#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dyp n ARG 14 N 0.00 -1.35 0.22 5.56 1.74 -1.26 -4.77 116.66 116.80 3dyp n ARG 14 Ca 0.00 0.20 0.15 0.00 -0.77 0.00 0.00 57.85 57.44 3dyp n ARG 14 Cb 0.00 -3.58 0.75 0.00 -1.02 0.00 0.00 32.46 28.61 3dyp n ARG 14 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3dyp h ASP 15 N -2.06 0.00 -0.11 0.55 3.32 -1.95 -0.89 116.42 115.28 3dyp h ASP 15 Ca -0.67 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.38 3dyp h ASP 15 Cb 1.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.94 3dyp h ASP 15 CO 0.61 0.00 0.00 -2.67 -1.72 0.00 0.00 179.24 175.46 3dyp n TRP 16 N -2.59 0.15 -2.59 4.55 2.14 -1.26 -3.31 117.44 114.53 3dyp n TRP 16 Ca -0.01 -0.07 -0.13 0.00 2.07 0.00 0.00 57.50 59.36 3dyp n TRP 16 Cb 0.13 0.00 0.03 0.00 -0.81 0.00 0.00 31.31 30.65 3dyp n TRP 16 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 3dyp n GLU 17 N -0.19 2.06 -3.16 -2.67 1.02 -0.34 -0.38 120.64 116.99 3dyp n GLU 17 Ca 0.05 -3.70 0.04 0.00 -0.02 0.00 0.00 57.16 53.52 3dyp n GLU 17 Cb 0.10 -1.66 -0.00 0.00 -0.02 0.00 0.00 31.44 29.86 3dyp n GLU 17 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3dyp s ASN 18 N -3.40 -1.52 0.00 1.62 3.84 -1.21 -4.78 114.94 109.50 3dyp s ASN 18 Ca 0.35 0.32 0.12 0.00 0.21 0.00 0.00 52.86 53.85 3dyp s ASN 18 Cb 0.41 2.03 0.57 0.00 -0.55 0.00 0.00 41.25 43.72 3dyp s ASN 18 CO -0.03 -0.29 1.28 -0.81 -2.79 0.00 0.00 177.10 174.46 3dyp n PRO 19 N 5.42 0.14 0.00 0.43 -0.04 -1.26 -1.15 135.00 138.55 3dyp n PRO 19 Ca 0.04 0.19 0.13 0.00 -0.04 0.00 0.00 63.50 63.82 3dyp n PRO 19 Cb 0.53 -1.50 0.40 0.00 -0.04 0.00 0.00 33.50 32.90 3dyp n PRO 19 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dyp n GLY 20 N -0.31 -1.04 2.89 0.55 0.00 -1.26 -4.33 105.19 101.69 3dyp n GLY 20 Ca 0.05 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 3dyp n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dyp s VAL 21 N -2.75 1.60 -1.53 1.61 1.01 -0.30 -4.91 120.40 115.13 3dyp s VAL 21 Ca 0.19 -1.81 0.17 0.00 0.00 0.00 0.00 61.98 60.52 3dyp s VAL 21 Cb 0.19 -2.15 -0.01 0.00 0.00 0.00 0.00 36.38 34.40 3dyp s VAL 21 CO 0.58 -0.57 0.88 0.35 0.00 0.00 0.00 175.10 176.34 3dyp n THR 22 N 4.55 0.00 -3.61 3.92 -2.24 -1.26 -4.79 114.28 110.84 3dyp n THR 22 Ca -0.01 -0.32 -0.01 0.00 -2.27 0.00 0.00 64.05 61.45 3dyp n THR 22 Cb 0.42 1.19 -0.01 0.00 -2.10 0.00 0.00 70.33 69.83 3dyp n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dyp s GLN 23 N -1.99 0.42 -0.11 -0.78 1.03 -1.26 -1.40 119.66 115.56 3dyp s GLN 23 Ca 0.14 -0.21 -0.05 0.00 0.04 0.00 0.00 55.36 55.28 3dyp s GLN 23 Cb 0.14 0.16 0.05 0.00 0.03 0.00 0.00 33.01 33.38 3dyp s GLN 23 CO 0.43 -0.19 0.26 -0.51 -2.54 0.00 0.00 175.29 172.74 3dyp s LEU 24 N -2.66 0.36 -0.60 2.60 1.43 -0.31 -4.86 118.68 114.64 3dyp s LEU 24 Ca 0.12 0.55 0.00 0.00 -1.03 0.00 0.00 54.13 53.77 3dyp s LEU 24 Cb 0.02 0.77 0.00 0.00 0.03 0.00 0.00 46.19 47.01 3dyp s LEU 24 CO -0.04 -0.17 0.00 0.59 0.23 0.00 0.00 176.35 176.96 3dyp n ASN 25 N 4.26 -5.16 -4.75 2.29 3.02 -1.26 -1.45 115.26 112.21 3dyp n ASN 25 Ca -0.25 0.14 -0.40 0.00 -0.03 0.00 0.00 54.58 54.04 3dyp n ASN 25 Cb 0.53 -3.15 -0.05 0.00 -0.61 0.00 0.00 39.78 36.50 3dyp n ASN 25 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3dyp s ARG 26 N -2.17 4.70 0.67 3.52 3.52 -1.26 -4.64 118.95 123.28 3dyp s ARG 26 Ca 0.00 1.70 -0.11 0.00 -0.13 0.00 0.00 55.73 57.19 3dyp s ARG 26 Cb 0.00 -3.23 -0.01 0.00 -1.56 0.00 0.00 34.95 30.15 3dyp s ARG 26 CO 0.00 0.28 1.06 -0.51 -0.81 0.00 0.00 175.30 175.33 3dyp s LEU 27 N -1.21 3.06 0.62 -0.88 1.43 -0.34 -5.00 118.68 116.35 3dyp s LEU 27 Ca 0.44 1.31 -0.19 0.00 -1.03 0.00 0.00 54.13 54.66 3dyp s LEU 27 Cb -0.30 -4.22 -0.02 0.00 0.03 0.00 0.00 46.19 41.68 3dyp s LEU 27 CO 0.38 -1.15 1.26 0.00 0.23 0.00 0.00 176.35 177.06 3dyp n ALA 28 N -2.91 1.11 -1.82 4.21 0.00 -1.26 -4.67 120.51 115.16 3dyp n ALA 28 Ca 0.07 0.03 -0.32 0.00 0.00 0.00 0.00 53.44 53.21 3dyp n ALA 28 Cb 0.55 -2.30 -0.03 0.00 0.00 0.00 0.00 19.45 17.67 3dyp n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dyp s ALA 29 N -1.38 3.03 0.16 0.00 0.00 -1.26 -4.99 121.76 117.32 3dyp s ALA 29 Ca 0.79 0.20 -0.25 0.00 0.00 0.00 0.00 51.96 52.70 3dyp s ALA 29 Cb -0.39 -3.13 0.06 0.00 0.00 0.00 0.00 23.12 19.66 3dyp s ALA 29 CO 0.43 -0.31 0.95 -3.38 0.00 0.00 0.00 175.76 173.45 3dyp s HIS 30 N -2.62 -0.14 0.90 0.00 -3.43 -1.26 -4.87 115.29 103.87 3dyp s HIS 30 Ca 0.59 -0.17 -0.12 0.00 -0.80 0.00 0.00 55.06 54.56 3dyp s HIS 30 Cb -0.11 0.64 0.13 0.00 -1.43 0.00 0.00 32.58 31.82 3dyp s HIS 30 CO 0.33 -0.84 1.10 -2.14 -2.00 0.00 0.00 174.74 171.19 3dyp s PRO 31 N -3.31 1.20 0.04 -0.38 0.02 -1.14 -4.29 135.00 127.15 3dyp s PRO 31 Ca 0.12 0.62 -0.35 0.00 0.02 0.00 0.00 61.00 61.41 3dyp s PRO 31 Cb -0.02 -1.82 -0.14 0.00 0.02 0.00 0.00 34.50 32.55 3dyp s PRO 31 CO 0.02 -2.23 1.66 -2.30 -0.33 0.00 0.00 177.00 173.82 3dyp n PRO 32 N -3.84 1.97 -4.39 5.54 -0.02 -1.26 -4.97 135.00 128.04 3dyp n PRO 32 Ca 0.06 0.72 -0.24 0.00 -2.02 0.00 0.00 63.50 62.02 3dyp n PRO 32 Cb 0.57 -2.49 -0.09 0.00 -0.02 0.00 0.00 33.50 31.46 3dyp n PRO 32 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3dyp s PHE 33 N 2.06 2.46 0.00 6.00 2.99 -1.26 -4.77 117.98 125.47 3dyp s PHE 33 Ca 0.85 -0.29 0.00 0.00 0.00 0.00 0.00 56.93 57.50 3dyp s PHE 33 Cb -0.74 -1.11 0.00 0.00 0.00 0.00 0.00 43.02 41.17 3dyp s PHE 33 CO 0.45 0.63 0.00 0.00 -0.00 0.00 0.00 175.22 176.31 3dyp n ALA 34 N -0.50 0.00 -4.06 5.36 0.00 -1.26 -5.04 120.51 115.01 3dyp n ALA 34 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.08 3dyp n ALA 34 Cb 0.59 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.00 3dyp n ALA 34 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3dyp n SER 35 N 0.00 -0.51 -4.75 0.00 2.88 -1.26 -4.28 113.62 105.69 3dyp n SER 35 Ca 0.00 -1.12 -0.35 0.00 -1.33 0.00 0.00 58.87 56.07 3dyp n SER 35 Cb 0.07 -2.51 0.04 0.00 -0.75 0.00 0.00 64.21 61.06 3dyp n SER 35 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 3dyp s TRP 36 N -4.04 2.40 -0.14 0.66 0.51 -0.80 -4.58 118.94 112.96 3dyp s TRP 36 Ca 0.07 1.53 0.17 0.00 -2.12 0.00 0.00 56.10 55.75 3dyp s TRP 36 Cb -0.03 -3.44 0.30 0.00 -0.81 0.00 0.00 33.47 29.49 3dyp s TRP 36 CO 0.93 -2.16 1.18 0.54 -0.51 0.00 0.00 176.95 176.93 3dyp n ARG 37 N -1.72 1.65 -3.69 4.98 5.12 -1.26 -0.54 116.66 121.19 3dyp n ARG 37 Ca 0.13 -2.54 -0.14 0.00 -1.93 0.00 0.00 57.85 53.37 3dyp n ARG 37 Cb 0.50 -1.51 -0.14 0.00 -1.16 0.00 0.00 32.46 30.15 3dyp n ARG 37 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 3dyp s ASN 38 N -2.60 0.30 0.34 0.55 3.84 -1.26 -4.97 114.94 111.15 3dyp s ASN 38 Ca 0.31 0.44 0.11 0.00 0.21 0.00 0.00 52.86 53.93 3dyp s ASN 38 Cb 0.27 0.41 0.61 0.00 -0.55 0.00 0.00 41.25 41.98 3dyp s ASN 38 CO 0.04 -0.21 1.77 0.28 -2.79 0.00 0.00 177.10 176.19 3dyp h SER 39 N 7.93 0.06 0.12 -4.21 0.02 -1.97 -2.73 113.55 112.78 3dyp h SER 39 Ca -0.24 -0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 60.57 3dyp h