#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a0h n GLN 28 N 0.00 1.96 0.00 -0.67 3.00 -1.26 -5.05 117.38 115.36 3a0h n GLN 28 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3a0h n GLN 28 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 3a0h n GLN 28 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 3a0h n GLU 29 N 0.00 0.00 -1.55 -1.09 0.00 -1.26 -4.43 120.64 112.32 3a0h n GLU 29 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 57.16 56.74 3a0h n GLU 29 Cb 0.00 -0.57 0.01 0.00 0.00 0.00 0.00 31.44 30.88 3a0h n GLU 29 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3a0h n SER 30 N -0.25 0.48 -0.05 4.31 2.88 -1.26 -0.46 113.62 119.26 3a0h n SER 30 Ca 0.00 1.02 -0.01 0.00 -1.33 0.00 0.00 58.87 58.55 3a0h n SER 30 Cb 0.00 -1.25 -0.00 0.00 -0.75 0.00 0.00 64.21 62.21 3a0h n SER 30 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3a0h n SER 31 N 0.90 -1.98 -0.37 -3.46 2.88 -1.26 -4.99 113.62 105.33 3a0h n SER 31 Ca 0.11 0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.65 3a0h n SER 31 Cb 0.38 -0.62 0.00 0.00 -0.75 0.00 0.00 64.21 63.22 3a0h n SER 31 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3a0h n GLY 32 N -1.84 3.14 0.00 0.46 0.00 0.39 -4.87 105.19 102.47 3a0h n GLY 32 Ca -0.01 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.00 3a0h n GLY 32 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3a0h n PHE 33 N 0.00 -2.13 -1.65 1.61 3.01 -1.26 -5.06 117.46 111.98 3a0h n PHE 33 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.38 3a0h n PHE 33 Cb 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 39.48 39.52 3a0h n PHE 33 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3a0h n ALA 34 N -3.00 -0.26 -0.08 4.37 0.00 -1.26 -4.83 120.51 115.45 3a0h n ALA 34 Ca 0.00 -0.51 -0.14 0.00 0.00 0.00 0.00 53.44 52.79 3a0h n ALA 34 Cb 0.00 0.02 -0.05 0.00 0.00 0.00 0.00 19.45 19.42 3a0h n ALA 34 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 3a0h h TRP 35 N -0.94 0.80 0.00 0.00 5.08 -2.00 -3.11 115.95 115.78 3a0h h TRP 35 Ca -0.11 -0.26 -0.01 0.00 1.08 0.00 0.00 58.89 59.59 3a0h h TRP 35 Cb 0.34 -0.16 -0.00 0.00 -3.00 0.00 0.00 29.16 26.33 3a0h h TRP 35 CO 0.00 1.00 -0.07 0.11 -1.28 0.00 0.00 178.44 178.20 3a0h h TRP 36 N 0.37 0.00 -0.96 0.12 5.08 -2.07 0.21 115.95 118.70 3a0h h TRP 36 Ca 0.03 0.00 -0.57 0.00 1.08 0.00 0.00 58.89 59.43 3a0h h TRP 36 Cb 0.90 0.00 -0.29 0.00 -3.00 0.00 0.00 29.16 26.76 3a0h h TRP 36 CO 0.08 0.07 0.67 0.00 -1.28 0.00 0.00 178.44 177.98 3a0h n ALA 37 N -2.36 5.83 -0.13 0.11 0.00 -1.19 -4.77 120.51 117.99 3a0h n ALA 37 Ca -0.03 -3.17 -0.06 0.00 0.00 0.00 0.00 53.44 50.18 3a0h n ALA 37 Cb 0.16 -1.52 -0.05 0.00 0.00 0.00 0.00 19.45 18.05 3a0h n ALA 37 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3a0h h GLY 38 N 1.44 -1.65 0.91 0.00 0.00 -0.52 -1.97 103.07 101.28 3a0h h GLY 38 Ca 0.60 0.88 0.00 0.00 0.00 0.00 0.00 47.33 48.81 3a0h h GLY 38 CO 1.26 -0.48 0.03 0.70 0.00 0.00 0.00 176.54 178.05 3a0h n ASN 39 N -4.02 0.00 0.06 0.19 5.03 -1.26 -1.83 115.26 113.42 3a0h n ASN 39 Ca -0.01 0.09 -0.11 0.00 0.87 0.00 0.00 54.58 55.42 3a0h n ASN 39 Cb 0.15 -0.09 -0.01 0.00 -1.02 0.00 0.00 39.78 38.81 3a0h n ASN 39 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3a0h h ALA 40 N 1.47 0.49 0.00 5.41 0.00 -1.74 -3.01 119.26 121.88 3a0h h ALA 40 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.26 3a0h h ALA 40 Cb 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3a0h h ALA 40 CO 0.00 0.79 0.00 0.54 0.00 0.00 0.00 179.25 180.58 3a0h n ARG 41 N -3.79 0.41 0.00 0.00 1.74 -0.76 -0.32 116.66 113.93 3a0h n ARG 41 Ca -0.05 0.03 0.12 0.00 -0.77 0.00 0.00 57.85 57.18 3a0h n ARG 41 Cb 0.76 -1.50 0.10 0.00 -1.02 0.00 0.00 32.46 30.80 3a0h n ARG 41 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 3a0h n LEU 42 N -1.06 2.13 -1.20 0.55 7.94 -1.14 -3.78 117.00 120.45 3a0h n LEU 42 Ca 0.10 -0.74 0.09 0.00 -1.11 0.00 0.00 56.01 54.34 3a0h n LEU 42 Cb 0.06 -0.01 0.27 0.00 0.53 0.00 0.00 43.42 44.27 3a0h n LEU 42 CO 0.09 0.38 0.73 0.00 -1.11 0.00 0.00 177.39 177.47 3a0h n ILE 43 N 0.27 1.09 -4.71 1.96 3.06 0.56 -4.36 119.36 117.23 3a0h n ILE 43 Ca 0.11 -0.86 -0.33 0.00 -2.50 0.00 0.00 62.75 59.17 3a0h n ILE 43 Cb 0.48 0.24 -0.13 0.00 0.54 0.00 0.00 39.64 40.77 3a0h n ILE 43 CO 0.00 0.00 0.00 0.21 -2.50 0.00 0.00 176.55 174.26 3a0h s ASN 44 N -0.92 4.26 1.37 9.51 3.84 -1.25 -4.93 114.94 126.82 3a0h s ASN 44 Ca 0.40 -0.22 0.00 0.00 0.21 0.00 0.00 52.86 53.25 3a0h s ASN 44 Cb 0.23 -1.43 0.00 0.00 -0.55 0.00 0.00 41.25 39.50 3a0h s ASN 44 CO 0.24 0.23 0.00 -0.11 -2.79 0.00 0.00 177.10 174.67 3a0h n LEU 45 N 3.09 0.00 -4.46 3.21 0.00 -1.26 -4.58 117.00 113.00 3a0h n LEU 45 Ca -0.18 0.00 -0.33 0.00 0.00 0.00 0.00 56.01 55.50 3a0h n LEU 45 Cb 0.53 0.00 -0.13 0.00 0.00 0.00 0.00 43.42 43.81 3a0h n LEU 45 CO 0.30 0.00 -0.43 -0.55 0.00 0.00 0.00 177.39 176.70 3a0h s SER 46 N -4.00 4.17 0.19 1.96 0.15 -1.26 -4.89 113.70 110.02 3a0h s SER 46 Ca 0.00 -0.21 -0.33 0.00 0.70 0.00 0.00 55.95 56.11 3a0h s SER 46 Cb 0.00 -1.22 -0.14 0.00 -1.71 0.00 0.00 66.02 62.96 3a0h s SER 46 CO 0.00 0.28 1.54 0.61 1.20 0.00 0.00 173.24 176.86 3a0h n GLY 47 N 2.78 1.05 0.34 9.45 0.00 -1.26 -4.25 105.19 113.30 3a0h n GLY 47 Ca -0.18 0.60 -0.05 0.00 0.00 0.00 0.00 46.02 46.39 3a0h n GLY 47 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3a0h h LYS 48 N 5.41 1.18 -4.51 1.61 2.10 -1.81 -3.35 116.57 117.20 3a0h h LYS 48 Ca -0.45 -0.21 -0.57 0.00 -2.00 0.00 0.00 60.65 57.43 3a0h h LYS 48 Cb 1.26 -0.19 -0.36 0.00 -0.90 0.00 0.00 32.23 32.03 3a0h h LYS 48 CO 0.85 0.95 -0.82 -0.48 -2.00 0.00 0.00 179.45 177.94 3a0h s LEU 49 N -9.70 1.50 0.30 7.07 -0.00 -1.24 -4.40 118.68 112.21 3a0h s LEU 49 Ca -0.12 -0.40 -0.00 0.00 -0.00 0.00 0.00 54.13 53.61 3a0h s LEU 49 Cb 0.16 -1.02 0.46 0.00 -0.00 0.00 0.00 46.19 45.79 3a0h s LEU 49 CO 0.84 -0.06 1.88 0.25 -0.00 0.00 0.00 176.35 179.25 3a0h h LEU 50 N 7.94 0.76 -1.05 1.48 6.46 -1.80 -3.29 115.31 125.81 3a0h h LEU 50 Ca -0.34 -0.10 0.43 0.00 -0.12 0.00 0.00 57.88 57.75 3a0h h LEU 50 Cb 1.14 -0.20 -0.17 0.00 -0.73 0.00 0.00 40.66 40.70 3a0h h LEU 50 CO 0.47 0.70 0.59 1.23 -0.62 0.00 0.00 178.44 180.81 3a0h h GLY 51 N 0.95 2.15 -0.25 3.75 0.00 -1.79 0.24 103.07 108.12 3a0h h GLY 51 Ca 0.19 -0.14 0.03 0.00 0.00 0.00 0.00 47.33 47.41 3a0h h GLY 51 CO -0.02 -0.76 -0.37 0.00 0.00 0.00 0.00 176.54 175.40 3a0h h ALA 52 N 1.94 -0.63 -0.82 3.60 0.00 -1.76 5.35 119.26 126.94 3a0h h ALA 52 Ca 0.85 -0.00 0.19 0.00 0.00 0.00 0.00 54.91 55.94 3a0h h ALA 52 Cb 2.32 0.97 -0.12 0.00 0.00 0.00 0.00 17.79 20.97 3a0h h ALA 52 CO -0.72 -0.80 0.30 0.45 0.00 0.00 0.00 179.25 178.48 3a0h h HIS 53 N -0.27 0.49 -0.12 0.00 -0.00 -0.79 0.23 115.15 114.70 3a0h h HIS 53 Ca 0.05 0.04 -0.10 0.00 -0.00 0.00 0.00 60.37 60.36 3a0h h HIS 53 Cb 0.39 -0.09 0.00 0.00 -0.00 0.00 0.00 27.41 27.72 3a0h h HIS 53 CO -0.67 -0.04 -0.30 0.28 -0.00 0.00 0.00 177.93 177.20 3a0h h VAL 54 N 0.36 1.38 -0.54 2.45 2.07 -1.13 0.80 116.25 121.64 3a0h h VAL 54 Ca 0.49 -1.59 0.05 0.00 0.82 0.00 0.00 66.70 66.46 3a0h h VAL 54 Cb 0.87 2.10 -0.06 0.00 -1.52 0.00 0.00 31.29 32.67 3a0h h VAL 54 CO -0.51 0.47 -0.32 0.00 0.02 0.00 0.00 177.57 177.23 3a0h n ALA 55 N -2.49 -0.34 0.13 1.67 0.00 1.74 -0.11 120.51 121.11 3a0h n ALA 55 Ca -0.07 0.46 0.02 0.00 0.00 0.00 0.00 53.44 53.85 3a0h n ALA 55 Cb 0.47 0.02 0.01 0.00 0.00 0.00 0.00 19.45 19.96 3a0h n ALA 55 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 3a0h h HIS 56 N 0.00 0.00 0.00 0.00 2.07 -1.28 -3.05 115.15 112.89 3a0h h HIS 56 Ca 0.09 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.61 3a0h h HIS 56 Cb 0.22 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.20 3a0h h HIS 56 CO -0.74 0.51 0.07 0.00 -3.07 0.00 0.00 177.93 174.70 3a0h n ALA 57 N -2.24 0.73 -0.14 6.11 0.00 0.85 0.17 120.51 125.99 3a0h n ALA 57 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.17 3a0h n ALA 57 Cb 0.74 -0.54 -0.10 0.00 0.00 0.00 0.00 19.45 19.56 3a0h n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a0h n GLY 58 N -0.92 -0.43 0.32 0.00 0.00 -0.97 -3.86 105.19 99.32 3a0h n GLY 58 Ca 0.00 -0.14 0.08 0.00 0.00 0.00 0.00 46.02 45.96 3a0h n GLY 58 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3a0h h LEU 59 N -0.92 0.56 -0.84 0.99 4.07 0.16 1.93 115.31 121.26 3a0h h LEU 59 Ca -0.68 0.09 0.06 0.00 0.08 0.00 0.00 57.88 57.43 3a0h h LEU 59 Cb 1.62 0.01 -0.06 0.00 1.08 0.00 0.00 40.66 43.30 3a0h h LEU 59 CO -0.40 0.22 0.52 0.16 -1.08 0.00 0.00 178.44 177.87 3a0h h ILE 60 N 0.64 1.06 0.00 1.22 3.07 -1.46 1.00 117.51 123.04 3a0h h ILE 60 Ca 0.48 -0.33 -0.23 0.00 1.55 0.00 0.00 64.86 66.33 3a0h h ILE 60 Cb 0.70 0.00 -0.04 0.00 -0.27 0.00 0.00 36.82 37.22 3a0h h ILE 60 CO -0.37 0.18 -1.27 1.62 -1.05 0.00 0.00 178.15 177.26 3a0h h VAL 61 N 0.97 1.28 -0.12 0.16 3.04 -0.79 -3.25 116.25 117.53 3a0h h VAL 61 Ca 0.36 -3.02 -0.14 0.00 -1.01 0.00 0.00 66.70 62.89 3a0h h VAL 61 Cb 0.14 2.62 -0.01 0.00 -2.01 0.00 0.00 31.29 32.03 3a0h h VAL 61 CO -0.16 0.73 -0.52 0.15 -1.01 0.00 0.00 177.57 176.76 3a0h h PHE 62 N 0.00 0.43 -0.88 3.17 3.57 0.34 -2.72 116.94 120.86 3a0h h PHE 62 Ca -0.12 -0.14 -0.01 0.00 3.53 0.00 0.00 57.97 61.22 3a0h h PHE 62 Cb 1.84 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 40.45 3a0h h PHE 62 CO 0.00 0.80 0.50 2.35 -2.23 0.00 0.00 178.31 179.73 3a0h h TRP 63 N 0.27 1.18 -0.82 0.41 7.01 1.00 0.49 115.95 125.48 3a0h h TRP 63 Ca 0.01 -0.02 -0.03 0.00 2.11 0.00 0.00 58.89 60.96 3a0h h TRP 63 Cb 1.01 -0.38 -0.04 0.00 -2.10 0.00 0.00 29.16 27.65 3a0h h TRP 63 CO 0.03 0.80 0.38 0.00 -2.79 0.00 0.00 178.44 176.86 3a0h h ALA 64 N 1.34 1.12 -0.78 2.65 0.00 -1.59 -0.57 119.26 121.43 3a0h h ALA 64 Ca 0.31 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 3a0h h ALA 64 Cb -0.01 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.42 3a0h h ALA 64 CO -0.05 0.65 0.38 0.78 0.00 0.00 0.00 179.25 181.02 3a0h h GLY 65 N 1.19 1.20 0.08 0.00 0.00 0.08 0.52 103.07 106.14 3a0h h GLY 65 Ca 0.28 -0.59 -0.00 0.00 0.00 0.00 0.00 47.33 47.02 3a0h h GLY 65 CO -0.03 0.56 -0.04 0.00 0.00 0.00 0.00 176.54 177.03 3a0h h ALA 66 N 1.20 -0.25 -0.81 3.60 0.00 -0.23 -3.12 119.26 119.65 3a0h h ALA 66 Ca 0.27 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.30 3a0h h ALA 66 Cb 0.10 0.04 -0.09 0.00 0.00 0.00 0.00 17.79 17.84 3a0h h ALA 66 CO -0.04 -0.25 0.39 0.52 0.00 0.00 0.00 179.25 179.88 3a0h h MET 67 N -0.37 0.54 -0.27 0.00 2.86 -1.21 1.22 114.93 117.70 3a0h h MET 67 Ca -0.01 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.61 3a0h h MET 67 Cb 0.08 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.60 3a0h h MET 67 CO 0.02 0.36 0.16 1.15 1.06 0.00 0.00 176.91 179.66 3a0h h THR 68 N 0.56 1.03 0.01 2.22 2.02 -1.05 1.99 112.91 119.70 3a0h h THR 68 Ca 0.44 -0.11 -0.00 0.00 0.77 0.00 0.00 66.41 67.51 3a0h h THR 68 Cb 0.63 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 3a0h h THR 68 CO -0.37 0.06 -0.01 -0.07 0.37 0.00 0.00 175.52 175.50 3a0h h LEU 69 N 0.33 -0.02 -0.65 2.58 3.38 -0.95 -2.17 115.31 117.82 3a0h h LEU 69 Ca 0.11 -0.08 0.09 0.00 0.09 0.00 0.00 57.88 58.08 3a0h h LEU 69 Cb -0.01 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.68 3a0h h LEU 69 CO -0.05 0.07 0.30 0.15 0.09 0.00 0.00 178.44 179.00 3a0h h PHE 70 N -0.10 0.53 0.00 1.13 3.57 0.21 0.56 116.94 122.84 3a0h h PHE 70 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 3a0h h PHE 70 Cb 0.10 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.69 3a0h h PHE 70 CO -0.05 0.19 0.00 0.39 -2.23 0.00 0.00 178.31 176.61 3a0h n GLU 71 N -4.91 0.00 -0.32 1.11 1.02 0.67 -1.86 120.64 116.35 3a0h n GLU 71 Ca 0.09 0.45 0.27 0.00 -0.02 0.00 0.00 57.16 57.95 3a0h n GLU 71 Cb 0.25 -1.32 0.58 0.00 -0.02 0.00 0.00 31.44 30.93 3a0h n GLU 71 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3a0h h LEU 72 N 0.00 0.31 -1.43 -4.62 6.46 -1.33 1.29 115.31 115.99 3a0h h LEU 72 Ca 0.00 0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.82 3a0h h LEU 72 Cb 0.00 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 39.94 3a0h h LEU 72 CO 0.00 0.05 0.18 0.00 -0.62 0.00 0.00 178.44 178.05 3a0h h ALA 73 N 1.57 1.14 0.00 1.25 0.00 0.89 -1.13 119.26 122.98 3a0h h ALA 73 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.50 3a0h h ALA 73 Cb 1.74 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.53 3a0h h ALA 73 CO -0.22 -0.14 0.00 0.72 0.00 0.00 0.00 179.25 179.61 3a0h n HIS 74 N -2.35 0.00 -2.29 0.00 8.25 0.43 -5.02 115.22 114.23 3a0h n HIS 74 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.03 3a0h n HIS 74 Cb 0.22 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.30 3a0h n HIS 74 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 3a0h s PHE 75 N -0.69 3.25 0.02 4.41 5.36 -0.20 -5.04 117.98 125.09 3a0h s PHE 75 Ca 0.00 1.08 0.03 0.00 -0.96 0.00 0.00 56.93 57.08 3a0h s PHE 75 Cb 0.00 -3.56 -0.04 0.00 -0.34 0.00 0.00 43.02 39.08 3a0h s PHE 75 CO 0.00 -1.91 -0.01 0.42 -1.46 0.00 0.00 175.22 172.27 3a0h s ILE 76 N 1.35 4.07 0.22 3.12 1.09 -1.26 -4.96 121.20 124.83 3a0h s ILE 76 Ca 0.62 -0.72 0.06 0.00 -1.10 0.00 0.00 60.65 59.51 3a0h s ILE 76 Cb -0.32 -2.84 -0.07 0.00 -1.06 0.00 0.00 42.46 38.16 3a0h s ILE 76 CO 0.29 0.31 1.52 1.55 -0.10 0.00 0.00 174.94 178.50 3a0h h PRO 77 N 4.11 0.13 0.33 2.79 0.13 -1.96 -3.36 132.00 134.17 3a0h h PRO 77 Ca -0.48 -0.11 -0.02 0.00 -0.87 0.00 0.00 66.00 64.52 3a0h h PRO 77 Cb 1.17 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3a0h h PRO 77 CO 0.58 0.78 -0.16 1.05 -0.23 0.00 0.00 178.00 180.01 3a0h h GLU 78 N 0.09 -0.43 -6.09 0.86 9.09 -1.96 -3.41 114.58 112.73 3a0h h GLU 78 Ca -0.02 0.03 -0.79 0.00 0.05 0.00 0.00 59.36 58.63 3a0h h GLU 78 Cb 1.24 0.10 0.02 0.00 -1.65 0.00 0.00 28.75 28.45 3a0h h GLU 78 CO 0.10 -0.27 0.70 1.17 0.05 0.00 0.00 179.01 180.76 3a0h n LYS 79 N -5.07 0.62 -1.73 1.06 4.81 -1.26 -4.74 118.16 111.86 3a0h n LYS 79 Ca -0.06 0.23 -0.62 0.00 -0.87 0.00 0.00 58.31 56.99 3a0h n LYS 79 Cb 0.18 -1.82 -0.08 0.00 0.02 0.00 0.00 35.03 33.33 3a0h n LYS 79 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 3a0h n PRO 80 N 4.20 0.69 -0.31 1.64 -0.02 -1.26 -4.80 135.00 135.14 3a0h n PRO 80 Ca 0.27 0.25 0.30 0.00 -2.02 0.00 0.00 63.50 62.30 3a0h n PRO 80 Cb 0.06 -1.86 0.54 0.00 -0.02 0.00 0.00 33.50 32.22 3a0h n PRO 80 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 3a0h n MET 81 N 4.81 -0.05 0.21 -0.52 0.00 -1.26 0.14 117.12 120.45 3a0h n MET 81 Ca 0.28 1.19 0.13 0.00 -0.00 0.00 0.00 57.70 59.31 3a0h n MET 81 Cb 0.05 -2.19 0.28 0.00 0.00 0.00 0.00 33.22 31.36 3a0h n MET 81 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 175.97 176.07 3a0h h TYR 82 N 0.00 0.00 0.00 1.12 -0.00 -1.79 -3.06 116.97 113.24 3a0h h TYR 82 Ca 0.76 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.49 3a0h h TYR 82 Cb 2.11 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.84 3a0h h TYR 82 CO -0.01 0.00 0.00 0.93 -0.00 0.00 0.00 178.16 179.08 3a0h h GLU 83 N 0.00 0.00 -2.92 0.10 5.08 0.83 -3.36 114.58 114.31 3a0h h GLU 83 Ca 0.00 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.70 3a0h h GLU 83 Cb 