#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kez s THR 36 N 0.00 0.75 -0.56 2.62 -4.23 -1.26 -5.09 115.64 107.88 3kez s THR 36 Ca 0.00 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.75 3kez s THR 36 Cb 0.00 -2.34 0.04 0.00 1.34 0.00 0.00 72.50 71.54 3kez s THR 36 CO 0.00 0.00 1.26 0.77 -0.54 0.00 0.00 174.62 176.11 3kez h SER 37 N 1.71 0.00 -3.52 3.99 4.64 -2.03 -3.43 113.55 114.92 3kez h SER 37 Ca -0.37 -0.18 -0.67 0.00 -0.47 0.00 0.00 61.79 60.10 3kez h SER 37 Cb 1.28 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 63.02 3kez h SER 37 CO 0.61 0.09 -0.80 -0.63 -0.87 0.00 0.00 176.83 175.23 3kez s ILE 38 N -3.21 2.39 0.00 0.95 -1.09 -1.26 -4.91 121.20 114.07 3kez s ILE 38 Ca 0.05 -1.24 0.00 0.00 -2.23 0.00 0.00 60.65 57.23 3kez s ILE 38 Cb 0.12 -2.23 0.00 0.00 -1.58 0.00 0.00 42.46 38.77 3kez s ILE 38 CO 0.74 0.20 0.00 0.59 -1.23 0.00 0.00 174.94 175.24 3kez n ASN 39 N 4.57 3.86 -4.21 3.58 5.03 -1.26 -5.09 115.26 121.73 3kez n ASN 39 Ca -0.17 0.00 -0.12 0.00 0.87 0.00 0.00 54.58 55.16 3kez n ASN 39 Cb 0.46 0.32 -0.10 0.00 -1.02 0.00 0.00 39.78 39.44 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 -1.81 0.44 0.29 2.41 -7.23 -1.26 -4.95 120.40 108.30 3kez s VAL 40 Ca 0.00 -1.95 0.01 0.00 -1.81 0.00 0.00 61.98 58.23 3kez s VAL 40 Cb 0.00 -2.13 0.29 0.00 0.56 0.00 0.00 36.38 35.10 3kez s VAL 40 CO 0.00 -0.43 1.86 -0.07 -0.31 0.00 0.00 175.10 176.14 3kez h LEU 41 N 2.74 0.92 -2.37 1.32 3.38 -1.99 -1.37 115.31 117.94 3kez h LEU 41 Ca -0.36 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 3kez h LEU 41 Cb 1.21 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 3kez h LEU 41 CO 0.61 0.52 -0.02 0.77 0.09 0.00 0.00 178.44 180.41 3kez h SER 42 N 1.00 0.00 -0.01 -0.43 4.64 -1.99 0.27 113.55 117.03 3kez h SER 42 Ca 0.47 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.70 3kez h SER 42 Cb 0.42 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.50 3kez h SER 42 CO -0.23 0.02 -0.25 0.44 -0.87 0.00 0.00 176.83 175.94 3kez h ASP 43 N 0.00 0.42 -0.37 4.97 3.32 -1.59 0.05 116.42 123.22 3kez h ASP 43 Ca -0.00 -0.14 -0.07 0.00 0.02 0.00 0.00 57.03 56.84 3kez h ASP 43 Cb 0.20 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3kez h ASP 43 CO 0.00 0.67 -0.06 0.40 -1.72 0.00 0.00 179.24 178.54 3kez h ILE 44 N 0.37 1.27 -0.78 0.35 1.08 -0.55 -0.33 117.51 118.92 3kez h ILE 44 Ca 0.06 -1.10 -0.03 0.00 -0.39 0.00 0.00 64.86 63.39 3kez h ILE 44 Cb 0.64 1.25 -0.04 0.00 -3.07 0.00 0.00 36.82 35.60 3kez h ILE 44 CO 0.05 0.36 0.36 -0.08 -0.69 0.00 0.00 178.15 178.15 3kez h GLU 45 N 0.49 1.14 -0.64 2.37 4.57 -1.13 0.09 114.58 121.46 3kez h GLU 45 Ca 0.10 -0.18 -0.01 0.00 -1.18 0.00 0.00 59.36 58.08 3kez h GLU 45 Cb 0.55 -0.20 -0.03 0.00 -0.16 0.00 0.00 28.75 28.91 3kez h GLU 45 CO 0.03 0.90 0.34 0.35 -1.18 0.00 0.00 179.01 179.45 3kez h PHE 46 N 1.11 0.89 -0.54 0.92 3.57 -0.87 -0.76 116.94 121.27 3kez h PHE 46 Ca 0.27 -0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.68 3kez h PHE 46 Cb 0.14 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.58 3kez h PHE 46 CO 0.01 0.65 0.11 1.15 -2.23 0.00 0.00 178.31 178.00 3kez h THR 47 N 0.88 1.25 -0.71 4.41 2.02 -0.42 -2.11 112.91 118.23 3kez h THR 47 Ca 0.23 -0.93 -0.04 0.00 0.77 0.00 0.00 66.41 66.44 3kez h THR 47 Cb 0.06 0.80 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 3kez h THR 47 CO -0.03 0.34 0.30 -0.07 0.37 0.00 0.00 175.52 176.42 3kez h LEU 48 N 0.78 0.96 -0.71 2.58 3.38 -0.67 -1.70 115.31 119.94 3kez h LEU 48 Ca 0.17 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 58.01 3kez h LEU 48 Cb 0.38 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 3kez h LEU 48 CO 0.01 0.86 0.44 0.78 0.09 0.00 0.00 178.44 180.62 3kez h ASN 49 N 1.01 0.72 -0.82 -0.43 2.35 -0.92 -0.22 115.58 117.27 3kez h ASN 49 Ca 0.24 0.00 0.05 0.00 -0.55 0.00 0.00 56.30 56.04 3kez h ASN 49 Cb 0.19 -0.15 -0.05 0.00 0.05 0.00 0.00 38.32 38.35 3kez h ASN 49 CO -0.02 0.50 0.51 1.23 -1.65 0.00 0.00 177.43 177.99 3kez h GLY 50 N 0.86 1.21 0.92 2.83 0.00 -0.96 -0.76 103.07 107.17 3kez h GLY 50 Ca 0.29 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 3kez h GLY 50 CO -0.11 0.29 0.01 -2.22 0.00 0.00 0.00 176.54 174.51 3kez h ILE 51 N 0.96 1.07 -0.60 2.60 2.04 -0.24 -0.82 117.51 122.52 3kez h ILE 51 Ca 0.34 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.96 3kez h ILE 51 Cb 0.10 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 3kez h ILE 51 CO -0.15 0.06 0.18 1.88 0.00 0.00 0.00 178.15 180.12 3kez h TYR 52 N -0.04 0.93 -0.72 1.37 0.05 -0.92 -1.90 116.97 115.74 3kez h TYR 52 Ca 0.01 -0.08 -0.06 0.00 0.05 0.00 0.00 58.73 58.65 3kez h TYR 52 Cb 0.08 -0.28 -0.03 0.00 1.01 0.00 0.00 36.73 37.51 3kez h TYR 52 CO -0.05 0.76 0.22 0.77 -1.05 0.00 0.00 178.16 178.81 3kez h SER 53 N 0.88 1.06 0.00 3.88 0.02 -0.81 -1.54 113.55 117.04 3kez h SER 53 Ca 0.20 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 3kez h SER 53 Cb 0.26 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.53 3kez h SER 53 CO -0.01 0.99 0.00 0.41 -1.14 0.00 0.00 176.83 177.08 3kez n THR 54 N -4.27 0.01 0.00 -2.27 -1.04 -0.34 -3.59 114.28 102.78 3kez n THR 54 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 3kez n THR 54 Cb 0.23 -0.39 0.00 0.00 -1.82 0.00 0.00 70.33 68.35 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 0.88 0.00 -1.75 -2.82 6.02 -0.58 -4.65 117.38 114.48 3kez n GLN 56 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.61 3kez n GLN 56 Cb 0.00 0.00 0.05 0.00 1.02 0.00 0.00 30.24 31.32 3kez n GLN 56 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3kez s SER 57 N 0.00 4.95 0.47 1.08 0.15 -1.24 -4.05 113.70 115.07 3kez s SER 57 Ca 0.00 2.73 0.32 0.00 0.70 0.00 0.00 55.95 59.70 3kez s SER 57 Cb 0.00 -2.63 1.50 0.00 -1.71 0.00 0.00 66.02 63.18 3kez s SER 57 CO 0.00 -1.78 1.96 0.77 1.20 0.00 0.00 173.24 175.39 3kez h SER 58 N 1.06 0.00 1.21 5.45 4.64 -1.83 0.10 113.55 124.18 3kez h SER 58 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3kez h SER 58 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3kez h SER 58 CO 0.55 0.00 -0.04 0.47 -0.87 0.00 0.00 176.83 176.95 3kez n ASP 59 N -2.74 0.44 0.00 4.97 8.00 -1.26 -1.08 116.55 124.88 3kez n ASP 59 Ca -0.00 0.50 0.00 0.00 0.71 0.00 0.00 54.79 56.00 3kez n ASP 59 Cb 0.18 -0.60 0.00 0.00 -0.02 0.00 0.00 41.12 40.68 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 -1.65 0.00 1.87 2.24 0.00 0.27 -4.43 120.51 118.81 3kez n ALA 60 Ca 0.06 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.66 3kez n ALA 60 Cb 0.39 0.00 0.85 0.00 0.00 0.00 0.00 19.45 20.69 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 0.72 0.00 4.01 -1.18 -1.67 117.16 119.05 3kez n TYR 61 Ca 0.00 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.85 3kez n TYR 61 Cb 0.00 -0.01 0.28 0.00 -0.31 0.00 0.00 39.34 39.30 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 -0.76 2.67 0.00 7.72 7.64 -0.71 -4.72 113.62 125.47 3kez n SER 62 Ca 0.23 -1.88 0.00 0.00 1.01 0.00 0.00 58.87 58.23 3kez n SER 62 Cb 0.17 -0.19 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 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 1.34 -0.91 0.36 0.23 0.00 -1.00 -4.30 105.19 100.92 3kez n GLY 63 Ca 0.18 0.52 0.07 0.00 0.00 0.00 0.00 46.02 46.79 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 0.86 0.00 1.61 3.08 -0.98 0.19 114.38 119.15 3kez h ARG 64 Ca 0.00 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 3kez h ARG 64 Cb 0.00 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 29.85 3kez h ARG 64 CO 0.00 0.57 -0.08 -0.07 -1.07 0.00 0.00 179.97 179.31 3kez h LEU 65 N 0.89 0.00 0.00 3.04 3.38 -1.53 -2.93 115.31 118.16 3kez h LEU 65 Ca 0.39 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.30 3kez h LEU 65 Cb 0.36 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3kez h LEU 65 CO -0.16 0.08 -0.45 0.58 0.09 0.00 0.00 178.44 178.59 3kez h VAL 66 N 0.00 0.86 0.00 1.22 2.07 -0.85 -3.38 116.25 116.16 3kez h VAL 66 Ca -0.00 -1.79 -0.00 0.00 0.82 0.00 0.00 66.70 65.73 3kez h VAL 66 Cb 0.75 1.77 -0.00 0.00 -1.52 0.00 0.00 31.29 32.28 3kez h VAL 66 CO 0.01 0.29 -0.02 0.10 0.02 0.00 0.00 177.57 177.98 3kez h TYR 67 N -1.00 0.00 -0.56 1.57 -0.00 -1.27 -3.24 116.97 112.47 3kez h TYR 67 Ca -0.10 0.00 0.11 0.00 0.00 0.00 0.00 58.73 58.74 3kez h TYR 67 Cb 0.79 0.00 -0.11 0.00 0.00 0.00 0.00 36.73 37.41 3kez h TYR 67 CO 0.08 0.02 -0.22 -0.92 -0.00 0.00 0.00 178.16 177.12 3kez h TYR 68 N 0.00 -0.55 0.00 0.10 3.20 -1.70 -0.54 116.97 117.48 3kez h TYR 68 Ca -0.00 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.93 3kez h TYR 68 Cb 0.55 0.33 0.00 0.00 1.54 0.00 0.00 36.73 39.15 3kez h TYR 68 CO 0.00 -0.31 0.00 0.41 -1.64 0.00 0.00 178.16 176.62 3kez n GLY 69 N -1.43 -1.20 0.10 1.82 0.00 -1.24 -2.61 105.19 100.63 3kez n GLY 69 Ca 0.05 -0.06 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 3kez n GLY 69 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3kez n ASP 70 N -1.57 1.85 0.11 1.61 8.00 -0.26 -2.93 116.55 123.36 3kez n ASP 70 Ca 0.05 0.47 0.13 0.00 0.71 0.00 0.00 54.79 56.14 3kez n ASP 70 Cb 0.24 -0.94 0.42 0.00 -0.02 0.00 0.00 41.12 40.81 3kez n ASP 70 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3kez n VAL 71 N -4.47 0.63 1.57 2.53 0.24 -0.93 -1.40 118.33 116.50 3kez n VAL 71 Ca -0.27 -0.22 0.13 0.00 -2.04 0.00 0.00 64.34 61.94 3kez n VAL 71 Cb 0.60 -0.67 0.57 0.00 -1.47 0.00 0.00 33.84 32.87 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 -2.26 0.05 -1.07 3.34 -2.24 -1.07 -3.99 114.28 107.02 3kez n THR 72 Ca 0.05 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 3kez n THR 72 Cb 0.40 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.85 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 1.10 1.44 0.19 3.38 0.00 -0.50 -5.01 105.19 105.80 3kez n GLY 73 Ca 0.19 -1.86 0.06 0.00 0.00 0.00 0.00 46.02 44.41 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 1.10 -1.07 1.61 5.75 -1.26 -4.88 116.55 117.79 3kez n ASP 74 Ca 0.00 -1.05 0.08 0.00 -0.01 0.00 0.00 54.79 53.81 3kez n ASP 74 Cb 0.00 0.61 0.27 0.00 -1.03 0.00 0.00 41.12 40.97 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 -0.50 4.03 0.00 -1.12 8.00 -1.26 -4.64 116.55 121.05 3kez n ASP 75 Ca 0.04 -2.65 0.00 0.00 0.71 0.00 0.00 54.79 52.89 3kez n ASP 75 Cb 0.22 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 40.83 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 0.18 0.00 -1.97 -1.24 10.64 -0.28 -0.96 117.38 123.74 3kez n GLN 77 Ca 0.21 0.00 -0.40 0.00 -1.83 0.00 0.00 57.00 54.97 3kez n GLN 77 Cb 0.81 0.00 -0.01 0.00 -0.86 0.00 0.00 30.24 30.19 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 3.43 0.34 2.61 0.00 -1.26 -1.64 121.76 123.24 3kez s ALA 78 Ca 0.00 1.37 0.15 0.00 0.00 0.00 0.00 51.96 53.48 3kez s ALA 78 Cb 0.00 -3.53 0.79 0.00 0.00 0.00 0.00 23.12 20.38 3kez s ALA 78 CO 0.00 -0.88 1.84 0.28 0.00 0.00 0.00 175.76 177.00 3kez h VAL 79 N 2.78 1.13 -3.25 0.00 2.07 -1.18 -3.46 116.25 114.35 3kez h VAL 79 Ca -0.50 -1.25 0.01 0.00 0.82 0.00 0.00 66.70 65.78 3kez h VAL 79 Cb 1.24 1.70 -0.08 0.00 -1.52 0.00 0.00 31.29 32.63 3kez h VAL 79 CO 0.64 0.34 0.08 -0.94 0.02 0.00 0.00 177.57 177.71 3kez s SER 80 N -6.76 -0.24 0.52 0.57 1.04 -1.26 -4.97 113.70 102.60 3kez s SER 80 Ca -0.02 -0.61 0.28 0.00 0.48 0.00 0.00 55.95 56.08 3kez s SER 80 Cb 0.14 0.64 1.44 0.00 0.10 0.00 0.00 66.02 68.34 3kez s SER 80 CO 0.70 -1.18 2.05 0.28 0.98 0.00 0.00 173.24 176.07 3kez h SER 81 N 2.12 0.00 -0.21 7.02 0.02 -1.92 -2.84 113.55 117.75 3kez h SER 81 Ca -0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 3kez h SER 81 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 3kez h SER 81 CO 0.31 0.12 0.00 0.35 -1.14 0.00 0.00 176.83 176.47 3kez n THR 82 N -3.54 0.26 -1.43 -2.27 -2.24 -1.26 -4.38 114.28 99.42 3kez n THR 82 Ca -0.01 -0.50 -0.31 0.00 -2.27 0.00 0.00 64.05 60.96 3kez n THR 82 Cb 0.25 0.75 0.08 0.00 -2.10 0.00 0.00 70.33 69.32 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 -1.74 2.38 0.44 -0.78 -0.14 -1.07 -4.91 119.74 113.92 3kez s LYS 83 Ca 0.35 0.95 0.17 0.00 -1.36 0.00 0.00 55.97 56.08 3kez s LYS 83 Cb 0.20 -1.93 1.10 0.00 -1.68 0.00 0.00 37.83 35.52 3kez s LYS 83 CO 0.29 -1.49 1.91 0.00 -0.76 0.00 0.00 175.35 175.30 3kez h ARG 84 N -1.01 0.36 -0.01 1.68 -0.00 -1.90 -0.75 114.38 112.75 3kez h ARG 84 Ca -0.45 -0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.01 3kez h ARG 84 Cb 1.24 -0.08 0.00 0.00 0.00 0.00 0.00 29.97 31.12 3kez h ARG 84 CO 0.55 0.24 -0.11 0.25 0.00 0.00 0.00 179.97 180.89 3kez n THR 85 N -4.47 0.00 0.09 2.04 -2.24 -1.26 -4.51 114.28 103.93 3kez n THR 85 Ca 0.15 -0.09 -0.12 0.00 -2.27 0.00 0.00 64.05 61.72 3kez n THR 85 Cb 0.58 0.05 -0.05 0.00 -2.10 0.00 0.00 70.33 68.80 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 4.95 -0.30 2.00 3.38 0.00 -1.33 -0.12 103.07 111.65 3kez h GLY 86 Ca 0.00 0.20 -0.07 0.00 0.00 0.00 0.00 47.33 47.46 3kez h GLY 86 CO 0.00 -0.17 -0.35 3.43 0.00 0.00 0.00 176.54 179.45 3kez h ASN 87 N -0.33 0.00 0.09 0.19 2.35 -1.78 0.20 115.58 116.30 3kez h ASN 87 Ca 0.03 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3kez h ASN 87 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 3kez h ASN 87 CO -0.10 0.35 -0.04 1.88 -1.65 0.00 0.00 177.43 177.87 3kez h TYR 88 N 0.00 -0.11 -0.79 1.19 -1.99 -1.74 0.28 116.97 113.81 3kez h TYR 88 Ca -0.00 -0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.80 3kez h TYR 88 Cb 0.64 0.04 -0.06 0.00 2.00 0.00 0.00 36.73 39.34 3kez h TYR 88 CO 0.00 0.30 0.46 -0.92 -0.00 0.00 0.00 178.16 178.00 3kez h TYR 89 N -0.55 0.85 -0.01 4.88 3.20 -0.71 -2.60 116.97 122.04 3kez h TYR 89 Ca -0.01 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3kez h TYR 89 Cb 0.46 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.46 3kez h TYR 89 CO 0.06 0.40 -0.06 0.54 -1.64 0.00 0.00 178.16 177.46 3kez n ARG 90 N -4.71 0.96 -3.97 1.82 1.74 0.03 -4.86 116.66 107.66 3kez n ARG 90 Ca 0.12 -0.32 -0.32 0.00 -0.77 0.00 0.00 57.85 56.55 3kez n ARG 90 Cb 0.21 -1.49 -0.01 0.00 -1.02 0.00 0.00 32.46 30.15 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 -0.74 -1.59 0.01 -1.55 3.72 -0.90 -4.74 117.46 111.67 3kez n PHE 91 Ca 0.18 0.52 0.12 0.00 -0.05 0.00 0.00 57.45 58.21 3kez n PHE 91 Cb 0.25 -3.32 0.26 0.00 -0.94 0.00 0.00 39.48 35.73 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 -2.73 3.68 -4.85 4.37 5.15 0.04 -4.98 115.26 115.94 3kez n ASN 92 Ca -0.22 -1.99 -0.32 0.00 -0.60 0.00 0.00 54.58 51.44 3kez n ASN 92 Cb 0.64 -0.35 -0.06 0.00 -0.53 0.00 0.00 39.78 39.48 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 -1.27 3.39 0.40 1.20 0.08 -1.26 -5.04 117.98 115.47 3kez s PHE 93 Ca 0.43 1.23 0.07 0.00 0.12 0.00 0.00 56.93 58.77 3kez s PHE 93 Cb 0.24 -2.55 -0.08 0.00 -0.57 0.00 0.00 43.02 40.06 3kez s PHE 93 CO 0.32 0.02 0.02 0.95 -0.10 0.00 0.00 175.22 176.43 3kez s THR 94 N -2.09 1.88 0.59 0.64 -4.23 -1.26 -4.94 115.64 106.22 3kez s THR 94 Ca 0.54 -2.00 0.32 0.00 -1.18 0.00 0.00 61.69 59.37 3kez s THR 94 Cb -0.10 -2.96 0.36 0.00 1.34 0.00 0.00 72.50 71.14 3kez s THR 94 CO 0.20 -0.00 2.26 0.07 -0.54 0.00 0.00 174.62 176.61 3kez h LYS 95 N 1.83 0.00 0.00 3.99 -0.00 -1.92 -0.28 116.57 120.19 3kez h LYS 95 Ca -0.43 0.00 -0.06 0.00 -0.00 0.00 0.00 60.65 60.15 3kez h LYS 95 Cb 1.24 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 33.46 3kez h LYS 95 CO 0.79 0.01 -0.88 -0.44 -0.00 0.00 0.00 179.45 178.93 3kez h ASP 96 N 0.00 0.00 0.00 7.07 3.32 -1.95 -3.36 116.42 121.50 3kez h ASP 96 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3kez h ASP 96 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 3kez h ASP 96 CO 0.00 0.23 0.00 -0.46 -1.72 0.00 0.00 179.24 177.29 3kez n ASN 97 N -2.88 1.25 -4.73 6.45 0.23 -0.89 -4.91 115.26 109.77 3kez n ASN 97 Ca -0.02 -1.42 -0.36 0.00 -0.53 0.00 0.00 54.58 52.25 3kez n ASN 97 Cb 0.65 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 38.43 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 -0.42 2.64 0.66 4.83 0.00 -0.17 -4.79 107.32 110.07 3kez s GLY 98 Ca 0.00 1.05 -0.16 0.00 0.00 0.00 0.00 44.72 45.61 3kez s GLY 98 CO 0.00 1.46 1.16 2.56 0.00 0.00 0.00 173.10 178.28 3kez s PRO 99 N -3.57 2.66 -0.00 2.90 0.04 -1.26 -4.74 135.00 131.03 3kez s PRO 99 Ca 0.78 1.60 0.09 0.00 0.04 0.00 0.00 61.00 63.51 3kez s PRO 99 Cb -0.33 -1.91 -0.10 0.00 0.04 0.00 0.00 34.50 32.19 3kez s PRO 99 CO 0.40 -1.40 0.39 -1.13 0.04 0.00 0.00 177.00 175.31 3kez n SER 100 N -2.28 0.54 -0.28 6.66 3.41 -1.26 -4.59 113.62 115.82 3kez n SER 100 Ca 0.12 -0.69 -0.06 0.00 -0.26 0.00 0.00 58.87 57.98 3kez n SER 100 Cb 0.51 1.02 0.06 0.00 -0.26 0.00 0.00 64.21 65.54 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 1.09 -0.01 4.04 4.64 -1.93 -1.51 113.55 119.87 3kez h SER 101 Ca 0.00 -0.19 0.02 0.00 -0.47 0.00 0.00 61.79 61.14 3kez h SER 101 Cb 0.23 -0.29 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 3kez h SER 101 CO 0.00 0.99 -0.08 0.45 -0.87 0.00 0.00 176.83 177.32 3kez h HIS 102 N 1.13 -0.20 0.48 4.77 3.86 -1.86 0.19 115.15 123.53 3kez h HIS 102 Ca 0.25 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.45 3kez h HIS 102 Cb 0.27 0.09 -0.00 0.00 1.06 0.00 0.00 27.41 28.82 3kez h HIS 102 CO 0.02 -0.12 -0.28 2.35 0.86 0.00 0.00 177.93 180.76 3kez h TRP 103 N -0.13 -0.74 -0.36 2.45 2.91 -1.83 -2.44 115.95 115.81 3kez h TRP 103 Ca 0.03 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.02 3kez h TRP 103 Cb 0.18 0.26 -0.02 0.00 -0.51 0.00 0.00 29.16 29.07 3kez h TRP 103 CO -0.15 -0.44 0.13 0.77 -1.03 0.00 0.00 178.44 177.73 3kez h SER 104 N -0.72 0.50 -0.27 2.65 0.02 -1.19 -1.34 113.55 113.20 3kez h SER 104 Ca -0.06 -0.18 -0.06 0.00 -0.84 0.00 0.00 61.79 60.66 3kez h SER 104 Cb 0.58 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 3kez h SER 104 CO 0.07 0.54 -0.05 1.88 -1.14 0.00 0.00 176.83 178.13 3kez h TYR 105 N 0.43 0.58 -0.63 3.45 -1.99 -1.02 -0.24 116.97 117.54 3kez h TYR 105 Ca 0.12 -0.12 -0.08 0.00 2.00 0.00 0.00 58.73 60.65 3kez h TYR 105 Cb 0.20 -0.14 -0.02 0.00 2.00 0.00 0.00 36.73 38.77 3kez h TYR 105 CO -0.00 0.71 0.07 -0.07 -0.00 0.00 0.00 178.16 178.87 3kez h LEU 106 N 0.28 1.01 -0.60 3.88 3.38 -1.38 -1.18 115.31 120.70 3kez h LEU 106 Ca 0.07 -0.25 -0.15 0.00 0.09 0.00 0.00 57.88 57.64 3kez h LEU 106 Cb 0.52 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3kez h LEU 106 CO 0.02 1.02 -0.63 1.88 0.09 0.00 0.00 178.44 180.83 3kez h TYR 107 N 0.98 0.34 0.01 1.13 0.05 -1.18 -0.35 116.97 117.96 3kez h TYR 107 Ca 0.19 -0.14 0.02 0.00 0.05 0.00 0.00 58.73 58.85 3kez h TYR 107 Cb 0.46 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 38.12 3kez h TYR 107 CO 0.03 0.82 -0.11 1.03 -1.05 0.00 0.00 178.16 178.88 3kez h SER 108 N 0.19 -0.33 -0.04 3.88 0.87 -0.75 0.24 113.55 117.61 3kez h SER 108 Ca -0.01 0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.63 3kez h SER 108 Cb 1.15 0.14 -0.04 0.00 -0.44 0.00 0.00 62.40 63.21 3kez h SER 108 CO 0.10 -0.16 -0.20 0.40 -0.53 0.00 0.00 176.83 176.43 3kez h ILE 109 N -0.20 0.51 -0.65 2.23 2.04 -1.07 -2.41 117.51 117.97 3kez h ILE 109 Ca 0.04 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.97 3kez h ILE 109 Cb 0.25 0.51 -0.06 0.00 -0.74 0.00 0.00 36.82 36.78 3kez h ILE 109 CO -0.10 0.00 0.32 0.40 0.00 0.00 0.00 178.15 178.76 3kez h ILE 110 N -0.30 0.88 -0.78 -0.67 2.04 -0.96 -0.87 117.51 116.85 3kez h ILE 110 Ca 0.07 -0.20 0.07 0.00 1.00 0.00 0.00 64.86 65.80 3kez h ILE 110 Cb 0.40 0.26 -0.06 0.00 -0.74 0.00 0.00 36.82 36.68 3kez h ILE 110 CO -0.22 0.10 0.46 1.56 0.00 0.00 0.00 178.15 180.05 3kez h GLN 111 N 0.57 0.80 -0.01 2.37 1.08 -0.65 0.01 115.11 119.28 3kez h GLN 111 Ca 0.31 -0.05 -0.14 0.00 -1.45 0.00 0.00 58.65 57.32 3kez h GLN 111 Cb 0.28 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.52 3kez h GLN 111 CO -0.23 0.53 -0.66 -0.91 -0.95 0.00 0.00 178.83 176.61 3kez h ASN 112 N 0.82 0.06 -0.26 1.46 2.35 -0.94 -0.85 115.58 118.23 3kez h ASN 112 Ca 0.35 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 56.05 3kez h ASN 112 Cb 0.22 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 3kez h ASN 112 CO -0.19 0.70 0.13 0.00 -1.65 0.00 0.00 177.43 176.42 3kez h ASN 114 N 0.30 0.52 -0.46 0.00 2.35 -0.80 0.49 115.58 117.98 3kez h ASN 114 Ca 0.09 0.04 0.08 0.00 -0.55 0.00 0.00 56.30 55.96 3kez h ASN 114 Cb 0.09 -0.06 -0.07 0.00 0.05 0.00 0.00 38.32 38.33 3kez h ASN 114 CO -0.01 0.33 0.04 0.25 -1.65 0.00 0.00 177.43 176.39 3kez h LEU 115 N 0.66 -0.10 -0.07 1.61 5.85 -1.02 -2.21 115.31 120.02 3kez h LEU 115 Ca 0.30 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 59.12 3kez h LEU 115 Cb 0.22 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.40 3kez h LEU 115 CO -0.20 -0.02 0.03 0.40 -0.34 0.00 0.00 178.44 178.32 3kez h ILE 116 N 0.16 1.13 0.00 4.05 2.04 -0.71 -3.19 117.51 120.99 3kez h ILE 116 Ca 0.23 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.71 3kez h ILE 116 Cb 0.32 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 3kez h ILE 116 CO -0.34 0.11 0.00 0.18 0.00 0.00 0.00 178.15 178.09 3kez n LEU 117 N -4.96 2.45 0.00 1.44 4.77 0.10 -0.24 117.00 120.57 3kez n LEU 117 Ca -0.06 -1.11 0.00 0.00 -0.03 0.00 0.00 56.01 54.81 3kez n LEU 117 Cb 0.10 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.68 3kez n LEU 117 CO 0.34 0.46 0.00 0.59 -1.33 0.00 0.00 177.39 177.45 3kez n ASN 119 N 1.63 0.00 -0.16 -1.43 3.02 -1.21 -4.55 115.26 112.56 3kez n ASN 119 Ca 0.00 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.58 3kez n ASN 119 Cb 0.24 0.00 0.32 0.00 -0.61 0.00 0.00 39.78 39.73 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 1.11 0.00 2.41 3.04 -0.88 -0.69 116.25 121.24 3kez h VAL 120 Ca 0.00 -0.29 0.00 0.00 -1.01 0.00 0.00 66.70 65.40 3kez h VAL 120 Cb 0.00 0.20 0.00 0.00 -2.01 0.00 0.00 31.29 29.48 3kez h VAL 120 CO 0.00 0.15 0.00 0.47 -1.01 0.00 0.00 177.57 177.18 3kez n ASP 121 N -4.45 0.41 0.13 3.17 8.00 -1.26 -3.05 116.55 119.50 3kez n ASP 121 Ca 0.08 0.54 0.12 0.00 0.71 0.00 0.00 54.79 56.25 3kez n ASP 121 Cb 0.11 -0.65 0.15 0.00 -0.02 0.00 0.00 41.12 40.70 3kez n ASP 121 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3kez h LYS 122 N 0.00 0.00 -6.34 -1.24 1.57 -1.50 -3.46 116.57 105.60 3kez h LYS 122 Ca 0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 3kez h LYS 122 Cb 0.59 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 3kez h LYS 122 CO 0.00 0.00 0.74 -0.51 -0.57 0.00 0.00 179.45 179.11 3kez s LEU 123 N -5.28 4.29 0.06 2.94 1.43 -1.17 -4.99 118.68 115.95 3kez s LEU 123 Ca 0.05 1.92 -0.29 0.00 -1.03 0.00 0.00 54.13 54.78 3kez s LEU 123 Cb 0.09 -3.56 -0.05 0.00 0.03 0.00 0.00 46.19 42.71 3kez s LEU 123 CO 0.71 -0.63 0.94 -0.94 0.23 0.00 0.00 176.35 176.66 3kez s SER 124 N 1.61 7.41 0.28 2.29 1.04 -1.26 -5.04 113.70 120.02 3kez s SER 124 Ca 0.59 1.69 0.02 0.00 0.48 0.00 0.00 55.95 58.73 3kez s SER 124 Cb -0.27 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.23 3kez s SER 124 CO 0.24 -0.14 0.09 0.27 0.98 0.00 0.00 173.24 174.68 3kez s ILE 125 N 0.42 0.66 0.48 -1.02 -4.36 -1.26 -4.98 121.20 111.14 3kez s ILE 125 Ca 0.48 -2.00 -0.17 0.00 -0.26 0.00 0.00 60.65 58.70 3kez s ILE 125 Cb -0.22 -2.65 -0.08 0.00 1.25 0.00 0.00 42.46 40.75 3kez s ILE 125 CO 0.28 0.00 0.96 -1.81 0.24 0.00 0.00 174.94 174.61 3kez s ASP 126 N -3.35 6.69 0.27 4.36 1.01 -1.26 -4.97 116.67 119.41 3kez s ASP 126 Ca 0.37 1.56 -0.04 0.00 0.71 0.00 0.00 52.55 55.15 3kez s ASP 126 Cb 0.08 -2.50 0.54 0.00 1.01 0.00 0.00 42.92 42.04 3kez s ASP 126 CO 0.14 -0.52 1.61 -0.08 0.21 0.00 0.00 175.17 176.53 3kez h GLU 127 N 1.18 0.07 -0.00 8.23 4.81 -2.02 -0.26 114.58 126.58 3kez h GLU 127 Ca -0.47 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 3kez h GLU 127 Cb 1.18 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.55 3kez h GLU 127 CO 0.62 0.04 0.00 -0.40 -0.73 0.00 0.00 179.01 178.54 3kez n ASP 128 N -5.41 0.03 -1.00 1.04 5.75 -1.26 -2.35 116.55 113.35 3kez n ASP 128 Ca 0.17 -1.37 0.11 0.00 -0.01 0.00 0.00 54.79 53.69 3kez n ASP 128 Cb 0.56 -0.00 0.15 0.00 -1.03 0.00 0.00 41.12 40.81 3kez n ASP 128 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3kez n GLU 129 N -0.80 2.26 0.03 0.11 1.02 -0.11 -4.73 120.64 118.42 3kez n GLU 129 Ca 0.15 -2.04 -0.13 0.00 -0.02 0.00 0.00 57.16 55.12 3kez n GLU 129 Cb 0.08 -1.45 -0.09 0.00 -0.02 0.00 0.00 31.44 29.95 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 4.22 1.17 -0.43 2.62 2.02 -1.50 0.16 112.91 121.17 3kez h THR 130 Ca 0.00 -0.67 0.03 0.00 0.77 0.00 0.00 66.41 66.54 3kez h THR 130 Cb 0.93 1.61 -0.03 0.00 -1.74 0.00 0.00 68.15 68.92 3kez h THR 130 CO 0.00 0.17 0.23 -0.33 0.37 0.00 0.00 175.52 175.96 3kez h GLU 131 N -0.34 0.46 -0.05 6.66 5.08 -1.85 0.46 114.58 125.00 3kez h GLU 131 Ca -0.01 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3kez h GLU 131 Cb 0.32 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 3kez h GLU 131 CO 0.01 0.30 0.01 -0.92 -1.00 0.00 0.00 179.01 177.42 3kez h TYR 132 N 0.47 0.03 -0.65 4.33 3.20 -1.83 0.44 116.97 122.96 3kez h TYR 132 Ca 0.18 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 3kez h TYR 132 Cb 0.05 -0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 3kez h TYR 132 CO -0.09 0.01 0.38 -0.22 -1.64 0.00 0.00 178.16 176.60 3kez h LYS 133 N 0.04 0.89 -0.99 1.82 3.11 -0.35 -1.59 116.57 119.50 3kez h LYS 133 Ca 0.02 -0.09 0.06 0.00 -2.81 0.00 0.00 60.65 57.83 3kez h LYS 133 Cb 0.01 -0.18 -0.06 0.00 -1.00 0.00 0.00 32.23 31.00 3kez h LYS 133 CO -0.02 0.65 0.64 -0.91 -2.81 0.00 0.00 179.45 176.99 3kez h ASN 134 N 0.88 1.04 -0.45 4.20 2.35 0.39 -1.23 115.58 122.75 3kez h ASN 134 Ca 0.23 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.89 3kez h ASN 134 Cb 0.00 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.14 3kez h ASN 134 CO -0.04 0.68 -0.10 -0.78 -1.65 0.00 0.00 177.43 175.53 3kez h ASP 135 N 1.18 0.87 -0.29 5.81 3.58 -0.42 0.77 116.42 127.93 3kez h ASP 135 Ca 0.42 -0.36 0.02 0.00 0.42 0.00 0.00 57.03 57.53 3kez h ASP 135 Cb 0.11 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 3kez h ASP 135 CO -0.16 1.03 0.14 -0.07 -2.88 0.00 0.00 179.24 177.30 3kez h LEU 136 N 0.70 0.20 -0.67 2.28 3.38 -0.97 0.28 115.31 120.52 3kez h LEU 136 Ca 0.11 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 3kez h LEU 136 Cb 0.64 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 3kez h LEU 136 CO 0.04 0.15 0.40 0.50 0.09 0.00 0.00 178.44 179.62 3kez h LYS 137 N 0.29 0.92 -0.99 1.13 3.64 -1.05 -2.43 116.57 118.07 3kez h LYS 137 Ca 0.12 -0.09 0.03 0.00 -1.27 0.00 0.00 60.65 59.44 3kez h LYS 137 Cb 0.05 -0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 31.62 3kez h LYS 137 CO -0.09 0.66 0.65 0.78 -2.27 0.00 0.00 179.45 179.19 3kez h GLY 138 N 0.91 1.44 1.00 5.01 0.00 -0.21 -1.61 103.07 109.62 3kez h GLY 138 Ca 0.24 -0.50 0.00 0.00 0.00 0.00 0.00 47.33 47.07 3kez h GLY 138 CO -0.04 0.44 0.32 1.46 0.00 0.00 0.00 176.54 178.72 3kez h GLN 139 N 1.27 0.65 -0.63 4.80 4.20 -0.09 -0.35 115.11 124.96 3kez h GLN 139 Ca 0.39 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 59.04 3kez h GLN 139 Cb -0.02 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.58 3kez h GLN 139 CO -0.12 0.44 0.34 0.00 -0.67 0.00 0.00 178.83 178.82 3kez h ALA 140 N 1.18 0.81 -0.08 3.87 0.00 -1.10 -1.06 119.26 122.88 3kez h ALA 140 Ca 0.18 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 3kez h ALA 140 Cb -0.07 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 3kez h ALA 140 CO -0.04 0.34 0.03 -0.07 0.00 0.00 0.00 179.25 179.51 3kez h LEU 141 N 0.86 0.11 -0.58 0.00 3.38 -1.14 -0.99 115.31 116.94 3kez h LEU 141 Ca 0.22 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 58.04 3kez h LEU 141 Cb 0.06 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3kez h LEU 141 CO -0.03 0.25 0.38 0.00 0.09 0.00 0.00 178.44 179.12 3kez h ALA 142 N 0.86 0.75 -0.44 1.53 0.00 -0.88 -1.52 119.26 119.56 3kez h ALA 142 Ca 0.03 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3kez h ALA 142 Cb 0.18 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3kez h ALA 142 CO -0.00 0.14 0.16 0.82 0.00 0.00 0.00 179.25 180.37 3kez h ILE 143 N 0.76 1.21 -0.81 0.00 2.04 -1.19 -2.77 117.51 116.75 3kez h ILE 143 Ca 0.22 -0.67 -0.01 0.00 1.00 0.00 0.00 64.86 65.40 3kez h ILE 143 Cb -0.04 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 36.82 3kez h ILE 143 CO -0.07 0.24 0.47 -0.09 0.00 0.00 0.00 178.15 178.71 3kez h ARG 144 N 0.57 1.11 -0.36 2.37 2.43 -0.94 0.42 114.38 119.99 3kez h ARG 144 Ca 0.15 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3kez h ARG 144 Cb 0.22 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 3kez h ARG 144 CO -0.01 0.79 0.00 0.41 -1.51 0.00 0.00 179.97 179.65 3kez n GLY 145 N -1.17 0.19 0.00 2.80 0.00 -0.59 -1.26 105.19 105.15 3kez n GLY 145 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 0.51 0.00 0.02 4.61 0.00 0.14 -0.78 120.51 125.00 3kez n ALA 147 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 3kez n ALA 147 Cb 0.03 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.62 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 0.51 -0.46 0.00 5.85 -1.42 -1.28 115.31 118.50 3kez h LEU 148 Ca 0.00 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.50 3kez h LEU 148 Cb 0.00 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 3kez h LEU 148 CO 0.00 0.85 0.30 0.15 -0.34 0.00 0.00 178.44 179.40 3kez h PHE 149 N 0.40 0.59 -0.53 1.25 3.57 -1.19 0.02 116.94 121.05 3kez h PHE 149 Ca 0.04 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 3kez h PHE 149 Cb 0.86 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 3kez h PHE 149 CO 0.03 0.38 0.19 -0.44 -2.23 0.00 0.00 178.31 176.24 3kez h ASP 150 N 0.62 0.76 -0.90 0.41 3.32 -1.75 -0.26 116.42 118.61 3kez h ASP 150 Ca 0.17 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3kez h ASP 150 Cb -0.05 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.26 3kez h ASP 150 CO -0.03 0.74 0.56 -0.07 -1.72 0.00 0.00 179.24 178.72 3kez h LEU 151 N 0.73 1.06 -0.31 1.55 3.38 -0.95 -1.51 115.31 119.25 3kez h LEU 151 Ca 0.17 -0.05 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 3kez h LEU 151 Cb 0.24 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3kez h LEU 151 CO -0.01 0.80 -0.40 0.74 0.09 0.00 0.00 178.44 179.65 3kez h THR 152 N 1.23 1.29 0.00 0.22 2.02 -0.37 -1.56 112.91 115.73 3kez h THR 152 Ca 0.32 -1.58 -0.10 0.00 0.77 0.00 0.00 66.41 65.82 3kez h THR 152 Cb -0.09 1.