SER 39 Cb 1.13 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.64 3dyp h SER 39 CO 0.23 0.47 -0.40 -0.08 -1.14 0.00 0.00 176.83 175.91 3dyp h GLU 40 N 0.05 0.36 -0.48 3.45 4.57 -1.98 -0.75 114.58 119.80 3dyp h GLU 40 Ca 0.00 -0.17 -0.08 0.00 -1.18 0.00 0.00 59.36 57.92 3dyp h GLU 40 Cb 0.75 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.32 3dyp h GLU 40 CO 0.06 0.71 -0.05 0.93 -1.18 0.00 0.00 179.01 179.48 3dyp h GLU 41 N 0.30 0.83 -0.54 1.92 4.39 -1.89 -0.48 114.58 119.10 3dyp h GLU 41 Ca 0.03 -0.25 -0.09 0.00 0.34 0.00 0.00 59.36 59.39 3dyp h GLU 41 Cb 0.84 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.39 3dyp h GLU 41 CO 0.07 0.86 -0.02 0.00 -1.16 0.00 0.00 179.01 178.76 3dyp h ALA 42 N 1.19 0.74 -0.64 3.43 0.00 -1.25 -1.15 119.26 121.58 3dyp h ALA 42 Ca 0.14 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.76 3dyp h ALA 42 Cb 0.52 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 3dyp h ALA 42 CO 0.03 0.58 0.41 -0.09 0.00 0.00 0.00 179.25 180.17 3dyp h ARG 43 N 0.85 0.79 -0.01 0.00 2.43 -0.74 -2.69 114.38 115.02 3dyp h ARG 43 Ca 0.15 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3dyp h ARG 43 Cb 0.56 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 3dyp h ARG 43 CO 0.03 0.53 -0.01 0.25 -1.51 0.00 0.00 179.97 179.25 3dyp n THR 44 N -4.68 0.00 -2.54 0.20 -2.24 -0.23 -4.93 114.28 99.87 3dyp n THR 44 Ca 0.06 -0.17 -0.20 0.00 -2.27 0.00 0.00 64.05 61.46 3dyp n THR 44 Cb 0.05 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 3dyp n THR 44 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3dyp n ASP 45 N -0.22 -5.74 -4.90 3.42 2.03 -0.52 -4.97 116.55 105.65 3dyp n ASP 45 Ca 0.20 -0.09 -0.29 0.00 0.52 0.00 0.00 54.79 55.14 3dyp n ASP 45 Cb 0.29 -4.72 0.05 0.00 -0.72 0.00 0.00 41.12 36.02 3dyp n ASP 45 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3dyp s ARG 46 N -5.16 2.74 0.42 -0.67 0.52 -0.71 -4.99 118.95 111.10 3dyp s ARG 46 Ca 0.08 0.22 -0.26 0.00 -0.52 0.00 0.00 55.73 55.25 3dyp s ARG 46 Cb -0.03 -2.11 -0.10 0.00 0.52 0.00 0.00 34.95 33.23 3dyp s ARG 46 CO 0.10 -1.00 1.38 -2.30 0.02 0.00 0.00 175.30 173.50 3dyp n PRO 47 N -2.90 2.22 -4.50 3.54 -0.02 -1.26 -4.85 135.00 127.23 3dyp n PRO 47 Ca 0.06 0.79 -0.34 0.00 -2.02 0.00 0.00 63.50 61.99 3dyp n PRO 47 Cb 0.58 -2.53 -0.11 0.00 -0.02 0.00 0.00 33.50 31.42 3dyp n PRO 47 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3dyp s SER 48 N -0.41 4.82 0.20 2.55 0.15 -1.26 -4.96 113.70 114.79 3dyp s SER 48 Ca 0.59 -0.02 0.21 0.00 0.70 0.00 0.00 55.95 57.44 3dyp s SER 48 Cb -0.48 -1.42 0.90 0.00 -1.71 0.00 0.00 66.02 63.30 3dyp s SER 48 CO 0.59 0.31 1.65 0.00 1.20 0.00 0.00 173.24 176.99 3dyp n GLN 49 N 2.60 0.15 -0.12 5.44 1.13 -1.26 -2.08 117.38 123.24 3dyp n GLN 49 Ca -0.18 0.39 0.11 0.00 -1.94 0.00 0.00 57.00 55.37 3dyp n GLN 49 Cb 0.53 -1.79 0.31 0.00 0.11 0.00 0.00 30.24 29.40 3dyp n GLN 49 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3dyp n GLN 50 N -2.07 1.96 -3.97 -1.09 3.00 -1.26 -4.69 117.38 109.26 3dyp n GLN 50 Ca 0.02 -1.45 -0.31 0.00 -0.01 0.00 0.00 57.00 55.26 3dyp n GLN 50 Cb 0.21 -1.42 -0.15 0.00 0.00 0.00 0.00 30.24 28.88 3dyp n GLN 50 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 3dyp s LEU 51 N -1.50 3.55 -0.01 1.08 2.96 -0.88 -1.03 118.68 122.85 3dyp s LEU 51 Ca 0.33 -1.66 -0.00 0.00 -0.22 0.00 0.00 54.13 52.58 3dyp s LEU 51 Cb 0.19 -1.39 -0.04 0.00 0.50 0.00 0.00 46.19 45.45 3dyp s LEU 51 CO 0.27 -0.30 0.06 -0.13 -1.32 0.00 0.00 176.35 174.93 3dyp s ARG 52 N 1.17 3.02 0.04 1.98 0.52 0.67 -4.70 118.95 121.65 3dyp s ARG 52 Ca 0.02 -0.49 -0.20 0.00 -0.52 0.00 0.00 55.73 54.54 3dyp s ARG 52 Cb -0.19 -2.83 -0.06 0.00 0.52 0.00 0.00 34.95 32.39 3dyp s ARG 52 CO -0.09 0.65 0.57 0.45 0.02 0.00 0.00 175.30 176.90 3dyp s SER 53 N -1.61 7.01 -0.14 0.23 0.15 -1.26 -1.05 113.70 117.03 3dyp s SER 53 Ca 0.21 1.20 0.16 0.00 0.70 0.00 0.00 55.95 58.22 3dyp s SER 53 Cb -0.12 -2.36 0.60 0.00 -1.71 0.00 0.00 66.02 62.44 3dyp s SER 53 CO 0.12 0.20 1.52 0.18 1.20 0.00 0.00 173.24 176.46 3dyp n LEU 54 N 2.16 4.33 -4.77 3.45 4.77 0.17 -4.91 117.00 122.20 3dyp n LEU 54 Ca -0.09 -2.67 -0.35 0.00 -0.03 0.00 0.00 56.01 52.87 3dyp n LEU 54 Cb 0.51 -0.53 0.01 0.00 -2.33 0.00 0.00 43.42 41.08 3dyp n LEU 54 CO 0.42 0.72 0.78 0.20 -1.33 0.00 0.00 177.39 178.18 3dyp s ASN 55 N -1.27 5.57 0.00 -1.43 0.01 -1.23 -4.84 114.94 111.75 3dyp s ASN 55 Ca 0.44 2.17 0.00 0.00 -0.71 0.00 0.00 52.86 54.76 3dyp s ASN 55 Cb 0.32 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 39.40 3dyp s ASN 55 CO 0.16 -1.32 0.00 0.61 -1.51 0.00 0.00 177.10 175.04 3dyp n GLY 56 N 0.09 0.49 3.65 0.66 0.00 -0.49 -5.01 105.19 104.58 3dyp n GLY 56 Ca 0.12 -1.36 -0.42 0.00 0.00 0.00 0.00 46.02 44.36 3dyp n GLY 56 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dyp s GLU 57 N -2.00 4.21 0.50 1.61 2.02 -1.26 -0.99 118.70 122.79 3dyp s GLU 57 Ca 0.00 0.95 0.03 0.00 0.02 0.00 0.00 54.97 55.97 3dyp s GLU 57 Cb 0.00 -3.63 -0.01 0.00 0.10 0.00 0.00 34.13 30.59 3dyp s GLU 57 CO 0.00 -0.47 0.08 -1.58 0.02 0.00 0.00 175.26 173.31 3dyp s TRP 58 N 2.67 1.93 0.00 1.61 0.52 -0.35 -4.93 118.94 120.38 3dyp s TRP 58 Ca 0.35 -0.89 0.00 0.00 0.02 0.00 0.00 56.10 55.59 3dyp s TRP 58 Cb -0.16 -1.70 -0.04 0.00 -1.15 0.00 0.00 33.47 30.43 3dyp s TRP 58 CO 0.08 0.13 0.05 1.03 0.02 0.00 0.00 176.95 178.27 3dyp s ARG 59 N -3.93 2.95 -0.12 4.98 1.81 -0.16 -1.34 118.95 123.14 3dyp s ARG 59 Ca 0.15 -0.54 -0.12 0.00 -1.72 0.00 0.00 55.73 53.50 3dyp s ARG 59 Cb 0.02 -2.78 0.03 0.00 -0.45 0.00 0.00 34.95 31.77 3dyp s ARG 59 CO 0.08 0.64 0.33 0.12 -0.68 0.00 0.00 175.30 175.79 3dyp s PHE 60 N -1.16 -0.35 -0.01 -0.53 5.36 0.25 -1.20 117.98 120.34 3dyp s PHE 60 Ca 0.22 0.84 0.00 0.00 -0.96 0.00 0.00 56.93 57.03 3dyp s PHE 60 Cb -0.12 0.12 0.00 0.00 -0.34 0.00 0.00 43.02 42.69 3dyp s PHE 60 CO 0.13 -0.19 -0.01 0.00 -1.46 0.00 0.00 175.22 173.69 3dyp s ALA 61 N 0.07 0.15 -0.09 11.12 0.00 -0.64 -1.13 121.76 131.25 3dyp s ALA 61 Ca -0.01 -0.02 -0.06 0.00 0.00 0.00 0.00 51.96 51.87 3dyp s ALA 61 Cb -0.03 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 22.97 3dyp s ALA 61 CO 0.01 0.01 0.16 -0.46 0.00 0.00 0.00 175.76 175.48 3dyp s TRP 62 N 0.16 3.59 0.13 0.00 -0.00 -1.26 -0.38 118.94 121.18 3dyp s TRP 62 Ca -0.01 0.51 0.06 0.00 -0.00 0.00 0.00 56.10 56.66 3dyp s TRP 62 Cb -0.03 -1.93 -0.04 0.00 -0.00 0.00 0.00 33.47 31.47 3dyp s TRP 62 CO -0.00 0.71 -0.14 -0.06 -0.00 0.00 0.00 176.95 177.46 3dyp s PHE 63 N -1.10 1.42 -0.77 5.86 0.40 0.60 -4.99 117.98 119.39 3dyp s PHE 63 Ca 0.18 -0.58 0.27 0.00 -0.60 0.00 0.00 56.93 56.20 3dyp s PHE 63 Cb -0.12 -0.73 0.88 0.00 0.51 0.00 0.00 43.02 43.56 3dyp s PHE 63 CO 0.08 0.16 1.80 -0.35 0.70 0.00 0.00 175.22 177.61 3dyp n PRO 64 N 0.36 0.22 -3.57 0.24 -0.04 -1.26 -0.26 135.00 130.69 3dyp n PRO 64 Ca -0.14 0.18 -0.12 0.00 -0.04 0.00 0.00 63.50 63.38 3dyp n PRO 64 Cb 0.58 -1.76 -0.05 0.00 -0.04 0.00 0.00 33.50 32.23 3dyp n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dyp