.68 0.52 -1.26 -4.89 118.95 120.68 3kez s ARG 432 Ca 0.10 2.00 -0.00 0.00 -0.52 0.00 0.00 55.73 57.31 3kez s ARG 432 Cb -0.18 -3.21 0.00 0.00 0.52 0.00 0.00 34.95 32.09 3kez s ARG 432 CO -0.21 -0.20 -0.15 0.42 0.02 0.00 0.00 175.30 175.19 3kez s ILE 433 N 0.02 2.65 -0.92 1.52 1.01 -1.26 -4.82 121.20 119.40 3kez s ILE 433 Ca 0.55 -0.76 -0.16 0.00 0.00 0.00 0.00 60.65 60.28 3kez s ILE 433 Cb -0.35 -2.13 0.17 0.00 0.01 0.00 0.00 42.46 40.15 3kez s ILE 433 CO 0.38 0.51 1.01 -0.62 0.00 0.00 0.00 174.94 176.22 3kez s ASP 434 N 1.01 6.73 0.27 3.58 2.15 -1.26 -4.59 116.67 124.56 3kez s ASP 434 Ca -0.02 -2.39 0.10 0.00 0.43 0.00 0.00 52.55 50.67 3kez s ASP 434 Cb -0.15 -2.32 -0.04 0.00 -0.30 0.00 0.00 42.92 40.11 3kez s ASP 434 CO -0.03 -0.84 -0.03 0.68 -0.17 0.00 0.00 175.17 174.78 3kez s VAL 435 N 1.56 3.26 0.21 1.11 -7.23 -1.26 -5.10 120.40 112.95 3kez s VAL 435 Ca 0.28 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.55 3kez s VAL 435 Cb -0.07 -2.75 -0.04 0.00 0.56 0.00 0.00 36.38 34.08 3kez s VAL 435 CO -0.09 -0.37 -0.07 -0.54 -0.31 0.00 0.00 175.10 173.72 3kez s LYS 436 N -3.65 2.11 -0.03 4.82 -0.14 -1.26 -4.69 119.74 116.90 3kez s LYS 436 Ca 0.31 -1.35 -0.01 0.00 -1.36 0.00 0.00 55.97 53.57 3kez s LYS 436 Cb -0.06 -2.13 0.03 0.00 -1.68 0.00 0.00 37.83 33.99 3kez s LYS 436 CO 0.19 0.41 0.06 0.34 -0.76 0.00 0.00 175.35 175.59 3kez s ASP 437 N -3.14 0.02 0.47 2.83 -1.08 -1.26 -5.03 116.67 109.48 3kez s ASP 437 Ca 0.27 0.11 0.26 0.00 -0.52 0.00 0.00 52.55 52.67 3kez s ASP 437 Cb -0.08 0.00 1.09 0.00 -1.46 0.00 0.00 42.92 42.48 3kez s ASP 437 CO 0.17 -0.13 1.90 0.77 0.52 0.00 0.00 175.17 178.39 3kez h SER 438 N 7.26 0.00 1.20 -0.34 4.64 -1.96 -2.53 113.55 121.83 3kez h SER 438 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3kez h SER 438 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3kez h SER 438 CO 0.47 0.19 0.00 0.44 -0.87 0.00 0.00 176.83 177.05 3kez h ASP 439 N 0.00 0.00 -2.08 4.97 3.32 -1.97 -3.34 116.42 117.32 3kez h ASP 439 Ca -0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 3kez h ASP 439 Cb 0.63 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.78 3kez h ASP 439 CO 0.02 0.00 -0.94 2.30 -1.72 0.00 0.00 179.24 178.91 3kez n ILE 440 N -2.70 0.62 1.57 0.35 -5.35 -0.96 -3.73 119.36 109.17 3kez n ILE 440 Ca 0.03 -4.61 0.15 0.00 -0.27 0.00 0.00 62.75 58.05 3kez n ILE 440 Cb 0.35 -1.65 0.78 0.00 -1.74 0.00 0.00 39.64 37.38 3kez n ILE 440 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 3kez n ASN 441 N 0.89 0.12 -0.75 7.28 0.23 0.68 -1.79 115.26 121.92 3kez n ASN 441 Ca 0.25 -0.48 0.12 0.00 -0.53 0.00 