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 3kez h THR 152 CO -0.06 0.52 -0.50 0.08 0.37 0.00 0.00 175.52 175.92 3kez h ARG 153 N 0.60 0.00 0.00 6.66 0.11 -0.97 -1.49 114.38 119.29 3kez h ARG 153 Ca 0.04 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 59.92 3kez h ARG 153 Cb 1.00 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.09 3kez h ARG 153 CO 0.10 0.50 -0.78 0.82 0.10 0.00 0.00 179.97 180.71 3kez h ILE 154 N 0.00 1.37 -0.01 0.08 2.04 -1.17 -3.39 117.51 116.44 3kez h ILE 154 Ca -0.00 -2.15 0.00 0.00 1.00 0.00 0.00 64.86 63.70 3kez h ILE 154 Cb 1.15 2.53 0.00 0.00 -0.74 0.00 0.00 36.82 39.76 3kez h ILE 154 CO 0.06 0.64 -0.30 0.49 0.00 0.00 0.00 178.15 179.05 3kez n PHE 155 N -4.08 0.00 -4.44 1.37 3.72 -0.60 -2.30 117.46 111.13 3kez n PHE 155 Ca -0.11 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.08 3kez n PHE 155 Cb 0.76 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 39.16 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 -1.61 0.82 0.50 1.37 0.00 -0.56 -4.87 107.32 102.97 3kez s GLY 156 Ca 0.09 -0.83 -0.22 0.00 0.00 0.00 0.00 44.72 43.76 3kez s GLY 156 CO 0.33 -0.78 1.14 -1.72 0.00 0.00 0.00 173.10 172.06 3kez n TYR 157 N 2.02 1.56 -1.65 1.90 4.01 -1.26 -4.56 117.16 119.18 3kez n TYR 157 Ca -0.17 0.48 -0.42 0.00 -0.16 0.00 0.00 57.90 57.63 3kez n TYR 157 Cb 0.55 -2.27 0.01 0.00 -0.31 0.00 0.00 39.34 37.31 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 -0.48 1.67 -0.19 -0.72 -0.04 -1.26 -4.89 135.00 129.10 3kez n PRO 158 Ca 0.10 0.59 -0.04 0.00 -0.04 0.00 0.00 63.50 64.12 3kez n PRO 158 Cb 0.43 -2.18 0.02 0.00 -0.04 0.00 0.00 33.50 31.73 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 1.94 -0.71 0.00 0.54 5.03 -1.91 -1.56 116.97 120.30 3kez h TYR 159 Ca -0.45 0.06 0.00 0.00 2.58 0.00 0.00 58.73 60.92 3kez h TYR 159 Cb 1.31 0.40 0.00 0.00 1.55 0.00 0.00 36.73 39.99 3kez h TYR 159 CO 0.47 -0.35 0.00 1.28 -1.32 0.00 0.00 178.16 178.24 3kez n LEU 160 N -5.43 0.00 -0.31 2.82 4.77 -1.26 -0.31 117.00 117.28 3kez n LEU 160 Ca 0.05 0.45 0.01 0.00 -0.03 0.00 0.00 56.01 56.49 3kez n LEU 160 Cb 0.34 -0.45 0.14 0.00 -2.33 0.00 0.00 43.42 41.12 3kez n LEU 160 CO 0.03 -0.22 1.19 0.50 -1.33 0.00 0.00 177.39 177.56 3kez h LYS 161 N 0.00 0.94 -0.05 3.23 3.64 -1.59 -3.38 116.57 119.36 3kez h LYS 161 Ca 0.00 -0.06 -0.16 0.00 -1.27 0.00 0.00 60.65 59.16 3kez h LYS 161 Cb 0.23 -0.21 -0.21 0.00 -0.41 0.00 0.00 32.23 31.63 3kez h LYS 161 CO 0.00 0.62 -0.51 -0.40 -2.27 0.00 0.00 179.45 176.89 3kez n ASP 162 N -4.62 -0.50 -4.06 4.20 5.68 -0.97 -5.00 116.55 111.27 3kez n ASP 162 Ca 0.12 -2.07 -0.31 0.00 -0.50 0.00 0.00 54.79 52.03 3kez n ASP 162 Cb 0.18 0.23 -0.01 0.00 -1.14 0.00 0.00 41.12 40.38 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 -0.48 -2.79 -0.61 -1.12 3.02 0.58 -2.10 115.26 111.75 3kez n ASN 163 Ca -0.15 -0.95 -0.08 0.00 -0.03 0.00 0.00 54.58 53.37 3kez n ASN 163 Cb 0.84 -3.15 -0.03 0.00 -0.61 0.00 0.00 39.78 36.83 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 -1.63 0.91 0.16 7.41 0.00 -0.19 -4.64 105.19 107.21 3kez n GLY 164 Ca -0.05 -0.69 0.01 0.00 0.00 0.00 0.00 46.02 45.30 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 0.03 0.98 -2.17 4.61 0.00 -1.70 0.19 119.26 121.18 3kez h ALA 165 Ca -0.16 -0.48 -0.44 0.00 0.00 0.00 0.00 54.91 53.83 3kez h ALA 165 Cb 0.55 -0.08 0.21 0.00 0.00 0.00 0.00 17.79 18.46 3kez h ALA 165 CO 0.23 0.66 0.03 -1.12 0.00 0.00 0.00 179.25 179.05 3kez s SER 166 N -6.68 1.12 -0.00 0.00 0.01 -1.26 -4.72 113.70 102.16 3kez s SER 166 Ca -0.01 1.46 -0.30 0.00 1.31 0.00 0.00 55.95 58.41 3kez s SER 166 Cb 0.12 -2.24 -0.04 0.00 0.21 0.00 0.00 66.02 64.07 3kez s SER 166 CO 0.73 -4.11 1.16 -0.76 0.41 0.00 0.00 173.24 170.67 3kez s LEU 167 N -7.14 4.33 0.00 2.44 1.43 -1.26 -0.44 118.68 118.04 3kez s LEU 167 Ca 0.68 1.86 0.00 0.00 -1.03 0.00 0.00 54.13 55.64 3kez s LEU 167 Cb -0.24 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.41 3kez s LEU 167 CO 0.64 -0.48 0.00 0.61 0.23 0.00 0.00 176.35 177.34 3kez n GLY 168 N 3.23 0.67 3.32 -3.19 0.00 0.52 -4.29 105.19 105.45 3kez n GLY 168 Ca 0.09 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.94 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 1.39 0.45 0.20 1.61 -7.23 -1.24 -4.66 120.40 110.92 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 -2.58 -0.10 0.00 0.56 0.00 0.00 36.38 34.26 3kez s VAL 169 CO 0.00 0.00 1.47 -2.84 -0.31 0.00 0.00 175.10 173.42 3kez s PRO 170 N -3.96 4.26 -0.34 4.82 0.02 -1.26 -1.87 135.00 136.68 3kez s PRO 170 Ca 0.37 2.28 -0.25 0.00 0.02 0.00 0.00 61.00 63.43 3kez s PRO 170 Cb 0.07 -3.14 0.01 0.00 0.02 0.00 0.00 34.50 31.45 3kez s PRO 170 CO 0.15 -0.48 0.86 0.42 -0.33 0.00 0.00 177.00 177.62 3kez s ILE 171 N 0.51 4.69 -0.24 2.83 1.01 -1.26 -4.90 121.20 123.83 3kez s ILE 171 Ca 0.63 1.19 0.01 0.00 0.00 0.00 0.00 60.65 62.48 3kez s ILE 171 Cb -0.42 -4.24 0.04 0.00 0.01 0.00 0.00 42.46 37.85 3kez s ILE 171 CO 0.38 -0.39 -0.11 -0.69 0.00 0.00 0.00 174.94 174.13 3kez s VAL 172 N 3.21 2.45 -0.13 2.92 1.01 -1.26 -4.97 120.40 123.63 3kez s VAL 172 Ca 0.35 -1.24 0.02 0.00 0.00 0.00 0.00 61.98 61.11 3kez s VAL 172 Cb -0.13 -2.28 -0.00 0.00 0.00 0.00 0.00 36.38 33.97 3kez s VAL 172 CO 0.15 0.18 0.26 0.29 0.00 0.00 0.00 175.10 175.98 3kez n LYS 173 N 4.57 3.56 -1.44 2.72 5.02 -1.26 -4.90 118.16 126.43 3kez n LYS 173 Ca -0.16 -0.24 0.00 0.00 -2.02 0.00 0.00 58.31 55.88 3kez n LYS 173 Cb 0.46 -0.76 0.00 0.00 -0.02 0.00 0.00 35.03 34.71 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 -0.58 2.51 -3.48 1.97 1.02 -1.26 -4.83 120.64 115.99 3kez n GLU 174 Ca 0.01 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.77 3kez n GLU 174 Cb 0.03 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.39 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 4.34 0.49 -4.62 1.43 -1.26 -4.90 118.68 114.16 3kez s LEU 175 Ca 0.00 0.76 -0.22 0.00 -1.03 0.00 0.00 54.13 53.64 3kez s LEU 175 Cb 0.00 -2.52 -0.07 0.00 0.03 0.00 0.00 46.19 43.62 3kez s LEU 175 CO 0.00 0.17 1.13 -0.44 0.23 0.00 0.00 176.35 177.44 3kez s SER 176 N -0.12 6.09 0.41 2.29 0.01 -1.26 -5.07 113.70 116.06 3kez s SER 176 Ca 0.22 2.20 0.04 0.00 1.31 0.00 0.00 55.95 59.71 3kez s SER 176 Cb -0.15 -2.59 -0.03 0.00 0.21 0.00 0.00 66.02 63.47 3kez s SER 176 CO 0.09 -0.97 0.11 0.42 0.41 0.00 0.00 173.24 173.30 3kez s THR 177 N -1.68 0.72 0.28 1.44 -4.23 -1.26 -5.02 115.64 105.88 3kez s THR 177 Ca 0.67 -2.00 0.33 0.00 -1.18 0.00 0.00 61.69 59.51 3kez s THR 177 Cb -0.25 -2.37 0.33 0.00 1.34 0.00 0.00 72.50 71.55 3kez s THR 177 CO 0.30 0.00 2.01 0.16 -0.54 0.00 0.00 174.62 176.55 3kez h ILE 178 N 1.78 0.00 -0.01 2.99 3.07 -2.06 -2.24 117.51 121.03 3kez h ILE 178 Ca -0.37 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.04 3kez h ILE 178 Cb 1.27 0.74 0.00 0.00 -0.27 0.00 0.00 36.82 38.56 3kez h ILE 178 CO 0.60 0.00 -0.28 -0.67 -1.05 0.00 0.00 178.15 176.75 3kez n ASP 179 N -2.68 1.42 -4.62 2.16 2.03 -1.26 -4.92 116.55 108.67 3kez n ASP 179 Ca -0.02 -1.16 -0.43 0.00 0.52 0.00 0.00 54.79 53.70 3kez n ASP 179 Cb 0.08 0.21 -0.02 0.00 -0.72 0.00 0.00 41.12 40.67 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 -2.42 6.58 -0.43 1.67 0.01 -0.85 -4.93 113.70 113.33 3kez s SER 180 Ca 0.24 1.05 0.10 0.00 1.31 0.00 0.00 55.95 58.65 3kez s SER 180 Cb 0.19 -2.54 0.33 0.00 0.21 0.00 0.00 66.02 64.21 3kez s SER 180 CO 0.51 -1.19 0.74 0.29 0.41 0.00 0.00 173.24 173.99 3kez n LYS 181 N 7.56 1.44 -2.50 12.44 4.01 -1.26 -4.94 118.16 134.90 3kez n LYS 181 Ca 0.15 -3.70 -0.34 0.00 -0.51 0.00 0.00 58.31 53.91 3kez n LYS 181 Cb 0.47 -1.76 -0.03 0.00 -0.51 0.00 0.00 35.03 33.21 3kez n LYS 181 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 3kez s PRO 182 N -2.42 3.76 0.53 1.97 0.04 -1.26 -4.55 135.00 133.06 3kez s PRO 182 Ca 0.41 1.41 -0.03 0.00 0.04 0.00 0.00 61.00 62.82 3kez s PRO 182 Cb 0.30 -2.11 -0.00 0.00 0.04 0.00 0.00 34.50 32.73 3kez s PRO 182 CO -0.09 -0.48 0.80 0.00 0.04 0.00 0.00 177.00 177.27 3kez s ALA 183 N -1.93 3.48 0.11 8.56 0.00 -1.26 -4.74 121.76 125.98 3kez s ALA 183 Ca 0.68 -0.81 -0.31 0.00 0.00 0.00 0.00 51.96 51.52 3kez s ALA 183 Cb -0.18 -2.43 -0.07 0.00 0.00 0.00 0.00 23.12 20.45 3kez s ALA 183 CO 0.21 -0.60 1.26 1.03 0.00 0.00 0.00 175.76 177.66 3kez s ARG 184 N -4.80 4.41 0.92 0.00 0.52 -1.26 -4.14 118.95 114.60 3kez s ARG 184 Ca 0.51 1.89 -0.14 0.00 -0.52 0.00 0.00 55.73 57.46 3kez s ARG 184 Cb -0.10 -3.29 0.16 0.00 0.52 0.00 0.00 34.95 32.23 3kez s ARG 184 CO 0.42 -0.27 1.22 -0.80 0.02 0.00 0.00 175.30 175.89 3kez s ASN 185 N 0.86 3.45 0.62 0.23 -0.87 -0.78 -4.84 114.94 113.60 3kez s ASN 185 Ca 0.59 0.59 -0.10 0.00 -1.57 0.00 0.00 52.86 52.38 3kez s ASN 185 Cb -0.32 -0.90 -0.02 0.00 -0.02 0.00 0.00 41.25 39.98 3kez s ASN 185 CO 0.31 -2.55 1.00 0.42 -2.57 0.00 0.00 177.10 173.71 3kez s THR 186 N -3.60 4.40 0.24 1.60 -4.23 -1.26 -0.36 115.64 112.43 3kez s THR 186 Ca 0.68 0.63 -0.05 0.00 -1.18 0.00 0.00 61.69 61.77 3kez s THR 186 Cb -0.09 -3.75 0.20 0.00 1.34 0.00 0.00 72.50 70.20 3kez s THR 186 CO 0.52 -0.94 1.81 0.58 -0.54 0.00 0.00 174.62 176.05 3kez h VAL 187 N -0.30 0.93 -0.45 2.29 2.07 -0.57 -1.05 116.25 119.17 3kez h VAL 187 Ca -0.45 -0.27 0.03 0.00 0.82 0.00 0.00 66.70 66.83 3kez h VAL 187 Cb 1.21 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 3kez h VAL 187 CO 0.62 0.15 0.24 0.00 0.02 0.00 0.00 177.57 178.60 3kez h ALA 188 N 1.43 0.56 -0.76 1.67 0.00 -0.88 -1.40 119.26 119.89 3kez h ALA 188 Ca 0.38 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.25 3kez h ALA 188 Cb 0.32 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3kez h ALA 188 CO -0.23 -0.09 0.28 0.93 0.00 0.00 0.00 179.25 180.14 3kez h GLU 189 N 0.49 1.15 -0.53 0.00 5.08 -1.69 -1.78 114.58 117.29 3kez h GLU 189 Ca 0.19 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 3kez h GLU 189 Cb 0.06 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 3kez h GLU 189 CO -0.11 0.95 0.30 0.00 -1.00 0.00 0.00 179.01 179.15 3kez h TYR 191 N 0.72 1.03 -0.62 0.00 -1.99 -0.86 0.43 116.97 115.68 3kez h TYR 191 Ca 0.19 -0.04 0.09 0.00 2.00 0.00 0.00 58.73 60.97 3kez h TYR 191 Cb 0.04 -0.32 -0.07 0.00 2.00 0.00 0.00 36.73 38.38 3kez h TYR 191 CO -0.02 0.75 0.26 1.15 -0.00 0.00 0.00 178.16 180.30 3kez h THR 192 N 1.04 0.81 -0.26 -2.88 2.02 -0.99 0.67 112.91 113.31 3kez h THR 192 Ca 0.25 -0.16 -0.13 0.00 0.77 0.00 0.00 66.41 67.14 3kez h THR 192 Cb 0.10 0.31 -0.00 0.00 -1.74 0.00 0.00 68.15 66.82 3kez h THR 192 CO -0.03 0.08 -0.35 -0.33 0.37 0.00 0.00 175.52 175.26 3kez h GLU 193 N 0.46 0.70 0.15 6.66 4.39 -1.06 -1.36 114.58 124.52 3kez h GLU 193 Ca 0.31 -0.41 -0.00 0.00 0.34 0.00 0.00 59.36 59.60 3kez h GLU 193 Cb 0.35 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 3kez h GLU 193 CO -0.28 1.02 -0.11 0.82 -1.16 0.00 0.00 179.01 179.30 3kez h ILE 194 N 0.43 0.76 -0.44 3.13 2.04 -0.65 -0.56 117.51 122.23 3kez h ILE 194 Ca 0.03 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.80 3kez h ILE 194 Cb 0.94 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 3kez h ILE 194 CO 0.08 0.00 -0.08 0.40 0.00 0.00 0.00 178.15 178.55 3kez h ILE 195 N -0.27 1.27 -0.34 -0.67 2.04 -0.89 -1.24 117.51 117.42 3kez h ILE 195 Ca -0.01 -1.18 0.02 0.00 1.00 0.00 0.00 64.86 64.69 3kez h ILE 195 Cb 0.23 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 3kez h ILE 195 CO -0.00 0.40 0.19 -1.28 0.00 0.00 0.00 178.15 177.46 3kez h SER 196 N 0.66 0.31 0.01 1.72 0.87 -1.11 0.19 113.55 116.21 3kez h SER 196 Ca 0.11 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.68 3kez h SER 196 Cb 0.61 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 3kez h SER 196 CO 0.04 0.23 -0.00 0.44 -0.53 0.00 0.00 176.83 177.00 3kez h ASP 197 N 0.40 -0.01 -0.45 6.23 3.32 -0.92 -2.31 116.42 122.69 3kez h ASP 197 Ca 0.14 -0.08 -0.07 0.00 0.02 0.00 0.00 57.03 57.03 3kez h ASP 197 Cb 0.01 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 3kez h ASP 197 CO -0.07 0.08 0.01 -0.07 -1.72 0.00 0.00 179.24 177.47 3kez h LEU 198 N -0.10 0.77 -0.36 1.55 3.38 -1.05 0.21 115.31 119.71 3kez h LEU 198 Ca -0.00 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.68 3kez h LEU 198 Cb 0.09 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 3kez h LEU 198 CO 0.00 0.88 0.22 0.50 0.09 0.00 0.00 178.44 180.13 3kez h LYS 199 N 0.63 0.44 -0.82 1.13 3.64 -0.63 -1.51 116.57 119.46 3kez h LYS 199 Ca 0.13 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 3kez h LYS 199 Cb 0.48 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 32.16 3kez h LYS 199 CO 0.02 0.29 0.42 -0.91 -2.27 0.00 0.00 179.45 177.00 3kez h ASN 200 N 0.45 1.04 -0.20 4.20 2.35 -1.22 -2.36 115.58 119.83 3kez h ASN 200 Ca 0.14 -0.10 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 3kez h ASN 200 Cb -0.02 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.07 3kez h ASN 200 CO -0.05 0.85 0.09 0.77 -1.65 0.00 0.00 177.43 177.44 