s ALA 65 N -3.08 -1.91 0.51 0.55 0.00 -1.20 -0.76 121.76 115.86 3dyp s ALA 65 Ca 0.11 1.56 0.17 0.00 0.00 0.00 0.00 51.96 53.80 3dyp s ALA 65 Cb 0.13 -0.63 1.25 0.00 0.00 0.00 0.00 23.12 23.88 3dyp s ALA 65 CO 0.59 -0.32 2.09 -1.00 0.00 0.00 0.00 175.76 177.12 3dyp h PRO 66 N 2.72 0.08 0.00 0.00 0.13 -1.87 -1.10 132.00 131.95 3dyp h PRO 66 Ca -0.20 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 3dyp h PRO 66 Cb 1.16 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3dyp h PRO 66 CO 0.31 0.05 0.00 0.93 -0.23 0.00 0.00 178.00 179.06 3dyp h GLU 67 N 0.08 0.00 -0.01 0.86 3.07 -1.95 -1.71 114.58 114.92 3dyp h GLU 67 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.96 3dyp h GLU 67 Cb 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 3dyp h GLU 67 CO -0.01 0.00 -0.15 0.00 -1.40 0.00 0.00 179.01 177.45 3dyp n ALA 68 N -1.92 2.87 -2.56 3.43 0.00 -0.42 -4.88 120.51 117.04 3dyp n ALA 68 Ca -0.01 -0.43 -0.42 0.00 0.00 0.00 0.00 53.44 52.58 3dyp n ALA 68 Cb 0.11 -1.14 -0.03 0.00 0.00 0.00 0.00 19.45 18.39 3dyp n ALA 68 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3dyp s VAL 69 N -2.29 4.47 0.32 0.00 1.01 -0.65 -5.00 120.40 118.26 3dyp s VAL 69 Ca 0.30 1.77 -0.29 0.00 0.00 0.00 0.00 61.98 63.76 3dyp s VAL 69 Cb 0.20 -4.14 -0.10 0.00 0.00 0.00 0.00 36.38 32.34 3dyp s VAL 69 CO 0.44 0.05 1.24 -2.84 0.00 0.00 0.00 175.10 173.99 3dyp s PRO 70 N 1.76 4.43 0.53 2.72 0.02 -1.26 -4.92 135.00 138.28 3dyp s PRO 70 Ca 0.54 2.08 0.25 0.00 0.02 0.00 0.00 61.00 63.88 3dyp s PRO 70 Cb -0.23 -3.10 1.47 0.00 0.02 0.00 0.00 34.50 32.66 3dyp s PRO 70 CO 0.23 -0.07 2.12 0.93 -0.33 0.00 0.00 177.00 179.88 3dyp h GLU 71 N 3.49 0.00 -0.91 5.54 3.07 -1.98 -2.00 114.58 121.79 3dyp h GLU 71 Ca -0.48 0.00 0.15 0.00 -0.50 0.00 0.00 59.36 58.53 3dyp h GLU 71 Cb 1.22 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 29.06 3dyp h GLU 71 CO 0.66 0.08 0.58 0.66 -1.40 0.00 0.00 179.01 179.60 3dyp h SER 72 N 0.00 0.65 -0.64 1.42 4.64 -1.92 -1.88 113.55 115.82 3dyp h SER 72 Ca -0.00 0.05 0.19 0.00 -0.47 0.00 0.00 61.79 61.55 3dyp h SER 72 Cb 0.20 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 62.18 3dyp h SER 72 CO 0.01 0.32 0.55 -0.25 -0.87 0.00 0.00 176.83 176.59 3dyp h TRP 73 N 0.68 0.00 -0.19 4.77 7.01 -1.48 0.59 115.95 127.33 3dyp h TRP 73 Ca 0.46 0.00 -0.09 0.00 2.11 0.00 0.00 58.89 61.38 3dyp h TRP 73 Cb 0.77 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.81 3dyp h TRP 73 CO -0.00 0.00 -0.26 -0.07 -2.79 0.00 0.00 178.44 175.32 3dyp h LEU 74 N 0.00 0.35 0.00 0.65 3.38 -1.53 -3.25 115.31 114.91 3dyp h LEU 74 Ca 0.31 -0.11 -0.35 0.00 0.09 0.00 0.00 57.88 57.81 3dyp h LEU 74 Cb 1.40 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.99 3dyp h LEU 74 CO -0.00 0.61 -2.33 -0.62 0.09 0.00 0.00 178.44 176.18 3dyp n GLU 75 N -4.14 0.82 -3.65 1.13 -0.58 -0.58 -3.32 120.64 110.33 3dyp n GLU 75 Ca -0.01 0.01 -0.11 0.00 -0.42 0.00 0.00 57.16 56.64 3dyp n GLU 75 Cb 0.39 -1.49 -0.05 0.00 -0.57 0.00 0.00 31.44 29.71 3dyp n GLU 75 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3dyp n ASP 77 N -0.13 2.54 -4.69 0.00 2.03 -1.26 -3.93 116.55 111.11 3dyp n ASP 77 Ca -0.16 1.17 -0.41 0.00 0.52 0.00 0.00 54.79 55.90 3dyp n ASP 77 Cb 0.63 -1.42 -0.04 0.00 -0.72 0.00 0.00 41.12 39.57 3dyp n ASP 77 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3dyp s LEU 78 N -0.19 4.25 0.49 -2.67 1.43 -1.26 -4.90 118.68 115.83 3dyp s LEU 78 Ca 0.63 1.27 0.17 0.00 -1.03 0.00 0.00 54.13 55.17 3dyp s LEU 78 Cb -0.64 -3.26 1.20 0.00 0.03 0.00 0.00 46.19 43.53 3dyp s LEU 78 CO 0.55 -0.30 2.06 -0.65 0.23 0.00 0.00 176.35 178.24 3dyp h PRO 79 N 7.08 0.15 0.00 1.29 0.11 -2.03 0.37 132.00 138.97 3dyp h PRO 79 Ca -0.34 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3dyp h PRO 79 Cb 1.16 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3dyp h PRO 79 CO 0.80 0.10 0.00 0.93 -0.21 0.00 0.00 178.00 179.62 3dyp h GLU 80 N 0.16 0.00 -7.25 1.05 3.07 -1.98 -3.45 114.58 106.18 3dyp h GLU 80 Ca 0.14 0.00 -0.52 0.00 -0.50 0.00 0.00 59.36 58.48 3dyp h GLU 80 Cb 0.38 0.00 0.18 0.00 -0.84 0.00 0.00 28.75 28.47 3dyp h GLU 80 CO -0.02 0.00 0.28 0.00 -1.40 0.00 0.00 179.01 177.87 3dyp s ALA 81 N -3.57 1.72 0.33 3.43 0.00 0.13 -4.95 121.76 118.85 3dyp s ALA 81 Ca 0.02 0.65 0.07 0.00 0.00 0.00 0.00 51.96 52.70 3dyp s ALA 81 Cb 0.09 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 3dyp s ALA 81 CO 0.55 -2.44 0.31 -0.51 0.00 0.00 0.00 175.76 173.67 3dyp s ASP 82 N -2.56 5.40 -0.25 0.00 1.01 -0.29 -4.87 116.67 115.11 3dyp s ASP 82 Ca 0.68 -0.44 -0.10 0.00 0.71 0.00 0.00 52.55 53.41 3dyp s ASP 82 Cb -0.24 -1.03 -0.04 0.00 1.01 0.00 0.00 42.92 42.62 3dyp s ASP 82 CO 0.54 -0.35 0.14 -0.89 0.21 0.00 0.00 175.17 174.82 3dyp s THR 83 N -2.28 5.02 0.17 -1.27 2.01 -1.26 -0.59 115.64 117.44 3dyp s THR 83 Ca 0.41 0.07 0.02 0.00 0.31 0.00 0.00 61.69 62.50 3dyp s THR 83 Cb -0.06 -3.36 -0.05 0.00 0.01 0.00 0.00 72.50 69.04 3dyp s THR 83 CO 0.27 0.31 -0.02 0.68 -0.69 0.00 0.00 174.62 175.18 3dyp s VAL 84 N 1.43 0.80 0.16 3.82 -7.23 -0.45 -4.95 120.40 113.97 3dyp s VAL 84 Ca 0.07 -1.99 -0.22 0.00 -1.81 0.00 0.00 61.98 58.02 3dyp s VAL 84 Cb -0.15 -2.08 -0.08 0.00 0.56 0.00 0.00 36.38 34.64 3dyp s VAL 84 CO 0.07 -0.53 0.70 -0.69 -0.31 0.00 0.00 175.10 174.34 3dyp s VAL 85 N -3.57 4.54 -0.07 1.32 1.01 -1.26 -1.22 120.40 121.14 3dyp s VAL 85 Ca 0.22 1.43 0.03 0.00 0.00 0.00 0.00 61.98 63.67 3dyp s VAL 85 Cb 0.05 -3.99 0.01 0.00 0.00 0.00 0.00 36.38 32.46 3dyp s VAL 85 CO 0.03 0.44 -0.17 -0.69 0.00 0.00 0.00 175.10 174.72 3dyp s VAL 86 N -1.25 1.46 0.56 2.92 1.01 -0.16 -4.10 120.40 120.85 3dyp s VAL 86 Ca 0.36 -0.68 -0.18 0.00 0.00 0.00 0.00 61.98 61.48 3dyp s VAL 86 Cb -0.20 -1.29 -0.05 0.00 0.00 0.00 0.00 36.38 34.83 3dyp s VAL 86 CO 0.23 0.43 1.07 -2.16 0.00 0.00 0.00 175.10 174.66 3dyp s PRO 87 N 0.47 3.41 0.05 2.72 0.04 -1.26 -1.40 135.00 139.04 3dyp s PRO 87 Ca -0.14 1.34 -0.28 0.00 0.04 0.00 0.00 61.00 61.95 3dyp s PRO 87 Cb -0.16 -2.04 0.09 0.00 0.04 0.00 0.00 34.50 32.43 3dyp s PRO 87 CO 0.05 -0.75 1.01 -1.54 0.04 0.00 0.00 177.00 175.81 3dyp s SER 88 N -2.36 -0.21 -0.19 6.66 1.04 -0.21 -4.94 113.70 113.49 3dyp s SER 88 Ca 0.66 -0.20 -0.05 0.00 0.48 0.00 0.00 55.95 56.84 3dyp s SER 88 Cb -0.18 0.37 -0.03 0.00 0.10 0.00 0.00 66.02 66.29 3dyp s SER 88 CO 0.31 -0.66 -0.00 0.20 0.98 0.00 0.00 173.24 174.06 3dyp s ASN 89 N -2.74 4.89 0.44 7.02 -0.87 -1.26 -3.17 114.94 119.25 3dyp s ASN 89 Ca 0.10 -0.17 0.30 0.00 -1.57 0.00 0.00 52.86 51.53 3dyp s ASN 89 Cb -0.00 -1.83 1.45 0.00 -0.02 0.00 0.00 41.25 40.85 3dyp s ASN 89 CO -0.03 0.09 1.91 4.11 -2.57 0.00 0.00 177.10 180.61 3dyp h TRP 90 N 7.30 0.00 0.00 2.20 0.09 -1.74 0.39 115.95 124.20 3dyp h TRP 90 Ca -0.35 0.00 -0.09 0.00 0.09 0.00 0.00 58.89 58.54 3dyp h TRP 90 Cb 1.18 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 30.41 3dyp h TRP 90 CO 0.58 0.00 -0.42 1.96 0.09 0.00 0.00 178.44 180.64 3dyp h GLN 91 N 0.00 0.00 0.00 0.12 7.50 -1.80 -2.45 