0.00 54.58 53.94 3kez n ASN 441 Cb 0.51 -0.16 0.07 0.00 -2.08 0.00 0.00 39.78 38.12 3kez n ASN 441 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3kez n LYS 442 N -1.12 1.85 -2.97 -3.83 5.02 -0.49 -4.92 118.16 111.69 3kez n LYS 442 Ca 0.17 -1.52 -0.42 0.00 -2.02 0.00 0.00 58.31 54.52 3kez n LYS 442 Cb 0.22 -1.47 -0.05 0.00 -0.02 0.00 0.00 35.03 33.71 3kez n LYS 442 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3kez s THR 443 N -2.20 4.76 -0.00 -0.18 2.01 -0.74 -5.00 115.64 114.29 3kez s THR 443 Ca 0.24 0.91 -0.17 0.00 0.31 0.00 0.00 61.69 62.98 3kez s THR 443 Cb 0.19 -4.19 0.03 0.00 0.01 0.00 0.00 72.50 68.55 3kez s THR 443 CO 0.41 -0.39 0.37 -1.59 -0.69 0.00 0.00 174.62 172.73 3kez s LYS 444 N 3.04 0.78 0.61 4.92 -2.85 -1.26 -4.77 119.74 120.22 3kez s LYS 444 Ca 0.31 -0.21 -0.17 0.00 -1.00 0.00 0.00 55.97 54.90 3kez s LYS 444 Cb -0.13 0.35 -0.02 0.00 -2.06 0.00 0.00 37.83 35.96 3kez s LYS 444 CO 0.16 -0.23 1.12 -1.01 0.10 0.00 0.00 175.35 175.49 3kez s HIS 445 N -1.69 2.62 -0.49 1.78 3.76 -1.26 -5.01 115.29 115.01 3kez s HIS 445 Ca -0.11 1.55 0.06 0.00 -0.15 0.00 0.00 55.06 56.42 3kez s HIS 445 Cb -0.03 -3.23 0.20 0.00 1.11 0.00 0.00 32.58 30.62 3kez s HIS 445 CO 0.03 -1.69 0.67 -1.71 -0.85 0.00 0.00 174.74 171.19 3kez n ASN 446 N -1.97 -2.59 -3.56 1.40 5.15 -1.26 -5.14 115.26 107.28 3kez n ASN 446 Ca 0.11 -2.87 -0.16 0.00 -0.60 0.00 0.00 54.58 51.05 3kez n ASN 446 Cb 0.51 1.20 -0.06 0.00 -0.53 0.00 0.00 39.78 40.90 3kez n ASN 446 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 3kez s THR 447 N 0.57 0.00 -0.44 -0.44 -1.32 -1.26 -4.86 115.64 107.88 3kez s THR 447 Ca 0.31 -0.00 0.25 0.00 -1.21 0.00 0.00 61.69 61.04 3kez s THR 447 Cb 0.06 -0.99 0.27 0.00 -1.51 0.00 0.00 72.50 70.33 3kez s THR 447 CO -0.12 -0.00 1.75 0.00 -2.21 0.00 0.00 174.62 174.04 3kez h ALA 448 N 3.76 1.00 -4.29 11.08 0.00 -1.96 -3.52 119.26 125.32 3kez h ALA 448 Ca -0.28 0.00 -0.70 0.00 0.00 0.00 0.00 54.91 53.94 3kez h ALA 448 Cb 1.15 0.00 -0.26 0.00 0.00 0.00 0.00 17.79 18.67 3kez h ALA 448 CO 0.26 0.00 -0.88 0.71 0.00 0.00 0.00 179.25 179.35 3kez s TYR 449 N -3.33 2.33 0.07 0.00 2.02 -1.26 -5.18 117.35 112.00 3kez s TYR 449 Ca 0.05 -0.41 -0.37 0.00 -0.37 0.00 0.00 57.07 55.97 3kez s TYR 449 Cb 0.10 -1.40 -0.17 0.00 -0.40 0.00 0.00 41.96 40.08 3kez s TYR 449 CO 0.44 0.13 1.28 0.39 -1.57 0.00 0.00 175.55 176.22 3kez n GLU 451 N 1.78 0.91 -3.53 -0.62 1.02 -1.26 -4.93 120.64 114.02 3kez n GLU 451 Ca -0.17 0.33 -0.17 0.00 -0.02 0.00 0.00 57.16 57.13 3kez n GLU 451 Cb 0.52 -1.94 -0.06 0.00 -0.02 0.00 0.00 31.44 29.94 3kez n GLU 451 CO 0.00 0.00 