0.88 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 29.75 3a0h h GLU 83 CO 0.00 0.00 -0.29 1.04 -1.00 0.00 0.00 179.01 178.76 3a0h n GLN 84 N -2.49 2.53 -1.17 2.33 6.02 -1.16 -4.95 117.38 118.50 3a0h n GLN 84 Ca 0.04 -4.54 0.00 0.00 -0.01 0.00 0.00 57.00 52.48 3a0h n GLN 84 Cb 0.37 -2.34 0.00 0.00 1.02 0.00 0.00 30.24 29.29 3a0h n GLN 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3a0h n GLY 85 N 1.73 0.00 3.27 1.08 0.00 -1.26 -4.79 105.19 105.22 3a0h n GLY 85 Ca 0.24 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.82 3a0h n GLY 85 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3a0h s LEU 86 N -1.55 6.06 -0.20 0.99 1.43 -1.24 -4.85 118.68 119.32 3a0h s LEU 86 Ca 0.00 -2.03 -0.19 0.00 -1.03 0.00 0.00 54.13 50.88 3a0h s LEU 86 Cb 0.00 -2.12 -0.16 0.00 0.03 0.00 0.00 46.19 43.93 3a0h s LEU 86 CO 0.00 -0.73 0.12 2.30 0.23 0.00 0.00 176.35 178.26 3a0h n ILE 87 N 4.84 1.52 0.19 -0.59 -5.35 -1.26 -4.31 119.36 114.39 3a0h n ILE 87 Ca -0.06 -0.02 -0.14 0.00 -0.27 0.00 0.00 62.75 62.26 3a0h n ILE 87 Cb 0.41 -2.08 -0.08 0.00 -1.74 0.00 0.00 39.64 36.15 3a0h n ILE 87 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 3a0h h LEU 88 N -1.00 -0.39 -0.90 7.28 7.12 -1.93 -3.33 115.31 122.16 3a0h h LEU 88 Ca -0.33 -0.10 0.13 0.00 0.13 0.00 0.00 57.88 57.70 3a0h h LEU 88 Cb 1.22 0.10 -0.09 0.00 -0.53 0.00 0.00 40.66 41.37 3a0h h LEU 88 CO -0.20 -0.12 0.52 0.40 -0.13 0.00 0.00 178.44 178.92 3a0h h ILE 89 N -0.66 0.84 -0.18 4.05 2.04 -1.93 -2.55 117.51 119.12 3a0h h ILE 89 Ca -0.05 -0.28 0.05 0.00 1.00 0.00 0.00 64.86 65.59 3a0h h ILE 89 Cb 0.47 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 3a0h h ILE 89 CO 0.08 0.15 0.27 1.55 0.00 0.00 0.00 178.15 180.20 3a0h h PRO 90 N 0.80 0.00 -0.09 2.37 0.13 -1.75 -1.72 132.00 131.74 3a0h h PRO 90 Ca 0.46 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.40 3a0h h PRO 90 Cb 0.53 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.66 3a0h h PRO 90 CO -0.30 0.00 -0.74 0.45 -0.23 0.00 0.00 178.00 177.18 3a0h h HIS 91 N 0.00 0.63 -0.12 1.56 3.86 -1.64 -1.46 115.15 117.98 3a0h h HIS 91 Ca 0.09 -0.28 -0.01 0.00 -1.16 0.00 0.00 60.37 59.01 3a0h h HIS 91 Cb 0.63 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.00 3a0h h HIS 91 CO 0.00 1.05 0.04 0.82 0.86 0.00 0.00 177.93 180.70 3a0h h ILE 92 N 0.32 1.16 -0.27 2.45 5.03 -1.45 -2.84 117.51 121.91 3a0h h ILE 92 Ca -0.03 -0.48 0.05 0.00 -0.12 0.00 0.00 64.86 64.28 3a0h h ILE 92 Cb 1.32 1.26 -0.05 0.00 -3.03 0.00 0.00 36.82 36.32 3a0h h ILE 92 CO 0.13 0.14 -0.05 0.00 -0.68 0.00 0.00 178.15 177.69 3a0h h ALA 93 N 0.88 0.19 0.00 1.87 0.00 -1.47 0.13 119.26 120.86 3a0h h ALA 93 Ca 0.04 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3a0h h ALA 93 Cb 0.18 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3a0h h ALA 93 CO -0.00 -0.46 0.19 1.79 0.00 0.00 0.00 179.25 180.77 3a0h h THR 94 N 0.02 0.00 -0.10 0.00 1.35 -1.03 0.26 112.91 113.41 3a0h h THR 94 Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.99 3a0h h THR 94 Cb 0.19 0.54 0.00 0.00 -1.73 0.00 0.00 68.15 67.15 3a0h h THR 94 CO -0.27 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.18 3a0h n LEU 95 N -2.47 2.31 0.00 3.87 4.77 0.02 -2.28 117.00 123.23 3a0h n LEU 95 Ca -0.02 -0.84 0.00 0.00 -0.03 0.00 0.00 56.01 55.12 3a0h n LEU 95 Cb 0.23 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 3a0h n LEU 95 CO 0.11 0.42 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 3a0h n GLY 96 N 1.27 0.12 3.74 -0.72 0.00 0.93 -4.04 105.19 106.50 3a0h n GLY 96 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3a0h n GLY 96 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3a0h s TRP 97 N -2.00 3.81 -1.44 1.61 0.51 -1.16 -4.22 118.94 116.05 3a0h s TRP 97 Ca 0.00 1.72 -0.11 0.00 -2.12 0.00 0.00 56.10 55.59 3a0h s TRP 97 Cb 0.00 -2.98 0.07 0.00 -0.81 0.00 0.00 33.47 29.76 3a0h s TRP 97 CO 0.00 0.26 0.71 0.41 -0.51 0.00 0.00 176.95 177.82 3a0h n GLY 98 N 2.19 -0.49 0.44 0.98 0.00 -1.26 -3.86 105.19 103.18 3a0h n GLY 98 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3a0h n GLY 98 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3a0h n VAL 99 N -4.33 0.00 -4.54 1.61 0.31 -1.26 -3.31 118.33 106.81 3a0h n VAL 99 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3a0h n VAL 99 Cb 0.54 -0.28 0.00 0.00 -0.91 0.00 0.00 33.84 33.20 3a0h n VAL 99 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3a0h n GLY 100 N 2.31 0.33 2.10 2.92 0.00 -1.26 -4.08 105.19 107.51 3a0h n GLY 100 Ca 0.00 -0.85 -0.32 0.00 0.00 0.00 0.00 46.02 44.84 3a0h n GLY 100 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3a0h n PRO 101 N 0.00 0.00 -0.06 1.61 -0.02 -1.26 -3.95 135.00 131.31 3a0h n PRO 101 Ca 0.00 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.49 3a0h n PRO 101 Cb 0.00 -0.76 -0.00 0.00 -0.02 0.00 0.00 33.50 32.72 3a0h n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3a0h n GLY 102 N 1.07 -0.45 0.62 -1.23 0.00 -0.92 -2.90 105.19 101.38 3a0h n GLY 102 Ca 0.12 -0.44 0.04 0.00 0.00 0.00 0.00 46.02 45.73 3a0h n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a0h n GLY 103 N -0.21 0.72 3.77 -0.02 0.00 -1.26 -4.51 105.19 103.68 3a0h n GLY 103 Ca 0.00 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 3a0h n GLY 103 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3a0h s GLU 104 N -1.64 4.04 -0.26 1.61 2.12 -1.14 -4.96 118.70 118.46 3a0h s GLU 104 Ca 0.18 2.42 -0.12 0.00 0.36 0.00 0.00 54.97 57.81 3a0h s GLU 104 Cb 0.11 -2.89 -0.05 0.00 0.26 0.00 0.00 34.13 31.56 3a0h s GLU 104 CO 0.10 -0.53 0.24 0.14 -0.54 0.00 0.00 175.26 174.66 3a0h s VAL 105 N -1.16 5.29 -0.17 3.70 -7.23 -1.26 -4.15 120.40 115.41 3a0h s VAL 105 Ca 0.54 0.30 0.10 0.00 -1.81 0.00 0.00 61.98 61.11 3a0h s VAL 105 Cb -0.44 -3.57 -0.17 0.00 0.56 0.00 0.00 36.38 32.76 3a0h s VAL 105 CO 0.58 0.26 -0.03 1.33 -0.31 0.00 0.00 175.10 176.93 3a0h n VAL 106 N 4.80 1.11 -3.72 1.32 0.24 -1.21 -4.89 118.33 115.98 3a0h n VAL 106 Ca -0.13 -0.59 -0.37 0.00 -2.04 0.00 0.00 64.34 61.21 3a0h n VAL 106 Cb 0.52 -0.80 -0.10 0.00 -1.47 0.00 0.00 33.84 31.99 3a0h n VAL 106 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 3a0h s ASP 107 N -5.29 5.34 0.37 -1.34 1.01 -1.26 -4.90 116.67 110.59 3a0h s ASP 107 Ca -0.14 -2.30 0.27 0.00 0.71 0.00 0.00 52.55 51.09 3a0h s ASP 107 Cb 0.05 -1.87 1.23 0.00 1.01 0.00 0.00 42.92 43.34 3a0h s ASP 107 CO 0.59 -0.51 1.82 0.00 0.21 0.00 0.00 175.17 177.28 3a0h h THR 108 N 5.95 0.00 0.32 -1.27 1.03 -1.90 -3.28 112.91 113.76 3a0h h THR 108 Ca -0.10 -0.23 -0.02 0.00 -0.01 0.00 0.00 66.41 66.05 3a0h h THR 108 Cb 1.02 1.00 0.00 0.00 -1.07 0.00 0.00 68.15 69.10 3a0h h THR 108 CO 0.73 0.00 -0.15 0.15 -0.01 0.00 0.00 175.52 176.23 3a0h h PHE 109 N 0.00 -0.40 -0.95 0.00 3.57 -1.98 -3.22 116.94 113.96 3a0h h PHE 109 Ca 0.00 -0.01 0.28 0.00 3.53 0.00 0.00 57.97 61.77 3a0h h PHE 109 Cb 0.30 0.13 -0.18 0.00 2.79 0.00 0.00 35.95 38.99 3a0h h PHE 109 CO 0.00 -0.25 0.08 -2.30 -2.23 0.00 0.00 178.31 173.61 3a0h n PRO 110 N -3.31 -0.07 0.39 6.41 -0.02 -1.24 -0.58 135.00 136.58 3a0h n PRO 110 Ca -0.05 1.41 -0.19 0.00 -2.02 0.00 0.00 63.50 62.65 3a0h n PRO 110 Cb 0.17 -2.27 -0.09 0.00 -0.02 0.00 0.00 33.50 31.28 3a0h n PRO 110 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 3a0h h PHE 111 N 0.00 -1.11 -0.74 6.00 -1.00 -1.76 -2.64 116.94 115.69 3a0h h PHE 111 Ca 0.60 -0.01 0.15 0.00 2.81 0.00 0.00 57.97 61.52 3a0h h PHE 111 Cb 1.30 0.39 -0.14 0.00 3.61 0.00 0.00 35.95 41.11 3a0h h PHE 111 CO -0.43 -0.64 -0.13 0.35 -1.61 0.00 0.00 178.31 175.85 3a0h h PHE 112 N -1.06 -0.28 -0.39 -0.55 3.57 -0.85 -2.07 116.94 115.30 3a0h h PHE 112 Ca -0.09 0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.51 3a0h h PHE 112 Cb 0.85 0.24 -0.06 0.00 2.79 0.00 0.00 35.95 39.77 3a0h h PHE 112 CO -0.09 -0.29 -0.37 0.28 -2.23 0.00 0.00 178.31 175.61 3a0h h VAL 113 N 0.03 0.00 -0.98 1.41 2.07 -0.77 -1.79 116.25 116.22 3a0h h VAL 113 Ca 0.37 0.00 0.16 0.00 0.82 0.00 0.00 66.70 68.05 3a0h h VAL 113 Cb 0.60 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.28 3a0h h VAL 113 CO -0.73 0.00 0.61 0.58 0.02 0.00 0.00 177.57 178.06 3a0h h VAL 114 N -0.18 0.79 0.06 2.57 2.07 -1.12 -1.26 116.25 119.19 3a0h h VAL 114 Ca 0.07 -0.27 -0.25 0.00 0.82 0.00 0.00 66.70 67.06 3a0h h VAL 114 Cb 0.35 -0.06 0.02 0.00 -1.52 0.00 0.00 31.29 30.08 3a0h h VAL 114 CO -0.46 0.14 -1.03 1.23 0.02 0.00 0.00 177.57 177.47 3a0h h GLY 115 N 0.79 0.67 0.46 2.17 0.00 -1.45 -2.44 103.07 103.27 3a0h h GLY 115 Ca 0.52 -1.28 0.09 0.00 0.00 0.00 0.00 47.33 46.66 3a0h h GLY 115 CO -0.29 1.13 0.29 -2.08 0.00 0.00 0.00 176.54 175.59 3a0h h VAL 116 N 0.20 0.83 0.36 4.60 2.07 -0.78 0.13 116.25 123.66 3a0h h VAL 116 Ca -0.15 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 3a0h h VAL 116 Cb 1.71 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 3a0h h VAL 116 CO 0.20 0.09 -0.17 1.62 0.02 0.00 0.00 177.57 179.33 3a0h h VAL 117 N 0.51 0.62 0.24 2.57 3.04 -1.30 -2.42 116.25 119.51 3a0h h VAL 117 Ca 0.32 -0.48 0.01 0.00 -1.01 0.00 0.00 66.70 65.53 3a0h h VAL 117 Cb 0.35 0.85 -0.04 0.00 -2.01 0.00 0.00 31.29 30.44 3a0h h VAL 117 CO -0.27 0.09 -0.42 0.45 -1.01 0.00 0.00 177.57 176.40 3a0h h HIS 118 N -0.77 -1.17 -0.28 3.17 3.86 -1.19 1.40 115.15 120.15 3a0h h HIS 118 Ca -0.05 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.21 3a0h h HIS 118 Cb 0.52 0.48 -0.04 0.00 1.06 0.00 0.00 27.41 29.43 3a0h h HIS 118 CO 0.01 -0.54 -0.25 1.25 0.86 0.00 0.00 177.93 179.26 3a0h h LEU 119 N -0.74 -0.86 -0.58 2.43 5.85 -0.81 0.92 115.31 121.54 3a0h h LEU 119 Ca -0.00 0.12 0.10 0.00 0.84 0.00 0.00 57.88 58.93 3a0h h LEU 119 Cb 0.71 0.36 -0.07 0.00 0.37 0.00 0.00 40.66 42.03 3a0h h LEU 119 CO -0.17 -0.14 0.18 0.40 -0.34 0.00 0.00 178.44 178.36 3a0h h ILE 120 N -0.10 0.73 -1.09 4.05 2.04 -1.20 0.16 117.51 122.10 3a0h h ILE 120 Ca 0.05 -0.12 0.30 0.00 1.00 0.00 0.00 64.86 66.09 3a0h h ILE 120 Cb 0.22 0.37 -0.08 0.00 -0.74 0.00 0.00 36.82 36.59 3a0h h ILE 120 CO -0.32 0.06 0.74 -1.28 0.00 0.00 0.00 178.15 177.35 3a0h h SER 121 N 0.34 0.27 -0.83 1.72 0.87 0.85 -0.80 113.55 115.97 3a0h h SER 121 Ca 0.29 0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.88 3a0h h SER 121 Cb 0.39 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.32 3a0h h SER 121 CO -0.33 0.04 0.43 0.77 -0.53 0.00 0.00 176.83 177.21 3a0h h SER 122 N 0.23 1.07 -0.29 6.23 4.64 0.34 -3.12 113.55 122.65 3a0h h SER 122 Ca 0.59 -0.11 0.04 0.00 -0.47 0.00 0.00 61.79 61.84 3a0h h SER 122 Cb 1.81 -0.27 -0.08 0.00 -0.31 0.00 0.00 62.40 63.55 3a0h h SER 122 CO -0.19 0.88 -0.54 0.00 -0.87 0.00 0.00 176.83 176.11 3a0h h ALA 123 N 1.29 -0.80 -0.93 5.18 0.00 -1.17 0.77 119.26 123.60 3a0h h ALA 123 Ca 0.29 -0.02 0.19 0.00 0.00 0.00 0.00 54.91 55.37 3a0h h ALA 123 Cb 0.07 1.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.80 3a0h h ALA 123 CO -0.04 -1.05 0.51 -0.39 0.00 0.00 0.00 179.25 178.27 3a0h h VAL 124 N -0.47 0.64 -0.54 0.00 -1.51 -1.68 4.94 116.25 117.62 3a0h h VAL 124 Ca 0.06 -0.21 -0.08 0.00 -1.23 0.00 0.00 66.70 65.24 3a0h h VAL 124 Cb 0.63 -0.03 -0.02 0.00 -2.13 0.00 0.00 31.29 29.74 3a0h h VAL 124 CO -0.52 0.11 0.04 -0.07 -1.23 0.00 0.00 177.57 175.90 3a0h h LEU 125 N 0.62 0.91 0.20 4.19 3.38 -0.83 -2.55 115.31 121.23 3a0h h LEU 125 Ca 0.55 -0.29 -0.33 0.00 0.09 0.00 0.00 57.88 57.89 3a0h h LEU 125 Cb 0.90 -0.24 0.02 0.00 0.09 0.00 0.00 40.66 41.42 3a0h h LEU 125 CO -0.42 0.97 -1.61 1.23 0.09 0.00 0.00 178.44 178.70 3a0h h GLY 126 N 0.82 0.48 0.05 0.83 0.00 0.38 -2.58 103.07 103.05 3a0h h GLY 126 Ca 0.16 -1.23 0.27 0.00 0.00 0.00 0.00 47.33 46.53 3a0h h GLY 126 CO 0.02 1.08 0.68 -2.75 0.00 0.00 0.00 176.54 175.57 3a0h h PHE 127 N 0.06 0.19 0.07 5.60 -0.00 0.96 0.18 116.94 124.00 3a0h h PHE 127 Ca -0.31 0.01 -0.35 0.00 -0.00 0.00 0.00 57.97 57.32 3a0h h PHE 127 Cb 2.07 -0.06 -0.03 0.00 -0.00 0.00 0.00 35.95 37.93 3a0h h PHE 127 CO 0.12 0.03 -1.96 0.41 -0.00 0.00 0.00 178.31 176.91 3a0h n GLY 128 N -1.66 -0.58 0.26 2.40 0.00 -0.96 -3.53 105.19 101.12 3a0h n GLY 128 Ca 0.21 -0.17 -0.04 0.00 0.00 0.00 0.00 46.02 46.02 3a0h n GLY 128 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3a0h h GLY 129 N 0.65 0.93 0.91 -0.02 0.00 -1.05 -0.52 103.07 103.96 3a0h h GLY 129 Ca -0.45 -0.31 0.14 0.00 0.00 0.00 0.00 47.33 46.70 3a0h h GLY 129 CO -0.04 0.27 0.41 -0.24 0.00 0.00 0.00 176.54 176.95 3a0h h VAL 130 N 0.81 0.79 0.00 4.60 3.04 -0.82 -2.83 116.25 121.84 3a0h h VAL 130 Ca 0.26 -0.07 0.00 0.00 -1.01 0.00 0.00 66.70 65.87 3a0h h VAL 130 Cb -0.00 0.56 0.00 0.00 -2.01 0.00 0.00 31.29 29.84 3a0h h VAL 130 CO -0.09 0.04 0.00 0.00 -1.01 0.00 0.00 177.57 176.50 3a0h n TYR 131 N -4.43 0.00 0.03 3.17 9.36 -0.38 -4.00 117.16 120.91 3a0h n TYR 131 Ca 0.11 0.00 0.08 0.00 3.32 0.00 0.00 57.90 61.41 3a0h n TYR 131 Cb 0.52 -0.44 0.12 0.00 -0.63 0.00 0.00 39.34 38.91 3a0h n TYR 131 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 3a0h n HIS 132 N -1.82 0.00 0.05 2.98 8.25 -0.35 0.11 115.22 124.45 3a0h n HIS 132 Ca 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.53 3a0h n HIS 132 Cb 0.00 -0.07 -0.06 0.00 1.12 0.00 0.00 29.99 30.98 3a0h n HIS 132 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3a0h n ALA 133 N -1.44 2.37 -0.00 -1.41 0.00 -1.08 -3.69 120.51 115.26 3a0h n ALA 133 Ca 0.07 -0.42 -0.00 0.00 0.00 0.00 0.00 53.44 53.09 3a0h n ALA 133 Cb 0.70 -0.96 -0.00 0.00 0.00 0.00 0.00 19.45 19.19 3a0h n ALA 133 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3a0h n ILE 134 N -2.66 0.02 0.94 0.00 5.41 0.30 -4.74 119.36 118.64 3a0h n ILE 134 Ca -0.05 -0.01 0.10 0.00 1.00 0.00 0.00 62.75 63.80 3a0h n ILE 134 Cb 0.66 -0.94 -0.01 0.00 -0.71 0.00 0.00 39.64 38.64 3a0h n ILE 134 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 3a0h n ARG 135 N -2.73 1.29 -0.25 0.38 5.12 -1.12 -4.97 116.66 114.39 3a0h n ARG 135 Ca -0.01 -0.94 0.00 0.00 -1.93 0.00 0.00 57.85 54.97 3a0h n ARG 135 Cb 0.51 -1.44 0.00 0.00 -1.16 0.00 0.00 32.46 30.37 3a0h n ARG 135 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3a0h n GLY 136 N 1.37 1.25 3.60 -0.13 0.00 -1.26 -4.96 105.19 105.06 3a0h n GLY 136 Ca 0.09 -1.97 -0.43 0.00 0.00 0.00 0.00 46.02 43.71 3a0h n GLY 136 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3a0h s PRO 137 N 0.82 3.21 0.00 1.61 0.04 -1.26 -4.75 135.00 134.68 3a0h s PRO 137 Ca 0.00 1.97 0.07 0.00 0.04 0.00 0.00 61.00 63.09 3a0h s PRO 137 Cb 0.00 -4.34 0.39 0.00 0.04 0.00 0.00 34.50 30.60 3a0h s PRO 137 CO 0.00 -2.01 1.04 -1.91 0.04 0.00 0.00 177.00 174.16 3a0h n GLU 138 N 8.64 0.14 -3.29 4.56 2.13 -1.26 -4.02 120.64 127.54 3a0h n GLU 138 Ca 0.28 0.16 -0.06 0.00 0.66 0.00 0.00 57.16 58.20 3a0h n GLU 138 Cb 0.45 -1.50 -0.06 0.00 0.27 0.00 0.00 31.44 30.60 3a0h n GLU 138 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 3a0h s THR 139 N -2.41 -0.70 -2.50 6.31 -1.32 -1.26 -3.73 115.64 110.03 3a0h s THR 139 Ca 0.08 -0.13 0.23 0.00 -1.21 0.00 0.00 61.69 60.66 3a0h s THR 139 Cb 0.05 -0.91 0.42 0.00 -1.51 0.00 0.00 72.50 70.54 3a0h s THR 139 CO 0.10 -0.15 1.49 -0.11 -2.21 0.00 0.00 174.62 173.75 3a0h n LEU 140 N 5.37 2.38 -0.13 9.08 0.00 -1.26 -3.74 