115.11 118.49 3dyp h GLN 91 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 3dyp h GLN 91 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.75 3dyp h GLN 91 CO 0.00 0.42 0.00 -1.33 -1.50 0.00 0.00 178.83 176.42 3dyp n MET 92 N -4.00 0.06 0.00 1.46 2.81 0.13 -1.99 117.12 115.59 3dyp n MET 92 Ca -0.02 0.18 0.12 0.00 -1.81 0.00 0.00 57.70 56.17 3dyp n MET 92 Cb 0.45 -1.59 0.14 0.00 -0.71 0.00 0.00 33.22 31.52 3dyp n MET 92 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 3dyp n HIS 93 N -1.69 0.00 -0.73 2.03 8.25 -0.95 -4.98 115.22 117.15 3dyp n HIS 93 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 3dyp n HIS 93 Cb 0.27 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.33 3dyp n HIS 93 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dyp n GLY 94 N 1.39 0.63 0.22 -1.41 0.00 -0.84 -4.97 105.19 100.22 3dyp n GLY 94 Ca 0.10 -0.08 -0.00 0.00 0.00 0.00 0.00 46.02 46.03 3dyp n GLY 94 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3dyp h TYR 95 N 0.00 0.32 -3.41 1.61 -1.99 -1.69 -3.46 116.97 108.36 3dyp h TYR 95 Ca 0.00 -0.06 -0.01 0.00 2.00 0.00 0.00 58.73 60.66 3dyp h TYR 95 Cb 0.00 -0.08 -0.08 0.00 2.00 0.00 0.00 36.73 38.57 3dyp h TYR 95 CO 0.00 0.53 0.01 0.16 -0.00 0.00 0.00 178.16 178.86 3dyp s ASP 96 N -6.86 -0.16 0.08 3.88 1.47 -1.26 -5.04 116.67 108.77 3dyp s ASP 96 Ca -0.05 -0.77 -0.25 0.00 1.18 0.00 0.00 52.55 52.66 3dyp s ASP 96 Cb 0.14 0.63 -0.06 0.00 -0.34 0.00 0.00 42.92 43.29 3dyp s ASP 96 CO 0.76 -1.19 0.75 0.00 0.68 0.00 0.00 175.17 176.17 3dyp s ALA 97 N -3.97 3.41 0.53 2.11 0.00 -1.26 -4.33 121.76 118.24 3dyp s ALA 97 Ca 0.17 0.28 -0.19 0.00 0.00 0.00 0.00 51.96 52.22 3dyp s ALA 97 Cb -0.02 -2.95 -0.07 0.00 0.00 0.00 0.00 23.12 20.08 3dyp s ALA 97 CO 0.07 0.15 1.05 -1.25 0.00 0.00 0.00 175.76 175.78 3dyp s PRO 98 N -0.42 3.60 -0.09 0.00 0.04 -1.26 -4.99 135.00 131.88 3dyp s PRO 98 Ca 0.37 1.34 0.03 0.00 0.04 0.00 0.00 61.00 62.77 3dyp s PRO 98 Cb -0.21 -2.06 -0.01 0.00 0.04 0.00 0.00 34.50 32.25 3dyp s PRO 98 CO 0.23 -0.60 -0.18 0.42 0.04 0.00 0.00 177.00 176.92 3dyp s ILE 99 N -2.11 2.67 -0.46 0.56 1.01 -0.77 -4.68 121.20 117.42 3dyp s ILE 99 Ca 0.67 -0.83 -0.07 0.00 0.00 0.00 0.00 60.65 60.41 3dyp s ILE 99 Cb -0.17 -2.06 0.12 0.00 0.01 0.00 0.00 42.46 40.36 3dyp s ILE 99 CO 0.26 0.56 0.31 -0.47 0.00 0.00 0.00 174.94 175.60 3dyp s TYR 100 N -0.05 3.47 -0.02 3.97 5.04 -1.26 0.04 117.35 128.54 3dyp s TYR 100 Ca -0.04 -2.03 0.06 0.00 -2.44 0.00 0.00 57.07 52.62 3dyp s TYR 100 Cb -0.14 -3.43 -0.01 0.00 0.35 0.00 0.00 41.96 38.72 3dyp s TYR 100 CO 0.04 -0.99 -0.19 -0.08 -1.34 0.00 0.00 175.55 172.99 3dyp s THR 101 N 1.29 1.52 0.00 4.34 -1.32 -1.26 -0.69 115.64 119.51 3dyp s THR 101 Ca 0.07 -0.82 0.00 0.00 -1.21 0.00 0.00 61.69 59.73 3dyp s THR 101 Cb -0.25 -1.27 0.00 0.00 -1.51 0.00 0.00 72.50 69.47 3dyp s THR 101 CO -0.02 0.43 0.00 -3.20 -2.21 0.00 0.00 174.62 169.62 3dyp n ASN 102 N 2.65 0.00 -0.11 8.08 2.85 -1.26 -4.08 115.26 123.39 3dyp n ASN 102 Ca -0.15 0.12 -0.25 0.00 -0.11 0.00 0.00 54.58 54.19 3dyp n ASN 102 Cb 0.53 -0.18 -0.11 0.00 1.24 0.00 0.00 39.78 41.26 3dyp n ASN 102 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 3dyp n VAL 103 N -1.34 1.56 -1.70 3.44 0.31 -1.26 -4.00 118.33 115.34 3dyp n VAL 103 Ca 0.00 -0.35 -0.44 0.00 -0.01 0.00 0.00 64.34 63.54 3dyp n VAL 103 Cb 0.00 -1.83 -0.03 0.00 -0.91 0.00 0.00 33.84 31.07 3dyp n VAL 103 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3dyp n THR 104 N -4.03 0.12 -1.74 2.52 -1.04 -1.26 -3.14 114.28 105.72 3dyp n THR 104 Ca -0.44 -0.02 -0.38 0.00 -2.04 0.00 0.00 64.05 61.17 3dyp n THR 104 Cb 0.87 -1.89 0.06 0.00 -1.82 0.00 0.00 70.33 67.55 3dyp n THR 104 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3dyp n TYR 105 N 4.36 2.11 1.38 -1.42 4.02 -1.26 -4.87 117.16 121.48 3dyp n TYR 105 Ca 0.17 0.42 0.14 0.00 -0.01 0.00 0.00 57.90 58.63 3dyp n TYR 105 Cb 0.33 -2.31 0.74 0.00 -0.02 0.00 0.00 39.34 38.08 3dyp n TYR 105 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 3dyp n PRO 106 N -1.53 0.40 -4.36 -0.72 -0.04 -1.26 -4.75 135.00 122.73 3dyp n PRO 106 Ca 0.14 0.01 -0.19 0.00 -0.04 0.00 0.00 63.50 63.42 3dyp n PRO 106 Cb 0.47 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.32 3dyp n PRO 106 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3dyp s ILE 107 N -2.59 1.52 0.36 0.52 -4.36 -1.26 -5.06 121.20 110.32 3dyp s ILE 107 Ca 0.27 -2.13 -0.28 0.00 -0.26 0.00 0.00 60.65 58.25 3dyp s ILE 107 Cb 0.20 -2.23 -0.12 0.00 1.25 0.00 0.00 42.46 41.56 3dyp s ILE 107 CO 0.45 -0.45 1.43 0.41 0.24 0.00 0.00 174.94 177.02 3dyp n THR 108 N -0.44 1.91 -2.68 8.37 -1.04 -1.26 -4.88 114.28 114.26 3dyp n THR 108 Ca -0.07 -0.48 -0.42 0.00 -2.04 0.00 0.00 64.05 61.04 3dyp n THR 108 Cb 0.62 -1.83 -0.03 0.00 -1.82 0.00 0.00 70.33 67.27 3dyp n THR 108 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3dyp s VAL 109 N -1.02 4.01 -0.43 12.58 1.01 -1.26 -4.77 120.40 130.52 3dyp s VAL 109 Ca 0.55 0.16 0.08 0.00 0.00 0.00 0.00 61.98 62.77 3dyp s VAL 109 Cb -0.51 -4.79 0.31 0.00 0.00 0.00 0.00 36.38 31.39 3dyp s VAL 109 CO 0.62 -1.62 0.94 -3.20 0.00 0.00 0.00 175.10 171.84 3dyp n ASN 110 N 8.58 -1.38 -4.74 3.32 5.15 -1.26 -5.11 115.26 119.82 3dyp n ASN 110 Ca 0.01 -3.40 -0.39 0.00 -0.60 0.00 0.00 54.58 50.19 3dyp n ASN 110 Cb 0.48 1.05 0.03 0.00 -0.53 0.00 0.00 39.78 40.81 3dyp n ASN 110 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 3dyp n PRO 111 N 0.57 1.93 -0.83 1.20 -0.04 -1.26 -0.55 135.00 136.01 3dyp n PRO 111 Ca 0.13 0.69 0.02 0.00 -0.04 0.00 0.00 63.50 64.30 3dyp n PRO 111 Cb 0.67 -2.55 0.32 0.00 -0.04 0.00 0.00 33.50 31.90 3dyp n PRO 111 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3dyp n PRO 112 N -0.50 4.05 -2.16 0.54 -0.04 -1.26 -5.09 135.00 130.53 3dyp n PRO 112 Ca 0.08 -2.73 -0.32 0.00 -0.04 0.00 0.00 63.50 60.49 3dyp n PRO 112 Cb 0.43 -2.15 -0.01 0.00 -0.04 0.00 0.00 33.50 31.72 3dyp n PRO 112 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3dyp s PHE 113 N -2.59 3.49 0.26 0.54 0.40 0.29 -4.32 117.98 116.04 3dyp s PHE 113 Ca 0.48 1.40 0.06 0.00 -0.60 0.00 0.00 56.93 58.27 3dyp s PHE 113 Cb 0.37 -2.78 -0.06 0.00 0.51 0.00 0.00 43.02 41.07 3dyp s PHE 113 CO 0.13 -0.54 -0.05 0.14 0.70 0.00 0.00 175.22 175.60 3dyp s VAL 114 N -2.84 1.47 0.63 -0.44 -7.23 -1.26 -4.52 120.40 106.22 3dyp s VAL 114 Ca 0.58 -2.10 -0.18 0.00 -1.81 0.00 0.00 61.98 58.46 3dyp s VAL 114 Cb -0.11 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.42 3dyp s VAL 114 CO 0.41 -0.33 1.13 -2.65 -0.31 0.00 0.00 175.10 173.35 3dyp n PRO 115 N -0.52 0.98 0.09 4.82 -0.02 -1.26 -4.89 135.00 134.20 3dyp n PRO 115 Ca -0.06 0.39 -0.07 0.00 -2.02 0.00 0.00 63.50 61.74 3dyp n PRO 115 Cb 0.63 -2.36 0.03 0.00 -0.02 0.00 0.00 33.50 31.78 3dyp n PRO 115 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3dyp h THR 116 N 0.46 1.47 -2.13 3.45 1.35 -2.00 -3.34 112.91 112.17 3dyp h THR 116 Ca -0.50 -2.44 -0.56 0.00 -0.55 0.00 0.00 66.41 62.35 3dyp h THR 116 Cb 1.35 2.34 -0.09 0.00 -1.73 0.00 0.00 68.15 70.02 3dyp h THR 116 CO 0.52 0.71 1.10 -1.61 -0.25 0.00 0.00 175.52 175.99 3dyp s GLU 117 N -3.36 3.28 -0.36 4.72 2.02 -1.26 -4.69 118.70 119.05 3dyp s GLU 117 Ca -0.03 -0.51 0.01 0.00 0.02 0.00 0.00 54.97 54.46 3dyp s GLU 117 Cb 0.11 -4.45 0.11 0.00 0.10 0.00 0.00 34.13 30.00 3dyp s GLU 117 CO 0.82 -2.12 0.12 1.21 0.02 0.00 0.00 175.26 175.31 3dyp s ASN 118 N 3.99 4.18 -0.08 -0.19 2.47 0.06 -4.98 114.94 120.38 3dyp s ASN 118 Ca 0.36 -2.07 -0.39 0.00 0.42 0.00 0.00 52.86 51.19 3dyp s ASN 118 Cb -0.07 -1.16 -0.17 0.00 -1.45 0.00 0.00 41.25 38.40 3dyp s ASN 118 CO 0.09 -0.36 1.48 -2.65 -3.72 0.00 0.00 177.10 171.93 3dyp n PRO 119 N 4.31 0.99 -4.77 0.43 -0.02 -1.20 -3.24 135.00 131.49 3dyp n PRO 119 Ca 0.02 0.36 -0.31 0.00 -2.02 0.00 0.00 63.50 61.55 3dyp n PRO 119 Cb 0.40 -2.00 -0.17 0.00 -0.02 0.00 0.00 33.50 31.72 3dyp n PRO 119 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3dyp s THR 120 N 1.68 1.92 -0.22 3.45 2.01 0.65 -1.14 115.64 123.98 3dyp s THR 120 Ca 0.91 -0.91 -0.07 0.00 0.31 0.00 0.00 61.69 61.93 3dyp s THR 120 Cb -1.05 -1.69 -0.03 0.00 0.01 0.00 0.00 72.50 69.73 3dyp s THR 120 CO 0.56 0.52 0.07 -0.83 -0.69 0.00 0.00 174.62 174.26 3dyp s GLY 121 N 0.72 1.82 -0.45 4.40 0.00 0.08 -0.29 107.32 113.59 3dyp s GLY 121 Ca -0.10 -0.97 -0.14 0.00 0.00 0.00 0.00 44.72 43.50 3dyp s GLY 121 CO 0.01 0.34 0.35 0.00 0.00 0.00 0.00 173.10 173.81 3dyp s TYR 123 N 1.61 3.18 0.04 0.00 1.51 -0.43 -1.61 117.35 121.64 3dyp s TYR 123 Ca 0.04 0.07 -0.15 0.00 -1.01 0.00 0.00 57.07 56.02 3dyp s TYR 123 Cb -0.23 -1.62 0.02 0.00 -0.11 0.00 0.00 41.96 40.02 3dyp s TYR 123 CO 0.06 0.52 0.33 -1.54 -1.11 0.00 0.00 175.55 173.81 3dyp s SER 124 N -2.36 -0.16 -0.13 2.29 1.04 -0.34 0.46 113.70 114.50 3dyp s SER 124 Ca 0.29 -0.14 -0.08 0.00 0.48 0.00 0.00 55.95 56.50 3dyp s SER 124 Cb -0.12 0.37 0.05 0.00 0.10 0.00 0.00 66.02 66.42 3dyp s SER 124 CO 0.21 -0.62 0.31 -0.22 0.98 0.00 0.00 173.24 173.90 3dyp s LEU 125 N -2.03 0.37 -0.23 2.42 2.96 -0.75 -0.99 118.68 120.44 3dyp s LEU 125 Ca -0.05 0.65 -0.07 0.00 -0.22 0.00 0.00 54.13 54.43 3dyp s LEU 125 Cb -0.01 0.98 -0.03 0.00 0.50 0.00 0.00 46.19 47.63 3dyp s LEU 125 CO -0.03 -0.16 0.07 -0.89 -1.32 0.00 0.00 176.35 174.02 3dyp s THR 126 N 1.04 4.46 0.21 3.68 2.01 -1.26 -0.79 115.64 124.99 3dyp s THR 126 Ca -0.07 -0.13 -0.12 0.00 0.31 0.00 0.00 61.69 61.68 3dyp s THR 126 Cb -0.08 -3.06 -0.00 0.00 0.01 0.00 0.00 72.50 69.37 3dyp s THR 126 CO -0.08 0.38 0.40 0.72 -0.69 0.00 0.00 174.62 175.35 3dyp s PHE 127 N 1.21 0.35 0.10 4.92 -0.12 0.24 -4.92 117.98 119.75 3dyp s PHE 127 Ca 0.05 -0.70 -0.01 0.00 -0.05 0.00 0.00 56.93 56.22 3dyp s PHE 127 Cb -0.14 0.10 -0.04 0.00 -0.63 0.00 0.00 43.02 42.30 3dyp s PHE 127 CO 0.03 -0.88 0.26 1.21 -0.05 0.00 0.00 175.22 175.80 3dyp s ASN 128 N -2.99 6.38 -0.06 1.98 2.47 -1.26 0.16 114.94 121.63 3dyp s ASN 128 Ca 0.20 0.32 0.01 0.00 0.42 0.00 0.00 52.86 53.81 3dyp s ASN 128 Cb 0.01 -1.98 0.02 0.00 -1.45 0.00 0.00 41.25 37.85 3dyp s ASN 128 CO 0.05 0.12 -0.06 -0.69 -3.72 0.00 0.00 177.10 172.79 3dyp s VAL 129 N -1.59 0.71 0.20 -5.21 1.01 0.45 -4.94 120.40 111.03 3dyp s VAL 129 Ca 0.36 -0.21 -0.30 0.00 0.00 0.00 0.00 61.98 61.83 3dyp s VAL 129 Cb -0.12 -0.71 -0.09 0.00 0.00 0.00 0.00 36.38 35.45 3dyp s VAL 129 CO 0.28 0.27 1.33 -1.81 0.00 0.00 0.00 175.10 175.16 3dyp s ASP 130 N 0.98 6.87 0.59 3.32 1.01 -1.26 -1.39 116.67 126.79 3dyp s ASP 130 Ca -0.10 2.43 0.29 0.00 0.71 0.00 0.00 52.55 55.89 3dyp s ASP 130 Cb -0.14 -2.61 1.75 0.00 1.01 0.00 0.00 42.92 42.93 3dyp s ASP 130 CO 0.00 -0.55 2.19 -0.08 0.21 0.00 0.00 175.17 176.95 3dyp h GLU 131 N 5.34 0.00 0.00 8.23 4.57 -1.95 0.16 114.58 130.93 3dyp h GLU 131 Ca -0.45 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 57.73 3dyp h GLU 131 Cb 1.21 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.80 3dyp h GLU 131 CO 0.77 0.00 -0.03 0.66 -1.18 0.00 0.00 179.01 179.24 3dyp h SER 132 N 0.00 0.00 1.74 1.04 4.64 -1.97 0.63 113.55 119.63 3dyp h SER 132 Ca 0.03 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.34 3dyp h SER 132 Cb 0.19 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.28 3dyp h SER 132 CO -0.00 0.03 -0.07 -0.50 -0.87 0.00 0.00 176.83 175.42 3dyp h TRP 133 N 0.00 0.00 0.00 4.77 4.06 -0.96 -3.34 115.95 120.49 3dyp h TRP 133 Ca -0.00 0.00 -0.22 0.00 2.06 0.00 0.00 58.89 60.73 3dyp h TRP 133 Cb 0.08 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.20 3dyp h TRP 133 CO 0.00 0.07 -2.03 1.28 -3.56 0.00 0.00 178.44 174.19 3dyp n LEU 134 N -3.12 0.00 0.26 -4.49 4.77 -0.11 -4.36 117.00 109.94 3dyp n LEU 134 Ca 0.03 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.18 3dyp n LEU 134 Cb 0.51 0.30 0.72 0.00 -2.33 0.00 0.00 43.42 42.63 3dyp n LEU 134 CO 0.34 0.30 0.99 0.06 -1.33 0.00 0.00 177.39 177.75 3dyp h GLN 135 N 0.00 0.00 -3.29 3.23 3.07 0.06 -3.44 115.11 114.73 3dyp h GLN 135 Ca -0.33 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.38 3dyp h GLN 135 Cb 1.70 0.00 -0.11 0.00 0.08 0.00 0.00 27.48 29.16 3dyp h GLN 135 CO 0.02 0.00 0.03 -1.83 0.09 0.00 0.00 178.83 177.14 3dyp s GLU 136 N -3.67 1.32 1.46 0.06 -1.05 -1.26 -5.11 118.70 110.44 3dyp s GLU 136 Ca 0.01 -0.80 0.00 0.00 -0.15 0.00 0.00 54.97 54.03 3dyp s GLU 136 Cb 0.09 0.52 0.00 0.00 -0.44 0.00 0.00 34.13 34.30 3dyp s GLU 136 CO 0.50 -0.55 0.00 0.41 0.95 0.00 0.00 175.26 176.56 3dyp n GLY 137 N -0.32 -1.57 3.20 -3.83 0.00 -1.26 -4.72 105.19 96.68 3dyp n GLY 137 Ca -0.12 -1.25 -0.31 0.00 0.00 0.00 0.00 46.02 44.34 3dyp n GLY 137 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dyp s GLN 138 N 0.00 2.92 -0.23 1.61 0.74 0.20 -4.81 119.66 120.08 3dyp s GLN 138 Ca 0.00 -0.83 -0.05 0.00 0.05 0.00 0.00 55.36 54.53 3dyp s GLN 138 Cb 0.00 -2.21 -0.01 0.00 1.10 0.00 0.00 33.01 31.89 3dyp s GLN 138 CO 0.00 0.16 -0.01 0.99 -0.55 0.00 0.00 175.29 175.89 3dyp s THR 139 N 0.37 3.61 0.27 -0.34 2.01 -1.26 -0.79 115.64 119.51 3dyp s THR 139 Ca -0.19 -0.45 0.12 0.00 0.31 0.00 0.00 61.69 61.48 3dyp s THR 139 Cb -0.18 -2.68 -0.05 0.00 0.01 0.00 0.00 72.50 69.61 3dyp s THR 139 CO 0.08 0.37 -0.19 0.00 -0.69 0.00 0.00 174.62 174.19 3dyp s ARG 140 N 1.51 1.69 -0.02 4.92 1.70 -0.27 -0.25 118.95 128.23 3dyp s ARG 140 Ca 0.06 -1.72 0.02 0.00 -0.47 0.00 0.00 55.73 53.62 3dyp s ARG 140 Cb -0.15 -1.80 -0.03 0.00 -0.57 0.00 0.00 34.95 32.40 3dyp s ARG 140 CO -0.01 0.34 -0.06 -1.50 -1.08 0.00 0.00 175.30 172.99 3dyp s ILE 141 N -2.39 3.73 -0.13 4.99 2.07 -0.30 -0.62 121.20 128.54 3dyp s ILE 141 Ca 0.29 -0.66 0.01 0.00 -1.41 0.00 0.00 60.65 58.88 3dyp s ILE 141 Cb -0.05 -2.60 0.02 0.00 0.13 0.00 0.00 42.46 39.96 3dyp s ILE 141 CO 0.15 0.45 -0.15 -0.63 -1.91 0.00 0.00 174.94 172.85 3dyp s ILE 142 N -0.95 1.58 -0.47 2.00 1.01 0.16 -1.60 121.20 122.94 3dyp s ILE 142 Ca 0.16 -0.66 -0.12 0.00 0.00 0.00 0.00 60.65 60.02 3dyp s ILE 142 Cb -0.11 -1.47 0.10 0.00 0.01 0.00 0.00 42.46 40.99 3dyp s ILE 142 CO 0.06 0.46 0.37 -0.36 0.00 0.00 0.00 174.94 175.47 3dyp s