3kez h SER 201 N 1.15 0.32 1.00 5.81 4.64 -0.28 -2.36 113.55 123.83 3kez h SER 201 Ca 0.29 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 3kez h SER 201 Cb 0.07 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3kez h SER 201 CO -0.04 0.31 0.00 0.71 -0.87 0.00 0.00 176.83 176.94 3kez h THR 202 N 0.36 0.00 0.00 2.95 1.35 -0.74 0.30 112.91 117.13 3kez h THR 202 Ca 0.09 -0.45 0.00 0.00 -0.55 0.00 0.00 66.41 65.50 3kez h THR 202 Cb 0.10 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 67.89 3kez h THR 202 CO -0.01 0.00 -0.88 -0.62 -0.25 0.00 0.00 175.52 173.76 3kez n GLU 203 N -2.80 0.18 -0.06 4.72 1.02 -0.91 -4.54 120.64 118.26 3kez n GLU 203 Ca 0.01 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.08 3kez n GLU 203 Cb 0.30 -1.56 -0.06 0.00 -0.02 0.00 0.00 31.44 30.10 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 -1.80 2.56 -4.76 -4.62 4.77 -0.85 -5.04 117.00 107.27 3kez n LEU 204 Ca 0.03 -0.05 -0.39 0.00 -0.03 0.00 0.00 56.01 55.57 3kez n LEU 204 Cb 0.40 -0.31 0.02 0.00 -2.33 0.00 0.00 43.42 41.19 3kez n LEU 204 CO 0.39 0.63 0.96 -0.76 -1.33 0.00 0.00 177.39 177.28 3kez s LEU 205 N -5.53 3.99 0.47 2.23 1.43 0.04 -3.24 118.68 118.06 3kez s LEU 205 Ca -0.14 2.68 -0.22 0.00 -1.03 0.00 0.00 54.13 55.42 3kez s LEU 205 Cb 0.04 -4.15 -0.08 0.00 0.03 0.00 0.00 46.19 42.03 3kez s LEU 205 CO 0.28 -1.25 1.09 -0.55 0.23 0.00 0.00 176.35 176.15 3kez s SER 206 N -0.92 6.29 0.00 2.29 0.15 -1.26 -4.51 113.70 115.73 3kez s SER 206 Ca 0.66 2.10 0.30 0.00 0.70 0.00 0.00 55.95 59.70 3kez s SER 206 Cb -0.38 -2.58 1.53 0.00 -1.71 0.00 0.00 66.02 62.87 3kez s SER 206 CO 0.47 -0.82 2.03 0.61 1.20 0.00 0.00 173.24 176.72 3kez n GLY 207 N 0.15 -0.93 3.75 9.45 0.00 -1.26 -0.93 105.19 115.43 3kez n GLY 207 Ca 0.08 -0.24 -0.37 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 -2.26 5.30 0.22 1.61 1.01 -1.26 -4.84 116.67 116.45 3kez s ASP 208 Ca 0.37 2.53 -0.32 0.00 0.71 0.00 0.00 52.55 55.84 3kez s ASP 208 Cb 0.21 -2.61 -0.14 0.00 1.01 0.00 0.00 42.92 41.38 3kez s ASP 208 CO 0.42 -1.53 1.32 0.33 0.21 0.00 0.00 175.17 175.92 3kez n PHE 209 N -1.26 1.86 -3.32 4.23 7.35 -1.26 -4.85 117.46 120.21 3kez n PHE 209 Ca 0.12 0.52 -0.11 0.00 -0.76 0.00 0.00 57.45 57.21 3kez n PHE 209 Cb 0.48 -2.40 -0.06 0.00 0.35 0.00 0.00 39.48 37.85 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 0.16 0.47 0.04 -2.13 3.84 -1.26 -4.98 114.94 111.08 3kez s ASN 210 Ca 0.69 -1.06 -0.30 0.00 0.21 0.00 0.00 52.86 52.40 3kez s ASN 210 Cb -0.71 0.97 -0.08 0.00 -0.55 0.00 0.00 41.25 40.88 3kez s ASN 210 CO 0.51 -0.27 1.80 -0.75 -2.79 0.00 0.00 177.10 175.59 3kez s LYS 211 N 1.86 4.16 0.00 0.43 2.47 -1.26 -1.08 119.74 126.33 3kez s LYS 211 Ca 0.14 2.45 0.00 0.00 -1.56 0.00 0.00 55.97 57.00 3kez s LYS 211 Cb -0.12 -3.89 0.00 0.00 -1.46 0.00 0.00 37.83 32.35 3kez s LYS 211 CO -0.13 -0.86 0.00 0.41 0.16 0.00 0.00 175.35 174.93 3kez n GLY 212 N 4.27 0.38 3.32 5.54 0.00 -1.25 -5.01 105.19 112.43 3kez n GLY 212 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.59 1.25 0.14 1.61 1.02 -0.24 -4.79 119.74 118.14 3kez s LYS 213 Ca 0.00 -1.49 -0.30 0.00 0.02 0.00 0.00 55.97 54.20 3kez s LYS 213 Cb 0.00 -1.07 -0.07 0.00 -0.52 0.00 0.00 37.83 36.17 3kez s LYS 213 CO 0.00 0.19 1.12 0.08 -0.92 0.00 0.00 175.35 175.82 3kez s VAL 214 N -2.73 3.95 0.46 3.17 1.01 -1.26 -4.70 120.40 120.30 3kez s VAL 214 Ca 0.19 1.59 0.01 0.00 0.00 0.00 0.00 61.98 63.77 3kez s VAL 214 Cb -0.02 -4.01 -0.00 0.00 0.00 0.00 0.00 36.38 32.34 3kez s VAL 214 CO 0.06 0.23 0.04 -0.46 0.00 0.00 0.00 175.10 174.97 3kez n ASN 215 N 2.84 2.67 -0.24 3.32 0.23 -1.26 -4.82 115.26 118.00 3kez n ASN 215 Ca 0.04 -3.11 -0.00 0.00 -0.53 0.00 0.00 54.58 50.98 3kez n ASN 215 Cb 0.46 0.55 0.12 0.00 -2.08 0.00 0.00 39.78 38.82 3kez n ASN 215 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 3kez h ARG 216 N 0.00 0.64 -0.31 -3.83 2.43 -1.26 -1.72 114.38 110.33 3kez h ARG 216 Ca -0.37 -0.04 -0.18 0.00 -0.81 0.00 0.00 59.98 58.58 3kez h ARG 216 Cb 1.20 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.61 3kez h ARG 216 CO 0.61 0.42 -0.52 -1.49 -1.51 0.00 0.00 179.97 177.48 3kez h TRP 217 N 0.65 1.10 -0.08 2.20 -0.00 -1.90 -2.80 115.95 115.11 3kez h TRP 217 Ca 0.32 -0.38 0.03 0.00 -0.00 0.00 0.00 58.89 58.86 3kez h TRP 217 Cb 0.26 -0.21 -0.03 0.00 -0.00 0.00 0.00 29.16 29.18 3kez h TRP 217 CO -0.09 1.21 -0.09 0.00 -0.00 0.00 0.00 178.44 179.47 3kez h ALA 218 N 0.72 -0.02 0.00 1.49 0.00 -1.73 -1.15 119.26 118.56 3kez h ALA 218 Ca 0.02 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3kez h ALA 218 Cb 1.12 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3kez h ALA 218 CO 0.12 -0.55 0.00 0.00 0.00 0.00 0.00 179.25 178.81 3kez n ALA 219 N -2.40 1.59 0.00 0.00 0.00 -0.66 -1.39 120.51 117.66 3kez n ALA 219 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3kez n ALA 219 Cb 0.15 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.60 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 0.90 0.00 -0.18 0.00 -1.04 -0.43 -0.80 114.28 112.73 3kez n THR 221 Ca 0.00 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.93 3kez n THR 221 Cb 0.06 0.00 0.01 0.00 -1.82 0.00 0.00 70.33 68.58 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 0.67 -0.97 -4.42 5.85 -1.49 -2.03 115.31 112.92 3kez h LEU 222 Ca 0.00 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 3kez h LEU 222 Cb 0.00 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.82 3kez h LEU 222 CO 0.00 0.62 0.44 0.25 -0.34 0.00 0.00 178.44 179.41 3kez h LEU 223 N 0.68 1.05 -1.03 2.25 5.85 -1.22 0.23 115.31 123.12 3kez h LEU 223 Ca 0.17 -0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.82 3kez h LEU 223 Cb 0.13 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.84 3kez h LEU 223 CO -0.02 0.85 0.65 0.77 -0.34 0.00 0.00 178.44 180.36 3kez h SER 224 N 1.17 1.11 -0.34 1.25 4.64 -1.69 0.07 113.55 119.75 3kez h SER 224 Ca 0.29 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.58 3kez h SER 224 Cb 0.05 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 61.86 3kez h SER 224 CO -0.04 0.77 0.16 -0.09 -0.87 0.00 0.00 176.83 176.76 3kez h ARG 225 N 1.29 0.49 -0.64 4.77 2.43 -0.41 -2.07 114.38 120.23 3kez h ARG 225 Ca 0.38 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.46 3kez h ARG 225 Cb -0.06 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.37 3kez h ARG 225 CO -0.11 0.45 0.34 0.28 -1.51 0.00 0.00 179.97 179.43 3kez h VAL 226 N 0.41 1.21 -0.83 0.20 2.07 -0.25 -1.23 116.25 117.82 3kez h VAL 226 Ca 0.12 -0.55 0.03 0.00 0.82 0.00 0.00 66.70 67.12 3kez h VAL 226 Cb 0.13 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 30.25 3kez h VAL 226 CO -0.01 0.23 0.55 1.88 0.02 0.00 0.00 177.57 180.24 3kez h TYR 227 N 0.88 1.00 -0.30 1.57 0.05 -0.90 -2.17 116.97 117.09 3kez h TYR 227 Ca 0.22 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 59.01 3kez h TYR 227 Cb 0.07 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 37.46 3kez h TYR 227 CO -0.00 0.59 0.13 -0.07 -1.05 0.00 0.00 178.16 177.76 3kez h LEU 228 N 1.04 0.41 -1.54 3.88 3.38 -0.54 0.13 115.31 122.07 3kez h LEU 228 Ca 0.33 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 58.19 3kez h LEU 228 Cb 0.01 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 3kez h LEU 228 CO -0.09 0.44 0.35 1.88 0.09 0.00 0.00 178.44 181.11 3kez h TYR 229 N 0.35 0.57 -0.00 1.13 -1.99 -0.80 -0.53 116.97 115.70 3kez h TYR 229 Ca 0.10 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.85 3kez h TYR 229 Cb 0.15 -0.19 0.00 0.00 2.00 0.00 0.00 36.73 38.69 3kez h TYR 229 CO -0.01 0.33 -0.05 1.17 -0.00 0.00 0.00 178.16 179.60 3kez n LYS 230 N -4.47 0.27 -1.11 4.88 4.81 -0.86 -4.12 118.16 117.56 3kez n LYS 230 Ca 0.06 -0.03 -0.04 0.00 -0.87 0.00 0.00 58.31 57.44 3kez n LYS 230 Cb 0.15 -1.50 -0.02 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 1.38 0.66 3.12 3.14 0.00 -0.21 -4.86 105.19 108.42 3kez n GLY 231 Ca 0.11 -0.78 -0.43 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.80 3.81 -0.09 1.61 1.02 0.38 -4.87 120.64 119.71 3kez n GLU 232 Ca -0.04 -4.07 -0.09 0.00 -0.02 0.00 0.00 57.16 52.94 3kez n GLU 232 Cb 0.13 -2.76 0.05 0.00 -0.02 0.00 0.00 31.44 28.85 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 6.11 0.93 -0.55 -0.32 0.05 -1.93 0.76 116.97 122.03 3kez h TYR 233 Ca 0.28 -0.24 0.04 0.00 0.05 0.00 0.00 58.73 58.86 3kez h TYR 233 Cb 0.72 -0.21 -0.04 0.00 1.01 0.00 0.00 36.73 38.21 3kez h TYR 233 CO 1.06 1.00 0.31 -0.91 -1.05 0.00 0.00 178.16 178.56 3kez h ASN 234 N 0.68 0.48 -0.27 3.88 2.35 -1.89 -0.07 115.58 120.74 3kez h ASN 234 Ca 0.08 0.02 -0.18 0.00 -0.55 0.00 0.00 56.30 55.66 3kez h ASN 234 Cb 0.84 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.13 3kez h ASN 234 CO 0.07 0.33 -0.55 -0.33 -1.65 0.00 0.00 177.43 175.30 3kez h GLU 235 N 0.60 0.85 -0.50 0.81 3.07 -1.90 -1.80 114.58 115.71 3kez h GLU 235 Ca 0.23 -0.55 0.08 0.00 -0.50 0.00 0.00 59.36 58.62 3kez h GLU 235 Cb 0.08 0.07 -0.07 0.00 -0.84 0.00 0.00 28.75 28.00 3kez h GLU 235 CO -0.13 1.18 0.13 0.00 -1.40 0.00 0.00 179.01 178.79 3kez h ALA 236 N 0.66 0.59 -0.27 3.43 0.00 -0.66 -3.06 119.26 119.96 3kez h ALA 236 Ca 0.01 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3kez h ALA 236 Cb 1.16 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 3kez h ALA 236 CO 0.12 -0.28 0.02 1.25 0.00 0.00 0.00 179.25 180.36 3kez h LEU 237 N 0.28 0.45 -1.04 0.00 5.85 -0.85 -1.10 115.31 118.90 3kez h LEU 237 Ca 0.25 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.68 3kez h LEU 237 Cb 0.32 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.23 3kez h LEU 237 CO -0.30 0.63 0.00 0.41 -0.34 0.00 0.00 178.44 178.83 3kez n THR 238 N -4.63 0.00 0.00 1.05 -1.04 -0.69 -1.16 114.28 107.81 3kez n THR 238 Ca -0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 3kez n THR 238 Cb 0.23 -0.02 0.00 0.00 -1.82 0.00 0.00 70.33 68.72 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 0.49 0.00 -0.23 2.41 0.00 -0.42 -1.56 120.51 121.21 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 1.01 -0.09 0.00 5.08 -1.39 -1.58 114.58 117.61 3kez h GLU 241 Ca 0.00 -0.23 -0.16 0.00 -1.00 0.00 0.00 59.36 57.97 3kez h GLU 241 Cb 0.00 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 3kez h GLU 241 CO 0.00 0.90 -0.63 -0.91 -1.00 0.00 0.00 179.01 177.38 3kez h ASN 242 N 0.93 0.38 -0.64 1.42 2.35 -1.52 -2.14 115.58 116.36 3kez h ASN 242 Ca 0.20 -0.23 0.02 0.00 -0.55 0.00 0.00 56.30 55.74 3kez h ASN 242 Cb 0.34 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.56 3kez h ASN 242 CO -0.00 0.91 0.41 0.00 -1.65 0.00 0.00 177.43 177.10 3kez h ALA 243 N 1.09 0.82 0.07 -0.83 0.00 -1.73 -1.10 119.26 117.57 3kez h ALA 243 Ca -0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3kez h ALA 243 Cb 1.16 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3kez h ALA 243 CO 0.10 0.19 -0.03 0.82 0.00 0.00 0.00 179.25 180.33 3kez h ILE 244 N 0.82 1.11 -0.49 0.00 2.04 -1.18 -1.11 117.51 118.69 3kez h ILE 244 Ca 0.25 -0.62 0.01 0.00 1.00 0.00 0.00 64.86 65.49 3kez h ILE 244 Cb -0.04 1.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 3kez h ILE 244 CO -0.08 0.15 0.32 0.11 0.00 0.00 0.00 178.15 178.66 3kez h LYS 245 N -0.37 0.63 -0.13 2.37 1.57 -1.24 -0.22 116.57 119.19 3kez h LYS 245 Ca -0.01 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 3kez h LYS 245 Cb 0.32 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 3kez h LYS 245 CO 0.02 0.42 -0.02 0.78 -0.57 0.00 0.00 179.45 180.07 3kez h GLY 246 N 0.65 0.27 0.97 3.86 0.00 -1.24 -1.67 103.07 105.90 3kez h GLY 246 Ca 0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 3kez h GLY 246 CO -0.05 0.20 0.24 0.00 0.00 0.00 0.00 176.54 176.92 3kez h ALA 247 N 0.71 0.60 -0.36 3.60 0.00 -1.08 -1.71 119.26 121.02 3kez h ALA 247 Ca 0.03 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 3kez h ALA 247 Cb 0.43 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3kez h ALA 247 CO 0.01 0.15 -0.21 0.93 0.00 0.00 0.00 179.25 180.13 3kez h GLU 248 N 0.61 0.70 -0.43 0.00 5.08 -1.07 -1.43 114.58 118.05 3kez h GLU 248 Ca 0.16 -0.27 0.02 0.00 -1.00 0.00 0.00 59.36 58.27 3kez h GLU 248 Cb 0.10 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 3kez h GLU 248 CO -0.02 0.86 0.28 0.87 -1.00 0.00 0.00 179.01 180.00 3kez h LYS 249 N 0.62 0.47 0.00 2.33 1.57 -1.07 -1.17 116.57 119.33 3kez h LYS 249 Ca 0.09 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3kez h LYS 249 Cb 0.70 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.90 3kez h LYS 249 CO 0.05 0.31 0.00 -1.91 -0.57 0.00 0.00 179.45 177.34 3kez n GLU 250 N -4.48 0.07 0.00 3.15 4.07 -0.62 -4.91 120.64 117.92 3kez n GLU 250 Ca 0.04 0.16 0.00 0.00 -0.06 0.00 0.00 57.16 57.31 3kez n GLU 250 Cb 0.13 -1.60 0.00 0.00 -0.06 0.00 0.00 31.44 29.91 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 0.84 0.71 3.77 8.31 0.00 -0.44 -4.94 105.19 113.45 3kez n GLY 251 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 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 2.75 -0.11 1.61 1.51 -0.70 -4.49 117.35 115.92 3kez s TYR 252 Ca 0.00 1.55 -0.21 0.00 -1.01 0.00 0.00 57.07 57.39 3kez s TYR 252 Cb 0.00 -3.30 0.05 0.00 -0.11 0.00 0.00 41.96 38.60 3kez s TYR 252 CO 0.00 -1.50 0.52 0.00 -1.11 0.00 0.00 175.55 173.46 3kez s ALA 253 N -1.73 -1.31 0.22 3.71 0.00 -0.63 -4.09 121.76 117.93 3kez s ALA 253 Ca 0.70 1.13 -0.32 0.00 0.00 0.00 0.00 51.96 53.48 3kez s ALA 253 Cb -0.25 -0.36 -0.14 0.00 0.00 0.00 0.00 23.12 22.38 3kez s ALA 253 CO 0.28 -0.29 1.33 1.28 0.00 0.00 0.00 175.76 178.36 3kez n LEU 254 N 1.82 2.60 -4.68 0.00 4.77 -1.26 -3.30 117.00 116.94 3kez n LEU 254 Ca -0.17 1.14 -0.45 0.00 -0.03 0.00 0.00 56.01 56.50 3kez n LEU 254 Cb 0.56 -1.36 -0.04 0.00 -2.33 0.00 0.00 43.42 40.26 3kez n LEU 254 CO 0.17 -0.75 1.23 0.79 -1.33 0.00 0.00 177.39 177.49 3kez n TRP 255 N 1.76 2.40 -0.87 -1.77 8.01 -1.26 -4.96 117.44 120.75 3kez n TRP 255 Ca 0.13 0.22 -0.30 0.00 -1.31 0.00 0.00 57.50 56.24 3kez n TRP 255 Cb 0.29 -2.57 0.16 0.00 -2.01 0.00 0.00 31.31 27.18 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 0.90 2.42 0.25 -0.99 -4.23 -1.26 -4.73 115.64 107.99 3kez s THR 256 Ca 0.77 0.14 -0.03 0.00 -1.18 0.00 0.00 61.69 61.38 3kez s THR 256 Cb -0.63 -2.33 0.22 0.00 1.34 0.00 0.00 72.50 71.09 3kez s THR 256 CO 0.37 -0.18 1.74 -1.13 -0.54 0.00 0.00 174.62 174.89 3kez h ASN 257 N -1.79 0.35 -0.67 3.99 -0.73 -1.92 -0.51 115.58 114.29 3kez h ASN 257 Ca -0.47 0.10 -0.06 0.00 1.87 0.00 0.00 56.30 57.74 3kez h ASN 257 Cb 1.27 0.06 -0.03 0.00 0.27 0.00 0.00 38.32 39.90 3kez h ASN 257 CO 0.47 0.14 0.20 -0.08 -0.37 0.00 0.00 177.43 177.79 3kez h GLU 258 N 0.49 1.07 -0.01 6.67 4.81 -1.91 -3.15 114.58 122.56 3kez h GLU 258 Ca 0.42 -0.23 -0.16 0.00 -0.13 0.00 0.00 59.36 59.26 3kez h GLU 258 Cb 0.62 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 3kez h GLU 258 CO -0.39 0.92 -0.73 0.93 -0.73 0.00 0.00 179.01 179.02 3kez h GLU 259 N 1.03 0.09 -0.65 1.92 5.08 -1.74 -3.40 114.58 116.91 3kez h GLU 259 Ca 0.22 -0.08 0.12 0.00 -1.00 0.00 0.00 59.36 58.63 3kez h GLU 259 Cb 0.31 0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.49 3kez h GLU 259 CO -0.01 0.77 0.19 -0.92 -1.00 0.00 0.00 179.01 178.04 3kez h TYR 260 N 0.06 0.31 0.00 4.33 5.03 -1.07 -0.46 116.97 125.17 3kez h TYR 260 Ca -0.01 0.04 -0.01 0.00 2.58 0.00 0.00 58.73 61.32 3kez h TYR 260 Cb 1.28 -0.04 -0.00 0.00 1.55 0.00 0.00 36.73 39.52 3kez h TYR 260 CO 0.01 0.01 -0.06 -1.35 -1.32 0.00 0.00 178.16 175.44 3kez h PRO 261 N 0.32 0.00 -0.00 1.82 0.11 -1.79 -3.19 132.00 129.28 3kez h PRO 261 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 3kez h PRO 261 Cb 0.51 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.62 3kez h PRO 261 CO -0.40 0.06 -0.04 0.25 -0.21 0.00 0.00 178.00 177.67 3kez n THR 262 N -4.31 0.00 0.22 -1.15 -2.24 -0.66 -4.73 114.28 101.42 3kez n THR 262 Ca -0.03 -0.48 0.06 0.00 -2.27 0.00 0.00 64.05 61.33 3kez n THR 262 Cb 0.14 1.03 0.52 0.00 -2.10 0.00 0.00 70.33 69.93 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 0.43 1.57 -0.28 6.98 0.00 -1.10 -1.99 119.26 124.86 3kez h ALA 263 Ca 0.00 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.80 3kez h ALA 263 Cb 0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3kez h ALA 263 CO 0.00 0.26 0.28 -1.49 0.00 0.00 0.00 179.25 178.30 3kez h TRP 264 N 0.00 0.00 -0.02 0.00 4.06 -1.85 -1.92 115.95 116.22 3kez h TRP 264 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 3kez h TRP 264 Cb 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.54 3kez h TRP 264 CO 0.00 0.00 -0.37 0.41 -3.56 0.00 0.00 178.44 174.92 3kez n GLY 265 N -1.46 0.11 3.63 1.49 0.00 -0.75 -4.33 105.19 103.89 3kez n GLY 265 Ca 0.04 -0.62 -0.31 0.00 0.00 0.00 0.00 46.02 45.13 3kez n GLY 265 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3kez n ASN 266 N 0.12 -0.01 -4.10 1.61 3.02 -0.73 -4.20 115.26 110.98 3kez n ASN 266 Ca 0.11 0.35 -0.34 0.00 -0.03 0.00 0.00 54.58 54.66 3kez n ASN 266 Cb 0.47 -1.44 -0.13 0.00 -0.61 0.00 0.00 39.78 38.07 3kez n ASN 266 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3kez s ASP 267 N -2.58 5.04 0.53 6.41 -1.08 -1.26 -4.92 116.67 118.81 3kez s ASP 267 Ca 0.67 -1.93 -0.20 0.00 -0.52 0.00 0.00 52.55 50.56 3kez s ASP 267 Cb -0.23 -1.75 -0.06 0.00 -1.46 0.00 0.00 42.92 39.42 3kez s ASP 267 CO 0.59 -0.44 1.15 0.00 0.52 0.00 0.00 175.17 176.99 3kez s ALA 268 N 1.09 2.74 0.29 3.66 0.00 -1.26 -5.03 121.76 123.24 3kez s ALA 268 Ca 0.06 0.88 0.03 0.00 0.00 0.00 0.00 51.96 52.93 3kez s ALA 268 Cb -0.21 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 3kez s ALA 268 CO -0.05 -0.80 0.26 -1.54 0.00 0.00 0.00 175.76 173.63 3kez s SER 269 N -1.65 1.04 0.25 0.00 1.04 -0.93 -4.97 113.70 108.49 3kez s SER 269 Ca 0.71 -1.59 -0.05 0.00 0.48 0.00 0.00 55.95 55.51 3kez s SER 269 Cb -0.26 0.51 0.34 0.00 0.10 0.00 0.00 66.02 66.71 3kez s SER 269 CO 0.30 -1.02 1.88 0.00 0.98 0.00 0.00 173.24 175.38 3kez h ALA 270 N 2.30 1.28 0.00 5.32 0.00 -1.96 0.13 119.26 126.32 3kez h ALA 270 Ca -0.29 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.53 3kez h ALA 270 Cb 1.24 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 3kez h ALA 270 CO 0.42 0.43 -0.30 0.66 0.00 0.00 0.00 179.25 180.46 3kez h SER 271 N 1.14 0.00 -2.35 0.00 4.64 -1.96 -3.36 113.55 111.64 3kez h SER 271 Ca 0.39 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 61.13 3kez h SER 271 Cb 0.09 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 61.79 3kez h SER 271 CO -0.15 0.30 -0.94 0.59 -0.87 0.00 0.00 176.83 175.76 3kez n ASN 272 N -3.44 0.37 0.24 4.97 3.02 -0.11 -5.00 115.26 115.30 3kez n ASN 272 Ca 0.00 -2.62 0.16 0.00 -0.03 0.00 0.00 54.58 52.09 3kez n ASN 272 Cb 0.47 -0.61 0.57 0.00 -0.61 0.00 0.00 39.78 39.61 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 5.11 0.00 0.00 3.52 0.11 -1.32 -2.47 132.00 136.95 3kez h PRO 273 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 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 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.66 3kez n GLY 274 N 0.24 2.14 0.00 -0.55 0.00 -1.26 -4.04 105.19 101.72 3kez n GLY 274 Ca 0.01 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.54 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 9.59 0.81 -2.52 1.61 0.28 -1.21 -1.60 120.64 127.61 3kez n GLU 275 Ca 0.00 -0.39 -0.43 0.00 -0.16 0.00 0.00 57.16 56.18 3kez n GLU 275 Cb 0.00 -0.89 -0.02 0.00 1.43 0.00 0.00 31.44 31.96 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 -0.23 4.41 -0.13 3.84 1.01 -1.26 -0.74 121.20 128.11 3kez s ILE 276 Ca 0.00 1.68 0.18 0.00 0.00 0.00 0.00 60.65 62.51 3kez s ILE 276 Cb 0.00 -4.16 -0.16 0.00 0.01 0.00 0.00 42.46 38.16 3kez s ILE 276 CO 0.00 -0.23 0.74 0.18 0.00 0.00 0.00 174.94 175.63 3kez n LEU 277 N 6.68 0.72 -3.66 2.97 4.77 0.90 -4.75 117.00 124.62 3kez n LEU 277 Ca 0.13 0.31 -0.15 0.00 -0.03 0.00 0.00 56.01 56.28 3kez n LEU 277 Cb 0.46 0.10 -0.14 0.00 -2.33 0.00 0.00 43.42 41.50 3kez n LEU 277 CO 0.56 0.15 -0.18 0.12 -1.33 0.00 0.00 177.39 176.71 3kez s PHE 278 N -2.95 -0.32 -0.13 -1.77 5.36 -0.83 -4.43 117.98 112.92 3kez s PHE 278 Ca -0.04 0.81 0.01 0.00 -0.96 0.00 0.00 56.93 56.76 3kez s PHE 278 Cb 0.09 -0.14 -0.01 0.00 -0.34 0.00 0.00 43.02 42.63 3kez s PHE 278 CO 0.82 -0.32 -0.18 -2.00 -1.46 0.00 0.00 175.22 172.08 3kez s GLU 279 N 2.36 3.22 -0.22 10.12 2.12 -1.26 -1.85 118.70 133.19 3kez s GLU 279 Ca 0.02 -0.77 -0.28 0.00 0.36 0.00 0.00 54.97 54.30 3kez s GLU 279 Cb -0.12 -2.52 0.00 0.00 0.26 0.00 0.00 34.13 31.76 3kez s GLU 279 CO -0.07 0.14 1.00 0.42 -0.54 0.00 0.00 175.26 176.21 3kez s ILE 280 N 0.50 4.72 -0.34 -3.70 -1.09 -0.41 -3.90 121.20 116.98 3kez s ILE 280 Ca -0.12 1.96 -0.16 0.00 -2.23 0.00 0.00 60.65 60.10 3kez s ILE 280 Cb -0.16 -4.28 -0.01 0.00 -1.58 0.00 0.00 42.46 36.42 3kez s ILE 280 CO 0.05 -0.14 0.42 -0.69 -1.23 0.00 0.00 174.94 173.35 3kez s VAL 281 N 2.98 5.12 -0.09 2.92 1.01 -1.26 -1.32 120.40 129.76 3kez s VAL 281 Ca 0.43 0.19 -0.00 0.00 0.00 0.00 0.00 61.98 62.59 3kez s VAL 281 Cb -0.15 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 3kez s VAL 281 CO 0.08 -0.12 -0.05 0.20 0.00 0.00 0.00 175.10 175.21 3kez s ASN 282 N 1.73 4.77 0.09 3.32 0.01 -1.26 -5.00 114.94 118.60 3kez s ASN 282 Ca 0.14 -0.02 0.07 0.00 -0.71 0.00 0.00 52.86 52.35 3kez s ASN 282 Cb -0.16 -1.34 -0.03 0.00 0.41 0.00 0.00 41.25 40.13 3kez s ASN 282 CO 0.12 0.33 -0.19 -0.76 -1.51 0.00 0.00 177.10 175.09 3kez s LEU 283 N -0.59 2.27 0.40 0.60 1.43 -0.92 -4.68 118.68 117.19 3kez s LEU 283 Ca 0.09 -0.64 0.21 0.00 -1.03 0.00 0.00 54.13 52.76 3kez s LEU 283 Cb -0.12 -0.78 1.20 0.00 0.03 0.00 0.00 46.19 46.52 3kez s LEU 283 CO 0.02 0.03 1.70 0.74 0.23 0.00 0.00 176.35 179.07 3kez h THR 284 N 4.18 0.36 -0.65 5.49 2.02 -1.97 0.23 112.91 122.57 3kez h THR 284 Ca -0.44 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 66.64 3kez h THR 284 Cb 1.18 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 3kez h THR 284 CO 0.40 0.05 0.00 0.35 0.37 0.00 0.00 175.52 176.70 3kez n THR 285 N -4.73 1.04 -2.76 3.16 -2.24 -1.26 -4.40 114.28 103.09 3kez n THR 285 Ca 0.30 -0.92 -0.09 0.00 -2.27 0.00 0.00 64.05 61.08 3kez n THR 285 Cb 1.07 0.37 0.05 0.00 -2.10 0.00 0.00 70.33 69.72 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 1.35 -2.74 -4.85 3.42 2.03 0.76 -5.15 116.55 111.37 3kez n ASP 286 Ca 0.22 -3.33 -0.37 0.00 0.52 0.00 0.00 54.79 51.83 3kez n ASP 286 Cb 0.61 1.76 -0.06 0.00 -0.72 0.00 0.00 41.12 42.71 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 -1.64 6.44 0.00 1.67 0.15 -0.99 -2.17 113.70 117.16 3kez s SER 287 Ca 0.31 0.52 0.23 0.00 0.70 0.00 0.00 55.95 57.72 3kez s SER 287 Cb 0.23 -2.10 1.00 0.00 -1.71 0.00 0.00 66.02 63.44 3kez s SER 287 CO -0.22 0.36 1.75 -0.81 1.20 0.00 0.00 173.24 175.52 3kez n PRO 288 N 2.17 0.01 0.00 5.44 -0.04 -1.26 -5.02 135.00 136.29 3kez n PRO 288 Ca -0.18 0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 3kez n PRO 288 Cb 0.54 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 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 0.91 -2.84 0.00 0.55 0.00 -1.26 -4.19 105.19 98.36 3kez n GLY 289 Ca 0.06 -1.71 0.10 0.00 0.00 0.00 0.00 46.02 44.46 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 -0.61 0.26 -0.32 1.61 5.02 -1.26 -2.13 118.16 120.73 3kez n LYS 290 Ca 0.00 0.10 0.06 0.00 -2.02 0.00 0.00 58.31 56.46 3kez n LYS 290 Cb 0.00 -1.50 0.21 0.00 -0.02 0.00 0.00 35.03 33.72 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 -1.31 2.41 0.00 1.97 1.02 -1.26 -4.37 120.64 119.11 3kez n GLU 291 Ca 0.09 -1.72 0.00 0.00 -0.02 0.00 0.00 57.16 55.51 3kez n GLU 291 Cb 0.17 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 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 0.71 0.00 0.00 1.62 3.41 -0.90 -4.63 113.62 113.83 3kez n SER 292 Ca 0.16 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.77 3kez n SER 292 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 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 4.52 0.00 0.07 5.00 0.00 -1.26 -0.83 105.19 112.69 3kez n GLY 294 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 0.01 -0.02 1.61 3.20 -1.82 -3.36 116.97 116.59 3kez h TYR 295 Ca 0.00 -0.01 -0.16 0.00 3.14 0.00 0.00 58.73 61.71 3kez h TYR 295 Cb 0.00 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 3kez h TYR 295 CO 0.00 1.01 -0.70 -0.07 -1.64 0.00 0.00 178.16 176.76 3kez h LEU 296 N 0.00 0.13 -4.91 2.82 3.38 -1.18 0.77 115.31 116.31 3kez h LEU 296 Ca -0.18 -0.09 -0.75 0.00 0.09 0.00 0.00 57.88 56.95 3kez h LEU 296 Cb 1.92 -0.04 -0.28 0.00 0.09 0.00 0.00 40.66 42.35 3kez h LEU 296 CO 0.10 0.79 0.93 0.59 0.09 0.00 0.00 178.44 180.94 3kez n ASN 297 N -3.75 7.35 -3.60 -0.43 3.02 -1.26 -2.04 115.26 114.55 3kez n ASN 297 Ca -0.02 -3.83 -0.15 0.00 -0.03 0.00 0.00 54.58 50.55 3kez n ASN 297 Cb 0.69 -1.02 -0.07 0.00 -0.61 0.00 0.00 39.78 38.77 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 -1.29 -0.73 0.00 6.41 0.15 -1.25 -4.45 113.70 112.54 3kez s SER 298 Ca 0.52 1.27 0.29 0.00 0.70 0.00 0.00 55.95 58.73 3kez s SER 298 Cb 0.44 1.24 1.29 0.00 -1.71 0.00 0.00 66.02 67.28 3kez s SER 298 CO -0.38 -0.34 1.91 0.00 1.20 0.00 0.00 173.24 175.63 3kez n TYR 299 N 2.26 0.00 0.45 3.44 0.18 -1.26 -1.96 117.16 120.26 3kez n TYR 299 Ca -0.15 0.00 0.09 0.00 1.88 0.00 0.00 57.90 59.72 3kez n TYR 299 Cb 0.55 -0.28 0.25 0.00 -0.38 0.00 0.00 39.34 39.48 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 -1.22 2.73 0.00 9.48 3.02 -1.26 -4.78 115.26 123.23 3kez n ASN 300 Ca 0.12 -1.96 0.00 0.00 -0.03 0.00 0.00 54.58 52.71 3kez n ASN 300 Cb 0.28 -0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.14 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 1.33 1.73 1.05 7.41 0.00 -0.83 -5.01 105.19 110.87 3kez n GLY 301 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 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 0.29 -3.92 1.61 4.01 0.26 -4.98 117.16 114.43 3kez n TYR 302 Ca 0.00 -0.14 -0.26 0.00 -0.16 0.00 0.00 57.90 57.34 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 1.37 -1.04 -0.42 7.72 9.92 -0.92 -5.00 116.55 128.18 3kez n ASP 303 Ca 0.17 -0.95 0.11 0.00 -0.53 0.00 0.00 54.79 53.59 3kez n ASP 303 Cb 0.59 -3.31 0.03 0.00 -0.64 0.00 0.00 41.12 37.79 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 -2.97 1.82 0.00 -2.24 -0.08 -0.86 -4.57 116.55 107.65 3kez n ASP 304 Ca -0.25 -1.39 0.00 0.00 -1.51 0.00 0.00 54.79 51.63 3kez n ASP 304 Cb 0.66 0.49 0.00 0.00 2.34 0.00 0.00 41.12 44.61 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 3.88 0.65 0.00 -4.36 -0.67 -1.13 121.20 117.57 3kez s ILE 307 Ca 0.00 1.09 -0.12 0.00 -0.26 0.00 0.00 60.65 61.36 3kez s ILE 307 Cb 0.00 -3.46 -0.01 0.00 1.25 0.00 0.00 42.46 40.24 3kez s ILE 307 CO 0.00 -0.33 1.05 0.42 0.24 0.00 0.00 174.94 176.31 3kez s THR 308 N -2.14 4.22 0.21 8.37 -4.23 -0.14 -4.72 115.64 117.21 3kez s THR 308 Ca 0.66 0.77 -0.10 0.00 -1.18 0.00 0.00 61.69 61.84 3kez s THR 308 Cb -0.15 -3.54 0.14 0.00 1.34 0.00 0.00 72.50 70.29 3kez s THR 308 CO 0.24 -0.89 1.86 0.00 -0.54 0.00 0.00 174.62 175.29 3kez h SER 310 N 0.91 0.92 -0.18 0.00 4.64 -1.82 0.37 113.55 118.39 3kez h SER 310 Ca 0.28 -0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.44 3kez h SER 310 Cb -0.04 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 61.85 3kez h SER 310 CO -0.09 0.62 -0.47 0.15 -0.87 0.00 0.00 176.83 176.17 3kez h PHE 311 N 1.06 0.83 -0.59 4.77 3.57 -1.74 -1.27 116.94 123.56 3kez h PHE 311 Ca 0.35 -0.32 0.08 0.00 3.53 0.00 0.00 57.97 61.61 3kez h PHE 311 Cb 0.05 -0.15 -0.06 0.00 2.79 0.00 0.00 35.95 38.58 3kez h PHE 311 CO -0.00 1.10 0.25 -0.92 -2.23 0.00 0.00 178.31 176.51 3kez h TYR 312 N 0.32 0.44 -0.60 0.41 3.20 -1.04 0.07 116.97 119.78 3kez h TYR 312 Ca -0.01 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.83 3kez h TYR 312 Cb 1.09 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 39.22 3kez h TYR 312 CO 0.09 0.15 0.14 1.96 -1.64 0.00 0.00 178.16 178.87 3kez h GLN 313 N 0.46 0.96 -0.50 1.82 4.20 -0.83 0.07 115.11 121.29 3kez h GLN 313 Ca 0.29 -0.23 0.04 0.00 0.06 0.00 0.00 58.65 58.81 3kez h GLN 313 Cb 0.31 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 27.93 3kez h GLN 313 CO -0.26 0.88 0.26 1.25 -0.67 0.00 0.00 178.83 180.29 3kez h LEU 314 N 0.87 0.39 -0.31 1.46 6.46 -0.95 -2.41 115.31 120.81 3kez h LEU 314 Ca 0.19 0.02 -0.14 0.00 -0.12 0.00 0.00 57.88 57.83 3kez h LEU 314 Cb 0.35 -0.05 -0.00 0.00 -0.73 0.00 0.00 40.66 40.23 3kez h LEU 314 CO 0.00 0.27 -0.36 0.25 -0.62 0.00 0.00 178.44 177.98 3kez h LEU 315 N 0.51 0.86 -0.11 2.25 5.85 -0.64 -3.03 115.31 121.01 3kez h LEU 315 Ca 0.21 -0.49 0.00 0.00 0.84 0.00 0.00 57.88 58.45 3kez h LEU 315 Cb 0.10 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.89 3kez h LEU 315 CO -0.14 1.17 -0.02 2.29 -0.34 0.00 0.00 178.44 181.40 3kez n LYS 316 N -4.17 0.82 -0.33 1.25 2.85 -0.02 -3.42 118.16 115.15 