117.00 128.71 3a0h n LEU 140 Ca -0.01 -0.94 -0.11 0.00 0.00 0.00 0.00 56.01 54.95 3a0h n LEU 140 Cb 0.50 -0.11 -0.02 0.00 0.00 0.00 0.00 43.42 43.79 3a0h n LEU 140 CO 0.02 0.47 0.73 -0.08 0.00 0.00 0.00 177.39 178.53 3a0h h GLU 141 N 3.32 0.73 0.03 1.96 4.81 -1.82 -1.43 114.58 122.18 3a0h h GLU 141 Ca 0.00 -0.27 -0.00 0.00 -0.13 0.00 0.00 59.36 58.96 3a0h h GLU 141 Cb 0.72 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.05 3a0h h GLU 141 CO 0.00 0.86 -0.02 1.05 -0.73 0.00 0.00 179.01 180.18 3a0h h GLU 142 N 0.54 -0.04 0.00 1.92 -0.00 -1.91 -2.88 114.58 112.21 3a0h h GLU 142 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.46 3a0h h GLU 142 Cb 0.58 0.01 0.00 0.00 -0.00 0.00 0.00 28.75 29.34 3a0h h GLU 142 CO 0.03 0.63 0.07 -0.92 -0.00 0.00 0.00 179.01 178.83 3a0h h TYR 143 N -0.82 0.00 0.00 2.06 5.03 -1.66 -3.39 116.97 118.19 3a0h h TYR 143 Ca -0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 3a0h h TYR 143 Cb 0.69 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.97 3a0h h TYR 143 CO 0.17 0.00 0.00 0.45 -1.32 0.00 0.00 178.16 177.46 3a0h n SER 144 N -2.33 0.00 0.00 -2.11 2.88 -0.54 -4.36 113.62 107.17 3a0h n SER 144 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 3a0h n SER 144 Cb 0.11 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.57 3a0h n SER 144 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3a0h n SER 145 N 0.00 0.00 -3.99 -3.46 3.41 -1.26 -3.56 113.62 104.75 3a0h n SER 145 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.50 3a0h n SER 145 Cb 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 3a0h n SER 145 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 3a0h n PHE 146 N 0.00 0.14 0.00 7.33 -1.74 -1.26 -4.08 117.46 117.85 3a0h n PHE 146 Ca 0.00 -0.12 0.00 0.00 -0.56 0.00 0.00 57.45 56.77 3a0h n PHE 146 Cb 0.00 -0.84 0.00 0.00 1.52 0.00 0.00 39.48 40.16 3a0h n PHE 146 CO 0.00 0.00 0.00 1.19 -0.56 0.00 0.00 176.76 177.39 3a0h n PHE 147 N 7.45 0.00 -4.17 2.97 0.99 -1.26 -4.87 117.46 118.57 3a0h n PHE 147 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.61 3a0h n PHE 147 Cb 0.39 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.87 3a0h n PHE 147 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3a0h n GLY 148 N 0.00 -0.47 2.97 1.37 0.00 -1.23 -4.95 105.19 102.88 3a0h n GLY 148 Ca 0.00 -1.10 -0.16 0.00 0.00 0.00 0.00 46.02 44.76 3a0h n GLY 148 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3a0h s TYR 149 N 0.00 0.52 0.00 1.61 5.04 -1.25 -5.03 117.35 118.24 3a0h s TYR 149 Ca 0.00 -0.11 0.00 0.00 -2.44 0.00 0.00 57.07 54.52 3a0h s TYR 149 Cb 0.00 -0.33 0.00 0.00 0.35 0.00 0.00 41.96 41.98 3a0h s TYR 149 CO 0.00 -0.01 0.00 -3.47 -1.34 0.00 0.00 175.55 170.73 3a0h n ASP 150 N 2.90 0.00 0.13 4.32 -0.08 -1.26 -4.62 116.55 117.94 3a0h n ASP 150 Ca -0.13 0.00 -0.07 0.00 -1.51 0.00 0.00 54.79 53.07 3a0h n ASP 150 Cb 0.58 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 44.00 3a0h n ASP 150 CO 0.00 0.00 0.00 -0.50 0.12 0.00 0.00 177.20 176.82 3a0h h TRP 151 N 0.00 -0.38 -1.58 -0.67 4.06 -1.97 -3.22 115.95 112.19 3a0h h TRP 151 Ca 0.00 -0.01 0.46 0.00 2.06 0.00 0.00 58.89 61.40 3a0h h TRP 151 Cb 0.00 0.12 -0.07 0.00 -1.00 0.00 0.00 29.16 28.21 3a0h h TRP 151 CO 0.00 -0.17 1.13 -0.22 -3.56 0.00 0.00 178.44 175.62 3a0h h LYS 152 N -1.08 0.02 -5.21 0.49 3.11 -1.95 -3.35 116.57 108.61 3a0h h LYS 152 Ca -0.04 -0.00 -0.09 0.00 -2.81 0.00 0.00 60.65 57.71 3a0h h LYS 152 Cb 0.37 -0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.57 3a0h h LYS 152 CO 0.07 0.01 0.57 -3.47 -2.81 0.00 0.00 179.45 173.82 3a0h n ASP 153 N -4.13 0.73 0.25 4.20 -0.08 -1.22 -4.73 116.55 111.58 3a0h n ASP 153 Ca 0.36 -1.37 0.16 0.00 -1.51 0.00 0.00 54.79 52.43 3a0h n ASP 153 Cb 1.63 -1.34 0.71 0.00 2.34 0.00 0.00 41.12 44.46 3a0h n ASP 153 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 3a0h h LYS 154 N 11.97 0.00 0.00 -0.67 3.64 -1.89 -2.87 116.57 126.75 3a0h h LYS 154 Ca 0.01 0.00 -0.38 0.00 -1.27 0.00 0.00 60.65 59.01 3a0h h LYS 154 Cb 1.03 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.78 3a0h h LYS 154 CO 1.16 0.00 -2.41 0.09 -2.27 0.00 0.00 179.45 176.02 3a0h n ASN 155 N -3.08 1.08 0.14 4.20 5.03 -1.26 -3.23 115.26 118.15 3a0h n ASN 155 Ca 0.02 -0.06 0.15 0.00 0.87 0.00 0.00 54.58 55.56 3a0h n ASN 155 Cb 0.54 0.21 0.71 0.00 -1.02 0.00 0.00 39.78 40.23 3a0h n ASN 155 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 3a0h h LYS 156 N 0.00 0.00 0.18 3.52 1.63 -1.85 0.21 116.57 120.26 3a0h h LYS 156 Ca -0.56 0.00 -0.34 0.00 -0.85 0.00 0.00 60.65 58.91 3a0h h LYS 156 Cb 2.06 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 33.70 3a0h h LYS 156 CO -0.03 0.00 -1.65 0.52 -3.45 0.00 0.00 179.45 174.84 3a0h h MET 157 N 0.00 0.38 -0.54 1.90 2.86 -1.71 -1.67 114.93 116.15 3a0h h MET 157 Ca 0.12 -0.64 -0.05 0.00 -2.06 0.00 0.00 59.70 57.07 3a0h h MET 157 Cb 0.53 0.24 -0.02 0.00 0.06 0.00 0.00 31.60 32.40 3a0h h MET 157 CO -0.00 1.28 0.13 0.00 1.06 0.00 0.00 176.91 179.38 3a0h h THR 158 N 0.10 1.24 -0.36 2.22 1.03 -1.24 -2.60 112.91 113.30 3a0h h THR 158 Ca -0.30 -0.86 -0.11 0.00 -0.01 0.00 0.00 66.41 65.12 3a0h h THR 158 Cb 2.09 0.78 -0.01 0.00 -1.07 0.00 0.00 68.15 69.94 3a0h h THR 158 CO 0.19 0.32 -0.21 0.74 -0.01 0.00 0.00 175.52 176.54 3a0h h THR 159 N 0.75 1.28 0.30 0.00 2.02 -0.72 -2.54 112.91 114.01 3a0h h THR 159 Ca 0.17 -1.35 -0.01 0.00 0.77 0.00 0.00 66.41 65.98 3a0h h THR 159 Cb 0.33 1.37 -0.00 0.00 -1.74 0.00 0.00 68.15 68.11 3a0h h THR 159 CO 0.00 0.45 -0.17 0.40 0.37 0.00 0.00 175.52 176.56 3a0h h ILE 160 N 0.58 0.00 -1.16 3.11 5.03 -1.19 -1.53 117.51 122.34 3a0h h ILE 160 Ca 0.08 0.00 0.34 0.00 -0.12 0.00 0.00 64.86 65.15 3a0h h ILE 160 Cb 0.77 0.00 -0.10 0.00 -3.03 0.00 0.00 36.82 34.46 3a0h h ILE 160 CO 0.06 0.00 0.76 0.25 -0.68 0.00 0.00 178.15 178.54 3a0h h LEU 161 N -0.44 0.33 -0.85 1.44 6.46 -1.59 1.19 115.31 121.85 3a0h h LEU 161 Ca -0.04 0.10 0.16 0.00 -0.12 0.00 0.00 57.88 57.98 3a0h h LEU 161 Cb 0.35 0.05 -0.10 0.00 -0.73 0.00 0.00 40.66 40.23 3a0h h LEU 161 CO 0.05 -0.02 0.42 1.23 -0.62 0.00 0.00 178.44 179.49 3a0h h GLY 162 N 0.24 1.40 0.81 3.75 0.00 -0.86 -0.10 103.07 108.31 3a0h h GLY 162 Ca 0.68 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.76 3a0h h GLY 162 CO -0.32 -0.09 -0.26 0.74 0.00 0.00 0.00 176.54 176.60 3a0h h PHE 163 N 0.56 -0.68 0.00 5.60 0.04 0.23 -2.48 116.94 120.20 3a0h h PHE 163 Ca 0.48 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.23 3a0h h PHE 163 Cb 0.75 0.23 0.00 0.00 2.20 0.00 0.00 35.95 39.12 3a0h h PHE 163 CO -0.11 -0.36 0.01 0.72 -0.60 0.00 0.00 178.31 177.98 3a0h n HIS 164 N -5.33 0.00 -0.01 -0.55 8.25 -0.66 -0.86 115.22 116.06 3a0h n HIS 164 Ca -0.12 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.13 3a0h n HIS 164 Cb 0.33 -0.24 -0.13 0.00 1.12 0.00 0.00 29.99 31.07 3a0h n HIS 164 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3a0h h LEU 165 N 0.00 0.34 -0.80 2.41 3.38 -0.58 -2.91 115.31 117.14 3a0h h LEU 165 Ca 0.00 -0.84 -0.05 0.00 0.09 0.00 0.00 57.88 57.08 3a0h h LEU 165 Cb 0.02 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 3a0h h LEU 165 CO 0.00 1.72 0.31 0.40 0.09 0.00 0.00 178.44 180.97 3a0h h ILE 166 N -0.24 1.26 -0.46 1.22 1.08 -0.85 -3.10 117.51 116.42 3a0h h ILE 166 Ca -0.37 -0.84 0.08 0.00 -0.39 0.00 0.00 64.86 63.34 3a0h h ILE 166 Cb 1.82 0.31 -0.10 0.00 -3.07 0.00 0.00 36.82 35.79 3a0h h ILE 166 CO 0.03 0.34 -0.35 0.58 -0.69 0.00 0.00 178.15 178.06 3a0h h VAL 167 N 1.17 0.19 0.38 1.67 2.07 -1.24 -0.86 116.25 119.62 3a0h h VAL 167 Ca 0.27 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.77 3a0h h VAL 167 Cb 0.23 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 3a0h h VAL 167 CO -0.02 0.00 -0.18 -0.07 0.02 0.00 0.00 177.57 177.32 3a0h h LEU 168 N -0.24 -0.43 -1.57 2.57 4.07 -1.44 -2.88 115.31 115.38 3a0h h LEU 168 Ca 0.18 0.01 0.35 0.00 0.08 0.00 0.00 57.88 58.51 3a0h h LEU 168 Cb 0.55 0.11 -0.05 0.00 1.08 0.00 0.00 40.66 42.35 3a0h h LEU 168 CO -0.59 -0.24 1.12 1.23 -1.08 0.00 0.00 178.44 178.87 3a0h h GLY 169 N -0.63 0.00 -0.47 0.83 0.00 -1.53 -0.26 103.07 101.01 3a0h h GLY 169 Ca -0.05 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.32 3a0h h GLY 169 CO 0.09 0.00 -0.40 -2.22 0.00 0.00 0.00 176.54 174.01 3a0h h ILE 170 N 0.00 0.00 0.00 2.60 2.04 -0.92 -0.90 117.51 120.33 3a0h h ILE 170 Ca 0.58 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.44 3a0h h ILE 170 Cb 2.80 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.88 3a0h h ILE 170 CO -0.01 0.00 -0.09 0.61 0.00 0.00 0.00 178.15 178.67 3a0h n GLY 171 N -1.22 -1.66 0.45 5.37 0.00 -0.13 -3.00 105.19 105.00 3a0h n GLY 171 Ca -0.01 -0.06 0.30 0.00 0.00 0.00 0.00 46.02 46.26 3a0h n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a0h h ALA 172 N 2.54 2.55 0.21 4.61 0.00 -0.99 3.24 119.26 131.43 3a0h h ALA 172 Ca 0.00 0.07 -0.28 0.00 0.00 0.00 0.00 54.91 54.70 3a0h h ALA 172 Cb 0.73 0.11 0.03 0.00 0.00 0.00 0.00 17.79 18.66 3a0h h ALA 172 CO 0.00 -1.04 -1.23 -0.07 0.00 0.00 0.00 179.25 176.90 3a0h h LEU 173 N 0.22 0.70 -0.91 0.00 3.38 -1.49 -2.74 115.31 114.47 3a0h h LEU 173 Ca 0.69 -0.93 0.26 0.00 0.09 0.00 0.00 57.88 57.98 3a0h h LEU 173 Cb 2.05 -0.23 -0.15 0.00 0.09 0.00 0.00 40.66 42.42 3a0h h LEU 173 CO -0.31 1.59 0.24 0.25 0.09 0.00 0.00 178.44 180.30 3a0h h LEU 174 N -0.06 -0.03 -0.03 1.67 5.85 0.55 0.73 115.31 123.99 3a0h h LEU 174 Ca -0.22 0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 3a0h h LEU 174 Cb 1.96 0.30 -0.00 0.00 0.37 0.00 0.00 40.66 43.29 3a0h h LEU 174 CO 0.22 -0.21 -0.06 0.25 -0.34 0.00 0.00 178.44 178.31 3a0h h LEU 175 N 0.16 0.11 -1.38 2.25 6.46 0.84 -2.08 115.31 121.67 3a0h h LEU 175 Ca 0.59 -0.55 0.26 0.00 -0.12 0.00 0.00 57.88 58.06 3a0h h LEU 175 Cb 1.25 -0.03 -0.09 0.00 -0.73 0.00 0.00 40.66 41.06 3a0h h LEU 175 CO -0.71 0.64 0.67 0.58 -0.62 0.00 0.00 178.44 179.00 3a0h h VAL 176 N -0.42 0.54 0.47 1.05 2.07 0.19 1.00 116.25 121.15 3a0h h VAL 176 Ca 0.00 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 3a0h h VAL 176 Cb 0.62 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 3a0h h VAL 176 CO 0.01 0.07 -0.23 0.00 0.02 0.00 0.00 177.57 177.45 3a0h h ALA 177 N 1.62 -0.63 -0.89 1.67 0.00 0.34 1.86 119.26 123.22 3a0h h ALA 177 Ca 0.58 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 55.42 3a0h h ALA 177 Cb 1.48 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 19.45 3a0h h ALA 177 CO -0.28 -0.70 0.58 -0.22 0.00 0.00 0.00 179.25 178.62 3a0h h LYS 178 N -0.93 0.79 -0.27 0.00 3.11 -0.36 5.36 116.57 124.26 3a0h h LYS 178 Ca -0.06 -0.05 -0.18 0.00 -2.81 0.00 0.00 60.65 57.54 3a0h h LYS 178 Cb 0.59 -0.18 0.00 0.00 -1.00 0.00 0.00 32.23 31.64 3a0h h LYS 178 CO 0.11 0.52 -0.56 0.00 -2.81 0.00 0.00 179.45 176.71 3a0h h ALA 179 N 1.57 0.49 0.00 5.00 0.00 0.13 0.97 119.26 127.43 3a0h h ALA 179 Ca 0.43 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3a0h h ALA 179 Cb 0.53 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 3a0h h ALA 179 CO -0.19 0.68 -1.35 -1.33 0.00 0.00 0.00 179.25 177.06 3a0h n MET 180 N -3.99 0.48 0.00 0.00 2.81 0.63 -0.39 117.12 116.66 3a0h n MET 180 Ca -0.04 -0.06 0.00 0.00 -1.81 0.00 0.00 57.70 55.79 3a0h n MET 180 Cb 0.63 -1.18 0.00 0.00 -0.71 0.00 0.00 33.22 31.97 3a0h n MET 180 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 3a0h n PHE 181 N -1.81 0.00 -0.01 2.03 3.72 1.73 -4.90 117.46 118.23 3a0h n PHE 181 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 3a0h n PHE 181 Cb 0.24 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.77 3a0h n PHE 181 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 3a0h n PHE 182 N -0.46 0.00 0.00 1.38 0.99 -0.25 -4.94 117.46 114.17 3a0h n PHE 182 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 3a0h n PHE 182 Cb 0.03 -0.08 0.00 0.00 -1.00 0.00 0.00 39.48 38.43 3a0h n PHE 182 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3a0h n GLY 183 N 2.56 0.02 0.00 1.37 0.00 -1.11 -5.03 105.19 102.99 3a0h n GLY 183 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3a0h n GLY 183 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a0h n GLY 184 N 0.00 -1.52 2.63 -0.02 0.00 0.33 -4.38 105.19 102.24 3a0h n GLY 184 Ca 0.00 -2.07 -0.19 0.00 0.00 0.00 0.00 46.02 43.76 3a0h n GLY 184 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3a0h n LEU 185 N 0.00 0.00 -4.76 0.99 4.77 0.15 -4.00 117.00 114.15 3a0h n LEU 185 Ca 0.00 -2.47 -0.37 0.00 -0.03 0.00 0.00 56.01 53.14 3a0h n LEU 185 Cb 0.00 0.87 -0.07 0.00 -2.33 0.00 0.00 43.42 41.90 3a0h n LEU 185 CO 0.00 -0.38 0.04 -0.47 -1.33 0.00 0.00 177.39 175.25 3a0h s TYR 186 N -2.79 3.53 -0.22 -1.77 5.04 -0.97 0.29 117.35 120.46 3a0h s TYR 186 Ca 0.18 0.73 -0.01 0.00 -2.44 0.00 0.00 57.07 55.53 3a0h s TYR 186 Cb 0.01 -2.36 0.06 0.00 0.35 0.00 0.00 41.96 40.03 3a0h s TYR 186 CO 0.13 0.33 0.01 0.34 -1.34 0.00 0.00 175.55 175.02 3a0h s ASP 187 N 0.12 3.35 0.35 4.32 3.68 -1.15 -4.93 116.67 122.41 3a0h s ASP 187 Ca 0.20 -1.03 0.07 0.00 2.13 0.00 0.00 52.55 53.93 3a0h s ASP 187 Cb -0.14 -0.83 0.67 0.00 -1.45 0.00 0.00 42.92 41.16 3a0h s ASP 187 CO 0.07 -0.29 1.86 0.71 0.13 0.00 0.00 175.17 177.65 3a0h h THR 188 N 6.57 1.21 -0.14 1.71 1.35 -1.87 -2.73 112.91 119.01 3a0h h THR 188 Ca -0.16 -0.93 -0.13 0.00 -0.55 0.00 0.00 66.41 64.64 3a0h h THR 188 Cb 1.09 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 3a0h h THR 188 CO 0.38 0.29 -0.41 -0.50 -0.25 0.00 0.00 175.52 175.03 3a0h h TRP 189 N 0.30 0.68 -0.05 4.73 4.06 -1.90 -3.15 115.95 120.63 3a0h h TRP 189 Ca 0.06 -0.27 -0.04 0.00 2.06 0.00 0.00 58.89 60.70 3a0h h TRP 189 Cb 0.45 -0.12 0.00 0.00 -1.00 0.00 0.00 29.16 28.49 3a0h h TRP 189 CO 0.01 1.02 0.02 0.00 -3.56 0.00 0.00 178.44 175.93 3a0h n ALA 190 N -2.52 -0.33 0.00 1.49 0.00 -1.05 -4.72 120.51 113.38 3a0h n ALA 190 Ca -0.07 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3a0h n ALA 190 Cb 0.54 -0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.90 3a0h n ALA 190 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3a0h n PRO 191 N 0.14 0.00 0.00 0.00 -0.02 -1.26 -2.11 135.00 131.75 3a0h n PRO 191 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 3a0h n PRO 191 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 3a0h n PRO 191 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3a0h n GLY 192 N 0.00 0.00 0.00 -1.23 0.00 -1.26 -4.80 105.19 97.90 3a0h n GLY 192 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3a0h n GLY 192 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a0h n GLY 193 N -0.84 -1.51 3.28 -0.02 0.00 -0.90 -5.10 105.19 100.11 3a0h n GLY 193 Ca 0.00 -1.08 -0.51 0.00 0.00 0.00 0.00 46.02 44.43 3a0h n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a0h n GLY 194 N -0.22 -0.98 0.00 -0.02 0.00 -1.19 -4.66 105.19 98.12 3a0h n GLY 194 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.54 3a0h n GLY 194 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3a0h n ASP 195 N 1.67 0.00 -4.69 1.61 4.64 -1.09 -2.16 116.55 116.53 3a0h n ASP 195 Ca 0.18 0.00 -0.52 0.00 -1.38 0.00 0.00 54.79 53.07 3a0h n ASP 195 Cb 0.16 0.00 -0.06 0.00 -1.04 0.00 0.00 41.12 