0.00 1.52 1.18 0.00 0.00 177.13 179.83 3kez s TYR 452 N 0.36 -0.64 0.00 -0.32 1.13 -0.19 -4.99 117.35 112.70 3kez s TYR 452 Ca 0.85 1.11 0.00 0.00 -1.41 0.00 0.00 57.07 57.62 3kez s TYR 452 Cb -1.02 0.41 0.00 0.00 -1.10 0.00 0.00 41.96 40.25 3kez s TYR 452 CO 0.49 -0.58 0.00 -0.40 -2.51 0.00 0.00 175.55 172.55 3kez n ASP 453 N 0.94 1.74 0.00 -0.18 5.68 -1.26 -0.47 116.55 123.00 3kez n ASP 453 Ca -0.18 -0.17 0.11 0.00 -0.50 0.00 0.00 54.79 54.05 3kez n ASP 453 Cb 0.57 0.00 0.64 0.00 -1.14 0.00 0.00 41.12 41.19 3kez n ASP 453 CO 0.00 0.00 0.00 -2.67 -1.33 0.00 0.00 177.20 173.20 3kez n TRP 454 N 0.00 0.00 1.24 2.11 2.14 -1.26 -1.54 117.44 120.12 3kez n TRP 454 Ca 0.00 0.00 0.13 0.00 2.07 0.00 0.00 57.50 59.70 3kez n TRP 454 Cb 0.00 0.00 0.41 0.00 -0.81 0.00 0.00 31.31 30.91 3kez n TRP 454 CO 0.00 0.00 0.00 0.09 2.07 0.00 0.00 177.69 179.85 3kez n ASN 455 N -0.98 0.81 -4.66 -0.67 3.02 -1.26 -4.88 115.26 106.64 3kez n ASN 455 Ca 0.16 -0.70 -0.43 0.00 -0.03 0.00 0.00 54.58 53.59 3kez n ASN 455 Cb 0.07 0.09 -0.02 0.00 -0.61 0.00 0.00 39.78 39.31 3kez n ASN 455 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3kez s PHE 456 N -2.58 2.95 0.32 3.10 5.36 -0.59 -4.90 117.98 121.63 3kez s PHE 456 Ca 0.23 1.10 0.31 0.00 -0.96 0.00 0.00 56.93 57.61 3kez s PHE 456 Cb 0.19 -3.47 1.47 0.00 -0.34 0.00 0.00 43.02 40.87 3kez s PHE 456 CO 0.54 -1.44 2.05 1.12 -1.46 0.00 0.00 175.22 176.03 3kez h HIS 457 N 8.09 0.00 -0.28 10.12 2.07 -1.89 -2.72 115.15 130.53 3kez h HIS 457 Ca -0.25 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.27 3kez h HIS 457 Cb 1.09 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.07 3kez h HIS 457 CO 0.79 0.09 0.00 1.63 -3.07 0.00 0.00 177.93 177.37 3kez n LYS 458 N -3.37 1.97 0.29 5.12 5.02 -1.26 -3.24 118.16 122.69 3kez n LYS 458 Ca -0.01 -1.48 0.17 0.00 -2.02 0.00 0.00 58.31 54.97 3kez n LYS 458 Cb 0.27 -1.41 0.90 0.00 -0.02 0.00 0.00 35.03 34.77 3kez n LYS 458 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 3kez h ILE 459 N 2.80 0.26 -2.74 -0.18 3.07 -1.84 -3.42 117.51 115.47 3kez h ILE 459 Ca 0.00 -0.30 -0.65 0.00 1.55 0.00 0.00 64.86 65.45 3kez h ILE 459 Cb 0.62 1.23 -0.06 0.00 -0.27 0.00 0.00 36.82 38.34 3kez h ILE 459 CO 0.00 0.04 -0.42 -0.76 -1.05 0.00 0.00 178.15 175.96 3kez s LEU 460 N -6.72 4.41 0.58 0.16 1.43 -1.20 -4.94 118.68 112.39 3kez s LEU 460 Ca -0.03 0.57 -0.18 0.00 -1.03 0.00 0.00 54.13 53.46 3kez s LEU 460 Cb 0.12 -2.23 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 3kez s LEU 460 CO 0.52 0.38 1.14 -0.76 0.23 0.00 0.00 176.35 177.85 3kez s LEU 461 N -1.12 3.66 0.64 1.79 1.43 -0.84 -5.01 118.68 119.24 3kez s LEU 461 Ca 0.18 2.18 -0.15 0.00 -1.03 0.00 0.00 54.13 55.31 3kez s LEU 461 Cb -0.13 -4.58 -0.01 0.00 0.03 0.00 0.00 46.19 41.50 3kez s LEU 461 CO 0.07 -1.37 1.09 -2.16 0.23 0.00 0.00 176.35 174.20 3kez s PRO 462 N -3.45 2.98 0.21 1.29 0.04 -1.26 -4.72 135.00 130.09 3kez s PRO 462 Ca 0.72 1.29 -0.31 0.00 0.04 0.00 0.00 61.00 62.75 3kez s PRO 462 Cb -0.24 -1.98 -0.10 0.00 0.04 0.00 0.00 34.50 32.21 3kez s PRO 462 CO 0.31 -1.09 1.54 0.42 0.04 0.00 0.00 177.00 178.22 3kez s ILE 463 N -2.43 2.53 0.55 0.56 -1.09 -1.26 -4.90 121.20 115.16 3kez s ILE 463 Ca 0.65 0.41 -0.21 0.00 -2.23 0.00 0.00 60.65 59.27 3kez s ILE 463 Cb -0.18 -3.26 -0.05 0.00 -1.58 0.00 0.00 42.46 37.39 3kez s ILE 463 CO 0.41 0.05 1.33 -2.84 -1.23 0.00 0.00 174.94 172.66 3kez s PRO 464 N 0.48 3.12 0.16 2.79 0.02 -1.26 -4.91 135.00 135.39 3kez s PRO 464 Ca 0.66 2.17 -0.15 0.00 0.02 0.00 0.00 61.00 63.70 3kez s PRO 464 Cb -0.44 -2.21 0.08 0.00 0.02 0.00 0.00 34.50 31.95 3kez s PRO 464 CO 0.37 -1.19 1.76 -0.22 -0.33 0.00 0.00 177.00 177.39 3kez h LYS 465 N 1.38 0.31 -0.85 5.54 3.64 -1.86 -1.78 116.57 122.94 3kez h LYS 465 Ca -0.51 -0.02 0.10 0.00 -1.27 0.00 0.00 60.65 58.95 3kez h LYS 465 Cb 1.30 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 32.99 3kez h LYS 465 CO 0.57 0.20 0.55 1.57 -2.27 0.00 0.00 179.45 180.07 3kez h LYS 466 N 0.32 0.79 -1.01 1.90 2.10 -1.92 0.20 116.57 118.94 3kez h LYS 466 Ca 0.18 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.78 3kez h LYS 466 Cb 0.15 -0.18 0.00 0.00 -0.90 0.00 0.00 32.23 31.30 3kez h LYS 466 CO -0.18 0.52 0.00 -1.91 -2.00 0.00 0.00 179.45 175.89 3kez n GLU 467 N -4.52 0.53 0.00 0.07 4.07 -0.67 -2.11 120.64 118.02 3kez n GLU 467 Ca 0.14 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.24 3kez n GLU 467 Cb 0.32 -1.25 0.00 0.00 -0.06 0.00 0.00 31.44 30.45 3kez n GLU 467 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 3kez n ASP 469 N 0.49 0.00 0.11 4.31 8.00 0.70 -1.50 116.55 128.67 3kez n ASP 469 Ca 0.00 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.51 3kez n ASP 469 Cb 0.20 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.29 3kez n ASP 469 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kez h ALA 470 N 0.00 0.62 -3.44 2.24 0.00 -1.65 -3.44 119.26 113.59 3kez h ALA 470 Ca 0.00 -0.57 -0.63 0.00 0.00 0.00 0.00 54.91 53.70 3kez h ALA 470 Cb 0.00 -0.05 -0.40 0.00 0.00 0.00 0.00 17.79 17.33 3kez h ALA 470 CO 0.00 0.76 -0.72 1.21 0.00 0.00 0.00 179.25 180.50 3kez s ASN 471 N -6.43 4.42 0.30 0.00 3.84 -0.56 -4.98 114.94 111.53 3kez s ASN 471 Ca 0.03 -2.11 0.22 0.00 0.21 