3kez n LYS 316 Ca -0.04 -0.11 0.17 0.00 -1.05 0.00 0.00 58.31 57.29 3kez n LYS 316 Cb 0.52 -1.50 0.38 0.00 -0.65 0.00 0.00 35.03 33.78 3kez n LYS 316 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 3kez h LYS 317 N 0.27 0.46 -4.24 -1.58 1.63 -1.30 -3.00 116.57 108.81 3kez h LYS 317 Ca 0.00 -0.03 -0.74 0.00 -0.85 0.00 0.00 60.65 59.03 3kez h LYS 317 Cb 0.19 -0.10 -0.27 0.00 -0.60 0.00 0.00 32.23 31.44 3kez h LYS 317 CO 0.00 0.30 -0.33 0.34 -3.45 0.00 0.00 179.45 176.31 3kez s ASP 318 N -5.13 5.90 0.22 4.20 2.15 -1.22 -4.97 116.67 117.82 3kez s ASP 318 Ca -0.11 -1.80 0.17 0.00 0.43 0.00 0.00 52.55 51.24 3kez s ASP 318 Cb 0.27 -2.09 0.85 0.00 -0.30 0.00 0.00 42.92 41.66 3kez s ASP 318 CO 0.79 -0.74 1.51 -2.65 -0.17 0.00 0.00 175.17 173.91 3kez n PRO 319 N 5.05 0.11 -0.35 4.34 -0.02 -1.14 -1.69 135.00 141.30 3kez n PRO 319 Ca -0.10 0.55 0.10 0.00 -2.02 0.00 0.00 63.50 62.03 3kez n PRO 319 Cb 0.41 -1.82 0.28 0.00 -0.02 0.00 0.00 33.50 32.35 3kez n PRO 319 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3kez n LYS 320 N -2.05 2.60 -2.01 -0.52 5.02 -1.26 -4.92 118.16 115.03 3kez n LYS 320 Ca -0.00 -2.30 -0.42 0.00 -2.02 0.00 0.00 58.31 53.57 3kez n LYS 320 Cb 0.06 -1.54 -0.03 0.00 -0.02 0.00 0.00 35.03 33.51 3kez n LYS 320 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3kez s ASP 321 N -0.97 6.67 0.60 4.39 -1.08 -0.68 -4.62 116.67 120.98 3kez s ASP 321 Ca 0.42 2.27 0.36 0.00 -0.52 0.00 0.00 52.55 55.08 3kez s ASP 321 Cb 0.23 -2.54 1.93 0.00 -1.46 0.00 0.00 42.92 41.08 3kez s ASP 321 CO 0.27 -0.90 2.23 1.62 0.52 0.00 0.00 175.17 178.91 3kez h VAL 322 N 5.40 0.25 0.00 1.11 3.04 -1.22 -1.81 116.25 123.03 3kez h VAL 322 Ca -0.40 -0.20 0.00 0.00 -1.01 0.00 0.00 66.70 65.09 3kez h VAL 322 Cb 1.18 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 31.62 3kez h VAL 322 CO 0.95 0.03 0.00 0.03 -1.01 0.00 0.00 177.57 177.56 3kez h ARG 323 N 0.00 0.00 -0.25 4.17 3.08 -1.89 -0.35 114.38 119.14 3kez h ARG 323 Ca -0.00 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.12 3kez h ARG 323 Cb 0.15 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 3kez h ARG 323 CO 0.00 0.00 0.18 -0.07 -1.07 0.00 0.00 179.97 179.02 3kez h LEU 324 N 0.00 0.00 0.00 3.04 3.38 -1.68 -2.59 115.31 117.46 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 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 3kez h LEU 324 CO 0.00 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.82 3kez n LYS 325 N -4.42 0.88 -0.47 1.13 5.02 -0.14 -2.33 118.16 117.83 3kez n LYS 325 Ca 0.03 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.40 3kez n LYS 325 Cb 0.33 -1.50 0.28 0.00 -0.02 0.00 0.00 35.03 34.12 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 -1.00 1.86 -3.50 -0.18 -6.64 -0.97 -4.87 119.36 104.05 3kez n ILE 326 Ca 0.21 -1.41 -0.37 0.00 -1.77 0.00 0.00 62.75 59.41 3kez n ILE 326 Cb 0.10 0.06 -0.06 0.00 -1.44 0.00 0.00 39.64 38.29 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 -2.05 4.32 -0.26 7.28 1.43 -0.98 0.43 118.68 128.84 3kez s LEU 327 Ca 0.41 0.69 -0.03 0.00 -1.03 0.00 0.00 54.13 54.17 3kez s LEU 327 Cb 0.29 -2.48 0.02 0.00 0.03 0.00 0.00 46.19 44.05 3kez s LEU 327 CO 0.16 0.16 -0.01 -0.55 0.23 0.00 0.00 176.35 176.34 3kez s SER 328 N -0.01 4.59 -0.22 2.29 0.15 0.18 -4.89 113.70 115.78 3kez s SER 328 Ca 0.20 -0.81 -0.13 0.00 0.70 0.00 0.00 55.95 55.91 3kez s SER 328 Cb -0.14 -1.74 -0.04 0.00 -1.71 0.00 0.00 66.02 62.39 3kez s SER 328 CO 0.08 -0.15 0.28 -0.36 1.20 0.00 0.00 173.24 174.29 3kez s PHE 329 N 1.38 3.35 -0.82 3.44 0.40 -1.26 0.01 117.98 124.48 3kez s PHE 329 Ca 0.01 0.43 -0.25 0.00 -0.60 0.00 0.00 56.93 56.52 3kez s PHE 329 Cb -0.17 -2.40 0.04 0.00 0.51 0.00 0.00 43.02 41.01 3kez s PHE 329 CO -0.02 0.04 1.29 0.34 0.70 0.00 0.00 175.22 177.57 3kez s ASP 330 N 1.01 6.28 1.08 1.36 2.15 0.27 -4.89 116.67 123.93 3kez s ASP 330 Ca 0.14 -0.87 0.00 0.00 0.43 0.00 0.00 52.55 52.24 3kez s ASP 330 Cb -0.14 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.94 3kez s ASP 330 CO 0.06 -1.67 0.00 0.29 -0.17 0.00 0.00 175.17 173.68 3kez n LYS 331 N 8.93 0.00 -1.78 4.34 4.76 -1.26 -0.51 118.16 132.65 3kez n LYS 331 Ca 0.12 0.00 -0.27 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 3.29 -0.07 1.97 5.02 -1.26 -4.79 118.16 136.32 3kez n LYS 332 Ca 0.00 -3.88 -0.14 0.00 -2.02 0.00 0.00 58.31 52.27 3kez n LYS 332 Cb 0.00 -2.27 -0.05 0.00 -0.02 0.00 0.00 35.03 32.69 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 -0.78 0.00 -3.91 2.13 4.01 0.34 0.26 117.16 119.20 3kez n TYR 333 Ca 0.49 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 58.14 3kez n TYR 333 Cb 0.88 -0.49 -0.09 0.00 -0.31 0.00 0.00 39.34 39.33 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 -2.25 0.16 -0.15 -0.72 2.02 -1.20 -1.45 117.35 113.76 3kez s TYR 334 Ca -0.19 -0.46 0.01 0.00 -0.37 0.00 0.00 57.07 56.06 3kez s TYR 334 Cb 0.07 -0.11 0.02 0.00 -0.40 0.00 0.00 41.96 41.54 3kez s TYR 334 CO 0.25 -0.39 -0.17 0.00 -1.57 0.00 0.00 175.55 173.67 3kez s ALA 335 N -2.68 2.02 0.16 3.71 0.00 -1.26 -0.57 121.76 123.15 3kez s ALA 335 Ca -0.04 -1.00 -0.02 0.00 0.00 0.00 0.00 51.96 50.89 3kez s ALA 335 Cb -0.01 -1.07 -0.05 0.00 0.00 0.00 0.00 23.12 22.00 3kez s ALA 335 CO -0.05 -0.31 0.37 0.71 0.00 0.00 0.00 175.76 176.48 3kez s TYR 336 N 1.32 3.48 -0.46 0.00 2.02 0.10 -1.68 117.35 122.14 3kez s TYR 336 Ca 0.03 0.41 -0.22 0.00 -0.37 0.00 0.00 57.07 56.92 3kez s TYR 336 Cb -0.13 -1.90 0.03 0.00 -0.40 0.00 0.00 41.96 39.55 3kez s TYR 336 CO -0.10 0.42 0.76 0.08 -1.57 0.00 0.00 175.55 175.14 3kez s VAL 337 N -1.75 4.68 -0.69 0.71 1.01 -1.26 -0.65 120.40 122.45 3kez s VAL 337 Ca 0.39 0.31 -0.04 0.00 0.00 0.00 0.00 61.98 62.64 3kez s VAL 337 Cb -0.12 -4.31 0.09 0.00 0.00 0.00 0.00 36.38 32.05 3kez s VAL 337 CO 0.27 -0.72 2.63 -3.20 0.00 0.00 0.00 175.10 174.08 3kez n ASN 338 N 6.64 6.91 0.08 3.32 5.15 0.17 -4.41 115.26 133.12 3kez n ASN 338 Ca 0.01 -3.23 0.07 0.00 -0.60 0.00 0.00 54.58 50.84 3kez n ASN 338 Cb 0.48 -1.26 -0.03 0.00 -0.53 0.00 0.00 39.78 38.44 3kez n ASN 338 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3kez n LYS 339 N 1.00 0.61 -2.96 1.20 5.02 -1.26 -4.52 118.16 117.25 3kez n LYS 339 Ca 0.52 0.16 -0.44 0.00 -2.02 0.00 0.00 58.31 56.53 3kez n LYS 339 Cb 0.46 -1.82 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 3kez n LYS 339 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3kez n TYR 340 N -2.75 4.52 -3.45 2.13 4.01 -1.26 -4.80 117.16 115.56 3kez n TYR 340 Ca -0.04 -3.35 -0.37 0.00 -0.16 0.00 0.00 57.90 53.98 3kez n TYR 340 Cb 0.65 -1.96 -0.07 0.00 -0.31 0.00 0.00 39.34 37.65 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 0.31 4.20 0.60 -0.72 -0.21 -1.26 -4.73 119.66 117.86 3kez s GLN 341 Ca 0.38 0.14 -0.18 0.00 0.02 0.00 0.00 55.36 55.72 3kez s GLN 341 Cb -0.02 -3.50 -0.03 0.00 1.00 0.00 0.00 33.01 30.46 3kez s GLN 341 CO -0.01 0.06 1.21 -1.25 -2.12 0.00 0.00 175.29 173.18 3kez s PRO 342 N 1.02 2.91 0.95 2.91 0.04 -1.26 -4.36 135.00 137.20 3kez s PRO 342 Ca 0.18 1.83 -0.12 0.00 0.04 0.00 0.00 61.00 62.92 3kez s PRO 342 Cb -0.14 -1.92 0.16 0.00 0.04 0.00 0.00 34.50 32.64 3kez s PRO 342 CO 0.07 -1.26 1.13 -0.65 0.04 0.00 0.00 177.00 176.32 3kez s GLN 343 N -3.37 0.86 0.23 4.56 1.11 -1.26 -4.72 119.66 117.06 3kez s GLN 343 Ca 0.77 0.33 -0.31 0.00 0.01 0.00 0.00 55.36 56.17 3kez s GLN 343 Cb -0.31 -1.80 -0.11 0.00 -1.01 0.00 0.00 33.01 29.78 3kez s GLN 343 CO 0.34 -2.40 1.58 -1.14 0.01 0.00 0.00 175.29 173.69 3kez s GLN 344 N -5.20 4.18 0.00 2.91 2.00 -1.26 -1.37 119.66 120.92 3kez s GLN 344 Ca 0.64 2.46 0.00 0.00 -2.00 0.00 0.00 55.36 56.47 3kez s GLN 344 Cb -0.16 -3.09 0.00 0.00 0.80 0.00 0.00 33.01 30.56 3kez s GLN 344 CO 0.55 -0.61 0.00 0.41 -0.50 0.00 0.00 175.29 175.14 3kez n GLY 345 N 3.07 1.76 3.91 2.59 0.00 -1.26 -5.04 105.19 110.22 3kez n GLY 345 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.39 3.59 0.62 1.61 2.02 -0.47 -5.08 118.70 120.60 3kez s GLU 346 Ca 0.00 -0.12 -0.15 0.00 0.02 0.00 0.00 54.97 54.72 3kez s GLU 346 Cb 0.00 -2.72 -0.02 0.00 0.10 0.00 0.00 34.13 31.49 3kez s GLU 346 CO 0.00 0.29 1.07 1.21 0.02 0.00 0.00 175.26 177.84 3kez s ASN 347 N -3.14 5.61 0.55 -0.19 3.84 -1.26 -4.79 114.94 115.56 3kez s ASN 347 Ca 0.42 1.82 0.25 0.00 0.21 0.00 0.00 52.86 55.56 3kez s ASN 347 Cb -0.11 -2.53 1.46 0.00 -0.55 0.00 0.00 41.25 39.52 3kez s ASN 347 CO 0.29 -1.28 2.04 0.16 -2.79 0.00 0.00 177.10 175.52 3kez h ILE 348 N 0.20 0.67 -0.94 -5.21 3.07 -1.93 -1.79 117.51 111.57 3kez h ILE 348 Ca -0.46 0.00 0.23 0.00 1.55 0.00 0.00 64.86 66.18 3kez h ILE 348 Cb 1.22 0.79 -0.07 0.00 -0.27 0.00 0.00 36.82 38.50 3kez h ILE 348 CO 0.57 0.00 0.63 0.74 -1.05 0.00 0.00 178.15 179.04 3kez h THR 349 N 0.00 0.61 -0.48 0.16 2.02 -1.90 -2.50 112.91 110.82 3kez h THR 349 Ca 0.17 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.23 3kez h THR 349 Cb 0.73 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.40 3kez h THR 349 CO -0.00 0.06 0.00 0.47 0.37 0.00 0.00 175.52 176.42 3kez n ASP 350 N -4.48 5.19 -4.73 4.18 8.00 -0.67 -4.61 116.55 119.42 3kez n ASP 350 Ca 0.21 -2.96 -0.42 0.00 0.71 0.00 0.00 54.79 52.32 3kez n ASP 350 Cb 0.80 -0.64 -0.01 0.00 -0.02 0.00 0.00 41.12 41.25 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 0.27 1.97 -1.40 2.24 0.00 -0.94 -4.34 120.51 118.31 3kez n ALA 351 Ca 0.26 0.37 -0.32 0.00 0.00 0.00 0.00 53.44 53.75 3kez n ALA 351 Cb 1.11 -2.37 0.07 0.00 0.00 0.00 0.00 19.45 18.26 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 0.09 4.86 -0.32 0.00 0.01 -1.26 -4.63 114.94 113.69 3kez s ASN 352 Ca 0.59 1.90 -0.09 0.00 -0.71 0.00 0.00 52.86 54.55 3kez s ASN 352 Cb -0.53 -2.53 0.01 0.00 0.41 0.00 0.00 41.25 38.60 3kez s ASN 352 CO 0.56 -1.79 0.15 -0.63 -1.51 0.00 0.00 177.10 173.88 3kez s ILE 353 N -2.63 4.41 -1.40 0.60 -1.09 -0.44 -4.75 121.20 115.89 3kez s ILE 353 Ca 0.64 -0.61 -0.15 0.00 -2.23 0.00 0.00 60.65 58.29 3kez s ILE 353 Cb -0.18 -3.31 0.04 0.00 -1.58 0.00 0.00 42.46 37.42 3kez s ILE 353 CO 0.49 -0.01 2.10 -0.81 -1.23 0.00 0.00 174.94 175.48 3kez n PRO 354 N 4.95 2.90 -0.16 2.79 -0.04 -1.26 -1.29 135.00 142.88 3kez n PRO 354 Ca -0.13 -2.74 -0.11 0.00 -0.04 0.00 0.00 63.50 60.47 3kez n PRO 354 Cb 0.48 -3.33 -0.00 0.00 -0.04 0.00 0.00 33.50 30.60 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 10.75 1.01 -7.82 1.53 5.85 -1.74 -3.40 115.31 121.48 3kez h LEU 355 Ca 0.54 -0.39 -0.52 0.00 0.84 0.00 0.00 57.88 58.35 3kez h LEU 355 Cb 0.70 -0.28 -0.35 0.00 0.37 0.00 0.00 40.66 41.10 3kez h LEU 355 CO 1.79 1.17 -0.81 -0.63 -0.34 0.00 0.00 178.44 179.62 3kez s ILE 356 N -4.71 1.07 0.06 4.05 1.01 -0.89 -4.99 121.20 116.79 3kez s ILE 356 Ca -0.12 -0.37 0.09 0.00 0.00 0.00 0.00 60.65 60.25 3kez s ILE 356 Cb 0.12 -1.04 -0.03 0.00 0.01 0.00 0.00 42.46 41.53 3kez s ILE 356 CO 0.87 0.36 -0.24 -0.13 0.00 0.00 0.00 174.94 175.80 3kez s ARG 357 N 1.25 1.53 0.44 2.79 0.52 -1.26 -0.07 118.95 124.15 3kez s ARG 357 Ca -0.04 -1.07 0.19 0.00 -0.52 0.00 0.00 55.73 54.30 3kez s ARG 357 Cb -0.14 -1.73 1.15 0.00 0.52 0.00 0.00 34.95 34.75 3kez s ARG 357 CO -0.03 0.44 1.88 1.25 0.02 0.00 0.00 175.30 178.86 3kez h LEU 358 N 4.66 0.33 -1.22 2.53 5.85 -1.31 -0.38 115.31 125.77 3kez h LEU 358 Ca -0.45 0.03 0.12 0.00 0.84 0.00 0.00 57.88 58.42 3kez h LEU 358 Cb 1.16 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 42.09 3kez h LEU 358 CO 0.43 0.14 0.58 0.28 -0.34 0.00 0.00 178.44 179.53 3kez h SER 359 N 0.33 0.74 -0.52 1.25 0.02 -1.96 -1.22 113.55 112.19 3kez h SER 359 Ca 0.43 0.03 -0.12 0.00 -0.84 0.00 0.00 61.79 61.30 3kez h SER 359 Cb 1.17 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.58 3kez h SER 359 CO -0.14 0.40 -0.13 -0.08 -1.14 0.00 0.00 176.83 175.75 3kez h GLU 360 N 0.80 1.02 -0.81 3.45 4.81 -1.47 -2.05 114.58 120.32 3kez h GLU 360 Ca 0.44 -0.39 0.06 0.00 -0.13 0.00 0.00 59.36 59.34 3kez h GLU 360 Cb 0.57 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.83 3kez h GLU 360 CO -0.20 1.07 0.50 0.00 -0.73 0.00 0.00 179.01 179.65 3kez h ALA 361 N 0.94 1.12 -0.23 2.92 0.00 -1.23 0.31 119.26 123.08 3kez h ALA 361 Ca 0.14 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.05 3kez h ALA 361 Cb 0.70 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3kez h ALA 361 CO 0.05 0.22 0.14 1.88 0.00 0.00 0.00 179.25 181.54 3kez h TYR 362 N 0.90 0.27 -0.43 0.00 -1.99 -1.12 -0.87 116.97 113.73 3kez h TYR 362 Ca 0.36 0.01 -0.09 0.00 2.00 0.00 0.00 58.73 61.01 3kez h TYR 362 Cb 0.18 -0.09 -0.02 0.00 2.00 0.00 0.00 36.73 38.80 3kez h TYR 362 CO -0.04 0.16 -0.08 -0.07 -0.00 0.00 0.00 178.16 178.13 3kez h LEU 363 N 0.29 0.74 -0.43 3.88 3.38 -0.82 -1.00 115.31 121.34 3kez h LEU 363 Ca 0.09 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 3kez h LEU 363 Cb -0.02 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 3kez h LEU 363 CO -0.03 0.85 0.19 0.78 0.09 0.00 0.00 178.44 180.32 3kez h ASN 364 N 0.69 0.58 -0.76 -0.43 2.35 -0.21 -1.30 115.58 116.51 3kez h ASN 364 Ca 0.12 -0.15 -0.02 0.00 -0.55 0.00 0.00 56.30 55.70 3kez h ASN 364 Cb 0.54 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.72 3kez h ASN 364 CO 0.03 0.57 0.38 0.00 -1.65 0.00 0.00 177.43 176.77 3kez h ALA 365 N 1.03 1.22 -0.18 -0.83 0.00 -0.94 -1.14 119.26 118.43 3kez h ALA 365 Ca 0.15 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3kez h ALA 365 Cb 0.16 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3kez h ALA 365 CO -0.01 0.60 0.07 0.00 0.00 0.00 0.00 179.25 179.91 3kez h ALA 366 N 1.33 0.24 -0.10 0.00 0.00 -1.03 0.42 119.26 120.11 3kez h ALA 366 Ca 0.27 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3kez h ALA 366 Cb 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3kez h ALA 366 CO -0.04 -0.16 0.07 1.49 0.00 0.00 0.00 179.25 180.61 3kez h GLU 367 N 0.13 0.14 -0.40 0.00 4.81 -1.05 -1.54 114.58 116.67 3kez h GLU 367 Ca 0.06 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.22 3kez h GLU 367 Cb 0.19 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 3kez h GLU 367 CO -0.00 0.10 0.01 0.00 -0.73 0.00 0.00 179.01 178.39 3kez h ALA 368 N 1.03 1.28 -0.31 2.92 0.00 -1.08 -0.29 119.26 122.80 3kez h ALA 368 Ca 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 3kez h ALA 368 Cb -0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3kez h ALA 368 CO -0.01 0.49 0.17 0.00 0.00 0.00 0.00 179.25 179.90 3kez h ALA 369 N 1.42 0.40 -0.15 0.00 0.00 -0.67 -1.17 119.26 119.08 3kez h ALA 369 Ca 0.13 