40.18 3a0h n ASP 195 CO 0.00 0.00 0.00 0.55 -0.82 0.00 0.00 177.20 176.93 3a0h n VAL 196 N -0.04 0.45 -4.09 5.18 3.14 -1.25 -2.94 118.33 118.77 3a0h n VAL 196 Ca 0.00 -0.08 -0.12 0.00 -2.96 0.00 0.00 64.34 61.18 3a0h n VAL 196 Cb 0.00 -1.60 -0.11 0.00 -1.06 0.00 0.00 33.84 31.07 3a0h n VAL 196 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 3a0h s ARG 197 N 3.73 0.62 -0.19 1.45 3.52 0.14 -4.94 118.95 123.28 3a0h s ARG 197 Ca 0.94 -0.95 -0.12 0.00 -0.13 0.00 0.00 55.73 55.47 3a0h s ARG 197 Cb -0.84 -0.23 -0.05 0.00 -1.56 0.00 0.00 34.95 32.28 3a0h s ARG 197 CO 0.56 0.02 0.21 0.14 -0.81 0.00 0.00 175.30 175.43 3a0h s VAL 198 N -2.19 5.35 -0.51 7.11 -7.23 -1.26 0.30 120.40 121.96 3a0h s VAL 198 Ca -0.03 0.35 -0.28 0.00 -1.81 0.00 0.00 61.98 60.22 3a0h s VAL 198 Cb -0.04 -3.55 -0.00 0.00 0.56 0.00 0.00 36.38 33.34 3a0h s VAL 198 CO -0.02 0.39 1.62 -0.63 -0.31 0.00 0.00 175.10 176.15 3a0h s ILE 199 N 0.60 3.61 -0.06 -0.62 1.09 0.48 -4.85 121.20 121.45 3a0h s ILE 199 Ca 0.12 0.53 -0.01 0.00 -1.10 0.00 0.00 60.65 60.19 3a0h s ILE 199 Cb -0.12 -4.11 -0.00 0.00 -1.06 0.00 0.00 42.46 37.16 3a0h s ILE 199 CO 0.02 -0.89 0.05 0.71 -0.10 0.00 0.00 174.94 174.72 3a0h h THR 200 N 6.61 0.00 -3.55 2.92 1.35 -1.94 -3.38 112.91 114.92 3a0h h THR 200 Ca -0.28 -0.65 -0.73 0.00 -0.55 0.00 0.00 66.41 64.19 3a0h h THR 200 Cb 1.13 0.00 -0.32 0.00 -1.73 0.00 0.00 68.15 67.23 3a0h h THR 200 CO 1.15 0.00 -0.07 0.21 -0.25 0.00 0.00 175.52 176.56 3a0h s ASN 201 N -4.67 6.08 1.43 5.36 3.84 -1.26 -5.05 114.94 120.68 3a0h s ASN 201 Ca -0.00 -3.17 -0.23 0.00 0.21 0.00 0.00 52.86 49.67 3a0h s ASN 201 Cb 0.00 -2.00 0.37 0.00 -0.55 0.00 0.00 41.25 39.07 3a0h s ASN 201 CO 0.01 -0.35 0.92 -2.84 -2.79 0.00 0.00 177.10 172.05 3a0h s PRO 202 N -0.55 -3.02 -0.05 0.43 0.02 -1.26 -4.86 135.00 125.72 3a0h s PRO 202 Ca 0.22 0.19 -0.20 0.00 0.02 0.00 0.00 61.00 61.23 3a0h s PRO 202 Cb -0.13 -1.36 -0.05 0.00 0.02 0.00 0.00 34.50 32.98 3a0h s PRO 202 CO -0.08 -4.94 0.55 0.99 -0.33 0.00 0.00 177.00 173.19 3a0h s THR 203 N -2.22 5.04 0.00 0.99 2.01 -0.38 -4.92 115.64 116.15 3a0h s THR 203 Ca 0.68 1.13 0.00 0.00 0.31 0.00 0.00 61.69 63.81 3a0h s THR 203 Cb -0.14 -3.88 0.00 0.00 0.01 0.00 0.00 72.50 68.49 3a0h s THR 203 CO 0.58 0.38 0.00 -0.11 -0.69 0.00 0.00 174.62 174.78 3a0h n LEU 204 N 3.11 0.95 0.00 4.42 0.00 -1.26 -4.71 117.00 119.51 3a0h n LEU 204 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.94 3a0h n LEU 204 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.93 3a0h n LEU 204 CO 0.43 0.00 0.00 0.47 0.00 0.00 0.00 177.39 178.29 3a0h n ASP 205 N -0.39 0.00 0.20 1.96 8.00 -1.26 -4.82 116.55 120.24 3a0h n ASP 205 Ca 0.00 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.57 3a0h n ASP 205 Cb 0.00 0.00 0.36 0.00 -0.02 0.00 0.00 41.12 41.46 3a0h n ASP 205 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 3a0h h PRO 206 N 0.00 0.00 -0.42 -0.24 0.13 -1.99 -3.14 132.00 126.34 3a0h h PRO 206 Ca 0.00 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 65.20 3a0h h PRO 206 Cb 0.00 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.07 3a0h h PRO 206 CO 0.00 0.33 0.08 0.00 -0.23 0.00 0.00 178.00 178.18 3a0h h ARG 207 N 0.00 0.20 0.00 0.86 2.47 -1.97 0.42 114.38 116.36 3a0h h ARG 207 Ca -0.00 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 3a0h h ARG 207 Cb 0.87 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 29.14 3a0h h ARG 207 CO 0.04 0.13 0.00 0.28 0.56 0.00 0.00 179.97 180.99 3a0h n VAL 208 N -5.11 0.00 -0.32 2.04 0.31 -1.19 0.17 118.33 114.23 3a0h n VAL 208 Ca 0.03 0.93 0.22 0.00 -0.01 0.00 0.00 64.34 65.51 3a0h n VAL 208 Cb 0.19 -1.78 0.43 0.00 -0.91 0.00 0.00 33.84 31.78 3a0h n VAL 208 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 3a0h h ILE 209 N 0.00 0.21 0.13 2.52 2.04 -1.60 -0.11 117.51 120.69 3a0h h ILE 209 Ca 0.00 -0.07 -0.25 0.00 1.00 0.00 0.00 64.86 65.55 3a0h h ILE 209 Cb 0.00 -0.00 0.01 0.00 -0.74 0.00 0.00 36.82 36.08 3a0h h ILE 209 CO 0.00 0.04 -1.21 -0.26 0.00 0.00 0.00 178.15 176.72 3a0h h PHE 210 N 0.19 0.48 -1.71 1.37 -1.00 -1.01 -3.37 116.94 111.90 3a0h h PHE 210 Ca 0.70 -0.35 0.50 0.00 2.81 0.00 0.00 57.97 61.63 3a0h h PHE 210 Cb 1.61 -0.02 -0.08 0.00 3.61 0.00 0.00 35.95 41.07 3a0h h PHE 210 CO -0.13 1.47 1.22 0.41 -1.61 0.00 0.00 178.31 179.67 3a0h n GLY 211 N 1.71 -0.87 0.25 -1.45 0.00 0.44 -0.58 105.19 104.69 3a0h n GLY 211 Ca -0.21 0.62 -0.04 0.00 0.00 0.00 0.00 46.02 46.40 3a0h n GLY 211 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3a0h h TYR 212 N 0.00 0.70 -0.70 1.61 0.05 -1.70 -2.13 116.97 114.79 3a0h h TYR 212 Ca 0.83 0.02 0.12 0.00 0.05 0.00 0.00 58.73 59.75 3a0h h TYR 212 Cb 3.28 -0.22 -0.08 0.00 1.01 0.00 0.00 36.73 40.71 3a0h h TYR 212 CO -0.00 0.38 0.29 -0.07 -1.05 0.00 0.00 178.16 177.71 3a0h h LEU 213 N 0.72 0.30 0.00 3.88 4.07 -0.99 0.45 115.31 123.74 3a0h h LEU 213 Ca 0.26 0.09 0.00 0.00 0.08 0.00 0.00 57.88 58.31 3a0h h LEU 213 Cb 0.07 0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.86 3a0h h LEU 213 CO -0.12 0.15 0.00 0.18 -1.08 0.00 0.00 178.44 177.57 3a0h n LEU 214 N -4.97 0.00 -4.80 1.67 7.99 -0.85 -4.84 117.00 111.20 3a0h n LEU 214 Ca 0.12 0.30 -0.34 0.00 -0.01 0.00 0.00 56.01 56.08 3a0h n LEU 214 Cb 0.34 -0.30 -0.03 0.00 -0.11 0.00 0.00 43.42 43.33 3a0h n LEU 214 CO 0.21 -0.10 0.71 -0.54 -1.51 0.00 0.00 177.39 176.16 3a0h s LYS 215 N -2.59 3.73 0.53 3.23 1.02 0.16 -4.98 119.74 120.83 3a0h s LYS 215 Ca 0.18 1.30 -0.15 0.00 0.02 0.00 0.00 55.97 57.32 3a0h s LYS 215 Cb 0.13 -2.09 -0.13 0.00 -0.52 0.00 0.00 37.83 35.23 3a0h s LYS 215 CO 0.31 -0.48 -0.24 0.43 -0.92 0.00 0.00 175.35 174.44 3a0h n SER 216 N -1.21 -3.62 -0.09 2.83 7.64 -1.25 -4.06 113.62 113.86 3a0h n SER 216 Ca 0.09 0.47 -0.09 0.00 1.01 0.00 0.00 58.87 60.35 3a0h n SER 216 Cb 0.53 -0.71 -0.15 0.00 -1.01 0.00 0.00 64.21 62.86 3a0h n SER 216 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3a0h n PRO 217 N 1.49 0.87 -2.00 1.43 -0.04 -1.19 -1.14 135.00 134.42 3a0h n PRO 217 Ca 0.05 -0.02 -0.29 0.00 -0.04 0.00 0.00 63.50 63.20 3a0h n PRO 217 Cb 0.42 -1.49 0.20 0.00 -0.04 0.00 0.00 33.50 32.59 3a0h n PRO 217 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3a0h s PHE 218 N -2.50 1.34 -0.09 0.54 0.08 -1.25 -4.43 117.98 111.67 3a0h s PHE 218 Ca -0.09 0.18 -0.39 0.00 0.12 0.00 0.00 56.93 56.75 3a0h s PHE 218 Cb 0.06 -4.12 -0.17 0.00 -0.57 0.00 0.00 43.02 38.22 3a0h s PHE 218 CO 0.78 -2.72 1.50 0.41 -0.10 0.00 0.00 175.22 175.10 3a0h n GLY 219 N -3.76 0.57 0.00 4.36 0.00 -1.26 -1.79 105.19 103.31 3a0h n GLY 219 Ca 0.17 0.81 0.00 0.00 0.00 0.00 0.00 46.02 47.00 3a0h n GLY 219 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a0h n GLY 220 N 3.21 1.59 3.15 -0.02 0.00 -1.26 -4.99 105.19 106.87 3a0h n GLY 220 Ca 0.22 -0.48 0.04 0.00 0.00 0.00 0.00 46.02 45.81 3a0h n GLY 220 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3a0h s GLU 221 N 0.00 0.52 -0.02 1.61 2.02 -0.74 -5.09 118.70 117.00 3a0h s GLU 221 Ca 0.00 0.43 -0.22 0.00 0.02 0.00 0.00 54.97 55.20 3a0h s GLU 221 Cb 0.00 0.21 -0.05 0.00 0.10 0.00 0.00 34.13 34.39 3a0h s GLU 221 CO 0.00 -0.94 0.64 0.20 0.02 0.00 0.00 175.26 175.17 3a0h s GLY 222 N 2.77 2.62 0.27 -1.39 0.00 -1.25 -3.19 107.32 107.14 3a0h s GLY 222 Ca 0.13 0.07 -0.01 0.00 0.00 0.00 0.00 44.72 44.92 3a0h s GLY 222 CO -0.24 0.90 1.78 0.11 0.00 0.00 0.00 173.10 175.66 3a0h h TRP 223 N 5.99 0.87 0.00 1.90 0.09 -1.27 -2.61 115.95 120.91 3a0h h TRP 223 Ca -0.44 0.03 -0.01 0.00 0.09 0.00 0.00 58.89 58.56 3a0h h TRP 223 Cb 1.20 -0.25 -0.00 0.00 0.08 0.00 0.00 29.16 30.18 3a0h h TRP 223 CO 0.65 0.26 -0.71 -0.89 0.09 0.00 0.00 178.44 177.83 3a0h n ILE 224 N -4.80 1.45 -0.34 0.12 2.08 -1.26 -4.09 119.36 112.51 3a0h n ILE 224 Ca 0.17 0.18 0.03 0.00 0.56 0.00 0.00 62.75 63.69 3a0h n ILE 224 Cb 0.41 -2.36 0.10 0.00 -0.75 0.00 0.00 39.64 37.03 3a0h n ILE 224 CO 0.00 0.00 0.00 -0.37 0.56 0.00 0.00 176.55 176.74 3a0h h VAL 225 N -1.00 0.04 -1.52 1.39 -1.51 -1.94 -3.40 116.25 108.31 3a0h h VAL 225 Ca -0.02 0.00 -0.51 0.00 -1.23 0.00 0.00 66.70 64.94 3a0h h VAL 225 Cb 0.70 0.04 -0.00 0.00 -2.13 0.00 0.00 31.29 29.90 3a0h h VAL 225 CO -0.01 0.00 1.60 -0.24 -1.23 0.00 0.00 177.57 177.69 3a0h n SER 226 N -5.56 2.36 -3.31 4.19 2.88 -0.98 -4.87 113.62 108.33 3a0h n SER 226 Ca 0.13 -0.22 -0.10 0.00 -1.33 0.00 0.00 58.87 57.35 3a0h n SER 226 Cb 0.45 -1.50 -0.06 0.00 -0.75 0.00 0.00 64.21 62.35 3a0h n SER 226 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3a0h s VAL 227 N 10.69 -0.60 0.13 2.46 1.01 -1.26 -4.98 120.40 127.86 3a0h s VAL 227 Ca 1.03 -0.45 -0.23 0.00 0.00 0.00 0.00 61.98 62.33 3a0h s VAL 227 Cb -0.35 -0.79 -0.02 0.00 0.00 0.00 0.00 36.38 35.22 3a0h s VAL 227 CO 0.32 -0.33 1.66 0.78 0.00 0.00 0.00 175.10 177.52 3a0h h ASN 228 N 7.73 -0.55 -5.02 3.32 4.21 -1.99 -3.43 115.58 119.84 3a0h h ASN 228 Ca -0.03 0.10 -0.64 0.00 1.21 0.00 0.00 56.30 56.93 3a0h h ASN 228 Cb 1.11 0.25 -0.13 0.00 -1.12 0.00 0.00 38.32 38.44 3a0h h ASN 228 CO 0.23 -0.23 -0.48 -0.46 -1.29 0.00 0.00 177.43 175.19 3a0h n ASN 229 N -5.32 2.65 0.03 5.81 2.04 -1.26 -4.83 115.26 114.39 3a0h n ASN 229 Ca -0.03 -3.25 -0.09 0.00 -0.44 0.00 0.00 54.58 50.77 3a0h n ASN 229 Cb 0.24 0.61 -0.13 0.00 -2.53 0.00 0.00 39.78 37.97 3a0h n ASN 229 CO 0.00 0.00 0.00 -0.07 -0.44 0.00 0.00 177.26 176.75 3a0h h LEU 230 N 0.00 0.05 -1.71 -4.53 3.38 -1.96 -3.29 115.31 107.25 3a0h h LEU 230 Ca -0.39 -0.07 0.26 0.00 0.09 0.00 0.00 57.88 57.77 3a0h h LEU 230 Cb 1.28 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.95 3a0h h LEU 230 CO 0.64 1.06 0.68 -0.33 0.09 0.00 0.00 178.44 180.58 3a0h h GLU 231 N 0.01 0.20 0.00 1.13 4.39 -1.97 0.40 114.58 118.74 3a0h h GLU 231 Ca -0.14 -0.01 -0.17 0.00 0.34 0.00 0.00 59.36 59.38 3a0h h GLU 231 Cb 1.89 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 30.46 3a0h h GLU 231 CO 0.12 0.13 -1.43 -0.25 -1.16 0.00 0.00 179.01 176.41 3a0h n ASP 232 N -4.41 0.85 0.00 1.42 8.00 -1.25 -1.25 116.55 119.91 3a0h n ASP 232 Ca 0.22 0.38 0.00 0.00 0.71 0.00 0.00 54.79 56.10 3a0h n ASP 232 Cb 0.93 0.16 0.00 0.00 -0.02 0.00 0.00 41.12 42.19 3a0h n ASP 232 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 3a0h n VAL 233 N -2.89 0.00 -0.33 2.53 0.31 0.12 -0.04 118.33 118.03 3a0h n VAL 233 Ca -0.10 0.55 0.13 0.00 -0.01 0.00 0.00 64.34 64.91 3a0h n VAL 233 Cb 0.85 -1.12 0.35 0.00 -0.91 0.00 0.00 33.84 33.01 3a0h n VAL 233 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 3a0h h VAL 234 N 0.00 0.74 -0.91 2.52 3.04 -1.31 0.65 116.25 120.99 3a0h h VAL 234 Ca 0.00 -0.25 0.04 0.00 -1.01 0.00 0.00 66.70 65.48 3a0h h VAL 234 Cb 0.00 -0.06 -0.05 0.00 -2.01 0.00 0.00 31.29 29.17 3a0h h VAL 234 CO 0.00 0.13 0.60 1.23 -1.01 0.00 0.00 177.57 178.52 3a0h h GLY 235 N 0.73 1.30 1.04 3.17 0.00 -1.55 -1.82 103.07 105.95 3a0h h GLY 235 Ca 0.54 -0.45 -0.25 0.00 0.00 0.00 0.00 47.33 47.17 3a0h h GLY 235 CO -0.32 0.38 -1.04 -1.33 0.00 0.00 0.00 176.54 174.23 3a0h h GLY 236 N 1.13 0.59 0.06 4.60 0.00 0.37 -3.29 103.07 106.54 3a0h h GLY 236 Ca 0.36 -1.24 0.12 0.00 0.00 0.00 0.00 47.33 46.58 3a0h h GLY 236 CO -0.11 1.09 0.07 0.45 0.00 0.00 0.00 176.54 178.04 3a0h h HIS 237 N 0.07 0.09 -0.15 5.60 3.86 0.41 -1.05 115.15 123.98 3a0h h HIS 237 Ca -0.16 0.04 0.02 0.00 -1.16 0.00 0.00 60.37 59.11 3a0h h HIS 237 Cb 1.75 0.05 -0.03 0.00 1.06 0.00 0.00 27.41 30.25 3a0h h HIS 237 CO 0.14 -0.10 -0.20 0.82 0.86 0.00 0.00 177.93 179.45 3a0h h ILE 238 N 0.19 0.00 -1.57 2.45 2.04 -1.42 1.01 117.51 120.21 3a0h h ILE 238 Ca 0.32 0.00 0.46 0.00 1.00 0.00 0.00 64.86 66.64 3a0h h ILE 238 Cb 0.51 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.52 3a0h h ILE 238 CO -0.46 0.00 1.14 -0.50 0.00 0.00 0.00 178.15 178.33 3a0h h TRP 239 N -0.13 0.00 0.13 1.37 4.06 -1.31 0.28 115.95 120.35 3a0h h TRP 239 Ca 0.03 0.00 -0.30 0.00 2.06 0.00 0.00 58.89 60.68 3a0h h TRP 239 Cb 0.21 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.37 3a0h h TRP 239 CO -0.66 0.00 -1.45 0.97 -3.56 0.00 0.00 178.44 173.74 3a0h h ILE 240 N 0.00 1.26 0.16 1.49 -0.00 0.20 -2.53 117.51 118.09 3a0h h ILE 240 Ca 0.75 -2.86 0.01 0.00 -0.00 0.00 0.00 64.86 62.76 3a0h h ILE 240 Cb 3.02 2.83 -0.03 0.00 -0.00 0.00 0.00 36.82 42.65 3a0h h ILE 240 CO -0.01 0.84 -0.27 1.23 -0.00 0.00 0.00 178.15 179.94 3a0h h GLY 241 N 1.55 -0.54 0.86 8.18 0.00 0.34 0.69 103.07 114.14 3a0h h GLY 241 Ca -0.21 0.32 -0.01 0.00 0.00 0.00 0.00 47.33 47.42 3a0h h GLY 241 CO 0.18 -0.23 0.05 1.41 0.00 0.00 0.00 176.54 177.95 3a0h h LEU 242 N -0.51 0.25 -0.93 3.11 4.07 -1.64 0.31 115.31 119.96 3a0h h LEU 242 Ca 0.02 -0.21 0.07 0.00 0.08 0.00 0.00 57.88 57.84 3a0h h LEU 242 Cb 0.52 -0.06 -0.07 0.00 1.08 0.00 0.00 40.66 42.13 3a0h h LEU 242 CO -0.13 0.39 0.59 0.40 -1.08 0.00 0.00 178.44 178.61 3a0h h ILE 243 N 0.09 1.05 -0.04 1.22 2.04 -1.20 0.19 117.51 120.86 3a0h h ILE 243 Ca 0.05 -0.36 -0.25 0.00 1.00 0.00 0.00 64.86 65.30 3a0h h ILE 243 Cb 0.23 -0.10 0.02 0.00 -0.74 0.00 0.00 36.82 36.22 3a0h h ILE 243 CO -0.00 0.19 -0.95 0.00 0.00 0.00 0.00 178.15 177.39 3a0h h ILE 245 N 0.42 1.26 0.00 0.00 2.04 0.18 -1.93 117.51 119.48 3a0h h ILE 245 Ca -0.10 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 64.88 3a0h h ILE 245 Cb 1.60 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 38.17 3a0h h ILE 245 CO 0.19 0.34 0.03 0.00 0.00 0.00 0.00 178.15 178.71 3a0h h ALA 246 N 1.10 1.02 0.11 1.87 0.00 -0.68 -0.23 119.26 122.46 3a0h h ALA 246 Ca 0.23 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.79 3a0h h ALA 246 Cb 0.30 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3a0h h ALA 246 CO -0.01 -0.02 -1.91 0.41 0.00 0.00 0.00 179.25 177.72 3a0h n GLY 247 N -1.28 -0.59 0.21 0.00 0.00 -0.74 -2.61 105.19 100.18 3a0h n GLY 247 Ca -0.02 -0.24 -0.10 0.00 0.00 0.00 0.00 46.02 45.67 3a0h n GLY 247 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3a0h h GLY 248 N 0.84 0.71 0.76 -0.02 0.00 -1.09 0.88 103.07 105.15 3a0h h GLY 248 Ca -0.42 -0.48 0.06 0.00 0.00 0.00 0.00 47.33 46.49 3a0h h GLY 248 CO 0.05 0.45 0.61 -2.22 0.00 0.00 0.00 176.54 175.42 3a0h h ILE 249 N 0.51 1.09 0.15 2.60 5.03 -1.24 -2.10 117.51 123.54 3a0h h ILE 249 Ca 0.12 -0.38 -0.01 0.00 -0.12 0.00 0.00 64.86 64.47 3a0h h ILE 249 Cb 0.38 -0.13 0.00 0.00 -3.03 0.00 0.00 36.82 34.05 3a0h h ILE 249 CO 0.01 0.20 -0.07 -0.25 -0.68 0.00 0.00 178.15 177.36 3a0h h TRP 250 N 1.11 -0.18 -0.71 1.37 2.91 -1.12 -3.22 115.95 116.12 3a0h h TRP 250 Ca 0.40 -0.00 0.09 0.00 1.13 0.00 0.00 58.89 60.51 3a0h h TRP 250 Cb 0.14 0.06 -0.05 0.00 -0.51 0.00 0.00 29.16 28.80 3a0h h TRP 250 CO -0.01 -0.11 0.47 0.45 -1.03 0.00 0.00 178.44 178.20 3a0h h HIS 251 N -0.26 0.66 -0.78 2.65 3.86 -0.92 -1.17 115.15 119.19 3a0h h HIS 251 Ca -0.02 0.02 0.12 0.00 -1.16 0.00 0.00 60.37 59.32 3a0h h HIS 251 Cb 0.15 -0.22 -0.05 0.00 1.06 0.00 0.00 27.41 28.35 3a0h h HIS 251 CO 0.13 0.32 0.51 0.97 0.86 0.00 0.00 177.93 180.72 3a0h h ILE 252 N 0.63 0.89 0.00 2.45 2.10 -1.48 -2.55 117.51 119.55 3a0h h ILE 252 Ca 0.32 -0.21 -0.02 0.00 1.08 0.00 0.00 64.86 66.03 3a0h h ILE 252 Cb 0.43 0.22 -0.00 0.00 -1.09 0.00 0.00 36.82 36.37 3a0h h ILE 252 CO -0.11 0.11 -0.95 -0.07 -1.08 0.00 0.00 178.15 176.05 3a0h h LEU 253 N 0.61 0.00 -9.10 2.19 3.38 -1.22 -3.42 115.31 107.75 3a0h h LEU 253 Ca 0.37 0.00 -0.43 0.00 0.09 0.00 0.00 57.88 57.91 3a0h h LEU 253 Cb 0.60 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.21 3a0h h LEU 253 CO -0.14 0.06 -0.60 0.42 0.09 0.00 0.00 178.44 178.27 3a0h s THR 254 N -3.31 0.85 -0.14 0.22 -4.23 -0.96 -5.13 115.64 102.94 3a0h s THR 254 Ca -0.00 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.45 3a0h s THR 254 Cb 0.09 -2.68 -0.04 0.00 1.34 0.00 0.00 72.50 71.21 3a0h s THR 254 CO 0.78 0.00 0.07 -0.89 -0.54 0.00 0.00 174.62 174.05 3a0h s THR 255 N -3.49 4.93 0.38 3.99 2.01 -1.26 -4.77 115.64 117.42 3a0h s THR 255 Ca 0.36 0.00 -0.27 0.00 0.31 0.00 0.00 61.69 62.09 3a0h s THR 255 Cb 0.08 -3.16 -0.11 0.00 0.01 0.00 0.00 72.50 69.31 3a0h s THR 255 CO 0.15 0.55 1.37 -2.65 -0.69 0.00 0.00 174.62 173.35 3a0h n PRO 256 N 2.70 2.32 -0.62 4.92 -0.02 -1.26 -4.98 135.00 138.05 3a0h n PRO 256 Ca -0.18 0.81 -0.29 0.00 -2.02 0.00 0.00 63.50 61.83 3a0h n PRO 256 Cb 0.53 -2.49 0.25 0.00 -0.02 0.00 0.00 33.50 31.78 3a0h n PRO 256 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3a0h s PHE 257 N -1.13 1.03 -0.02 6.00 0.40 -1.26 -4.81 117.98 118.19 3a0h s PHE 257 Ca 0.56 0.98 0.30 0.00 -0.60 0.00 0.00 56.93 58.16 3a0h s PHE 257 Cb -0.51 -3.10 1.06 0.00 0.51 0.00 0.00 43.02 40.98 3a0h s PHE 257 CO 0.62 -4.01 1.87 0.78 0.70 0.00 0.00 175.22 175.18 3a0h h GLY 258 N -2.72 0.00 1.65 4.36 0.00 -2.00 -2.72 103.07 101.64 3a0h h GLY 258 Ca -0.57 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.76 3a0h h GLY 258 CO 0.47 0.00 -0.34 0.11 0.00 0.00 0.00 176.54 176.78 3a0h h TRP 259 N 0.00 0.00 0.32 5.60 5.08 -1.98 -2.59 115.95 122.39 3a0h h TRP 259 Ca -0.00 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.95 3a0h h TRP 259 Cb 0.67 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.83 3a0h h TRP 259 CO 0.00 0.00 -0.16 0.00 -1.28 0.00 0.00 178.44 177.00 3a0h h ALA 260 N 2.06 -0.44 -0.38 0.11 0.00 -1.86 -1.41 119.26 117.34 3a0h h ALA 260 Ca 0.00 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.80 3a0h h ALA 260 Cb 0.97 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.87 3a0h h ALA 260 CO 0.00 -0.47 0.01 0.00 0.00 0.00 0.00 179.25 178.79 3a0h h ARG 261 N -0.98 0.11 -0.68 0.00 3.08 -1.57 -1.77 114.38 112.56 3a0h h ARG 261 Ca -0.04 -0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.11 3a0h h ARG 261 Cb 0.50 -0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.44 3a0h h ARG 261 CO 0.07 0.07 0.26 -0.09 -1.07 0.00 0.00 179.97 179.22 3a0h h ARG 262 N 0.11 0.42 0.42 0.04 2.43 -1.50 -3.27 114.38 113.04 3a0h h ARG 262 Ca 0.19 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.31 3a0h h ARG 262 Cb 0.26 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 3a0h h ARG 262 CO -0.31 0.28 -0.20 0.00 -1.51 0.00 0.00 179.97 178.23 3a0h h ALA 263 N 1.48 -0.57 -3.19 2.80 0.00 -0.57 -3.47 119.26 115.74 3a0h h ALA 263 Ca 0.36 -0.16 -0.62 0.00 0.00 0.00 0.00 54.91 54.49 3a0h h ALA 263 Cb 0.49 0.22 -0.14 0.00 0.00 0.00 0.00 17.79 18.36 3a0h h ALA 263 CO -0.35 -0.56 -0.54 -0.06 0.00 0.00 0.00 179.25 177.74 3a0h s PHE 264 N -3.71 3.33 0.31 0.00 2.99 -0.73 -5.07 117.98 115.10 3a0h s PHE 264 Ca -0.10 0.21 -0.29 0.00 0.00 0.00 0.00 56.93 56.74 3a0h s PHE 264 Cb 0.01 -2.05 -0.10 0.00 0.00 0.00 0.00 43.02 40.87 3a0h s PHE 264 CO 0.33 0.30 1.43 -1.50 -0.00 0.00 0.00 175.22 175.78 3a0h s ILE 265 N 0.06 2.47 -0.24 0.64 2.07 -1.26 -4.79 121.20 120.15 3a0h s ILE 265 Ca 0.07 0.44 -0.03 0.00 -1.41 0.00 0.00 60.65 59.71 3a0h s ILE 265 Cb -0.12 -3.28 0.01 0.00 0.13 0.00 0.00 42.46 39.20 3a0h s ILE 265 CO 0.00 0.09 -0.05 0.26 -1.91 0.00 0.00 174.94 173.34 3a0h s TRP 266 N -0.62 3.01 -0.14 3.50 0.52 -1.26 -4.77 118.94 119.19 3a0h s TRP 266 Ca 0.55 -1.24 -0.29 0.00 0.02 0.00 0.00 56.10 55.14 3a0h s TRP 266 Cb -0.43 -2.09 0.08 0.00 -1.15 0.00 0.00 33.47 29.88 3a0h s TRP 266 CO 0.51 -0.64 0.76 0.45 0.02 0.00 0.00 176.95 178.06 3a0h s SER 267 N 1.41 -0.62 0.19 2.95 0.15 -1.26 -4.81 113.70 111.70 3a0h s SER 267 Ca 0.03 0.86 -0.21 0.00 0.70 0.00 0.00 55.95 57.33 3a0h s SER 267 Cb -0.15 0.76 0.12 0.00 -1.71 0.00 0.00 66.02 65.03 3a0h s SER 267 CO -0.04 -0.45 1.58 1.23 1.20 0.00 0.00 173.24 176.77 3a0h h GLY 268 N 3.51 -0.13 0.39 9.45 0.00 -1.95 0.46 103.07 114.81 3a0h h GLY 268 Ca -0.26 0.44 -0.01 0.00 0.00 0.00 0.00 47.33 47.50 3a0h h GLY 268 CO 0.27 -0.20 -0.48 -2.09 0.00 0.00 0.00 176.54 174.04 3a0h h GLU 269 N -0.16 -0.86 -1.33 4.80 4.81 -1.96 -1.89 114.58 117.98 3a0h h GLU 269 Ca 0.23 0.06 0.41 0.00 -0.13 0.00 0.00 59.36 59.93 3a0h h GLU 269 Cb 0.55 0.20 -0.11 0.00 0.63 0.00 0.00 28.75 30.02 3a0h h GLU 269 CO -0.68 -0.57 0.88 0.00 -0.73 0.00 0.00 179.01 177.90 3a0h h ALA 270 N -0.89 2.81 -0.57 2.92 0.00 -1.57 0.77 119.26 122.73 3a0h h ALA 270 Ca -0.05 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 3a0h h ALA 270 Cb 0.80 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 3a0h h ALA 270 CO -0.11 -1.37 -0.06 1.88 0.00 0.00 0.00 179.25 179.59 3a0h h TYR 271 N 0.12 1.17 -0.18 0.00 0.05 -0.12 -1.63 116.97 116.38 3a0h h TYR 271 Ca 0.78 -0.23 -0.03 0.00 0.05 0.00 0.00 58.73 59.30 3a0h h TYR 271 Cb 2.51 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 39.94 3a0h h TYR 271 CO -0.00 1.06 -0.01 1.25 -1.05 0.00 0.00 178.16 179.40 3a0h h LEU 272 N 0.95 0.33 -0.65 3.88 5.85 0.65 -2.73 115.31 123.59 3a0h h LEU 272 Ca 0.16 -0.33 0.06 0.00 0.84 0.00 0.00 57.88 58.61 3a0h h LEU 272 Cb 0.63 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.49 3a0h h LEU 272 CO 0.04 0.58 -0.48 -1.28 -0.34 0.00 0.00 178.44 176.96 3a0h h SER 273 N 0.07 -1.71 0.00 1.25 0.87 -0.39 0.61 113.55 114.24 3a0h h SER 273 Ca 0.05 0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.86 3a0h h SER 273 Cb 0.42 0.74 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 3a0h h SER 273 CO 0.01 -0.25 0.00 -1.22 -0.53 0.00 0.00 176.83 174.84 3a0h n TYR 274 N -4.90 0.00 0.00 2.24 4.01 -0.64 -3.27 117.16 114.60 3a0h n TYR 274 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3a0h n TYR 274 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 3a0h n TYR 274 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 3a0h n SER 275 N 0.00 0.00 -0.00 7.72 7.64 -1.03 0.19 113.62 128.14 3a0h n SER 275 Ca 0.00 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.89 3a0h n SER 275 Cb 0.00 0.00 0.34 0.00 -1.01 0.00 0.00 64.21 63.54 3a0h n SER 275 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 3a0h h LEU 276 N 0.00 0.48 -1.15 -3.43 6.46 0.25 -2.65 115.31 115.27 3a0h h LEU 276 Ca 0.00 -0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.70 3a0h h LEU 276 Cb 0.00 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 39.81 3a0h h LEU 276 CO 0.00 0.48 0.00 0.61 -0.62 0.00 0.00 178.44 178.91 3a0h n GLY 277 N -1.09 0.93 0.05 3.75 0.00 0.51 -2.28 105.19 107.05 3a0h n GLY 277 Ca 0.02 -0.19 0.01 0.00 0.00 0.00 0.00 46.02 45.86 3a0h n GLY 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a0h n ALA 278 N 0.07 2.16 0.03 4.61 0.00 -1.00 -3.94 120.51 122.44 3a0h n ALA 278 Ca 0.06 -0.79 -0.03 0.00 0.00 0.00 0.00 53.44 52.68 3a0h n ALA 278 Cb 0.32 -0.40 -0.01 0.00 0.00 0.00 0.00 19.45 19.36 3a0h n ALA 278 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3a0h h LEU 279 N 0.00 -0.15 -0.07 0.00 3.38 -1.55 -2.00 115.31 114.92 3a0h h LEU 279 Ca -0.23 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.75 3a0h h LEU 279 Cb 1.45 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.23 3a0h h LEU 279 CO 0.01 0.28 -0.04 -0.24 0.09 0.00 0.00 178.44 178.54 3a0h n SER 280 N -4.63 -0.08 -0.10 -0.43 2.88 -1.11 0.17 113.62 110.33 3a0h n SER 280 Ca -0.02 0.73 -0.11 0.00 -1.33 0.00 0.00 58.87 58.14 3a0h n SER 280 Cb 0.07 -0.32 -0.05 0.00 -0.75 0.00 0.00 64.21 63.16 3a0h n SER 280 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 3a0h h MET 281 N 0.00 -0.35 -0.75 -1.46 1.85 -1.70 -1.85 114.93 110.66 3a0h h MET 281 Ca 0.01 0.02 0.12 0.00 -0.61 0.00 0.00 59.70 59.24 3a0h h MET 281 Cb 0.03 0.08 -0.08 0.00 0.43 0.00 0.00 31.60 32.06 3a0h h MET 281 CO -0.07 -0.23 0.35 1.98 -0.40 0.00 0.00 176.91 178.54 3a0h h MET 282 N -0.37 0.54 -0.65 0.39 -1.53 0.14 -0.47 114.93 112.99 3a0h h MET 282 Ca 0.12 -0.03 -0.00 0.00 -3.44 0.00 0.00 59.70 56.35 3a0h h MET 282 Cb 0.59 -0.12 -0.03 0.00 -0.55 0.00 0.00 31.60 31.49 3a0h h MET 282 CO -0.53 0.36 0.40 0.78 0.14 0.00 0.00 176.91 178.05 3a0h h GLY 283 N 0.56 0.93 0.79 1.39 0.00 0.26 -0.39 103.07 106.60 3a0h h GLY 283 Ca 0.39 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.35 3a0h h GLY 283 CO -0.33 0.36 0.00 0.74 0.00 0.00 0.00 176.54 177.32 3a0h h PHE 284 N 0.89 0.02 0.00 5.60 0.04 -0.80 0.20 116.94 122.90 3a0h h PHE 284 Ca 0.23 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.00 3a0h h PHE 284 Cb -0.05 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.10 3a0h h PHE 284 CO 0.00 0.23 0.40 0.82 -0.60 0.00 0.00 178.31 179.16 3a0h h ILE 285 N -0.19 0.00 0.00 -0.55 2.04 0.39 0.72 117.51 119.92 3a0h h ILE 285 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3a0h h ILE 285 Cb 0.21 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 3a0h h ILE 285 CO -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 178.15 177.89 3a0h h ALA 286 N 1.19 0.00 -1.03 1.87 0.00 0.05 -3.08 119.26 118.25 3a0h h ALA 286 Ca 0.00 -0.35 0.36 0.00 0.00 0.00 0.00 54.91 54.92 3a0h h ALA 286 Cb 0.81 0.26 -0.15 0.00 0.00 0.00 0.00 17.79 18.71 3a0h h ALA 286 CO 0.00 0.26 0.59 1.15 0.00 0.00 0.00 179.25 181.25 3a0h h THR 287 N -0.59 0.20 0.00 0.00 2.02 0.58 3.36 112.91 118.48 3a0h h THR 287 Ca 0.00 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.11 3a0h h THR 287 Cb 0.26 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.64 3a0h h THR 287 CO 0.00 0.04 0.00 0.00 0.37 0.00 0.00 175.52 175.93 3a0h n PHE 289 N -2.62 0.59 0.50 0.00 -0.00 1.08 -3.86 117.46 113.14 3a0h n PHE 289 Ca 0.04 0.13 0.11 0.00 -0.00 0.00 0.00 57.45 57.73 3a0h n PHE 289 Cb 0.42 -1.08 0.44 0.00 -0.00 0.00 0.00 39.48 39.26 3a0h n PHE 289 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.76 178.31 3a0h n VAL 290 N -3.43 0.79 0.03 -2.13 3.14 0.13 -1.82 118.33 115.04 3a0h n VAL 290 Ca -0.40 0.16 0.05 0.00 -2.96 0.00 0.00 64.34 61.18 3a0h n VAL 290 Cb 1.00 -1.00 -0.09 0.00 -1.06 0.00 0.00 33.84 32.69 3a0h n VAL 290 CO 0.00 0.00 0.00 1.87 -6.46 0.00 0.00 176.83 172.24 3a0h n TRP 291 N -1.98 0.64 -0.05 1.45 -0.00 -1.22 -4.62 117.44 111.66 3a0h n TRP 291 Ca 0.03 0.20 -0.02 0.00 -0.00 0.00 0.00 57.50 57.72 3a0h n TRP 291 Cb 0.24 -0.91 -0.11 0.00 -0.00 0.00 0.00 31.31 30.54 3a0h n TRP 291 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 3a0h n PHE 292 N -2.67 0.00 -3.83 5.87 3.72 -0.95 -4.24 117.46 115.37 3a0h n PHE 292 Ca -0.08 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 56.95 3a0h n PHE 292 Cb 0.73 -0.55 -0.06 0.00 -0.94 0.00 0.00 39.48 38.66 3a0h n PHE 292 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3a0h s ASN 293 N -4.33 6.37 0.04 4.37 2.47 -0.75 -4.96 114.94 118.15 3a0h s ASN 293 Ca -0.06 0.44 0.23 0.00 0.42 0.00 0.00 52.86 53.89 3a0h s ASN 293 Cb 0.06 -2.08 -0.03 0.00 -1.45 0.00 0.00 41.25 37.74 3a0h s ASN 293 CO 0.57 0.35 0.94 -3.20 -3.72 0.00 0.00 177.10 172.05 3a0h n ASN 294 N 2.31 0.59 0.04 -4.21 2.85 -1.25 -3.52 115.26 112.07 3a0h n ASN 294 Ca -0.19 -0.27 -0.02 0.00 -0.11 0.00 0.00 54.58 53.99 3a0h n ASN 294 Cb 0.54 0.96 -0.01 0.00 1.24 0.00 0.00 39.78 42.51 3a0h n ASN 294 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 3a0h h THR 295 N 0.00 0.00 0.00 -0.44 2.02 -1.88 -2.85 112.91 109.76 3a0h h THR 295 Ca 0.00 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 66.99 3a0h h THR 295 Cb 0.74 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.15 3a0h h THR 295 CO 0.00 0.00 0.00 1.33 0.37 0.00 0.00 175.52 177.22 3a0h n VAL 296 N -2.87 0.02 -3.37 3.16 0.24 -1.26 -3.88 118.33 110.37 3a0h n VAL 296 Ca -0.02 0.01 -0.26 0.00 -2.04 0.00 0.00 64.34 62.03 3a0h n VAL 296 Cb 0.05 -0.51 -0.10 0.00 -1.47 0.00 0.00 33.84 31.81 3a0h n VAL 296 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 3a0h s TYR 297 N -2.58 0.77 0.62 6.34 1.51 -1.23 -5.03 117.35 117.75 3a0h s TYR 297 Ca 0.28 -1.98 0.25 0.00 -1.01 0.00 0.00 57.07 54.61 3a0h s TYR 297 Cb 0.20 -0.81 1.19 0.00 -0.11 0.00 0.00 41.96 42.43 3a0h s TYR 297 CO 0.45 -0.86 1.65 -1.35 -1.11 0.00 0.00 175.55 174.33 3a0h h PRO 298 N 6.02 0.00 0.00 -1.71 0.11 -1.61 -3.31 132.00 131.50 3a0h h PRO 298 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 3a0h h PRO 298 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 3a0h h PRO 298 CO 0.31 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.53 3a0h n SER 299 N -3.25 0.00 0.04 -2.05 7.64 -1.25 -4.61 113.62 110.14 3a0h n SER 299 Ca 0.08 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.09 3a0h n SER 299 Cb 0.85 -0.10 0.40 0.00 -1.01 0.00 0.00 64.21 64.34 3a0h n SER 299 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3a0h n GLU 300 N -1.88 0.13 0.00 1.43 4.71 -1.26 -3.61 120.64 120.17 3a0h n GLU 300 Ca 0.00 0.08 0.00 0.00 -0.01 0.00 0.00 57.16 57.23 3a0h n GLU 300 Cb 0.00 -1.62 0.00 0.00 -1.01 0.00 0.00 31.44 28.81 3a0h n GLU 300 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 3a0h n PHE 301 N -1.84 0.00 -3.87 -0.32 3.72 -1.26 -4.27 117.46 109.61 3a0h n PHE 301 Ca 0.06 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.27 3a0h n PHE 301 Cb 0.38 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.92 3a0h n PHE 301 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3a0h n TYR 302 N -2.00 -0.63 -2.20 1.38 4.01 -1.24 -3.34 117.16 113.14 3a0h n TYR 302 Ca 0.00 -1.64 -0.27 0.00 -0.16 0.00 0.00 57.90 55.83 3a0h n TYR 302 Cb 0.49 -0.30 0.15 0.00 -0.31 0.00 0.00 39.34 39.38 3a0h n TYR 302 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3a0h s GLY 303 N -3.35 1.77 0.25 2.72 0.00 -1.26 -3.88 107.32 103.57 3a0h s GLY 303 Ca 0.19 -1.41 -0.30 0.00 0.00 0.00 0.00 44.72 43.20 3a0h s GLY 303 CO 0.12 -0.73 1.12 2.56 0.00 0.00 0.00 173.10 176.17 3a0h s PRO 304 N -5.58 4.60 0.31 2.90 0.04 -1.26 -4.24 135.00 131.77 3a0h s PRO 304 Ca 0.71 1.81 -0.30 0.00 0.04 0.00 0.00 61.00 63.26 3a0h s PRO 304 Cb -0.05 -3.21 -0.12 0.00 0.04 0.00 0.00 34.50 31.17 3a0h s PRO 304 CO 0.49 0.13 1.58 -2.37 0.04 0.00 0.00 177.00 176.88 3a0h n THR 305 N 1.60 1.18 -0.04 1.26 5.66 -1.26 -4.44 114.28 118.24 3a0h n THR 305 Ca 0.00 -0.29 -0.01 0.00 -3.05 0.00 0.00 64.05 60.70 3a0h n THR 305 Cb 0.45 -1.97 -0.01 0.00 -1.55 0.00 0.00 70.33 67.25 3a0h n THR 305 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3a0h n GLY 306 N 1.89 -0.63 0.26 1.09 0.00 -1.26 0.18 105.19 106.73 3a0h n GLY 306 Ca 0.07 0.19 -0.03 0.00 0.00 0.00 0.00 46.02 46.25 3a0h n GLY 306 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3a0h h PRO 307 N 0.00 0.75 -0.79 1.61 0.11 -1.90 -1.82 132.00 129.96 3a0h h PRO 307 Ca 0.02 -0.04 0.19 0.00 0.11 0.00 0.00 66.00 66.27 3a0h h PRO 307 Cb 0.04 -0.17 -0.13 0.00 0.11 0.00 0.00 31.00 30.85 3a0h h PRO 307 CO -0.09 0.49 0.08 1.49 -0.21 0.00 0.00 178.00 179.76 3a0h h GLU 308 N 0.77 0.14 0.00 1.05 4.81 0.16 -2.31 114.58 119.20 3a0h h GLU 308 Ca 0.28 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.51 3a0h h GLU 308 Cb 0.09 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.44 3a0h h GLU 308 CO -0.14 0.09 0.00 0.00 -0.73 0.00 0.00 179.01 178.23 3a0h n ALA 309 N -2.87 -0.05 0.00 2.92 0.00 -0.69 0.12 120.51 119.94 3a0h n ALA 309 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 3a0h n ALA 309 Cb 0.53 0.18 0.00 0.00 0.00 0.00 0.00 19.45 20.16 3a0h n ALA 309 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3a0h n SER 310 N -1.18 0.00 -0.09 0.00 2.88 -1.02 0.24 113.62 114.45 3a0h n SER 310 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 3a0h n SER 310 Cb 0.00 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.37 3a0h n SER 310 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3a0h n GLN 311 N -0.72 0.76 -0.22 -1.46 1.13 -0.52 -4.11 117.38 112.24 3a0h n GLN 311 Ca 0.00 0.08 -0.06 0.00 -1.94 0.00 0.00 57.00 55.08 3a0h n GLN 311 Cb 0.00 -1.37 0.04 0.00 0.11 0.00 0.00 30.24 29.02 3a0h n GLN 311 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3a0h h ALA 312 N 0.18 0.78 -0.13 -1.58 0.00 1.08 -0.47 119.26 119.12 3a0h h ALA 312 Ca -0.41 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.47 3a0h h ALA 312 Cb 1.71 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 19.21 3a0h h ALA 312 CO -0.04 0.25 -0.12 0.37 0.00 0.00 0.00 179.25 179.71 3a0h h GLN 313 N 0.83 -0.14 -0.11 0.00 4.15 -1.29 -0.02 115.11 118.52 3a0h h GLN 313 Ca 0.22 0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.66 3a0h h GLN 313 Cb -0.03 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.67 3a0h h GLN 313 CO -0.04 -0.09 -0.15 0.00 -1.93 0.00 0.00 178.83 176.62 3a0h h ALA 314 N 0.94 -0.41 -0.93 3.38 0.00 -1.51 -1.15 119.26 119.57 3a0h h ALA 314 Ca 0.09 0.00 0.23 0.00 0.00 0.00 0.00 54.91 55.23 3a0h h ALA 314 Cb 0.28 0.83 -0.17 0.00 0.00 0.00 0.00 17.79 18.73 3a0h h ALA 314 CO -0.22 -0.49 -0.05 1.98 0.00 0.00 0.00 179.25 180.47 3a0h h MET 315 N -0.10 0.03 -0.16 0.00 1.85 -0.54 0.16 114.93 116.18 3a0h h MET 315 Ca 0.02 -0.00 0.01 0.00 -0.61 0.00 0.00 59.70 59.11 3a0h h MET 315 Cb 0.16 -0.01 -0.01 0.00 0.43 0.00 0.00 31.60 32.17 3a0h h MET 315 CO -0.16 0.02 0.09 1.15 -0.40 0.00 0.00 176.91 177.61 3a0h h THR 316 N 0.03 1.02 0.00 -0.77 2.02 0.15 -2.57 112.91 112.80 3a0h h THR 316 Ca 0.52 -0.07 -0.08 0.00 0.77 0.00 0.00 66.41 67.55 3a0h h THR 316 Cb 0.98 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 3a0h h THR 316 CO -0.88 0.03 -0.38 -0.26 0.37 0.00 0.00 175.52 174.40 3a0h h PHE 317 N 0.19 0.00 -0.46 3.16 -1.00 -0.11 -0.17 116.94 118.55 3a0h h PHE 317 Ca 0.06 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.81 3a0h h PHE 317 Cb -0.01 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.53 3a0h h PHE 317 CO -0.08 0.38 0.17 1.25 -1.61 0.00 0.00 178.31 178.42 3a0h h LEU 318 N 0.00 0.61 -0.00 1.54 6.46 -0.64 -2.70 115.31 120.57 3a0h h LEU 318 Ca -0.00 -0.07 -0.04 0.00 -0.12 0.00 0.00 57.88 57.64 3a0h h LEU 318 Cb 1.21 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 40.99 3a0h h LEU 318 CO 0.05 0.56 -0.17 0.40 -0.62 0.00 0.00 178.44 178.67 3a0h h ILE 319 N 0.66 1.58 -0.81 4.05 2.04 -1.08 -2.53 117.51 121.42 3a0h h ILE 319 Ca 0.16 -1.92 0.20 0.00 1.00 0.00 0.00 64.86 64.30 3a0h h ILE 319 Cb 0.16 2.81 -0.13 0.00 -0.74 0.00 0.00 36.82 38.92 3a0h h ILE 319 CO -0.01 0.52 0.12 -0.09 0.00 0.00 0.00 178.15 178.69 3a0h h ARG 320 N -0.60 0.16 0.01 2.37 2.43 -0.76 0.59 114.38 118.59 3a0h h ARG 320 Ca -0.02 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.07 3a0h h ARG 320 Cb 0.93 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 3a0h h ARG 320 CO 0.03 0.11 -0.34 -0.44 -1.51 0.00 0.00 179.97 177.82 3a0h h ASP 321 N 0.17 0.04 -1.01 -3.80 3.45 -1.60 -0.86 116.42 112.81 3a0h h ASP 321 Ca 0.47 -0.90 0.21 0.00 0.43 0.00 0.00 57.03 57.24 3a0h h ASP 321 Cb 0.89 -0.01 -0.11 0.00 -0.56 0.00 0.00 39.33 39.53 3a0h h ASP 321 CO -0.64 1.14 0.61 -0.61 -1.57 0.00 0.00 179.24 178.16 3a0h h GLN 322 N -0.94 0.70 0.00 3.56 4.15 -1.08 3.68 115.11 125.17 3a0h h GLN 322 Ca -0.09 -0.04 -0.08 0.00 0.77 0.00 0.00 58.65 59.21 3a0h h GLN 322 Cb 1.12 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 28.64 3a0h h GLN 322 CO -0.03 0.46 -0.39 -0.22 -1.93 0.00 0.00 178.83 176.72 3a0h h LYS 323 N 0.72 0.00 -0.00 1.69 3.64 0.11 -2.34 116.57 120.39 3a0h h LYS 323 Ca 0.60 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.98 3a0h h LYS 323 Cb 0.99 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 3a0h h LYS 323 CO -0.41 0.39 -0.12 -0.11 -2.27 0.00 0.00 179.45 176.93 3a0h n LEU 324 N -3.40 0.24 0.00 5.20 7.94 1.13 -4.90 117.00 123.21 3a0h n LEU 324 Ca 0.01 0.22 0.00 0.00 -1.11 0.00 0.00 56.01 55.13 3a0h n LEU 324 Cb 0.57 -0.32 0.00 0.00 0.53 0.00 0.00 43.42 44.20 3a0h n LEU 324 CO 0.37 0.05 0.00 0.61 -1.11 0.00 0.00 177.39 177.31 3a0h n GLY 325 N 1.40 1.38 3.88 -3.96 0.00 0.35 -5.02 105.19 103.21 3a0h n GLY 325 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 3a0h n GLY 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a0h s ALA 326 N -2.00 3.53 0.11 4.61 0.00 -0.52 -4.96 121.76 122.53 3a0h s ALA 326 Ca 0.00 -0.31 0.27 0.00 0.00 0.00 0.00 51.96 51.92 3a0h s ALA 326 Cb 0.00 -2.46 1.06 0.00 0.00 0.00 0.00 23.12 21.72 3a0h s ALA 326 CO 0.00 0.36 1.88 -2.95 0.00 0.00 0.00 175.76 175.05 3a0h h ASN 327 N 2.13 0.00 0.00 0.00 -1.07 -1.90 -3.37 115.58 111.37 3a0h h ASN 327 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.90 3a0h h ASN 327 Cb 1.18 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.43 3a0h h ASN 327 CO 0.67 0.14 0.00 0.52 0.07 0.00 0.00 177.43 178.84 3a0h n VAL 328 N -3.29 0.00 -0.33 6.14 0.31 -1.26 -4.04 118.33 115.86 3a0h n VAL 328 Ca 0.00 0.00 0.21 0.00 -0.01 0.00 0.00 64.34 64.55 3a0h n VAL 328 Cb 0.39 0.00 0.41 0.00 -0.91 0.00 0.00 33.84 33.73 3a0h n VAL 328 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3a0h h GLY 329 N 0.00 1.67 -3.81 2.92 0.00 -1.96 0.60 103.07 102.49 3a0h h GLY 329 Ca 0.00 0.01 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 3a0h h GLY 329 CO 0.00 -0.60 0.59 -1.26 0.00 0.00 0.00 176.54 175.27 3a0h n SER 330 N -5.36 5.72 -4.35 0.19 2.88 -1.26 -4.83 113.62 106.62 3a0h n SER 330 Ca 0.29 -3.73 -0.43 0.00 -1.33 0.00 0.00 58.87 53.67 3a0h n SER 330 Cb 0.95 -0.85 -0.08 0.00 -0.75 0.00 0.00 64.21 63.48 3a0h n SER 330 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3a0h s ALA 331 N -3.59 3.47 -0.19 -1.46 0.00 0.20 -5.02 121.76 115.18 3a0h s ALA 331 Ca 0.59 -2.12 -0.29 0.00 0.00 0.00 0.00 51.96 50.15 3a0h s ALA 331 Cb 0.48 -2.93 -0.05 0.00 0.00 0.00 0.00 23.12 20.63 3a0h s ALA 331 CO 0.03 -1.70 1.98 -1.14 0.00 0.00 0.00 175.76 174.93 3a0h s GLN 332 N 1.57 3.49 0.42 0.00 0.74 -1.26 -2.98 119.66 121.65 3a0h s GLN 332 Ca 0.04 1.96 -0.17 0.00 0.05 0.00 0.00 55.36 57.24 3a0h s GLN 332 Cb -0.24 -4.23 -0.09 0.00 1.10 0.00 0.00 33.01 29.55 3a0h s GLN 332 CO 0.05 -1.68 0.88 0.20 -0.55 0.00 0.00 175.29 174.19 3a0h s GLY 333 N 6.35 2.24 0.11 2.59 0.00 -1.26 -4.66 107.32 112.69 3a0h s GLY 333 Ca 0.89 0.18 -0.02 0.00 0.00 0.00 0.00 44.72 45.77 3a0h s GLY 333 CO 0.35 0.43 0.60 -1.05 0.00 0.00 0.00 173.10 173.43 3a0h n PRO 334 N -0.86 -0.03 -0.07 2.90 -0.02 -1.26 -0.67 135.00 134.99 3a0h n PRO 334 Ca 0.05 0.59 -0.14 0.00 -2.02 0.00 0.00 63.50 61.99 3a0h n PRO 334 Cb 0.54 -0.90 -0.06 0.00 -0.02 0.00 0.00 33.50 33.05 3a0h n PRO 334 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3a0h h THR 335 N 0.00 1.33 0.00 3.45 1.03 -1.95 -3.47 112.91 113.30 3a0h h THR 335 Ca 0.20 -1.48 0.00 0.00 -0.01 0.00 0.00 66.41 65.12 3a0h h THR 335 Cb 0.34 1.81 0.00 0.00 -1.07 0.00 0.00 68.15 69.23 3a0h h THR 335 CO -0.39 0.45 0.00 0.61 -0.01 0.00 0.00 175.52 176.19 3a0h n GLY 336 N 0.28 -0.23 0.10 2.99 0.00 0.16 -5.03 105.19 103.47 3a0h n GLY 336 Ca -0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.75 3a0h n GLY 336 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3a0h h LEU 337 N 0.00 0.00 0.00 0.99 3.38 -1.90 -3.44 115.31 114.34 3a0h h LEU 337 Ca 0.00 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.48 3a0h h LEU 337 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3a0h h LEU 337 CO 0.00 1.48 0.00 0.61 0.09 0.00 0.00 178.44 180.62 3a0h n GLY 338 N 1.44 4.24 0.00 0.83 0.00 -1.26 -4.46 105.19 105.98 3a0h n GLY 338 Ca -0.32 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.62 3a0h n GLY 338 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3a0h n LYS 339 N -0.55 0.00 -0.21 1.61 5.02 -1.16 -4.38 118.16 118.49 3a0h n LYS 339 Ca 0.00 0.16 -0.08 0.00 -2.02 0.00 0.00 58.31 56.37 3a0h n LYS 339 Cb 0.00 -0.99 0.03 0.00 -0.02 0.00 0.00 35.03 34.04 3a0h n LYS 339 CO 0.00 0.00 0.00 1.88 -0.52 0.00 0.00 177.40 178.76 3a0h h TYR 340 N 0.00 0.92 -4.32 2.13 0.05 -1.83 -3.35 116.97 110.57 3a0h h TYR 340 Ca 0.00 -0.08 -0.58 0.00 0.05 0.00 0.00 58.73 58.12 3a0h h TYR 340 Cb 0.00 -0.27 -0.30 0.00 1.01 0.00 0.00 36.73 37.17 3a0h h TYR 340 CO 0.05 0.76 -0.85 -0.51 -1.05 0.00 0.00 178.16 176.56 3a0h s LEU 341 N -9.70 2.02 0.00 3.88 1.43 -1.26 -2.70 118.68 112.35 3a0h s LEU 341 Ca -0.13 -0.35 0.06 0.00 -1.03 0.00 0.00 54.13 52.68 3a0h s LEU 341 Cb 0.13 -1.00 -0.02 0.00 0.03 0.00 0.00 46.19 45.33 3a0h s LEU 341 CO 0.80 0.23 0.21 0.80 0.23 0.00 0.00 176.35 178.62 3a0h n MET 342 N 2.68 0.48 -4.65 1.70 1.56 -0.62 -4.47 117.12 113.79 3a0h n MET 342 Ca -0.15 -3.18 -0.24 0.00 -0.27 0.00 0.00 57.70 53.85 3a0h n MET 342 Cb 0.53 2.21 -0.16 0.00 2.15 0.00 0.00 33.22 37.95 3a0h n MET 342 CO 0.00 0.00 0.00 0.50 -0.73 0.00 0.00 175.97 175.74 3a0h s ARG 343 N -3.36 1.58 0.20 2.12 3.52 -1.26 -3.01 118.95 118.74 3a0h s ARG 343 Ca 0.29 -0.47 0.04 0.00 -0.13 0.00 0.00 55.73 55.46 3a0h s ARG 343 Cb 0.01 -1.36 -0.03 0.00 -1.56 0.00 0.00 34.95 32.01 3a0h s ARG 343 CO 0.21 0.14 0.32 0.45 -0.81 0.00 0.00 175.30 175.61 3a0h s SER 344 N 0.30 6.31 0.12 -2.12 0.15 -1.09 -5.00 113.70 112.36 3a0h s SER 344 Ca -0.08 0.11 -0.19 0.00 0.70 0.00 0.00 55.95 56.49 3a0h s SER 344 Cb -0.12 -1.87 -0.06 0.00 -1.71 0.00 0.00 66.02 62.26 3a0h s SER 344 CO 0.02 -0.01 1.73 1.55 1.20 0.00 0.00 173.24 177.73 3a0h h PRO 345 N 1.61 0.34 0.00 5.44 0.13 -2.01 -3.38 132.00 134.13 3a0h h PRO 345 Ca -0.50 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 3a0h h PRO 345 Cb 1.21 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3a0h h PRO 345 CO 0.64 0.29 0.00 0.25 -0.23 0.00 0.00 178.00 178.95 3a0h n THR 346 N -4.87 0.00 -2.30 1.56 -2.24 -1.26 -4.79 114.28 100.38 3a0h n THR 346 Ca -0.03 0.46 -0.42 0.00 -2.27 0.00 0.00 64.05 61.80 3a0h n THR 346 Cb 0.07 -1.42 -0.03 0.00 -2.10 0.00 0.00 70.33 66.84 3a0h n THR 346 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3a0h s GLY 347 N -2.34 2.06 0.17 3.38 0.00 -1.26 -4.95 107.32 104.38 3a0h s GLY 347 Ca 0.00 0.88 -0.12 0.00 0.00 0.00 0.00 44.72 45.48 3a0h s GLY 347 CO 0.00 2.31 1.70 -2.09 0.00 0.00 0.00 173.10 175.02 3a0h h GLU 348 N 7.30 0.90 -5.05 2.90 4.81 -1.71 -3.29 114.58 120.44 3a0h h GLU 348 Ca -0.39 -0.19 -0.63 0.00 -0.13 0.00 0.00 59.36 58.02 3a0h h GLU 348 Cb 1.19 -0.13 -0.34 0.00 0.63 0.00 0.00 28.75 30.10 3a0h h GLU 348 CO 0.87 0.80 -0.86 0.42 -0.73 0.00 0.00 179.01 179.51 3a0h s ILE 349 N -5.42 1.79 0.23 2.32 1.01 -1.20 -2.67 121.20 117.26 3a0h s ILE 349 Ca -0.13 -0.84 -0.16 0.00 0.00 0.00 0.00 60.65 59.52 3a0h s ILE 349 Cb 0.13 -1.58 0.01 0.00 0.01 0.00 0.00 42.46 41.03 3a0h s ILE 349 CO 0.80 0.50 0.54 0.27 0.00 0.00 0.00 174.94 177.06 3a0h s ILE 350 N 0.66 0.01 0.56 2.92 -5.25 -1.16 -2.19 121.20 116.75 3a0h s ILE 350 Ca -0.13 -1.04 -0.21 0.00 -0.99 0.00 0.00 60.65 58.28 3a0h s ILE 350 Cb -0.16 -1.87 -0.04 0.00 2.95 0.00 0.00 42.46 43.33 3a0h s ILE 350 CO 0.03 -0.06 1.35 0.49 -1.79 0.00 0.00 174.94 174.96 3a0h n PHE 351 N -0.38 2.26 -5.01 1.37 3.72 -1.26 -1.59 117.46 116.57 3a0h n PHE 351 Ca -0.06 0.43 -0.28 0.00 -0.05 0.00 0.00 57.45 57.49 3a0h n PHE 351 Cb 0.62 -2.35 -0.16 0.00 -0.94 0.00 0.00 39.48 36.64 3a0h n PHE 351 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3a0h s GLY 352 N -0.98 1.06 0.00 1.37 0.00 -1.10 -4.22 107.32 103.44 3a0h s GLY 352 Ca 0.73 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 44.60 3a0h s GLY 352 CO 0.48 -0.56 0.00 0.61 0.00 0.00 0.00 173.10 173.63 3a0h n GLY 353 N 2.91 -0.51 0.00 0.20 0.00 -1.26 -4.45 105.19 102.08 3a0h n GLY 353 Ca -0.17 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.45 3a0h n GLY 353 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3a0h n GLU 354 N 0.00 5.23 -0.07 1.61 2.13 -1.26 -4.71 120.64 123.56 3a0h n GLU 354 Ca 0.00 -0.09 0.25 0.00 0.66 0.00 0.00 57.16 57.97 3a0h n GLU 354 Cb 0.00 -0.58 0.72 0.00 0.27 0.00 0.00 31.44 31.85 3a0h n GLU 354 CO 0.00 0.00 0.00 1.79 -0.41 0.00 0.00 177.13 178.51 3a0h h THR 355 N 0.01 0.51 -0.96 6.31 1.35 -1.87 -3.14 112.91 115.11 3a0h h THR 355 Ca 0.00 0.00 0.24 0.00 -0.55 0.00 0.00 66.41 66.10 3a0h h THR 355 Cb 0.00 0.59 -0.18 0.00 -1.73 0.00 0.00 68.15 66.84 3a0h h THR 355 CO 0.00 0.00 -0.07 1.15 -0.25 0.00 0.00 175.52 176.35 3a0h n MET 356 N -4.08 -0.08 -0.45 4.72 0.00 -1.26 -0.38 117.12 115.59 3a0h n MET 356 Ca 0.14 1.45 0.40 0.00 0.00 0.00 0.00 57.70 59.70 3a0h n MET 356 Cb 0.82 -2.26 0.64 0.00 0.00 0.00 0.00 33.22 32.41 3a0h n MET 356 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3a0h h ARG 357 N 0.00 0.00 -0.62 3.17 3.08 -1.93 0.17 114.38 118.25 3a0h h ARG 357 Ca 0.54 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 60.29 3a0h h ARG 357 Cb 1.03 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 30.90 3a0h h ARG 357 CO -0.93 0.00 0.22 1.19 -1.07 0.00 0.00 179.97 179.38 3a0h n PHE 358 N -3.61 1.91 0.97 3.04 0.99 0.49 -4.57 117.46 116.69 3a0h n PHE 358 Ca 0.33 -1.65 0.08 0.00 -0.00 0.00 0.00 57.45 56.22 3a0h n PHE 358 Cb 1.75 -0.67 0.46 0.00 -1.00 0.00 0.00 39.48 40.02 3a0h n PHE 358 CO 0.00 0.00 0.00 -2.67 -0.00 0.00 0.00 176.76 174.09 3a0h n TRP 359 N -1.05 0.00 0.97 1.38 4.27 0.58 -1.13 117.44 122.46 3a0h n TRP 359 Ca 0.43 0.00 0.12 0.00 -3.89 0.00 0.00 57.50 54.16 3a0h n TRP 359 Cb 1.30 -0.02 0.16 0.00 -1.36 0.00 0.00 31.31 31.39 3a0h n TRP 359 CO 0.00 0.00 0.00 -0.25 -2.29 0.00 0.00 177.69 175.15 3a0h n ASP 360 N -1.02 0.61 -4.74 -0.67 8.00 -1.26 -4.93 116.55 112.53 3a0h n ASP 360 Ca 0.12 -0.39 -0.42 0.00 0.71 0.00 0.00 54.79 54.81 3a0h n ASP 360 Cb 0.06 0.42 -0.02 0.00 -0.02 0.00 0.00 41.12 41.56 3a0h n ASP 360 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3a0h s PHE 361 N -3.01 2.96 -0.05 1.24 5.36 -0.28 -5.01 117.98 119.18 3a0h s PHE 361 Ca 0.10 0.89 -0.00 0.00 -0.96 0.00 0.00 56.93 56.96 3a0h s PHE 361 Cb 0.17 -3.90 0.03 0.00 -0.34 0.00 0.00 43.02 38.97 3a0h s PHE 361 CO 0.74 -3.04 -0.01 1.03 -1.46 0.00 0.00 175.22 172.48 3a0h s ARG 362 N -0.12 0.55 0.06 10.12 1.81 -1.26 -5.06 118.95 125.05 3a0h s ARG 362 Ca 0.62 0.05 -0.12 0.00 -1.72 0.00 0.00 55.73 54.57 3a0h s ARG 362 Cb -0.44 -0.77 0.01 0.00 -0.45 0.00 0.00 34.95 33.31 3a0h s ARG 362 CO 0.42 -0.19 0.26 0.20 -0.68 0.00 0.00 175.30 175.31 3a0h s GLY 363 N 1.40 -0.05 0.55 -3.53 0.00 -1.26 -4.81 107.32 99.61 3a0h s GLY 363 Ca -0.04 -0.21 0.25 0.00 0.00 0.00 0.00 44.72 