PHE 143 N 1.27 3.32 0.26 3.97 0.40 -0.11 -1.19 117.98 125.90 3dyp s PHE 143 Ca 0.00 -1.44 0.34 0.00 -0.60 0.00 0.00 56.93 55.24 3dyp s PHE 143 Cb -0.14 -3.36 1.56 0.00 0.51 0.00 0.00 43.02 41.59 3dyp s PHE 143 CO -0.07 -0.92 2.06 -0.44 0.70 0.00 0.00 175.22 176.55 3dyp h ASP 144 N 8.61 0.00 -1.31 1.36 3.32 -0.58 -0.68 116.42 127.15 3dyp h ASP 144 Ca -0.25 0.00 0.12 0.00 0.02 0.00 0.00 57.03 56.91 3dyp h ASP 144 Cb 1.09 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.43 3dyp h ASP 144 CO 0.88 0.03 -0.09 -0.83 -1.72 0.00 0.00 179.24 177.52 3dyp s GLY 145 N -4.19 -0.69 -0.09 2.75 0.00 -1.26 -3.31 107.32 100.53 3dyp s GLY 145 Ca -0.01 2.34 -0.01 0.00 0.00 0.00 0.00 44.72 47.05 3dyp s GLY 145 CO 0.53 3.28 -0.05 0.14 0.00 0.00 0.00 173.10 177.00 3dyp s VAL 146 N 2.81 0.79 -0.27 1.40 1.01 -1.24 -1.85 120.40 123.04 3dyp s VAL 146 Ca 0.04 -0.15 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 3dyp s VAL 146 Cb -0.12 -0.85 0.03 0.00 0.00 0.00 0.00 36.38 35.44 3dyp s VAL 146 CO -0.19 0.33 -0.01 0.21 0.00 0.00 0.00 175.10 175.44 3dyp s ASN 147 N 1.72 4.66 -0.00 3.32 3.84 0.18 -3.92 114.94 124.74 3dyp s ASN 147 Ca 0.04 -0.94 0.04 0.00 0.21 0.00 0.00 52.86 52.20 3dyp s ASN 147 Cb -0.13 -1.73 -0.05 0.00 -0.55 0.00 0.00 41.25 38.80 3dyp s ASN 147 CO -0.06 -0.18 0.13 -1.54 -2.79 0.00 0.00 177.10 172.65 3dyp n SER 148 N 4.71 1.64 -3.52 -4.21 3.41 -0.53 -0.55 113.62 114.56 3dyp n SER 148 Ca -0.15 -0.37 -0.13 0.00 -0.26 0.00 0.00 58.87 57.96 3dyp n SER 148 Cb 0.46 1.06 -0.04 0.00 -0.26 0.00 0.00 64.21 65.44 3dyp n SER 148 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyp s ALA 149 N -1.68 -1.36 0.07 7.33 0.00 -1.18 -3.98 121.76 120.96 3dyp s ALA 149 Ca 0.00 0.44 -0.26 0.00 0.00 0.00 0.00 51.96 52.14 3dyp s ALA 149 Cb 0.03 0.64 0.07 0.00 0.00 0.00 0.00 23.12 23.85 3dyp s ALA 149 CO 0.15 -0.63 0.64 -0.59 0.00 0.00 0.00 175.76 175.33 3dyp s PHE 150 N -3.21 -0.58 -0.02 0.00 -0.12 -0.62 -0.79 117.98 112.64 3dyp s PHE 150 Ca -0.01 0.65 0.00 0.00 -0.05 0.00 0.00 56.93 57.52 3dyp s PHE 150 Cb -0.00 0.50 -0.04 0.00 -0.63 0.00 0.00 43.02 42.85 3dyp s PHE 150 CO -0.08 -0.74 0.02 -1.01 -0.05 0.00 0.00 175.22 173.36 3dyp s HIS 151 N -2.70 3.14 -0.06 3.49 3.76 -0.45 -1.39 115.29 121.08 3dyp s HIS 151 Ca -0.04 0.13 0.03 0.00 -0.15 0.00 0.00 55.06 55.03 3dyp s HIS 151 Cb -0.01 -1.70 0.01 0.00 1.11 0.00 0.00 32.58 31.99 3dyp s HIS 151 CO -0.04 0.49 -0.14 -1.17 -0.85 0.00 0.00 174.74 173.03 3dyp s LEU 152 N -1.49 1.75 0.15 0.89 2.96 -0.59 -1.07 118.68 121.27 3dyp s LEU 152 Ca 0.19 -0.32 0.09 0.00 -0.22 0.00 0.00 54.13 53.87 3dyp s LEU 152 Cb -0.12 -0.88 -0.04 0.00 0.50 0.00 0.00 46.19 45.65 3dyp s LEU 152 CO 0.10 0.07 -0.21 0.26 -1.32 0.00 0.00 176.35 175.26 3dyp s TRP 153 N 0.45 1.93 -0.09 5.38 0.51 -0.43 0.07 118.94 126.78 3dyp s TRP 153 Ca -0.11 -0.43 -0.02 0.00 -2.12 0.00 0.00 56.10 53.42 3dyp s TRP 153 Cb -0.14 -0.99 0.03 0.00 -0.81 0.00 0.00 33.47 31.56 3dyp s TRP 153 CO 0.04 0.33 0.03 0.00 -0.51 0.00 0.00 176.95 176.83 3dyp n ASN 155 N 5.18 -5.78 0.00 0.00 3.02 0.77 -1.64 115.26 116.80 3dyp n ASN 155 Ca -0.06 -0.63 0.00 0.00 -0.03 0.00 0.00 54.58 53.85 3dyp n ASN 155 Cb 0.50 -4.59 0.00 0.00 -0.61 0.00 0.00 39.78 35.08 3dyp n ASN 155 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dyp n GLY 156 N -1.89 2.21 3.69 7.41 0.00 -1.21 -5.01 105.19 110.39 3dyp n GLY 156 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 3dyp n GLY 156 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dyp s ARG 157 N -0.05 3.41 0.12 1.61 0.52 -0.65 -4.91 118.95 118.98 3dyp s ARG 157 Ca 0.00 -0.35 -0.31 0.00 -0.52 0.00 0.00 55.73 54.55 3dyp s ARG 157 Cb 0.00 -2.99 -0.08 0.00 0.52 0.00 0.00 34.95 32.40 3dyp s ARG 157 CO 0.00 0.55 1.34 -0.46 0.02 0.00 0.00 175.30 176.75 3dyp s TRP 158 N -0.44 3.28 -0.22 -0.53 -0.00 -1.26 -0.38 118.94 119.39 3dyp s TRP 158 Ca 0.09 1.06 -0.15 0.00 -0.00 0.00 0.00 56.10 57.10 3dyp s TRP 158 Cb -0.12 -3.62 -0.09 0.00 -0.00 0.00 0.00 33.47 29.64 3dyp s TRP 158 CO 0.02 -2.10 -0.34 0.28 -0.00 0.00 0.00 176.95 174.81 3dyp n VAL 159 N 3.76 1.46 -2.96 5.86 0.31 0.11 -4.90 118.33 121.97 3dyp n VAL 159 Ca 0.10 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 3dyp n VAL 159 Cb 0.43 -2.04 0.00 0.00 -0.91 0.00 0.00 33.84 31.32 3dyp n VAL 159 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3dyp n GLY 160 N 1.44 -1.26 3.13 2.92 0.00 -1.13 -4.70 105.19 105.58 3dyp n GLY 160 Ca -0.36 -0.85 -0.11 0.00 0.00 0.00 0.00 46.02 44.69 3dyp n GLY 160 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3dyp s TYR 161 N -2.95 0.02 0.00 1.61 5.04 -0.53 -1.55 117.35 118.99 3dyp s TYR 161 Ca 0.00 -0.10 -0.17 0.00 -2.44 0.00 0.00 57.07 54.36 3dyp s TYR 161 Cb 0.00 -0.03 0.03 0.00 0.35 0.00 0.00 41.96 42.31 3dyp s TYR 161 CO 0.00 -0.31 0.37 0.20 -1.34 0.00 0.00 175.55 174.47 3dyp s GLY 162 N -1.41 -0.21 0.37 8.97 0.00 -0.49 -1.17 107.32 113.38 3dyp s GLY 162 Ca -0.14 0.38 0.03 0.00 0.00 0.00 0.00 44.72 44.99 3dyp s GLY 162 CO 0.02 0.15 0.10 1.20 0.00 0.00 0.00 173.10 174.56 3dyp s GLN 163 N -1.69 1.80 0.00 2.90 -0.21 -0.50 -1.59 119.66 120.38 3dyp s GLN 163 Ca -0.11 -2.06 0.00 0.00 0.02 0.00 0.00 55.36 53.21 3dyp s GLN 163 Cb -0.03 -0.69 0.00 0.00 1.00 0.00 0.00 33.01 33.29 3dyp s GLN 163 CO 0.03 -0.37 0.00 -3.47 -2.12 0.00 0.00 175.29 169.36 3dyp n ASP 164 N -1.03 -1.37 0.00 5.90 -0.08 -1.26 -4.92 116.55 113.79 3dyp n ASP 164 Ca -0.05 0.00 0.09 0.00 -1.51 0.00 0.00 54.79 53.33 3dyp n ASP 164 Cb 0.66 -0.69 0.55 0.00 2.34 0.00 0.00 41.12 43.98 3dyp n ASP 164 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 3dyp n SER 165 N 0.00 0.00 -0.15 1.67 7.64 -1.25 -3.74 113.62 117.79 3dyp n SER 165 Ca 0.00 -0.49 0.01 0.00 1.01 0.00 0.00 58.87 59.40 3dyp n SER 165 Cb 0.00 -0.05 0.03 0.00 -1.01 0.00 0.00 64.21 63.19 3dyp n SER 165 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3dyp n ARG 166 N -1.05 2.36 -4.12 1.43 5.12 -1.26 -3.70 116.66 115.44 3dyp n ARG 166 Ca 0.13 -1.47 -0.16 0.00 -1.93 0.00 0.00 57.85 54.43 3dyp n ARG 166 Cb 0.08 -1.07 -0.12 0.00 -1.16 0.00 0.00 32.46 30.20 3dyp n ARG 166 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3dyp s LEU 167 N -0.87 2.28 0.41 0.55 1.43 -1.24 -4.42 118.68 116.81 3dyp s LEU 167 Ca 0.05 -0.60 -0.25 0.00 -1.03 0.00 0.00 54.13 52.30 3dyp s LEU 167 Cb 0.03 -0.34 -0.08 0.00 0.03 0.00 0.00 46.19 45.83 3dyp s LEU 167 CO 0.04 -0.15 1.24 -2.16 0.23 0.00 0.00 176.35 175.55 3dyp s PRO 168 N -1.75 3.96 -0.11 1.29 0.04 -1.21 -4.52 135.00 132.72 3dyp s PRO 168 Ca -0.05 2.01 0.03 0.00 0.04 0.00 0.00 61.00 63.03 3dyp s PRO 168 Cb -0.09 -2.69 -0.01 0.00 0.04 0.00 0.00 34.50 31.74 3dyp s PRO 168 CO 0.01 -0.45 -0.19 -1.12 0.04 0.00 0.00 177.00 175.29 3dyp s SER 169 N -0.93 3.49 0.07 6.66 0.01 -0.26 -4.94 113.70 117.81 3dyp s SER 169 Ca 0.58 -0.45 0.08 0.00 1.31 0.00 0.00 55.95 57.47 3dyp s SER 169 Cb -0.35 -1.41 -0.03 0.00 0.21 0.00 0.00 66.02 64.44 3dyp s SER 169 CO 0.44 0.18 -0.21 -1.61 0.41 0.00 0.00 173.24 172.45 3dyp s GLU 170 N 0.25 1.27 -0.05 12.44 2.02 -1.26 -0.93 118.70 132.43 3dyp s GLU 170 Ca -0.13 -1.06 -0.05 0.00 0.02 0.00 0.00 54.97 53.75 3dyp s GLU 170 Cb -0.16 -1.46 0.02 0.00 0.10 0.00 0.00 34.13 32.62 3dyp s GLU 170 CO 0.07 0.36 0.14 -0.06 0.02 0.00 0.00 175.26 175.79 3dyp s PHE 171 N -0.98 -0.16 -0.23 1.61 0.40 -0.62 -1.20 117.98 116.80 3dyp s PHE 171 Ca 0.07 0.39 -0.29 0.00 -0.60 0.00 0.00 56.93 56.50 3dyp s PHE 171 Cb -0.09 0.04 0.00 0.00 0.51 0.00 0.00 43.02 43.48 3dyp s PHE 171 CO 0.03 -0.08 1.11 0.34 0.70 0.00 0.00 175.22 177.32 3dyp s ASP 172 N 0.15 7.02 0.00 1.36 -1.08 -1.26 -1.15 116.67 121.71 3dyp s ASP 172 Ca -0.01 1.41 0.20 0.00 -0.52 0.00 0.00 52.55 53.63 3dyp s ASP 172 Cb -0.02 -2.54 0.26 0.00 -1.46 0.00 0.00 42.92 39.17 3dyp s ASP 172 CO -0.00 -0.74 1.22 0.18 0.52 0.00 0.00 175.17 176.35 3dyp n LEU 173 N 6.53 2.95 -0.30 -1.34 4.77 0.65 -4.70 117.00 125.55 3dyp n LEU 173 Ca 0.13 -1.26 0.04 0.00 -0.03 0.00 0.00 56.01 54.89 3dyp n LEU 173 Cb 0.46 -0.11 0.12 0.00 -2.33 0.00 0.00 43.42 41.56 3dyp n LEU 173 CO 0.54 0.58 0.70 0.28 -1.33 0.00 0.00 177.39 178.16 3dyp h SER 174 N 3.91 -0.76 0.59 -1.43 0.02 -1.83 0.42 113.55 114.46 3dyp h SER 174 Ca 0.00 0.26 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 3dyp h SER 174 Cb 0.87 0.52 0.00 0.00 0.14 0.00 0.00 62.40 63.93 3dyp h SER 174 CO 0.00 -0.28 -0.03 0.00 -1.14 0.00 0.00 176.83 175.38 3dyp n ALA 175 N -3.38 2.54 0.30 3.77 0.00 -1.26 -3.66 120.51 118.83 3dyp n ALA 175 Ca 0.13 -0.16 0.09 0.00 0.00 0.00 0.00 53.44 53.50 3dyp n ALA 175 Cb 0.45 -1.45 -0.13 0.00 0.00 0.00 0.00 19.45 18.32 3dyp n ALA 175 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3dyp n PHE 176 N -1.27 0.00 -3.11 0.00 3.01 0.14 -5.01 117.46 111.22 3dyp n PHE 176 Ca 0.13 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.36 3dyp n PHE 176 Cb 0.26 -0.26 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 3dyp n PHE 176 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3dyp s LEU 177 N -3.73 3.76 0.04 4.37 1.43 -0.58 -4.70 118.68 119.27 3dyp s LEU 177 Ca -0.02 0.32 0.02 0.00 -1.03 0.00 0.00 54.13 53.42 3dyp s LEU 177 Cb 0.12 -3.20 -0.03 0.00 0.03 0.00 0.00 46.19 43.11 3dyp s LEU 177 CO 0.74 -0.57 -0.06 0.00 0.23 0.00 0.00 176.35 176.68 3dyp s ARG 178 N -4.48 0.52 0.45 1.70 1.70 -1.26 -5.03 118.95 112.56 3dyp s ARG 178 Ca 0.46 -0.82 -0.25 0.00 -0.47 0.00 0.00 55.73 54.65 3dyp s ARG 178 Cb -0.10 -0.18 -0.09 0.00 -0.57 0.00 0.00 34.95 34.02 3dyp s ARG 178 CO 0.37 0.01 1.38 0.00 -1.08 0.00 0.00 175.30 175.99 3dyp n ALA 179 N 1.25 1.79 0.00 7.88 0.00 -1.26 -4.58 120.51 125.59 3dyp n ALA 179 Ca -0.21 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3dyp n ALA 179 Cb 0.56 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.65 3dyp n ALA 179 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dyp n GLY 180 N 0.66 0.70 3.73 0.00 0.00 -0.49 -4.93 105.19 104.86 3dyp n GLY 180 Ca 0.06 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 44.13 3dyp n GLY 180 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dyp s GLU 181 N 0.00 4.56 0.08 1.61 0.41 -1.26 -0.41 118.70 123.69 3dyp s GLU 181 Ca 0.00 1.70 0.02 0.00 -0.41 0.00 0.00 54.97 56.28 3dyp s GLU 181 Cb 0.00 -3.31 -0.04 0.00 -1.78 0.00 0.00 34.13 29.01 3dyp s GLU 181 CO 0.00 0.00 -0.07 -0.80 -0.49 0.00 0.00 175.26 173.90 3dyp s ASN 182 N 0.21 1.06 -0.12 -0.19 0.01 0.43 -4.87 114.94 111.46 3dyp s ASN 182 Ca 0.51 -0.91 0.01 0.00 -0.71 0.00 0.00 52.86 51.76 3dyp s ASN 182 Cb -0.29 0.08 0.02 0.00 0.41 0.00 0.00 41.25 41.48 3dyp s ASN 182 CO 0.33 -0.41 -0.12 -0.60 -1.51 0.00 0.00 177.10 174.79 3dyp s ARG 183 N -3.34 2.01 0.11 -0.60 3.52 -1.26 0.81 118.95 120.21 3dyp s ARG 183 Ca 0.07 -0.46 -0.06 0.00 -0.13 0.00 0.00 55.73 55.15 3dyp s ARG 183 Cb 0.02 -1.86 -0.05 0.00 -1.56 0.00 0.00 34.95 31.50 3dyp s ARG 183 CO -0.04 -0.19 0.36 -0.51 -0.81 0.00 0.00 175.30 174.11 3dyp s LEU 184 N 1.39 4.30 -0.08 -0.88 1.43 0.03 -0.16 118.68 124.70 3dyp s LEU 184 Ca 0.01 0.61 0.00 0.00 -1.03 0.00 0.00 54.13 53.73 3dyp s LEU 184 Cb -0.13 -3.17 0.02 0.00 0.03 0.00 0.00 46.19 42.94 3dyp s LEU 184 CO -0.07 0.10 -0.07 0.00 0.23 0.00 0.00 176.35 176.54 3dyp s ALA 185 N -1.57 1.05 -0.15 4.21 0.00 -0.37 -1.82 121.76 123.11 3dyp s ALA 185 Ca 0.38 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.02 3dyp s ALA 185 Cb -0.13 -0.68 0.03 0.00 0.00 0.00 0.00 23.12 22.34 3dyp s ALA 185 CO 0.23 -0.20 -0.13 0.08 0.00 0.00 0.00 175.76 175.74 3dyp s VAL 186 N 1.30 1.54 -0.30 0.00 1.01 0.17 -1.31 120.40 122.82 3dyp s VAL 186 Ca -0.04 -0.66 -0.10 0.00 0.00 0.00 0.00 61.98 61.18 3dyp s VAL 186 Cb -0.14 -1.48 -0.02 0.00 0.00 0.00 0.00 36.38 34.74 3dyp s VAL 186 CO -0.03 0.41 0.16 -0.32 0.00 0.00 0.00 175.10 175.33 3dyp s MET 187 N 1.49 3.54 -0.25 2.72 1.75 -0.24 -1.31 119.30 127.01 3dyp s MET 187 Ca 0.04 -0.58 -0.10 0.00 -1.25 0.00 0.00 55.69 53.80 3dyp s MET 187 Cb -0.13 -3.59 -0.04 0.00 2.84 0.00 0.00 34.83 33.91 3dyp s MET 187 CO -0.10 -0.33 0.14 0.08 -0.65 0.00 0.00 175.02 174.16 3dyp s VAL 188 N 1.66 5.05 -0.14 10.11 1.01 -0.01 -1.35 120.40 136.74 3dyp s VAL 188 Ca 0.06 0.08 -0.16 0.00 0.00 0.00 0.00 61.98 61.95 3dyp s VAL 188 Cb -0.17 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 3dyp s VAL 188 CO 0.08 0.32 0.39 -0.76 0.00 0.00 0.00 175.10 175.13 3dyp s LEU 189 N 1.39 4.26 0.12 3.92 1.43 0.03 -0.74 118.68 129.09 3dyp s LEU 189 Ca 0.07 0.68 -0.16 0.00 -1.03 0.00 0.00 54.13 53.69 3dyp s LEU 189 Cb -0.15 -2.55 -0.02 0.00 0.03 0.00 0.00 46.19 43.50 3dyp s LEU 189 CO 0.07 0.05 1.61 -0.09 0.23 0.00 0.00 176.35 178.21 3dyp h ARG 190 N 6.68 0.63 -6.62 1.70 2.43 -1.39 -1.40 114.38 116.41 3dyp h ARG 190 Ca -0.41 -0.16 -0.68 0.00 -0.81 0.00 0.00 59.98 57.91 3dyp h ARG 190 Cb 1.17 -0.08 -0.22 0.00 -0.42 0.00 0.00 29.97 30.43 3dyp h ARG 190 CO 0.75 0.68 -0.81 -1.58 -1.51 0.00 0.00 179.97 177.50 3dyp s TRP 191 N -5.21 2.53 0.31 2.20 0.52 -1.26 -3.84 118.94 114.18 3dyp s TRP 191 Ca -0.13 -0.27 -0.18 0.00 0.02 0.00 0.00 56.10 55.53 3dyp s TRP 191 Cb 0.10 -1.43 0.03 0.00 -1.15 0.00 0.00 33.47 31.01 3dyp s TRP 191 CO 0.77 0.27 0.72 -1.54 0.02 0.00 0.00 176.95 177.19 3dyp s SER 192 N -1.56 -0.14 0.64 2.95 1.04 -1.26 -4.92 113.70 110.45 3dyp s SER 192 Ca 0.15 -0.81 0.41 0.00 0.48 0.00 0.00 55.95 56.18 3dyp s SER 192 Cb -0.10 0.75 2.24 0.00 0.10 0.00 0.00 66.02 69.01 3dyp s SER 192 CO 0.06 -1.43 2.33 -2.24 0.98 0.00 0.00 173.24 172.93 3dyp h ASP 193 N 2.02 0.00 -0.47 7.02 3.04 -0.91 0.31 116.42 127.43 3dyp h ASP 193 Ca -0.24 0.00 0.02 0.00 -3.24 0.00 0.00 57.03 53.57 3dyp h ASP 193 Cb 1.25 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 39.52 3dyp h ASP 193 CO 0.29 0.00 0.31 1.23 -2.04 0.00 0.00 179.24 179.04 3dyp h GLY 194 N 0.13 0.64 1.50 7.15 0.00 -1.90 -1.94 103.07 108.65 3dyp h GLY 194 Ca -0.00 -0.23 0.05 0.00 0.00 0.00 0.00 47.33 47.15 3dyp h GLY 194 CO 0.00 0.21 0.20 1.76 0.00 0.00 0.00 176.54 178.71 3dyp h SER 195 N 0.59 0.00 0.86 0.19 0.02 -1.28 0.63 113.55 114.56 3dyp h SER 195 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 