0.00 0.00 52.86 51.21 3kez s ASN 471 Cb 0.08 -1.35 1.10 0.00 -0.55 0.00 0.00 41.25 40.54 3kez s ASN 471 CO 0.76 -0.37 1.67 -0.81 -2.79 0.00 0.00 177.10 175.56 3kez n PRO 472 N 4.28 0.15 -2.90 0.43 -0.04 -1.26 -4.85 135.00 130.81 3kez n PRO 472 Ca 0.03 0.58 -0.44 0.00 -0.04 0.00 0.00 63.50 63.62 3kez n PRO 472 Cb 0.41 -1.93 0.00 0.00 -0.04 0.00 0.00 33.50 31.94 3kez n PRO 472 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3kez n ASN 473 N -2.24 5.36 -3.64 3.54 3.02 -1.26 -5.13 115.26 114.89 3kez n ASN 473 Ca -0.00 -3.05 -0.05 0.00 -0.03 0.00 0.00 54.58 51.44 3kez n ASN 473 Cb 0.09 -1.49 -0.07 0.00 -0.61 0.00 0.00 39.78 37.70 3kez n ASN 473 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3kez s LYS 475 N 0.41 0.55 0.61 3.52 2.20 -1.26 -4.30 119.74 121.47 3kez s LYS 475 Ca 0.39 0.91 -0.17 0.00 -0.36 0.00 0.00 55.97 56.74 3kez s LYS 475 Cb -0.01 0.13 -0.02 0.00 -1.51 0.00 0.00 37.83 36.41 3kez s LYS 475 CO -0.00 -0.11 1.15 -1.14 -0.36 0.00 0.00 175.35 174.89 3kez s GLN 476 N 1.36 2.94 0.55 4.03 2.00 -1.26 -4.92 119.66 124.36 3kez s GLN 476 Ca -0.08 1.62 -0.20 0.00 -2.00 0.00 0.00 55.36 54.70 3kez s GLN 476 Cb -0.04 -1.95 -0.05 0.00 0.80 0.00 0.00 33.01 31.77 3kez s GLN 476 CO -0.16 -1.18 1.23 -0.80 -0.50 0.00 0.00 175.29 173.88 3kez s ASN 477 N -1.99 5.43 0.51 6.67 0.01 -1.26 -4.96 114.94 119.35 3kez s ASN 477 Ca 0.72 2.45 -0.23 0.00 -0.71 0.00 0.00 52.86 55.10 3kez s ASN 477 Cb -0.25 -2.61 -0.06 0.00 0.41 0.00 0.00 41.25 38.74 3kez s ASN 477 CO 0.35 -1.43 1.36 -0.81 -1.51 0.00 0.00 177.10 175.06 3kez n PRO 478 N -1.21 1.84 -0.78 -0.60 -0.04 -1.26 -2.90 135.00 130.05 3kez n PRO 478 Ca 0.11 0.67 0.00 0.00 -0.04 0.00 0.00 63.50 64.24 3kez n PRO 478 Cb 0.48 -2.57 0.00 0.00 -0.04 0.00 0.00 33.50 31.38 3kez n PRO 478 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3kez n GLY 479 N 0.73 1.15 0.02 0.55 0.00 -1.26 -4.84 105.19 101.55 3kez n GLY 479 Ca 0.09 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.18 3kez n GLY 479 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3kez n TYR 480 N -2.00 0.00 -3.15 1.61 4.01 -1.14 -4.80 117.16 111.69 3kez n TYR 480 Ca 0.00 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.35 3kez n TYR 480 Cb 0.00 -0.56 -0.05 0.00 -0.31 0.00 0.00 39.34 38.42 3kez n TYR 480 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3kez s VAL 481 N -3.28 5.10 -0.93 -0.72 0.11 -1.26 -4.40 120.40 115.02 3kez s VAL 481 Ca -0.08 1.26 0.07 0.00 -2.93 0.00 0.00 61.98 60.31 3kez s VAL 481 Cb 0.12 -3.96 0.06 0.00 -1.53 0.00 0.00 36.38 31.07 3kez s VAL 481 CO 0.86 0.28 0.74 0.47 -3.33 0.00 0.00 175.10 174.11