44.73 3a0h s GLY 363 CO -0.03 -0.41 2.17 -2.55 0.00 0.00 0.00 173.10 172.29 3a0h h PRO 364 N 3.12 0.00 0.00 2.90 0.11 -1.97 -2.43 132.00 133.73 3a0h h PRO 364 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3a0h h PRO 364 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3a0h h PRO 364 CO 0.49 0.05 0.00 -2.67 -0.21 0.00 0.00 178.00 175.66 3a0h n TRP 365 N -3.95 0.00 0.00 0.65 4.27 -1.26 -3.53 117.44 113.62 3a0h n TRP 365 Ca -0.03 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.58 3a0h n TRP 365 Cb 0.14 -0.37 0.00 0.00 -1.36 0.00 0.00 31.31 29.71 3a0h n TRP 365 CO 0.00 0.00 0.00 -0.11 -2.29 0.00 0.00 177.69 175.29 3a0h n LEU 366 N -1.37 0.00 0.01 5.67 7.94 -0.95 -4.83 117.00 123.47 3a0h n LEU 366 Ca 0.06 -0.20 -0.05 0.00 -1.11 0.00 0.00 56.01 54.70 3a0h n LEU 366 Cb 0.15 0.00 0.15 0.00 0.53 0.00 0.00 43.42 44.25 3a0h n LEU 366 CO 0.13 0.00 0.65 -0.33 -1.11 0.00 0.00 177.39 176.73 3a0h h GLU 367 N 0.00 0.49 -0.39 1.96 4.39 -1.50 -3.11 114.58 116.42 3a0h h GLU 367 Ca 0.00 -0.23 0.07 0.00 0.34 0.00 0.00 59.36 59.54 3a0h h GLU 367 Cb 0.00 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 28.58 3a0h h GLU 367 CO 0.00 0.78 0.02 -1.35 -1.16 0.00 0.00 179.01 177.30 3a0h h PRO 368 N 0.42 0.13 -2.81 2.33 0.11 -1.88 -1.24 132.00 129.06 3a0h h PRO 368 Ca 0.05 -0.01 -0.38 0.00 0.11 0.00 0.00 66.00 65.77 3a0h h PRO 368 Cb 0.82 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.89 3a0h h PRO 368 CO 0.07 0.08 1.89 1.28 -0.21 0.00 0.00 178.00 181.11 3a0h n LEU 369 N -5.17 5.85 -4.51 2.35 4.77 -1.17 -4.79 117.00 114.33 3a0h n LEU 369 Ca 0.03 -3.26 -0.25 0.00 -0.03 0.00 0.00 56.01 52.50 3a0h n LEU 369 Cb 0.20 -1.26 -0.11 0.00 -2.33 0.00 0.00 43.42 39.93 3a0h n LEU 369 CO 0.21 1.34 -0.36 -0.60 -1.33 0.00 0.00 177.39 176.64 3a0h s ARG 370 N 2.22 1.74 0.32 3.23 6.06 -0.47 -4.33 118.95 127.72 3a0h s ARG 370 Ca 0.55 -1.91 -0.01 0.00 -2.50 0.00 0.00 55.73 51.85 3a0h s ARG 370 Cb 0.19 -1.48 -0.01 0.00 0.06 0.00 0.00 34.95 33.71 3a0h s ARG 370 CO -0.03 0.07 0.41 0.20 -2.50 0.00 0.00 175.30 173.45 3a0h s GLY 371 N -3.56 1.57 0.05 8.12 0.00 0.50 -4.48 107.32 109.52 3a0h s GLY 371 Ca 0.32 -1.59 -0.26 0.00 0.00 0.00 0.00 44.72 43.19 3a0h s GLY 371 CO 0.15 -1.10 1.39 -2.55 0.00 0.00 0.00 173.10 171.00 3a0h h PRO 372 N 2.17 -0.84 0.00 2.90 0.11 -2.02 -2.80 132.00 131.52 3a0h h PRO 372 Ca -0.28 0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.89 3a0h h PRO 372 Cb 1.24 0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.54 3a0h h PRO 372 CO 0.39 -0.56 0.00 -0.91 -0.21 0.00 0.00 178.00 176.71 3a0h h ASN 373 N -0.88 0.00 0.00 -2.05 2.35 -1.99 -3.49 115.58 109.52 3a0h h ASN 373 Ca -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 3a0h h ASN 373 Cb 0.69 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.06 3a0h h ASN 373 CO 0.10 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.49 3a0h n GLY 374 N -0.12 0.39 3.70 2.83 0.00 -1.06 -3.02 105.19 107.93 3a0h n GLY 374 Ca 0.01 -1.26 -0.42 0.00 0.00 0.00 0.00 46.02 44.35 3a0h n GLY 374 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3a0h s LEU 375 N 0.00 4.37 -0.16 0.99 1.43 -0.93 0.19 118.68 124.57 3a0h s LEU 375 Ca 0.00 2.60 -0.20 0.00 -1.03 0.00 0.00 54.13 55.51 3a0h s LEU 375 Cb 0.00 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.61 3a0h s LEU 375 CO 0.00 -0.89 0.56 -0.62 0.23 0.00 0.00 176.35 175.63 3a0h s ASP 376 N 1.86 6.68 0.15 2.29 -1.08 -1.26 -4.81 116.67 120.49 3a0h s ASP 376 Ca 0.73 0.81 -0.15 0.00 -0.52 0.00 0.00 52.55 53.42 3a0h s ASP 376 Cb -0.43 -2.32 0.02 0.00 -1.46 0.00 0.00 42.92 38.74 3a0h s ASP 376 CO 0.32 -0.15 1.75 0.25 0.52 0.00 0.00 175.17 177.86 3a0h h LEU 377 N 7.55 0.57 -0.44 -1.34 7.12 -1.98 0.89 115.31 127.69 3a0h h LEU 377 Ca -0.36 -0.10 -0.01 0.00 0.13 0.00 0.00 57.88 57.54 3a0h h LEU 377 Cb 1.16 -0.15 -0.02 0.00 -0.53 0.00 0.00 40.66 41.12 3a0h h LEU 377 CO 0.75 0.51 0.25 0.78 -0.13 0.00 0.00 178.44 180.60 3a0h h ASN 378 N 0.59 0.54 0.00 1.25 4.21 -1.99 -0.74 115.58 119.44 3a0h h ASN 378 Ca 0.16 -0.08 0.00 0.00 1.21 0.00 0.00 56.30 57.59 3a0h h ASN 378 Cb 0.07 -0.14 0.00 0.00 -1.12 0.00 0.00 38.32 37.14 3a0h h ASN 378 CO -0.02 0.46 0.00 0.29 -1.29 0.00 0.00 177.43 176.87 3a0h n LYS 379 N -4.72 0.00 -0.39 0.81 5.02 -1.12 -2.43 118.16 115.34 3a0h n LYS 379 Ca 0.01 0.28 0.32 0.00 -2.02 0.00 0.00 58.31 56.90 3a0h n LYS 379 Cb 0.07 -1.13 0.53 0.00 -0.02 0.00 0.00 35.03 34.48 3a0h n LYS 379 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 3a0h n ILE 380 N -1.34 -0.17 -0.05 -0.18 0.13 0.29 0.48 119.36 118.52 3a0h n ILE 380 Ca 0.00 1.36 -0.16 0.00 -1.10 0.00 0.00 62.75 62.85 3a0h n ILE 380 Cb 0.00 -2.22 -0.07 0.00 -0.84 0.00 0.00 39.64 36.51 3a0h n ILE 380 CO 0.00 0.00 0.00 0.11 2.80 0.00 0.00 176.55 179.46 3a0h h LYS 381 N 0.00 0.69 0.00 9.51 1.57 -1.10 -3.39 116.57 123.85 3a0h h LYS 381 Ca 0.68 -0.50 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3a0h h LYS 381 Cb 2.27 0.09 0.00 0.00 0.08 0.00 0.00 32.23 34.67 3a0h h LYS 381 CO -0.31 1.12 -0.79 0.09 -0.57 0.00 0.00 179.45 178.99 3a0h n ASN 382 N -4.12 3.93 -1.30 0.86 3.02 0.18 -4.76 115.26 113.07 3a0h n ASN 382 Ca -0.07 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.58 3a0h n ASN 382 Cb 0.63 0.72 0.30 0.00 -0.61 0.00 0.00 39.78 40.82 3a0h n ASN 382 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3a0h n ASP 383 N -1.26 3.81 -4.56 6.41 8.00 0.26 -4.83 116.55 124.38 3a0h n ASP 383 Ca 0.00 -2.15 -0.42 0.00 0.71 0.00 0.00 54.79 52.93 3a0h n ASP 383 Cb 0.06 -0.48 -0.03 0.00 -0.02 0.00 0.00 41.12 40.65 3a0h n ASP 383 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3a0h s ILE 384 N -1.39 4.10 0.74 0.53 2.07 -1.25 -4.93 121.20 121.08 3a0h s ILE 384 Ca 0.45 0.64 -0.08 0.00 -1.41 0.00 0.00 60.65 60.25 3a0h s ILE 384 Cb 0.25 -4.70 0.08 0.00 0.13 0.00 0.00 42.46 38.23 3a0h s ILE 384 CO 0.27 -1.34 1.06 -1.10 -1.91 0.00 0.00 174.94 171.92 3a0h s GLN 385 N 4.74 1.99 0.10 3.50 -0.21 -1.26 -5.03 119.66 123.49 3a0h s GLN 385 Ca 0.38 -0.28 -0.16 0.00 0.02 0.00 0.00 55.36 55.32 3a0h s GLN 385 Cb -0.09 -2.12 -0.06 0.00 1.00 0.00 0.00 33.01 31.74 3a0h s GLN 385 CO 0.22 -1.40 1.51 -1.35 -2.12 0.00 0.00 175.29 172.15 3a0h h PRO 386 N -0.75 0.59 0.00 2.91 0.11 -2.01 -3.06 132.00 129.80 3a0h h PRO 386 Ca -0.44 -0.22 0.00 0.00 0.11 0.00 0.00 66.00 65.45 3a0h h PRO 386 Cb 1.31 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3a0h h PRO 386 CO 0.58 0.76 0.24 -2.67 -0.21 0.00 0.00 178.00 176.70 3a0h n TRP 387 N -4.48 0.28 -0.06 0.65 4.27 -1.26 -1.23 117.44 115.60 3a0h n TRP 387 Ca -0.03 0.15 -0.22 0.00 -3.89 0.00 0.00 57.50 53.51 3a0h n TRP 387 Cb 0.31 -0.55 -0.13 0.00 -1.36 0.00 0.00 31.31 29.58 3a0h n TRP 387 CO 0.00 0.00 0.00 1.04 -2.29 0.00 0.00 177.69 176.44 3a0h n GLN 388 N -1.77 0.67 -0.10 -2.67 6.02 -1.15 -3.34 117.38 115.04 3a0h n GLN 388 Ca -0.01 0.34 0.15 0.00 -0.01 0.00 0.00 57.00 57.48 3a0h n GLN 388 Cb 0.25 -1.67 0.54 0.00 1.02 0.00 0.00 30.24 30.38 3a0h n GLN 388 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 3a0h h GLU 389 N -0.38 0.32 0.10 -1.09 4.81 -1.24 0.93 114.58 118.04 3a0h h GLU 389 Ca -0.45 -0.02 -0.30 0.00 -0.13 0.00 0.00 59.36 58.46 3a0h h GLU 389 Cb 1.75 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 31.05 3a0h h GLU 389 CO -0.08 0.21 -1.47 0.07 -0.73 0.00 0.00 179.01 177.01 3a0h h ARG 390 N 0.33 0.22 0.00 1.92 0.11 -1.71 -1.89 114.38 113.36 3a0h h ARG 390 Ca 0.31 -0.38 -0.24 0.00 0.10 0.00 0.00 59.98 59.77 3a0h h ARG 390 Cb 0.75 0.14 0.01 0.00 1.11 0.00 0.00 29.97 31.98 3a0h h ARG 390 CO -0.08 1.08 -0.99 -0.09 0.10 0.00 0.00 179.97 179.99 3a0h h ARG 391 N 0.06 0.53 -0.59 0.08 9.65 -1.36 -2.50 114.38 120.24 3a0h h ARG 391 Ca -0.22 -0.57 -0.00 0.00 -1.10 0.00 0.00 59.98 58.09 3a0h h ARG 391 Cb 1.99 0.16 -0.03 0.00 -1.39 0.00 0.00 29.97 30.71 3a0h h ARG 391 CO 0.16 1.20 0.35 0.00 2.80 0.00 0.00 179.97 184.48 3a0h h ALA 392 N 0.60 1.50 0.01 2.80 0.00 0.79 -1.65 119.26 123.31 3a0h h ALA 392 Ca -0.10 -0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 3a0h h ALA 392 Cb 1.64 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 3a0h h ALA 392 CO 0.18 0.43 -0.89 0.00 0.00 0.00 0.00 179.25 178.97 3a0h h ALA 393 N 1.57 0.53 -0.14 0.00 0.00 -1.28 -1.34 119.26 118.60 3a0h h ALA 393 Ca 0.21 -0.78 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 3a0h h ALA 393 Cb -0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3a0h h ALA 393 CO -0.04 1.04 0.04 1.49 0.00 0.00 0.00 179.25 181.77 3a0h h GLU 394 N 0.03 0.22 0.00 0.00 4.57 -0.91 -1.62 114.58 116.87 3a0h h GLU 394 Ca -0.02 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 58.07 3a0h h GLU 394 Cb 1.55 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 30.11 3a0h h GLU 394 CO 0.12 0.37 -0.17 1.88 -1.18 0.00 0.00 179.01 180.03 3a0h h TYR 395 N 0.03 0.00 0.13 0.92 0.99 -1.34 0.10 116.97 117.80 3a0h h TYR 395 Ca 0.04 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.77 3a0h h TYR 395 Cb 0.25 0.00 0.00 0.00 1.00 0.00 0.00 36.73 37.98 3a0h h TYR 395 CO 0.01 0.17 -0.06 1.98 -0.00 0.00 0.00 178.16 180.26 3a0h h MET 396 N 0.00 -0.16 0.00 4.88 4.05 -0.83 -3.38 114.93 119.49 3a0h h MET 396 Ca -0.00 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 3a0h h MET 396 Cb 0.65 0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.48 3a0h h MET 396 CO 0.02 0.22 0.00 0.25 0.23 0.00 0.00 176.91 177.63 3a0h n THR 397 N -4.98 0.00 -1.53 -0.77 -2.24 -0.65 -4.26 114.28 99.86 3a0h n THR 397 Ca -0.09 0.96 -0.26 0.00 -2.27 0.00 0.00 64.05 62.40 3a0h n THR 397 Cb 0.24 -1.93 -0.11 0.00 -2.10 0.00 0.00 70.33 66.42 3a0h n THR 397 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3a0h n HIS 398 N -0.49 0.85 -4.32 4.78 -0.00 0.32 -4.87 115.22 111.49 3a0h n HIS 398 Ca 0.00 0.09 -0.24 0.00 -0.00 0.00 0.00 57.72 57.57 3a0h n HIS 398 Cb 0.00 -2.09 -0.12 0.00 -0.00 0.00 0.00 29.99 27.78 3a0h n HIS 398 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3a0h s ALA 399 N 9.70 1.97 -0.16 -1.41 0.00 -1.26 -4.33 121.76 126.27 3a0h s ALA 399 Ca 1.11 -1.35 -0.02 0.00 0.00 0.00 0.00 51.96 51.70 3a0h s ALA 399 Cb -0.51 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 3a0h s ALA 399 CO 0.31 0.36 1.31 -2.30 0.00 0.00 0.00 175.76 175.45 3a0h n PRO 400 N 0.84 0.62 -3.84 0.00 -0.02 -1.26 -4.64 135.00 126.70 3a0h n PRO 400 Ca -0.18 -0.52 -0.29 0.00 -2.02 0.00 0.00 63.50 60.50 3a0h n PRO 400 Cb 0.54 -1.87 -0.16 0.00 -0.02 0.00 0.00 33.50 31.99 3a0h n PRO 400 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3a0h s LEU 401 N 0.02 1.80 0.18 2.45 2.01 -1.26 -4.91 118.68 118.96 3a0h s LEU 401 Ca 0.15 -0.93 -0.24 0.00 0.01 0.00 0.00 54.13 53.12 3a0h s LEU 401 Cb 0.06 -0.88 0.05 0.00 0.01 0.00 0.00 46.19 45.43 3a0h s LEU 401 CO -0.01 -0.26 0.80 -0.83 1.01 0.00 0.00 176.35 177.06 3a0h s GLY 402 N 1.64 -0.29 0.21 -3.19 0.00 -1.25 0.20 107.32 104.64 3a0h s GLY 402 Ca -0.03 0.17 0.03 0.00 0.00 0.00 0.00 44.72 44.89 3a0h s GLY 402 CO -0.07 0.05 0.36 -1.35 0.00 0.00 0.00 173.10 172.08 3a0h s SER 403 N -2.83 6.33 0.37 1.64 1.04 -1.24 -4.94 113.70 114.07 3a0h s SER 403 Ca 0.09 0.19 0.10 0.00 0.48 0.00 0.00 55.95 56.81 3a0h s SER 403 Cb -0.03 -1.92 0.87 0.00 0.10 0.00 0.00 66.02 65.04 3a0h s SER 403 CO -0.01 -0.04 1.87 -0.07 0.98 0.00 0.00 173.24 175.97 3a0h h LEU 404 N 1.60 0.61 -1.88 2.42 3.38 -2.02 3.30 115.31 122.71 3a0h h LEU 404 Ca -0.50 0.04 0.37 0.00 0.09 0.00 0.00 57.88 57.88 3a0h h LEU 404 Cb 1.21 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.82 3a0h h LEU 404 CO 0.65 0.30 0.90 -1.13 0.09 0.00 0.00 178.44 179.24 3a0h h ASN 405 N 0.64 0.07 0.00 -0.43 -0.73 -2.06 -3.44 115.58 109.63 3a0h h ASN 405 Ca 0.45 0.02 0.00 0.00 1.87 0.00 0.00 56.30 58.64 3a0h h ASN 405 Cb 0.80 0.01 0.00 0.00 0.27 0.00 0.00 38.32 39.40 3a0h h ASN 405 CO -0.20 0.00 0.00 -1.20 -0.37 0.00 0.00 177.43 175.66 3a0h n SER 406 N -4.24 -1.47 -4.42 1.15 7.64 1.10 -5.02 113.62 108.36 3a0h n SER 406 Ca 0.28 0.00 -0.45 0.00 1.01 0.00 0.00 58.87 59.72 3a0h n SER 406 Cb 1.30 -0.32 -0.03 0.00 -1.01 0.00 0.00 64.21 64.16 3a0h n SER 406 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3a0h s VAL 407 N -2.00 4.93 0.05 0.44 0.11 -1.24 -3.68 120.40 119.00 3a0h s VAL 407 Ca 0.00 -1.71 -0.33 0.00 -2.93 0.00 0.00 61.98 57.02 3a0h s VAL 407 Cb 0.00 -4.68 -0.12 0.00 -1.53 0.00 0.00 36.38 30.05 3a0h s VAL 407 CO 0.00 -1.37 1.80 0.61 -3.33 0.00 0.00 175.10 172.81 3a0h n GLY 408 N 5.11 1.48 0.00 6.54 0.00 -1.24 -3.65 105.19 113.42 3a0h n GLY 408 Ca 0.18 0.76 0.00 0.00 0.00 0.00 0.00 46.02 46.96 3a0h n GLY 408 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a0h n GLY 409 N 4.11 -0.64 3.40 -0.02 0.00 0.54 -4.54 105.19 108.04 3a0h n GLY 409 Ca 0.19 -1.59 -0.32 0.00 0.00 0.00 0.00 46.02 44.31 3a0h n GLY 409 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3a0h n VAL 410 N 3.83 0.00 -0.29 1.61 0.31 -1.26 -3.86 118.33 118.67 3a0h n VAL 410 Ca 0.00 -0.25 0.12 0.00 -0.01 0.00 0.00 64.34 64.20 3a0h n VAL 410 Cb 0.00 -0.72 0.37 0.00 -0.91 0.00 0.00 33.84 32.58 3a0h n VAL 410 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3a0h h ALA 411 N -1.97 1.81 -2.01 3.52 0.00 -1.96 -3.12 119.26 115.53 3a0h h ALA 411 Ca -0.50 0.03 -0.65 0.00 0.00 0.00 0.00 54.91 53.78 3a0h h ALA 411 Cb 1.32 -0.12 -0.38 0.00 0.00 0.00 0.00 17.79 18.61 3a0h h ALA 411 CO 0.39 -0.07 -0.17 0.25 0.00 0.00 0.00 179.25 179.65 3a0h n THR 412 N -4.59 3.83 -4.14 0.00 -2.24 -1.26 -5.05 114.28 100.83 3a0h n THR 412 Ca 0.19 -5.66 -0.26 0.00 -2.27 0.00 0.00 64.05 56.05 3a0h n THR 412 Cb 0.49 -1.55 -0.06 0.00 -2.10 0.00 0.00 70.33 67.11 3a0h n THR 412 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3a0h s GLU 413 N -3.53 2.69 0.65 -0.78 2.56 -1.18 -5.10 118.70 114.00 3a0h s GLU 413 Ca 0.45 -1.01 -0.14 0.00 0.00 0.00 0.00 54.97 54.26 3a0h s GLU 413 Cb 0.23 -2.50 -0.01 0.00 2.00 0.00 0.00 34.13 33.85 3a0h s GLU 413 CO -0.11 0.46 1.08 0.42 -0.56 0.00 0.00 175.26 176.54 3a0h s ILE 414 N -1.82 3.64 0.09 -3.70 1.01 -1.26 -4.97 121.20 114.18 3a0h s ILE 414 Ca 0.30 0.70 -0.31 0.00 0.00 0.00 0.00 60.65 61.34 3a0h s ILE 414 Cb -0.09 -3.26 -0.06 0.00 0.01 0.00 0.00 42.46 39.06 3a0h s ILE 414 CO 0.22 -0.53 1.22 0.20 0.00 0.00 0.00 174.94 176.04 3a0h s ASN 415 N -2.97 7.05 0.00 3.58 -0.87 -1.26 -4.59 114.94 115.88 3a0h s ASN 415 Ca 0.63 2.08 0.00 0.00 -1.57 0.00 0.00 52.86 54.01 3a0h s ASN 415 Cb -0.17 -2.58 0.00 0.00 -0.02 0.00 0.00 41.25 38.48 3a0h s ASN 415 CO 0.43 -0.47 0.00 -0.24 -2.57 0.00 0.00 177.10 174.25 3a0h n SER 416 N 3.71 0.00 -4.66 -1.22 2.88 -1.26 -5.09 113.62 107.98 3a0h n SER 416 Ca 0.08 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.20 3a0h n SER 416 Cb 0.46 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.89 3a0h n SER 416 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3a0h s VAL 417 N 0.00 3.99 0.04 2.46 0.11 -1.26 -4.99 120.40 120.75 3a0h s VAL 417 Ca 0.00 1.19 0.07 0.00 -2.93 0.00 0.00 61.98 60.31 3a0h s VAL 417 Cb 0.00 -3.81 -0.02 0.00 -1.53 0.00 0.00 36.38 31.02 3a0h s VAL 417 CO 0.00 -0.15 -0.20 0.54 -3.33 0.00 0.00 175.10 171.96 3a0h s ASN 418 N 2.67 2.44 -0.30 3.54 2.20 -1.26 -3.73 114.94 120.50 3a0h s ASN 418 Ca 0.62 -0.51 -0.17 