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3kez h ALA 369 Cb 0.36 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3kez h ALA 369 CO 0.01 -0.07 0.09 0.28 0.00 0.00 0.00 179.25 179.56 3kez h VAL 370 N 0.38 1.01 0.00 0.00 2.07 -0.68 0.15 116.25 119.18 3kez h VAL 370 Ca 0.11 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.57 3kez h VAL 370 Cb 0.07 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 3kez h VAL 370 CO -0.02 0.03 0.00 1.56 0.02 0.00 0.00 177.57 179.17 3kez h GLN 371 N 0.18 0.00 -0.36 1.57 1.08 -0.92 -1.77 115.11 114.90 3kez h GLN 371 Ca 0.06 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 3kez h GLN 371 Cb -0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3kez h GLN 371 CO -0.03 0.00 0.00 0.25 -0.95 0.00 0.00 178.83 178.10 3kez n THR 372 N -2.66 0.57 -1.12 -0.54 -2.24 -0.46 -4.97 114.28 102.87 3kez n THR 372 Ca 0.01 -0.79 0.00 0.00 -2.27 0.00 0.00 64.05 61.01 3kez n THR 372 Cb 0.27 0.89 0.00 0.00 -2.10 0.00 0.00 70.33 69.38 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 1.21 0.48 3.17 3.38 0.00 -0.60 -4.99 105.19 107.84 3kez n GLY 373 Ca 0.17 -0.92 -0.39 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.88 6.07 0.22 1.61 -1.08 0.41 -4.91 116.67 116.11 3kez s ASP 374 Ca 0.00 -3.27 -0.06 0.00 -0.52 0.00 0.00 52.55 48.70 3kez s ASP 374 Cb 0.00 -1.98 0.20 0.00 -1.46 0.00 0.00 42.92 39.67 3kez s ASP 374 CO 0.00 -0.32 1.71 -1.13 0.52 0.00 0.00 175.17 175.95 3kez h ASN 375 N 6.70 0.94 -0.61 -0.34 -1.24 -1.92 -1.82 115.58 117.28 3kez h ASN 375 Ca 0.10 -0.23 0.09 0.00 0.71 0.00 0.00 56.30 56.97 3kez h ASN 375 Cb 0.90 -0.25 -0.07 0.00 0.73 0.00 0.00 38.32 39.63 3kez h ASN 375 CO 0.81 0.97 0.24 0.00 -1.29 0.00 0.00 177.43 178.17 3kez h ALA 376 N 1.13 0.80 -0.23 1.57 0.00 -1.95 0.84 119.26 121.42 3kez h ALA 376 Ca 0.17 0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.96 3kez h ALA 376 Cb 0.47 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3kez h ALA 376 CO 0.02 -0.17 -0.64 -0.22 0.00 0.00 0.00 179.25 178.24 3kez h LYS 377 N 0.43 0.84 -0.22 0.00 3.64 -1.92 -1.46 116.57 117.88 3kez h LYS 377 Ca 0.31 -0.59 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 3kez h LYS 377 Cb 0.36 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 3kez h LYS 377 CO -0.29 1.21 0.14 0.00 -2.27 0.00 0.00 179.45 178.24 3kez h ALA 378 N 0.65 0.28 -0.67 5.00 0.00 -0.59 -1.80 119.26 122.12 3kez h ALA 378 Ca -0.01 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.90 3kez h ALA 378 Cb 1.25 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.91 3kez h ALA 378 CO 0.14 -0.24 0.42 0.28 0.00 0.00 0.00 179.25 179.85 3kez h VAL 379 N 0.29 1.09 0.14 0.00 2.07 -0.84 0.29 116.25 119.28 3kez h VAL 379 Ca 0.08 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.34 3kez h VAL 379 Cb -0.02 0.20 -0.04 0.00 -1.52 0.00 0.00 31.29 29.92 3kez h VAL 379 CO -0.02 0.15 -0.30 0.50 0.02 0.00 0.00 177.57 177.93 3kez h LYS 380 N 0.82 -0.51 -0.20 1.57 3.64 -0.87 0.58 116.57 121.59 3kez h LYS 380 Ca 0.27 0.03 -0.21 0.00 -1.27 0.00 0.00 60.65 59.47 3kez h LYS 380 Cb 0.02 0.11 0.01 0.00 -0.41 0.00 0.00 32.23 31.96 3kez h LYS 380 CO -0.11 -0.34 -0.70 1.88 -2.27 0.00 0.00 179.45 177.92 3kez h TYR 381 N -0.52 1.08 -0.22 1.91 0.05 -1.21 -3.03 116.97 115.03 3kez h TYR 381 Ca 0.03 -0.44 -0.10 0.00 0.05 0.00 0.00 58.73 58.26 3kez h TYR 381 Cb 0.55 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 38.09 3kez h TYR 381 CO -0.26 1.28 -0.30 1.25 -1.05 0.00 0.00 178.16 179.08 3kez h LEU 382 N 0.59 0.45 -1.33 3.88 5.85 -0.86 -2.84 115.31 121.06 3kez h LEU 382 Ca -0.03 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.47 3kez h LEU 382 Cb 1.32 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 3kez h LEU 382 CO 0.15 0.74 -0.16 -1.13 -0.34 0.00 0.00 178.44 177.69 3kez h ASN 383 N 0.39 0.24 -0.77 1.25 -1.24 -0.76 -0.93 115.58 113.76 3kez h ASN 383 Ca 0.05 -0.05 -0.00 0.00 0.71 0.00 0.00 56.30 57.00 3kez h ASN 383 Cb 0.73 -0.06 -0.04 0.00 0.73 0.00 0.00 38.32 39.67 3kez h ASN 383 CO 0.06 0.43 0.47 0.28 -1.29 0.00 0.00 177.43 177.37 3kez h SER 384 N 0.23 0.92 0.14 1.15 0.02 -1.43 0.25 113.55 114.84 3kez h SER 384 Ca 0.05 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 3kez h SER 384 Cb 0.43 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.74 3kez h SER 384 CO 0.03 0.70 -0.07 0.40 -1.14 0.00 0.00 176.83 176.75 3kez h ILE 385 N 1.05 1.01 -0.37 3.27 1.08 -1.39 -2.37 117.51 119.78 3kez h ILE 385 Ca 0.28 -0.99 0.08 0.00 -0.39 0.00 0.00 64.86 63.84 3kez h ILE 385 Cb -0.05 1.58 -0.09 0.00 -3.07 0.00 0.00 36.82 35.19 3kez h ILE 385 CO -0.05 0.22 -0.24 0.58 -0.69 0.00 0.00 178.15 177.96 3kez h VAL 386 N -0.69 0.35 0.00 1.67 2.07 -1.09 -2.34 116.25 116.22 3kez h VAL 386 Ca -0.02 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.38 3kez h VAL 386 Cb 0.51 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 3kez h VAL 386 CO 0.03 0.00 -0.57 1.56 0.02 0.00 0.00 177.57 178.62 3kez h GLN 387 N -0.19 0.00 -0.41 1.57 4.20 -0.59 -1.84 115.11 117.85 3kez h GLN 387 Ca 0.18 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.82 3kez h GLN 387 Cb 0.47 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 3kez h GLN 387 CO -0.48 0.57 -0.03 -0.09 -0.67 0.00 0.00 178.83 178.12 3kez h ARG 388 N 0.00 0.68 -0.05 1.46 1.12 -1.24 -2.15 114.38 114.19 3kez h ARG 388 Ca -0.01 -0.18 -0.15 0.00 -1.11 0.00 0.00 59.98 58.53 3kez h ARG 388 Cb 1.13 -0.08 -0.01 0.00 -0.01 0.00 0.00 29.97 30.99 3kez h ARG 388 CO 0.07 0.72 -0.65 0.00 -3.11 0.00 0.00 179.97 177.00 3kez h ALA 389 N 1.33 0.81 -0.86 2.80 0.00 -0.97 -3.34 119.26 119.03 3kez h ALA 389 Ca 0.12 -0.57 0.11 0.00 0.00 0.00 0.00 54.91 54.57 3kez h ALA 389 Cb 0.44 -0.09 -0.21 0.00 0.00 0.00 0.00 17.79 17.94 3kez h ALA 389 CO 0.02 0.76 -0.21 1.21 0.00 0.00 0.00 179.25 181.03 3kez s ASN 390 N -6.90 -1.24 0.26 0.00 3.84 -0.73 -0.68 114.94 109.49 3kez s ASN 390 Ca -0.04 0.64 0.22 0.00 0.21 0.00 0.00 52.86 53.89 3kez s ASN 390 Cb 0.12 1.99 1.00 0.00 -0.55 0.00 0.00 41.25 43.81 3kez s ASN 390 CO 0.80 -0.23 1.66 -0.81 -2.79 0.00 0.00 177.10 175.73 3kez n PRO 391 N 5.42 0.16 0.14 0.43 -0.04 -0.82 -1.72 135.00 138.58 3kez n PRO 391 Ca -0.01 0.49 0.13 0.00 -0.04 0.00 0.00 63.50 64.08 3kez n PRO 391 Cb 0.52 -1.88 0.44 0.00 -0.04 0.00 0.00 33.50 32.55 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 -6.58 0.54 5.08 -1.93 -3.46 114.58 108.23 3kez h GLU 392 Ca 0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 3kez h GLU 392 Cb 0.22 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.48 3kez h GLU 392 CO 0.00 0.00 -0.12 -0.80 -1.00 0.00 0.00 179.01 177.09 3kez s ASN 393 N -4.70 6.35 -0.17 1.42 0.01 -0.70 -5.11 114.94 112.05 3kez s ASN 393 Ca 0.07 0.63 -0.22 0.00 -0.71 0.00 0.00 52.86 52.63 3kez s ASN 393 Cb 0.10 -2.11 0.06 0.00 0.41 0.00 0.00 41.25 39.71 3kez s ASN 393 CO 0.52 -0.31 0.58 -0.55 -1.51 0.00 0.00 177.10 175.84 3kez s SER 394 N -3.71 -0.59 -0.03 -1.22 0.15 -1.26 -4.57 113.70 102.47 3kez s SER 394 Ca 0.43 1.00 0.21 0.00 0.70 0.00 0.00 55.95 58.28 3kez s SER 394 Cb -0.10 0.99 0.64 0.00 -1.71 0.00 0.00 66.02 65.85 3kez s SER 394 CO 0.35 -0.31 1.54 1.33 1.20 0.00 0.00 173.24 177.35 3kez n VAL 395 N 2.25 1.19 -1.82 4.45 0.24 -1.26 -4.99 118.33 118.39 3kez n VAL 395 Ca -0.15 -1.05 -0.40 0.00 -2.04 0.00 0.00 64.34 60.69 3kez n VAL 395 Cb 0.56 0.42 0.01 0.00 -1.47 0.00 0.00 33.84 33.36 3kez n VAL 395 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3kez s GLU 396 N -1.19 3.87 0.00 7.34 2.12 -1.26 -2.16 118.70 127.42 3kez s GLU 396 Ca 0.48 2.46 0.00 0.00 0.36 0.00 0.00 54.97 58.27 3kez s GLU 396 Cb 0.26 -2.79 0.00 0.00 0.26 0.00 0.00 34.13 31.87 3kez s GLU 396 CO 0.30 -0.68 0.00 0.41 -0.54 0.00 0.00 175.26 174.75 3kez n GLY 397 N 0.54 0.96 3.90 -1.50 0.00 -1.26 -5.04 105.19 102.79 3kez n GLY 397 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.03 3.53 -0.55 1.61 -0.14 -0.92 -5.04 119.74 118.20 3kez s LYS 398 Ca 0.00 -0.21 -0.19 0.00 -1.36 0.00 0.00 55.97 54.20 3kez s LYS 398 Cb 0.00 -3.01 0.08 0.00 -1.68 0.00 0.00 37.83 33.22 3kez s LYS 398 CO 0.00 0.59 0.69 0.99 -0.76 0.00 0.00 175.35 176.86 3kez s THR 399 N -1.46 4.80 0.27 2.17 2.01 -1.26 -4.96 115.64 117.20 3kez s THR 399 Ca 0.33 -0.68 -0.30 0.00 0.31 0.00 0.00 61.69 61.36 3kez s THR 399 Cb -0.13 -4.41 -0.09 0.00 0.01 0.00 0.00 72.50 67.87 3kez s THR 399 CO 0.22 -1.00 1.09 -0.76 -0.69 0.00 0.00 174.62 173.49 3kez s LEU 400 N 2.79 4.55 0.30 4.42 1.43 -1.26 -5.06 118.68 125.85 3kez s LEU 400 Ca 0.14 2.24 0.07 0.00 -1.03 0.00 0.00 54.13 55.56 3kez s LEU 400 Cb -0.21 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.36 3kez s LEU 400 CO 0.10 -0.13 0.25 0.42 0.23 0.00 0.00 176.35 177.22 3kez s THR 401 N -1.09 3.91 0.23 5.49 -4.23 -1.26 -4.95 115.64 113.74 3kez s THR 401 Ca 0.45 -1.38 -0.07 0.00 -1.18 0.00 0.00 61.69 59.51 3kez s THR 401 Cb -0.32 -3.28 0.18 0.00 1.34 0.00 0.00 72.50 70.43 3kez s THR 401 CO 0.40 -0.25 1.78 0.25 -0.54 0.00 0.00 174.62 176.26 3kez h LEU 402 N 1.35 0.47 -1.03 4.79 5.85 -1.95 -2.25 115.31 122.54 3kez h LEU 402 Ca -0.46 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.32 3kez h LEU 402 Cb 1.25 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.21 3kez h LEU 402 CO 0.59 0.26 0.56 -0.08 -0.34 0.00 0.00 178.44 179.44 3kez h GLU 403 N 0.61 1.23 -0.48 1.25 4.81 -1.98 0.07 114.58 120.08 3kez h GLU 403 Ca 0.35 -0.10 0.05 0.00 -0.13 0.00 0.00 59.36 59.53 3kez h GLU 403 Cb 0.38 -0.26 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 3kez h GLU 403 CO -0.27 0.85 0.22 -0.91 -0.73 0.00 0.00 179.01 178.16 3kez h ASN 404 N 1.25 0.29 -0.23 1.04 -0.26 -1.84 0.05 115.58 115.89 3kez h ASN 404 Ca 0.33 0.04 -0.04 0.00 -0.56 0.00 0.00 56.30 56.07 3kez h ASN 404 Cb -0.07 -0.01 -0.01 0.00 -1.06 0.00 0.00 38.32 37.17 3kez h ASN 404 CO -0.06 0.20 -0.01 0.58 -1.06 0.00 0.00 177.43 177.07 3kez h VAL 405 N 0.43 1.26 -0.32 2.81 2.07 -0.78 -2.27 116.25 119.45 3kez h VAL 405 Ca 0.22 -0.93 -0.05 0.00 0.82 0.00 0.00 66.70 66.75 3kez h VAL 405 Cb 0.16 1.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 3kez h VAL 405 CO -0.18 0.29 -0.00 -0.07 0.02 0.00 0.00 177.57 177.63 3kez h LEU 406 N 0.17 0.46 -0.90 2.57 3.38 -0.91 0.59 115.31 120.67 3kez h LEU 406 Ca 0.06 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 3kez h LEU 406 Cb 0.43 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3kez h LEU 406 CO 0.01 0.53 0.07 0.44 0.09 0.00 0.00 178.44 179.58 3kez h ASP 407 N 0.47 0.83 -0.25 -0.43 3.32 -0.88 -0.33 116.42 119.16 3kez h ASP 407 Ca 0.10 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 56.92 3kez h ASP 407 Cb 0.31 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 3kez h ASP 407 CO 0.01 0.86 -0.03 -0.08 -1.72 0.00 0.00 179.24 178.28 3kez h GLU 408 N 0.83 0.47 -0.70 3.56 4.57 -1.00 -3.27 114.58 119.03 3kez h GLU 408 Ca 0.17 -0.16 0.05 0.00 -1.18 0.00 0.00 59.36 58.23 3kez h GLU 408 Cb 0.40 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.91 3kez h GLU 408 CO 0.01 0.66 0.41 -0.09 -1.18 0.00 0.00 179.01 178.82 3kez h ARG 409 N 0.23 0.75 -0.24 1.92 2.43 -0.64 -1.52 114.38 117.30 3kez h ARG 409 Ca 0.07 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.15 3kez h ARG 409 Cb 0.47 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 3kez h ARG 409 CO 0.02 0.49 -0.03 0.07 -1.51 0.00 0.00 179.97 179.01 3kez h ARG 410 N 0.77 0.36 -0.30 0.20 0.11 -1.15 0.64 114.38 115.01 3kez h ARG 410 Ca 0.30 -0.07 -0.12 0.00 0.10 0.00 0.00 59.98 60.19 3kez h ARG 410 Cb 0.13 -0.06 -0.01 0.00 1.11 0.00 0.00 29.97 31.15 3kez h ARG 410 CO -0.16 0.42 -0.27 0.87 0.10 0.00 0.00 179.97 180.93 3kez h LYS 411 N 0.35 0.72 -0.27 0.08 1.57 -1.45 -2.88 116.57 114.69 3kez h LYS 411 Ca 0.08 -0.37 -0.15 0.00 -1.87 0.00 0.00 60.65 58.33 3kez h LYS 411 Cb 0.28 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 3kez h LYS 411 CO 0.01 0.99 -0.45 1.49 -0.57 0.00 0.00 179.45 180.91 3kez h GLU 412 N 0.47 0.71 -0.36 3.15 4.57 -0.68 -3.34 114.58 119.10 3kez h GLU 412 Ca 0.05 -0.40 0.00 0.00 -1.18 0.00 0.00 59.36 57.83 3kez h GLU 412 Cb 0.84 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.46 3kez h GLU 412 CO 0.07 1.02 0.00 1.28 -1.18 0.00 0.00 179.01 180.20 3kez n LEU 413 N -4.02 3.18 -4.63 1.64 4.77 0.16 -5.00 117.00 113.11 3kez n LEU 413 Ca -0.03 -2.17 -0.49 0.00 -0.03 0.00 0.00 56.01 53.29 3kez n LEU 413 Cb 0.56 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 41.30 3kez n LEU 413 CO 0.47 0.74 1.05 0.55 -1.33 0.00 0.00 177.39 178.87 3kez n VAL 414 N 0.44 0.02 -1.02 4.08 3.14 -1.09 -1.72 118.33 122.18 3kez n VAL 414 Ca 0.14 -0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.51 3kez n VAL 414 Cb 0.52 -1.17 -0.00 0.00 -1.06 0.00 0.00 33.84 32.13 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 3.05 -0.01 -0.10 1.55 0.00 -1.26 -4.87 120.51 118.88 3kez n ALA 415 Ca 0.18 0.01 0.04 0.00 0.00 0.00 0.00 53.44 53.67 3kez n ALA 415 Cb 0.23 -0.38 0.11 0.00 0.00 0.00 0.00 19.45 19.42 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 -2.24 2.69 -0.55 0.00 1.02 -0.70 -4.87 120.64 115.98 3kez n GLU 416 Ca -0.01 -1.85 0.00 0.00 -0.02 0.00 0.00 57.16 55.29 3kez n GLU 416 Cb 0.11 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 30.33 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 0.29 0.88 0.09 0.62 0.00 -1.22 -4.96 105.19 100.89 3kez n GLY 417 Ca 0.09 -0.45 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.40 0.00 0.00 1.61 8.25 -1.26 -4.08 115.22 117.33 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 0.06 -0.77 0.00 0.00 1.12 0.00 0.00 29.99 30.39 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 -2.87 0.00 0.00 -0.41 3.00 -1.15 -1.74 116.66 113.50 3kez n ARG 419 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.54 3kez n ARG 419 Cb 0.93 -1.02 0.00 0.00 0.00 0.00 0.00 32.46 32.37 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 0.55 0.00 0.02 -0.14 4.01 -1.26 -2.09 117.16 118.24 3kez n TYR 421 Ca 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.70 3kez n TYR 421 Cb 0.00 0.00 0.18 0.00 -0.31 0.00 0.00 39.34 39.21 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 0.48 0.15 7.72 3.32 -1.72 0.16 116.42 126.53 3kez h ASP 422 Ca 0.00 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 3kez h ASP 422 Cb 0.00 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.42 3kez h ASP 422 CO 0.00 0.77 -0.07 0.58 -1.72 0.00 0.00 179.24 178.80 3kez h VAL 423 N 0.41 1.00 -0.51 -1.35 2.07 -1.70 -3.34 116.25 112.82 3kez h VAL 423 Ca 0.05 -0.98 -0.09 0.00 0.82 0.00 0.00 66.70 66.51 3kez h VAL 423 Cb 0.74 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 3kez h VAL 423 CO 0.06 0.22 -0.04 0.40 0.02 0.00 0.00 177.57 178.22 3kez h ILE 424 N -0.70 1.26 0.00 4.57 1.08 -1.79 -2.46 117.51 119.47 3kez h ILE 424 Ca -0.02 -1.12 -0.03 0.00 -0.39 0.00 0.00 64.86 63.30 3kez h ILE 424 Cb 0.51 0.91 -0.00 0.00 -3.07 0.00 0.00 36.82 35.16 3kez h ILE 424 CO 0.03 0.40 -0.15 0.08 -0.69 0.00 0.00 178.15 177.82 3kez h ARG 425 N 0.82 0.00 -0.58 2.37 0.11 -0.84 -1.76 114.38 114.50 3kez h ARG 425 Ca 0.15 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.23 3kez h ARG 425 Cb 0.54 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.62 3kez h ARG 425 CO 0.03 0.15 0.00 0.09 0.10 0.00 0.00 179.97 180.34 3kez n ASN 426 N -3.56 3.31 -2.64 0.08 3.02 -0.93 -4.63 115.26 109.91 3kez n ASN 426 Ca -0.01 -2.22 -0.07 0.00 -0.03 0.00 0.00 54.58 52.25 3kez n ASN 426 Cb 0.29 -0.44 0.01 0.00 -0.61 0.00 0.00 39.78 39.03 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 1.04 -1.22 2.87 7.41 0.00 -0.66 -5.10 105.19 109.53 3kez n GLY 427 Ca 0.18 1.05 -0.23 0.00 0.00 0.00 0.00 46.02 47.02 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 -2.36 0.67 -0.01 2.61 2.01 -1.26 -4.98 115.64 112.32 3kez s THR 429 Ca 0.21 -0.13 -0.30 0.00 0.31 0.00 0.00 61.69 61.78 3kez s THR 429 Cb -0.06 -0.72 -0.06 0.00 0.01 0.00 0.00 72.50 71.67 3kez s THR 429 CO 0.65 0.28 1.56 -0.69 -0.69 0.00 0.00 174.62 175.73 3kez s VAL 430 N 1.38 3.50 -0.31 3.82 1.01 0.15 -4.87 120.40 125.08 3kez s VAL 430 Ca -0.03 0.80 0.01 0.00 0.00 0.00 0.00 61.98 62.76 3kez s VAL 430 Cb -0.13 -3.51 0.10 0.00 0.00 0.00 0.00 36.38 32.83 3kez s VAL 430 CO -0.03 -0.03 0.06 -0.54 0.00 0.00 0.00 175.10 174.56 3kez s LYS 431 N 3.12 1.13 0.12 2.72 1.02 -1.26 -1.00 119.74 125.58 3kez s LYS 431 Ca 0.70 -1.41 -0.31 0.00 0.02 0.00 0.00 55.97 54.98 3kez s LYS 431 Cb -0.34 -2.57 -0.07 0.00 -0.52 0.00 0.00 37.83 34.33 3kez s LYS 431 CO 0.29 -0.93 1.30 1.03 -0.92 0.00 0.00 175.35 176.12 3kez s ARG 432 N 1.29 4.38 -0.22 1.68 0.52 -1.26 -4.88 118.95 120.46 3kez s ARG 432 Ca 0.09 1.95 -0.05 0.00 -0.52 0.00 0.00 55.73 57.21 3kez s ARG 432 Cb -0.18 -3.27 -0.01 0.00 0.52 0.00 0.00 34.95 32.01 3kez s ARG 432 CO -0.16 -0.31 -0.02 0.42 0.02 0.00 0.00 175.30 175.25 3kez s ILE 433 N 0.81 3.59 -1.23 1.52 1.01 -1.26 -4.82 121.20 120.83 3kez s ILE 433 Ca 0.60 -0.42 -0.12 0.00 0.00 0.00 0.00 60.65 60.71 3kez s ILE 433 Cb -0.34 -2.64 0.17 0.00 0.01 0.00 0.00 42.46 39.66 3kez s ILE 433 CO 0.32 0.41 1.56 -0.67 0.00 0.00 0.00 174.94 176.56 3kez n ASP 434 N 4.74 5.20 -4.77 3.58 2.03 -1.26 -4.60 116.55 121.47 3kez n ASP 434 Ca -0.18 -3.02 -0.29 0.00 0.52 0.00 0.00 54.79 51.82 3kez n ASP 434 Cb 0.51 -1.54 -0.06 0.00 -0.72 0.00 0.00 41.12 39.31 3kez n ASP 434 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3kez s VAL 435 N 1.14 4.44 0.19 5.18 -7.23 -1.26 -5.06 120.40 117.79 3kez s VAL 435 Ca 0.42 -0.89 0.06 0.00 -1.81 0.00 0.00 61.98 59.75 3kez s VAL 435 Cb 0.01 -3.17 -0.04 0.00 0.56 0.00 0.00 36.38 33.74 3kez s VAL 435 CO 0.00 0.06 0.15 -0.54 -0.31 0.00 0.00 175.10 174.46 3kez s LYS 436 N -2.58 2.89 -0.05 4.82 -0.14 -1.26 -4.64 119.74 118.78 3kez s LYS 436 Ca 0.29 -0.92 -0.02 0.00 -1.36 0.00 0.00 55.97 53.96 3kez s LYS 436 Cb -0.11 -2.62 0.03 0.00 -1.68 0.00 0.00 37.83 33.45 3kez s LYS 436 CO 0.22 0.46 0.10 0.34 -0.76 0.00 0.00 175.35 175.71 3kez s ASP 437 N -3.27 -0.06 0.16 2.83 -1.08 -1.26 -5.03 116.67 108.96 3kez s ASP 437 Ca 0.31 0.20 0.24 0.00 -0.52 0.00 0.00 52.55 52.79 3kez s ASP 437 Cb -0.09 0.12 0.91 0.00 -1.46 0.00 0.00 42.92 42.40 3kez s ASP 437 CO 0.24 -0.12 1.73 -1.54 0.52 0.00 0.00 175.17 176.01 3kez n SER 438 N 3.92 0.52 0.21 -0.34 3.41 -1.26 -2.43 113.62 117.65 3kez n SER 438 Ca -0.23 0.58 0.11 0.00 -0.26 0.00 0.00 58.87 59.07 3kez n SER 438 Cb 0.53 -0.71 0.27 0.00 -0.26 0.00 0.00 64.21 64.04 3kez n SER 438 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3kez h ASP 439 N 0.00 0.00 -2.03 4.04 3.32 -1.97 -3.35 116.42 116.44 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 0.50 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.66 3kez h ASP 439 CO 0.00 0.14 -1.04 2.30 -1.72 0.00 0.00 179.24 178.92 3kez n ILE 440 N -3.17 -0.16 1.56 0.35 -5.35 -1.02 -3.87 119.36 107.71 3kez n ILE 440 Ca 0.02 -4.27 0.15 0.00 -0.27 0.00 0.00 62.75 58.38 3kez n ILE 440 Cb 0.52 -1.78 0.80 0.00 -1.74 0.00 0.00 39.64 37.44 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 1.18 0.00 -0.74 7.28 0.23 0.14 -2.16 115.26 121.19 3kez n ASN 441 Ca 0.23 -0.39 0.10 0.00 -0.53 0.00 0.00 54.58 53.99 3kez n ASN 441 Cb 0.53 -0.20 0.06 0.00 -2.08 0.00 0.00 39.78 38.09 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 -1.20 1.78 -2.94 -3.83 5.02 -0.53 -4.94 118.16 111.53 3kez n LYS 442 Ca 0.17 -1.54 -0.42 0.00 -2.02 0.00 0.00 58.31 54.50 3kez n LYS 442 Cb 0.19 -1.40 -0.05 0.00 -0.02 0.00 0.00 35.03 33.76 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 -1.86 4.84 -0.06 -0.18 2.01 -0.92 -4.99 115.64 114.48 3kez s THR 443 Ca 0.22 1.36 -0.22 0.00 0.31 0.00 0.00 61.69 63.36 3kez s THR 443 Cb 0.17 -4.11 0.05 0.00 0.01 0.00 0.00 72.50 68.62 3kez s THR 443 CO 0.32 -0.13 0.50 -1.59 -0.69 0.00 0.00 174.62 173.03 3kez s LYS 444 N 2.85 0.82 0.56 4.92 -2.85 -1.26 -4.77 119.74 120.01 3kez s LYS 444 Ca 0.33 0.17 -0.20 0.00 -1.00 0.00 0.00 55.97 55.26 3kez s LYS 444 Cb -0.15 0.38 -0.05 0.00 -2.06 0.00 0.00 37.83 35.96 3kez s LYS 444 CO 0.10 -0.22 1.23 -1.01 0.10 0.00 0.00 175.35 175.54 3kez s HIS 445 N -0.97 2.46 -0.47 1.78 3.76 -1.26 -5.00 115.29 115.59 3kez s HIS 445 Ca -0.10 1.49 0.06 0.00 -0.15 0.00 0.00 55.06 56.36 3kez s HIS 445 Cb -0.03 -3.52 0.19 0.00 1.11 0.00 0.00 32.58 30.33 3kez s HIS 445 CO 0.06 -2.21 0.59 -1.71 -0.85 0.00 0.00 174.74 170.62 3kez n ASN 446 N -1.28 -2.10 -3.62 1.40 5.15 -1.26 -5.13 115.26 108.42 3kez n ASN 446 Ca 0.12 -2.74 -0.16 0.00 -0.60 0.00 0.00 54.58 51.20 3kez n ASN 446 Cb 0.48 0.77 -0.07 0.00 -0.53 0.00 0.00 39.78 40.44 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 0.42 0.02 -0.44 -0.44 -1.32 -1.26 -4.89 115.64 107.74 3kez s THR 447 Ca 0.32 -0.19 0.26 0.00 -1.21 0.00 0.00 61.69 60.87 3kez s THR 447 Cb 0.05 -0.84 0.30 0.00 -1.51 0.00 0.00 72.50 70.50 3kez s THR 447 CO -0.13 -0.10 1.77 0.00 -2.21 0.00 0.00 174.62 173.95 3kez h ALA 448 N 3.40 1.00 -4.17 11.08 0.00 -1.95 -3.52 119.26 125.09 3kez h ALA 448 Ca -0.28 0.00 -0.69 0.00 0.00 0.00 0.00 54.91 53.94 3kez h ALA 448 Cb 1.16 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 18.70 3kez h ALA 448 CO 0.39 0.00 -0.82 0.71 0.00 0.00 0.00 179.25 179.53 3kez s TYR 449 N -3.30 2.54 0.08 0.00 2.02 -1.26 -5.18 117.35 112.24 3kez s TYR 449 Ca 0.06 -0.27 -0.36 0.00 -0.37 0.00 0.00 57.07 56.12 3kez s TYR 449 Cb 0.10 -1.53 -0.18 0.00 -0.40 0.00 0.00 41.96 39.94 3kez s TYR 449 CO 0.52 0.15 1.04 0.39 -1.57 0.00 0.00 175.55 176.07 3kez n GLU 451 N 2.06 0.39 -3.49 -0.62 1.02 -1.26 -4.90 120.64 113.84 3kez n GLU 451 Ca -0.17 0.14 -0.12 0.00 -0.02 0.00 0.00 57.16 56.99 3kez n GLU 451 Cb 0.52 -1.58 -0.03 0.00 -0.02 0.00 0.00 31.44 30.33 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 -0.13 -0.48 0.00 -0.32 1.13 -0.17 -4.98 117.35 112.39 3kez s TYR 452 Ca 0.82 0.52 0.00 0.00 -1.41 0.00 0.00 57.07 57.00 3kez s TYR 452 Cb -1.09 0.50 0.00 0.00 -1.10 0.00 0.00 41.96 40.28 3kez s TYR 452 CO 0.54 -0.62 0.00 -0.40 -2.51 0.00 0.00 175.55 172.56 3kez n ASP 453 N 0.12 0.46 0.00 -0.18 5.68 -1.26 0.33 116.55 121.70 3kez n ASP 453 Ca -0.14 -0.65 0.06 0.00 -0.50 0.00 0.00 54.79 53.56 3kez n ASP 453 Cb 0.61 0.00 0.33 0.00 -1.14 0.00 0.00 41.12 40.92 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 1.06 2.11 2.14 -1.26 -1.31 117.44 120.18 3kez n TRP 454 Ca 0.00 0.00 0.12 0.00 2.07 0.00 0.00 57.50 59.69 3kez n TRP 454 Cb 0.00 0.00 0.18 0.00 -0.81 0.00 0.00 31.31 30.68 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 -0.85 0.87 -4.67 -0.67 3.02 -1.26 -4.88 115.26 106.83 3kez n ASN 455 Ca 0.08 -0.68 -0.43 0.00 -0.03 0.00 0.00 54.58 53.53 3kez n ASN 455 Cb 0.04 0.40 -0.02 0.00 -0.61 0.00 0.00 39.78 39.59 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 -2.83 3.39 -0.05 3.10 5.36 -0.43 -4.90 117.98 121.61 3kez s PHE 456 Ca 0.14 1.47 0.31 0.00 -0.96 0.00 0.00 56.93 57.90 3kez s PHE 456 Cb 0.18 -3.22 1.22 0.00 -0.34 0.00 0.00 43.02 40.85 3kez s PHE 456 CO 0.68 -0.39 1.91 1.12 -1.46 0.00 0.00 175.22 177.08 3kez h HIS 457 N 7.36 0.00 -0.14 10.12 2.07 -1.89 -2.68 115.15 129.99 3kez h HIS 457 Ca -0.23 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.29 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 0.74 0.00 0.00 1.63 -3.07 0.00 0.00 177.93 177.23 3kez n LYS 458 N -2.93 1.83 0.17 5.12 5.02 -1.26 -3.20 118.16 122.91 3kez n LYS 458 Ca 0.01 -1.24 0.13 0.00 -2.02 0.00 0.00 58.31 55.19 3kez n LYS 458 Cb 0.31 -1.43 0.56 0.00 -0.02 0.00 0.00 35.03 34.45 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 2.65 0.00 -3.06 -0.18 3.07 -1.83 -3.41 117.51 114.74 3kez h ILE 459 Ca 0.00 -0.25 -0.63 0.00 1.55 0.00 0.00 64.86 65.53 3kez h ILE 459 Cb 0.57 1.02 -0.11 0.00 -0.27 0.00 0.00 36.82 38.04 3kez h ILE 459 CO 0.00 0.00 -0.49 -0.76 -1.05 0.00 0.00 178.15 175.85 3kez s LEU 460 N -4.86 4.25 0.50 0.16 1.43 -1.19 -4.93 118.68 114.03 3kez s LEU 460 Ca 0.03 0.30 -0.23 0.00 -1.03 0.00 0.00 54.13 53.20 3kez s LEU 460 Cb 0.09 -2.07 -0.06 0.00 0.03 0.00 0.00 46.19 44.17 3kez s LEU 460 CO 0.40 0.26 1.28 -0.76 0.23 0.00 0.00 176.35 177.76 3kez s LEU 461 N -0.12 3.94 0.70 1.79 1.43 -0.97 -5.00 118.68 120.45 3kez s LEU 461 Ca 0.10 2.58 -0.13 0.00 -1.03 0.00 0.00 54.13 55.66 3kez s LEU 461 Cb -0.11 -4.23 0.02 0.00 0.03 0.00 0.00 46.19 41.90 3kez s LEU 461 CO 0.00 -1.26 1.10 -2.16 0.23 0.00 0.00 176.35 174.26 3kez s PRO 462 N -2.77 2.59 0.24 1.29 0.04 -1.26 -4.74 135.00 130.39 3kez s PRO 462 Ca 0.67 1.29 -0.30 0.00 0.04 0.00 0.00 61.00 62.70 3kez s PRO 462 Cb -0.36 -1.93 -0.11 0.00 0.04 0.00 0.00 34.50 32.15 3kez s PRO 462 CO 0.43 -1.40 1.54 0.42 0.04 0.00 0.00 177.00 178.02 3kez s ILE 463 N -2.58 2.40 0.42 0.56 -1.09 -1.26 -4.90 121.20 114.75 3kez s ILE 463 Ca 0.64 0.33 -0.25 0.00 -2.23 0.00 0.00 60.65 59.14 3kez s ILE 463 Cb -0.19 -3.21 -0.08 0.00 -1.58 0.00 0.00 42.46 37.40 3kez s ILE 463 CO 0.47 0.05 1.29 -2.84 -1.23 0.00 0.00 174.94 172.68 3kez s PRO 464 N -0.01 3.89 0.33 2.79 0.02 -1.26 -4.89 135.00 135.87 3kez s PRO 464 Ca 0.64 2.12 0.09 0.00 0.02 0.00 0.00 61.00 63.87 3kez s PRO 464 Cb -0.45 -2.69 0.81 0.00 0.02 0.00 0.00 34.50 32.20 3kez s PRO 464 CO 0.42 -0.55 1.80 -0.22 -0.33 0.00 0.00 177.00 178.12 3kez h LYS 465 N 2.53 0.68 -0.50 5.54 3.64 -1.85 -0.34 116.57 126.25 3kez h LYS 465 Ca -0.50 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 58.81 3kez h LYS 465 Cb 1.25 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.89 3kez h LYS 465 CO 0.62 0.45 0.17 1.57 -2.27 0.00 0.00 179.45 179.98 3kez h LYS 466 N 0.70 0.74 -1.15 1.90 2.10 -1.93 0.34 116.57 119.26 3kez h LYS 466 Ca 0.55 -0.12 0.00 0.00 -2.00 0.00 0.00 60.65 59.08 3kez h LYS 466 Cb 0.94 -0.13 0.00 0.00 -0.90 0.00 0.00 32.23 32.15 3kez h LYS 466 CO -0.32 0.64 0.00 -1.91 -2.00 0.00 0.00 179.45 175.86 3kez n GLU 467 N -4.32 0.59 0.00 0.07 4.07 -0.14 -1.63 120.64 119.28 3kez n GLU 467 Ca 0.04 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.14 3kez n GLU 467 Cb 0.18 -1.23 0.00 0.00 -0.06 0.00 0.00 31.44 30.33 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 0.55 0.00 0.12 4.31 8.00 0.12 -1.03 116.55 128.61 3kez n ASP 469 Ca 0.00 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.62 3kez n ASP 469 Cb 0.25 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.41 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 0.61 -3.41 2.24 0.00 -1.54 -3.44 119.26 113.72 3kez h ALA 470 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.32 3kez h ALA 470 Cb 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 17.79 17.40 3kez h ALA 470 CO 0.00 0.00 -0.76 1.21 0.00 0.00 0.00 179.25 179.70 3kez s ASN 471 N -5.29 3.88 0.00 0.00 3.84 -0.20 -4.99 114.94 112.18 3kez s ASN 471 Ca 0.02 -1.41 0.26 0.00 0.21 0.00 0.00 52.86 51.94 3kez s ASN 471 Cb 0.09 -1.03 1.34 0.00 -0.55 0.00 0.00 41.25 41.10 3kez s ASN 471 CO 0.75 -0.33 1.88 -0.81 -2.79 0.00 0.00 177.10 175.81 3kez n PRO 472 N 4.74 0.42 -2.87 0.43 -0.05 -1.26 -4.88 135.00 131.53 3kez n PRO 472 Ca -0.06 0.04 -0.44 0.00 -0.05 0.00 0.00 63.50 62.99 3kez n PRO 472 Cb 0.44 -1.50 0.00 0.00 -0.05 0.00 0.00 33.50 32.39 3kez n PRO 472 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 175.50 175.54 3kez n ASN 473 N -1.25 5.55 -3.64 3.54 3.02 -1.26 -5.13 115.26 116.09 3kez n ASN 473 Ca 0.13 -3.14 -0.04 0.00 -0.03 0.00 0.00 54.58 51.50 3kez n ASN 473 Cb 0.19 -1.43 -0.07 0.00 -0.61 0.00 0.00 39.78 37.87 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 -0.46 0.48 0.60 3.52 2.20 -1.26 -4.17 119.74 120.65 3kez s LYS 475 Ca 0.36 0.81 -0.17 0.00 -0.36 0.00 0.00 55.97 56.61 3kez s LYS 475 Cb 0.01 0.11 -0.03 0.00 -1.51 0.00 0.00 37.83 36.41 3kez s LYS 475 CO 0.01 -0.10 1.13 -1.14 -0.36 0.00 0.00 175.35 174.89 3kez s GLN 476 N 1.32 3.06 0.60 4.03 2.00 -1.26 -4.92 119.66 124.49 3kez s GLN 476 Ca -0.08 1.52 -0.18 0.00 -2.00 0.00 0.00 55.36 54.62 3kez s GLN 476 Cb -0.04 -1.97 -0.03 0.00 0.80 0.00 0.00 33.01 31.76 3kez s GLN 476 CO -0.15 -1.07 1.20 -0.80 -0.50 0.00 0.00 175.29 173.97 3kez s ASN 477 N -2.14 5.16 0.57 6.67 0.01 -1.26 -4.97 114.94 118.97 3kez s ASN 477 Ca 0.70 2.36 -0.20 0.00 -0.71 0.00 0.00 52.86 55.02 3kez s ASN 477 Cb -0.23 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 38.80 3kez s ASN 477 CO 0.34 -1.61 1.24 -2.16 -1.51 0.00 0.00 177.10 173.40 3kez s PRO 478 N -3.39 3.09 0.00 -0.60 0.04 -1.26 -3.30 135.00 129.58 3kez s PRO 478 Ca 0.77 1.94 0.00 0.00 0.04 0.00 0.00 61.00 63.74 3kez s PRO 478 Cb -0.30 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.18 3kez s PRO 478 CO 0.34 -1.14 0.00 0.41 0.04 0.00 0.00 177.00 176.64 3kez n GLY 479 N 0.59 1.68 0.19 0.56 0.00 -1.26 -4.84 105.19 102.10 3kez n GLY 479 Ca 0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.92 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 0.57 1.61 4.01 -1.21 -5.08 117.16 115.07 3kez n TYR 480 Ca 0.00 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.79 3kez n TYR 480 Cb 0.00 -0.89 0.27 0.00 -0.31 0.00 0.00 39.34 38.41 3kez n TYR 480 CO 0.00 0.00 0.00 1.55 -0.46 0.00 0.00 176.86 177.95