0.00 -0.94 0.00 0.00 52.86 51.87 3a0h s ASN 418 Cb -0.25 -0.21 0.20 0.00 -2.00 0.00 0.00 41.25 38.99 3a0h s ASN 418 CO 0.21 0.16 1.23 0.12 -2.94 0.00 0.00 177.10 175.89 3a0h s PHE 419 N -0.77 -0.15 -0.14 1.54 2.19 -1.24 -4.67 117.98 114.74 3a0h s PHE 419 Ca 0.07 0.29 0.02 0.00 0.33 0.00 0.00 56.93 57.64 3a0h s PHE 419 Cb -0.09 0.09 0.01 0.00 -1.31 0.00 0.00 43.02 41.73 3a0h s PHE 419 CO 0.01 -0.08 -0.19 0.08 1.83 0.00 0.00 175.22 176.88 3a0h s VAL 420 N 1.50 1.85 0.32 3.12 1.01 -1.26 -3.72 120.40 123.22 3a0h s VAL 420 Ca -0.05 -0.84 -0.29 0.00 0.00 0.00 0.00 61.98 60.80 3a0h s VAL 420 Cb -0.02 -1.66 -0.12 0.00 0.00 0.00 0.00 36.38 34.57 3a0h s VAL 420 CO -0.13 0.51 1.33 -0.24 0.00 0.00 0.00 175.10 176.57 3a0h n SER 421 N 4.28 2.83 -0.24 3.32 2.88 -1.26 -4.84 113.62 120.58 3a0h n SER 421 Ca -0.19 1.19 0.11 0.00 -1.33 0.00 0.00 58.87 58.64 3a0h n SER 421 Cb 0.51 -1.48 0.37 0.00 -0.75 0.00 0.00 64.21 62.86 3a0h n SER 421 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3a0h h PRO 422 N 2.96 0.68 -0.81 -1.46 0.11 -1.92 0.19 132.00 131.76 3a0h h PRO 422 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3a0h h PRO 422 Cb 1.28 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 3a0h h PRO 422 CO 0.66 0.45 0.52 0.00 -0.21 0.00 0.00 178.00 179.42 3a0h h ARG 423 N 0.70 1.07 0.27 1.05 3.08 -1.88 0.17 114.38 118.83 3a0h h ARG 423 Ca 0.41 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.38 3a0h h ARG 423 Cb 0.60 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 3a0h h ARG 423 CO -0.17 0.72 -0.26 0.77 -1.07 0.00 0.00 179.97 179.96 3a0h h SER 424 N 1.10 -0.71 -0.01 7.04 0.02 -0.97 0.90 113.55 120.91 3a0h h SER 424 Ca 0.29 0.06 0.03 0.00 -0.84 0.00 0.00 61.79 61.32 3a0h h SER 424 Cb -0.10 0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.63 3a0h h SER 424 CO -0.06 -0.34 -0.16 -0.50 -1.14 0.00 0.00 176.83 174.62 3a0h h TRP 425 N -0.52 -0.42 0.00 3.45 4.06 -1.31 0.15 115.95 121.36 3a0h h TRP 425 Ca -0.03 0.01 -0.00 0.00 2.06 0.00 0.00 58.89 60.93 3a0h h TRP 425 Cb 0.45 0.19 -0.00 0.00 -1.00 0.00 0.00 29.16 28.80 3a0h h TRP 425 CO -0.15 -0.24 -0.00 -0.07 -3.56 0.00 0.00 178.44 174.42 3a0h h LEU 426 N -0.26 -0.00 -0.73 -4.49 4.07 -0.64 -1.00 115.31 112.26 3a0h h LEU 426 Ca 0.06 0.00 0.14 0.00 0.08 0.00 0.00 57.88 58.15 3a0h h LEU 426 Cb 0.33 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 41.98 3a0h h LEU 426 CO -0.16 -0.00 0.27 0.00 -1.08 0.00 0.00 178.44 177.46 3a0h h ALA 427 N -1.67 0.99 -1.14 1.53 0.00 -0.80 -2.95 119.26 115.23 3a0h h ALA 427 Ca -0.00 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3a0h h ALA 427 Cb 0.00 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3a0h h ALA 427 CO -0.00 -0.23 0.00 -2.37 0.00 0.00 0.00 179.25 176.65 3a0h n THR 428 N -5.02 0.00 0.00 0.00 5.66 0.51 -3.05 114.28 112.38 3a0h n THR 428 Ca 0.13 1.31 0.00 0.00 -3.05 0.00 0.00 64.05 62.44 3a0h n THR 428 Cb 0.40 -2.29 0.00 0.00 -1.55 0.00 0.00 70.33 66.89 3a0h n THR 428 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 3a0h n SER 429 N -1.46 0.00 -0.44 1.09 3.41 -0.39 0.04 113.62 115.87 3a0h n SER 429 Ca 0.00 0.34 0.35 0.00 -0.26 0.00 0.00 58.87 59.30 3a0h n SER 429 Cb 0.00 -0.04 0.56 0.00 -0.26 0.00 0.00 64.21 64.47 3a0h n SER 429 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3a0h n HIS 430 N -1.06 0.29 0.04 7.33 8.25 -1.12 0.12 115.22 129.07 3a0h n HIS 430 Ca 0.00 0.29 -0.12 0.00 -0.26 0.00 0.00 57.72 57.63 3a0h n HIS 430 Cb 0.00 -0.68 -0.09 0.00 1.12 0.00 0.00 29.99 30.34 3a0h n HIS 430 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 3a0h h PHE 431 N 0.00 -0.14 -0.92 4.41 -0.00 -0.31 0.63 116.94 120.62 3a0h h PHE 431 Ca 0.68 -0.00 0.07 0.00 -0.00 0.00 0.00 57.97 58.72 3a0h h PHE 431 Cb 2.46 0.05 -0.06 0.00 -0.00 0.00 0.00 35.95 38.40 3a0h h PHE 431 CO -0.00 0.31 0.60 -0.24 -0.00 0.00 0.00 178.31 178.97 3a0h h VAL 432 N -0.65 1.06 0.41 1.41 3.04 0.11 1.24 116.25 122.87 3a0h h VAL 432 Ca -0.02 -0.36 -0.02 0.00 -1.01 0.00 0.00 66.70 65.30 3a0h h VAL 432 Cb 0.51 -0.07 0.00 0.00 -2.01 0.00 0.00 31.29 29.73 3a0h h VAL 432 CO 0.02 0.19 -0.20 -0.07 -1.01 0.00 0.00 177.57 176.51 3a0h h LEU 433 N 1.04 -0.46 -1.53 3.16 3.38 -1.21 -0.90 115.31 118.79 3a0h h LEU 433 Ca 0.40 -0.04 0.23 0.00 0.09 0.00 0.00 57.88 58.56 3a0h h LEU 433 Cb 0.20 0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.00 3a0h h LEU 433 CO -0.15 -0.02 0.64 0.00 0.09 0.00 0.00 178.44 178.99 3a0h h ALA 434 N -1.02 2.32 -0.73 1.53 0.00 0.63 0.57 119.26 122.56 3a0h h ALA 434 Ca -0.06 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3a0h h ALA 434 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3a0h h ALA 434 CO 0.09 -0.64 0.00 0.34 0.00 0.00 0.00 179.25 179.04 3a0h n PHE 435 N -4.51 0.00 -0.26 0.00 7.35 0.42 -1.90 117.46 118.57 3a0h n PHE 435 Ca 0.21 0.00 0.17 0.00 -0.76 0.00 0.00 57.45 57.07 3a0h n PHE 435 Cb 0.80 -0.38 0.32 0.00 0.35 0.00 0.00 39.48 40.58 3a0h n PHE 435 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 3a0h n PHE 436 N -1.64 0.67 -0.20 -5.13 0.99 -0.10 0.27 117.46 112.32 3a0h n PHE 436 Ca 0.00 0.92 -0.05 0.00 -0.00 0.00 0.00 57.45 58.32 3a0h n PHE 436 Cb 0.00 -1.19 0.05 0.00 -1.00 0.00 0.00 39.48 37.34 3a0h n PHE 436 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.76 177.50 3a0h h PHE 437 N 0.00 0.69 -0.71 1.38 0.05 0.19 0.16 116.94 118.70 3a0h h PHE 437 Ca 0.55 0.02 0.14 0.00 3.82 0.00 0.00 57.97 62.49 3a0h h PHE 437 Cb 1.29 -0.23 -0.05 0.00 2.00 0.00 0.00 35.95 38.97 3a0h h PHE 437 CO -0.23 0.41 0.48 1.25 -0.18 0.00 0.00 178.31 180.03 3a0h h LEU 438 N 0.73 0.38 -0.98 1.54 7.12 0.45 1.96 115.31 126.51 3a0h h LEU 438 Ca 0.23 0.02 -0.05 0.00 0.13 0.00 0.00 57.88 58.20 3a0h h LEU 438 Cb -0.01 -0.06 -0.03 0.00 -0.53 0.00 0.00 40.66 40.03 3a0h h LEU 438 CO -0.08 0.21 0.14 0.58 -0.13 0.00 0.00 178.44 179.15 3a0h h VAL 439 N 0.41 1.23 0.66 1.05 2.07 -0.22 -2.61 116.25 118.84 3a0h h VAL 439 Ca 0.34 -0.84 -0.03 0.00 0.82 0.00 0.00 66.70 67.00 3a0h h VAL 439 Cb 0.77 0.64 0.01 0.00 -1.52 0.00 0.00 31.29 31.19 3a0h h VAL 439 CO -0.11 0.31 -0.32 1.23 0.02 0.00 0.00 177.57 178.71 3a0h h GLY 440 N 0.99 -0.93 -1.83 2.17 0.00 0.48 -1.89 103.07 102.07 3a0h h GLY 440 Ca 0.19 0.34 0.55 0.00 0.00 0.00 0.00 47.33 48.41 3a0h h GLY 440 CO -0.00 -0.34 1.34 0.84 0.00 0.00 0.00 176.54 178.38 3a0h h HIS 441 N -1.18 0.07 0.07 5.60 -0.00 0.13 0.43 115.15 120.26 3a0h h HIS 441 Ca -0.09 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.28 3a0h h HIS 441 Cb 0.71 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 28.10 3a0h h HIS 441 CO 0.00 -0.04 -0.03 -0.07 -0.00 0.00 0.00 177.93 177.79 3a0h h LEU 442 N 0.00 -0.08 -2.24 0.26 3.38 -1.09 -2.95 115.31 112.59 3a0h h LEU 442 Ca 0.92 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.90 3a0h h LEU 442 Cb 3.61 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 44.38 3a0h h LEU 442 CO -0.07 0.10 0.25 -0.25 0.09 0.00 0.00 178.44 178.57 3a0h h TRP 443 N -0.40 0.00 0.00 1.13 -0.00 -0.17 1.12 115.95 117.63 3a0h h TRP 443 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.88 3a0h h TRP 443 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.23 3a0h h TRP 443 CO 0.02 0.00 -1.17 0.72 -0.00 0.00 0.00 178.44 178.01 3a0h n HIS 444 N -3.04 0.62 0.02 2.65 8.25 -0.35 -2.97 115.22 120.39 3a0h n HIS 444 Ca -0.01 0.18 -0.19 0.00 -0.26 0.00 0.00 57.72 57.44 3a0h n HIS 444 Cb 0.32 -0.75 -0.14 0.00 1.12 0.00 0.00 29.99 30.54 3a0h n HIS 444 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3a0h h ALA 445 N 2.14 0.42 -0.75 -1.41 0.00 -0.16 -2.87 119.26 116.63 3a0h h ALA 445 Ca 0.00 -1.33 0.01 0.00 0.00 0.00 0.00 54.91 53.59 3a0h h ALA 445 Cb 0.93 0.58 -0.04 0.00 0.00 0.00 0.00 17.79 19.26 3a0h h ALA 445 CO 0.00 1.29 0.50 0.78 0.00 0.00 0.00 179.25 181.82 3a0h h GLY 446 N 1.48 1.06 1.92 0.00 0.00 0.94 0.16 103.07 108.63 3a0h h GLY 446 Ca -0.37 -0.39 -0.22 0.00 0.00 0.00 0.00 47.33 46.35 3a0h h GLY 446 CO 0.11 0.38 -1.05 -0.09 0.00 0.00 0.00 176.54 175.89 3a0h h ARG 447 N 1.01 0.02 0.20 4.80 2.43 -1.67 -3.32 114.38 117.86 3a0h h ARG 447 Ca 0.28 -0.04 -0.32 0.00 -0.81 0.00 0.00 59.98 59.09 3a0h h ARG 447 Cb -0.11 0.02 0.02 0.00 -0.42 0.00 0.00 29.97 29.48 3a0h h ARG 447 CO -0.07 1.00 -1.46 0.00 -1.51 0.00 0.00 179.97 177.93 3a0h h ALA 448 N 0.96 -0.02 0.00 2.80 0.00 -1.32 -3.09 119.26 118.59 3a0h h ALA 448 Ca -0.03 -0.93 0.00 0.00 0.00 0.00 0.00 54.91 53.95 3a0h h ALA 448 Cb 1.80 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.77 3a0h h ALA 448 CO 0.13 0.85 0.00 -2.13 0.00 0.00 0.00 179.25 178.10 3a0h n ARG 449 N -3.63 0.11 0.05 0.00 3.00 0.53 -2.15 116.66 114.58 3a0h n ARG 449 Ca -0.16 0.45 -0.20 0.00 -0.00 0.00 0.00 57.85 57.94 3a0h n ARG 449 Cb 1.08 -1.76 -0.12 0.00 0.00 0.00 0.00 32.46 31.65 3a0h n ARG 449 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3a0h h ALA 450 N 2.21 0.03 -0.57 5.13 0.00 -1.64 -3.25 119.26 121.17 3a0h h ALA 450 Ca 0.00 -0.70 0.10 0.00 0.00 0.00 0.00 54.91 54.31 3a0h h ALA 450 Cb 0.19 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 17.99 3a0h h ALA 450 CO 0.00 0.56 0.15 0.00 0.00 0.00 0.00 179.25 179.96 3a0h h ALA 451 N 0.29 0.69 -0.54 0.00 0.00 -1.46 -0.38 119.26 117.86 3a0h h ALA 451 Ca -0.14 0.11 0.16 0.00 0.00 0.00 0.00 54.91 55.03 3a0h h ALA 451 Cb 1.69 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.58 3a0h h ALA 451 CO 0.19 -0.27 0.65 0.00 0.00 0.00 0.00 179.25 179.82 3a0h n ALA 452 N -2.53 0.52 0.00 0.00 0.00 -1.23 0.15 120.51 117.43 3a0h n ALA 452 Ca 0.08 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.70 3a0h n ALA 452 Cb 0.28 -0.31 0.00 0.00 0.00 0.00 0.00 19.45 19.42 3a0h n ALA 452 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a0h n ALA 453 N -1.78 0.72 -0.37 0.00 0.00 -0.79 -5.05 120.51 113.24 3a0h n ALA 453 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 3a0h n ALA 453 Cb 0.81 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.26 3a0h n ALA 453 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a0h n GLY 454 N 0.57 0.69 0.42 0.00 0.00 0.41 -4.94 105.19 102.34 3a0h n GLY 454 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 3a0h n GLY 454 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3a0h n PHE 455 N -2.01 0.30 0.17 1.61 1.16 -1.21 -4.07 117.46 113.40 3a0h n PHE 455 Ca 0.00 -0.14 0.02 0.00 -1.87 0.00 0.00 57.45 55.46 3a0h n PHE 455 Cb 0.00 -0.02 0.36 0.00 -1.61 0.00 0.00 39.48 38.22 3a0h n PHE 455 CO 0.00 0.00 0.00 1.05 -1.87 0.00 0.00 176.76 175.94 3a0h h GLU 456 N 1.21 0.08 -0.01 3.97 -0.00 -1.90 -2.08 114.58 115.84 3a0h h GLU 456 Ca 0.00 -0.03 -0.15 0.00 -0.00 0.00 0.00 59.36 59.19 3a0h h GLU 456 Cb 0.32 -0.01 -0.02 0.00 -0.00 0.00 0.00 28.75 29.05 3a0h h GLU 456 CO 0.01 0.38 -0.69 0.87 -0.00 0.00 0.00 179.01 179.59 3a0h h LYS 457 N 0.07 0.05 0.00 1.06 1.57 -1.93 -3.49 116.57 113.90 3a0h h LYS 457 Ca 0.01 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3a0h h LYS 457 Cb 0.58 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.90 3a0h h LYS 457 CO 0.04 0.71 0.00 0.41 -0.57 0.00 0.00 179.45 180.05 3a0h n GLY 458 N 0.44 -0.63 2.91 3.86 0.00 -0.78 -5.10 105.19 105.89 3a0h n GLY 458 Ca -0.01 -0.51 -0.28 0.00 0.00 0.00 0.00 46.02 45.22 3a0h n GLY 458 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a0h s ILE 459 N -4.00 1.14 -0.17 -0.61 1.01 -1.26 -4.46 121.20 112.84 3a0h s ILE 459 Ca 0.00 -0.55 -0.30 0.00 0.00 0.00 0.00 60.65 59.80 3a0h s ILE 459 Cb 0.00 -1.25 -0.08 0.00 0.01 0.00 0.00 42.46 41.15 3a0h s ILE 459 CO 0.00 0.22 2.13 -0.67 0.00 0.00 0.00 174.94 176.62 3a0h n ASP 460 N 4.88 3.30 0.15 3.58 -0.08 -1.26 -4.87 116.55 122.25 3a0h n ASP 460 Ca -0.12 0.46 0.04 0.00 -1.51 0.00 0.00 54.79 53.65 3a0h n ASP 460 Cb 0.48 -1.49 0.22 0.00 2.34 0.00 0.00 41.12 42.68 3a0h n ASP 460 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 3a0h n ARG 461 N 8.20 0.06 0.00 -0.67 1.74 -1.26 -1.46 116.66 123.27 3a0h n ARG 461 Ca 0.29 0.51 0.00 0.00 -0.77 0.00 0.00 57.85 57.88 3a0h n ARG 461 Cb 0.39 -2.12 0.00 0.00 -1.02 0.00 0.00 32.46 29.71 3a0h n ARG 461 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 3a0h n GLU 462 N -1.89 -0.10 -2.86 5.56 0.28 -1.26 -4.87 120.64 115.49 3a0h n GLU 462 Ca -0.01 -0.29 -0.12 0.00 -0.16 0.00 0.00 57.16 56.59 3a0h n GLU 462 Cb 0.44 -0.77 0.03 0.00 1.43 0.00 0.00 31.44 32.57 3a0h n GLU 462 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 3a0h n SER 463 N -0.07 0.43 -4.68 -1.84 2.88 -0.54 -5.10 113.62 104.71 3a0h n SER 463 Ca 0.00 -2.89 -0.38 0.00 -1.33 0.00 0.00 58.87 54.28 3a0h n SER 463 Cb 0.08 -0.12 -0.08 0.00 -0.75 0.00 0.00 64.21 63.34 3a0h n SER 463 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 3a0h s GLU 464 N -2.13 4.18 0.36 -1.46 -1.05 -1.19 -4.73 118.70 112.68 3a0h s GLU 464 Ca 0.30 0.16 0.17 0.00 -0.15 0.00 0.00 54.97 55.45 3a0h s GLU 464 Cb 0.40 -3.52 1.13 0.00 -0.44 0.00 0.00 34.13 31.69 3a0h s GLU 464 CO -0.03 0.01 1.68 -1.35 0.95 0.00 0.00 175.26 176.52 3a0h h PRO 465 N 7.28 0.31 -0.05 -4.83 0.11 -1.94 -2.61 132.00 130.26 3a0h h PRO 465 Ca -0.37 -0.02 -0.18 0.00 0.11 0.00 0.00 66.00 65.54 3a0h h PRO 465 Cb 1.16 -0.07 0.01 0.00 0.11 0.00 0.00 31.00 32.22 3a0h h PRO 465 CO 0.72 0.20 -0.67 0.28 -0.21 0.00 0.00 178.00 178.32 3a0h h VAL 466 N 0.32 1.36 0.00 3.15 2.07 -1.97 -3.18 116.25 118.00 3a0h h VAL 466 Ca 0.72 -2.02 0.00 0.00 0.82 0.00 0.00 66.70 66.22 3a0h h VAL 466 Cb 1.75 2.36 0.00 0.00 -1.52 0.00 0.00 31.29 33.89 3a0h h VAL 466 CO -0.53 0.61 0.00 -0.11 0.02 0.00 0.00 177.57 177.56 3a0h n LEU 467 N -4.12 0.00 -3.04 2.57 0.00 -0.99 -2.88 117.00 108.54 3a0h n LEU 467 Ca -0.09 0.00 -0.17 0.00 0.00 0.00 0.00 56.01 55.74 3a0h n LEU 467 Cb 0.70 0.00 -0.03 0.00 0.00 0.00 0.00 43.42 44.09 3a0h n LEU 467 CO 0.49 0.00 -0.10 -1.20 0.00 0.00 0.00 177.39 176.58 3a0h n SER 468 N -0.58 -1.24 -3.51 1.96 7.64 -1.20 -5.05 113.62 111.63 3a0h n SER 468 Ca 0.02 -2.87 -0.16 0.00 1.01 0.00 0.00 58.87 56.87 3a0h n SER 468 Cb 0.01 0.39 -0.05 0.00 -1.01 0.00 0.00 64.21 63.55 3a0h n SER 468 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 3a0h s MET 469 N -0.22 1.10 -0.36 1.43 -1.94 -1.14 -4.87 119.30 113.30 3a0h s MET 469 Ca 0.33 0.04 -0.27 0.00 -1.71 0.00 0.00 55.69 54.08 3a0h s MET 469 Cb 0.16 0.51 -0.05 0.00 2.01 0.00 0.00 34.83 37.46 3a0h s MET 469 CO -0.16 -0.38 2.24 -1.25 -0.01 0.00 0.00 175.02 175.46 3a0h s PRO 470 N -1.88 2.71 -0.32 2.03 0.04 -1.26 -4.87 135.00 131.45 3a0h s PRO 470 Ca -0.08 1.66 -0.39 0.00 0.04 0.00 0.00 61.00 62.23 3a0h s PRO 470 Cb -0.00 -4.44 -0.14 0.00 0.04 0.00 0.00 34.50 29.95 3a0h s PRO 470 CO 0.04 -2.59 1.95 -1.13 0.04 0.00 0.00 177.00 175.30 3a0h n SER 471 N 13.31 2.20 -0.31 6.66 3.41 -1.26 -4.79 113.62 132.85 3a0h n SER 471 Ca 0.31 0.80 0.27 0.00 -0.26 0.00 0.00 58.87 60.00 3a0h n SER 471 Cb 0.49 -1.17 0.46 0.00 -0.26 0.00 0.00 64.21 63.74 3a0h n SER 471 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3a0h n LEU 472 N 7.20 0.18 0.00 1.04 -0.00 -1.26 -5.31 117.00 118.84 3a0h n LEU 472 Ca 0.34 1.03 0.00 0.00 -0.00 0.00 0.00 56.01 57.38 3a0h n LEU 472 Cb 0.15 -0.51 0.00 0.00 -0.00 0.00 0.00 43.42 43.07 3a0h n LEU 472 CO 0.80 -1.13 0.00 0.47 -0.00 0.00 0.00 177.39 177.52