3dyp h SER 195 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 3dyp h SER 195 CO -0.04 0.00 0.00 1.88 -1.14 0.00 0.00 176.83 177.53 3dyp h TYR 196 N 0.00 0.00 -0.66 3.45 -1.99 -1.49 -1.71 116.97 114.57 3dyp h TYR 196 Ca 0.09 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.82 3dyp h TYR 196 Cb 0.48 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.21 3dyp h TYR 196 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 179.44 3dyp n LEU 197 N -2.98 3.82 -2.71 3.88 4.77 0.20 -4.37 117.00 119.61 3dyp n LEU 197 Ca 0.00 -1.94 -0.19 0.00 -0.03 0.00 0.00 56.01 53.85 3dyp n LEU 197 Cb 0.27 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 3dyp n LEU 197 CO 0.25 0.94 0.02 -0.62 -1.33 0.00 0.00 177.39 176.65 3dyp n GLU 198 N 1.54 2.26 -1.24 3.23 1.02 -0.64 -0.13 120.64 126.68 3dyp n GLU 198 Ca 0.23 -3.96 -0.29 0.00 -0.02 0.00 0.00 57.16 53.12 3dyp n GLU 198 Cb 0.61 -1.82 0.11 0.00 -0.02 0.00 0.00 31.44 30.32 3dyp n GLU 198 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3dyp n ASP 199 N -0.19 6.04 -4.76 1.62 2.03 -0.17 -4.98 116.55 116.13 3dyp n ASP 199 Ca 0.25 -3.65 -0.35 0.00 0.52 0.00 0.00 54.79 51.56 3dyp n ASP 199 Cb 0.68 -0.92 0.03 0.00 -0.72 0.00 0.00 41.12 40.18 3dyp n ASP 199 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 3dyp s GLN 200 N -3.44 3.06 -0.98 -0.67 1.11 -1.26 -4.59 119.66 112.89 3dyp s GLN 200 Ca 0.59 1.70 -0.24 0.00 0.01 0.00 0.00 55.36 57.42 3dyp s GLN 200 Cb 0.47 -1.96 -0.00 0.00 -1.01 0.00 0.00 33.01 30.51 3dyp s GLN 200 CO 0.04 -1.10 1.73 0.34 0.01 0.00 0.00 175.29 176.31 3dyp s ASP 201 N -1.78 5.76 0.16 5.90 2.15 -1.26 -4.81 116.67 122.79 3dyp s ASP 201 Ca 0.74 -1.10 -0.24 0.00 0.43 0.00 0.00 52.55 52.39 3dyp s ASP 201 Cb -0.27 -2.57 0.07 0.00 -0.30 0.00 0.00 42.92 39.86 3dyp s ASP 201 CO 0.32 -2.19 1.02 0.00 -0.17 0.00 0.00 175.17 174.15 3dyp s MET 202 N 6.05 1.20 0.40 4.34 0.23 -1.26 -5.01 119.30 125.24 3dyp s MET 202 Ca 0.59 -0.72 -0.27 0.00 -1.03 0.00 0.00 55.69 54.27 3dyp s MET 202 Cb -0.03 0.37 -0.10 0.00 -1.53 0.00 0.00 34.83 33.54 3dyp s MET 202 CO -0.04 -0.55 1.46 -1.58 -2.03 0.00 0.00 175.02 172.27 3dyp s TRP 203 N -2.73 2.58 -0.45 3.16 0.52 -1.26 -4.32 118.94 116.44 3dyp s TRP 203 Ca 0.17 1.21 -0.16 0.00 0.02 0.00 0.00 56.10 57.34 3dyp s TRP 203 Cb -0.01 -3.97 0.05 0.00 -1.15 0.00 0.00 33.47 28.38 3dyp s TRP 203 CO 0.03 -2.90 0.40 1.03 0.02 0.00 0.00 176.95 175.53 3dyp s ARG 204 N -2.19 3.01 0.32 4.98 1.81 0.11 -4.93 118.95 122.06 3dyp s ARG 204 Ca 0.55 -1.13 0.00 0.00 -1.72 0.00 0.00 55.73 53.43 3dyp s ARG 204 Cb -0.45 -4.07 -0.00 0.00 -0.45 0.00 0.00 34.95 29.98 3dyp s ARG 204 CO 0.60 -0.95 0.01 -1.33 -0.68 0.00 0.00 175.30 172.95 3dyp n MET 205 N 5.35 1.19 -3.73 3.54 2.81 -1.26 -1.85 117.12 123.17 3dyp n MET 205 Ca -0.11 -2.35 -0.09 0.00 -1.81 0.00 0.00 57.70 53.34 3dyp n MET 205 Cb 0.45 0.66 -0.03 0.00 -0.71 0.00 0.00 33.22 33.60 3dyp n MET 205 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3dyp s SER 206 N -2.77 -0.33 0.00 7.83 1.04 -1.26 -4.83 113.70 113.38 3dyp s SER 206 Ca 0.01 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 55.99 3dyp s SER 206 Cb 0.00 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.78 3dyp s SER 206 CO 0.01 -1.18 0.00 0.61 0.98 0.00 0.00 173.24 173.66 3dyp n GLY 207 N -0.41 0.89 3.42 7.32 0.00 0.29 -1.79 105.19 114.92 3dyp n GLY 207 Ca -0.08 -2.19 -0.45 0.00 0.00 0.00 0.00 46.02 43.30 3dyp n GLY 207 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dyp s ILE 208 N -0.98 5.00 -1.70 -0.61 1.01 -1.19 -0.65 121.20 122.09 3dyp s ILE 208 Ca 0.00 -1.90 0.17 0.00 0.00 0.00 0.00 60.65 58.92 3dyp s ILE 208 Cb 0.00 -4.70 0.35 0.00 0.01 0.00 0.00 42.46 38.12 3dyp s ILE 208 CO 0.00 -1.38 1.27 2.22 0.00 0.00 0.00 174.94 177.05 3dyp n PHE 209 N 5.75 0.46 -4.43 3.97 1.16 -0.77 -1.04 117.46 122.56 3dyp n PHE 209 Ca 0.22 -0.32 -0.22 0.00 -1.87 0.00 0.00 57.45 55.27 3dyp n PHE 209 Cb 0.48 -0.01 -0.09 0.00 -1.61 0.00 0.00 39.48 38.25 3dyp n PHE 209 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 3dyp s ARG 210 N -1.16 1.70 0.58 3.97 0.52 -1.16 -4.30 118.95 119.10 3dyp s ARG 210 Ca 0.30 -1.98 -0.19 0.00 -0.52 0.00 0.00 55.73 53.34 3dyp s ARG 210 Cb 0.17 -0.50 -0.06 0.00 0.52 0.00 0.00 34.95 35.08 3dyp s ARG 210 CO 0.23 -0.37 0.89 -0.25 0.02 0.00 0.00 175.30 175.82 3dyp n ASP 211 N -0.93 0.49 -4.20 0.23 8.00 -1.26 -4.39 116.55 114.49 3dyp n ASP 211 Ca -0.02 0.81 -0.31 0.00 0.71 0.00 0.00 54.79 55.98 3dyp n ASP 211 Cb 0.66 -1.35 -0.17 0.00 -0.02 0.00 0.00 41.12 40.24 3dyp n ASP 211 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3dyp s VAL 212 N -1.53 1.93 0.14 2.53 1.01 -1.26 0.10 120.40 123.33 3dyp s VAL 212 Ca 0.73 -0.95 -0.07 0.00 0.00 0.00 0.00 61.98 61.69 3dyp s VAL 212 Cb -0.43 -1.67 -0.02 0.00 0.00 0.00 0.00 36.38 34.26 3dyp s VAL 212 CO 0.49 0.53 0.21 -0.94 0.00 0.00 0.00 175.10 175.40 3dyp s SER 213 N 0.30 0.12 -0.13 3.32 1.04 -0.34 0.42 113.70 118.45 3dyp s SER 213 Ca -0.16 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 55.35 3dyp s SER 213 Cb -0.17 0.39 -0.01 0.00 0.10 0.00 0.00 66.02 66.32 3dyp s SER 213 CO 0.08 -0.83 -0.15 -0.76 0.98 0.00 0.00 173.24 172.56 3dyp s LEU 214 N -2.97 2.60 -0.09 2.42 1.43 -0.22 0.40 118.68 122.24 3dyp s LEU 214 Ca 0.17 -0.38 0.03 0.00 -1.03 0.00 0.00 54.13 52.92 3dyp s LEU 214 Cb 0.05 -1.58 0.01 0.00 0.03 0.00 0.00 46.19 44.70 3dyp s LEU 214 CO -0.01 0.15 -0.18 -0.22 0.23 0.00 0.00 176.35 176.32 3dyp s LEU 215 N 0.41 1.88 -0.23 1.79 2.96 0.20 -0.23 118.68 125.46 3dyp s LEU 215 Ca -0.11 -0.45 -0.09 0.00 -0.22 0.00 0.00 54.13 53.25 3dyp s LEU 215 Cb -0.16 -1.16 -0.04 0.00 0.50 0.00 0.00 46.19 45.32 3dyp s LEU 215 CO 0.06 0.09 0.11 -2.28 -1.32 0.00 0.00 176.35 173.01 3dyp s HIS 216 N 0.58 3.24 0.14 5.38 5.65 -0.19 -1.11 115.29 128.97 3dyp s HIS 216 Ca -0.15 0.05 0.08 0.00 0.25 0.00 0.00 55.06 55.29 3dyp s HIS 216 Cb -0.17 -2.21 -0.04 0.00 -1.18 0.00 0.00 32.58 28.98 3dyp s HIS 216 CO 0.05 -0.01 -0.20 0.15 -0.65 0.00 0.00 174.74 174.09 3dyp s LYS 217 N 1.01 1.22 0.74 2.88 -0.14 0.03 -4.70 119.74 120.79 3dyp s LYS 217 Ca 0.06 -1.30 -0.11 0.00 -1.36 0.00 0.00 55.97 53.25 3dyp s LYS 217 Cb -0.14 -1.38 0.04 0.00 -1.68 0.00 0.00 37.83 34.67 3dyp s LYS 217 CO 0.04 0.30 1.08 -2.14 -0.76 0.00 0.00 175.35 173.86 3dyp s PRO 218 N -2.40 2.53 0.24 -1.68 0.02 -1.26 0.58 135.00 133.03 3dyp s PRO 218 Ca 0.12 0.86 -0.06 0.00 0.02 0.00 0.00 61.00 61.94 3dyp s PRO 218 Cb -0.08 -1.95 0.23 0.00 0.02 0.00 0.00 34.50 32.72 3dyp s PRO 218 CO 0.06 -1.36 1.84 1.15 -0.33 0.00 0.00 177.00 178.36 3dyp h THR 219 N -0.91 1.25 -3.55 0.99 2.02 -1.93 -3.32 112.91 107.46 3dyp h THR 219 Ca -0.45 -0.70 -0.70 0.00 0.77 0.00 0.00 66.41 65.34 3dyp h THR 219 Cb 1.23 0.17 -0.19 0.00 -1.74 0.00 0.00 68.15 67.63 3dyp h THR 219 CO 0.57 0.30 -0.28 -0.89 0.37 0.00 0.00 175.52 175.59 3dyp s THR 220 N -5.70 5.15 0.17 3.16 2.01 -1.26 -3.78 115.64 115.39 3dyp s THR 220 Ca -0.12 -0.37 -0.08 0.00 0.31 0.00 0.00 61.69 61.43 3dyp s THR 220 Cb 0.16 -3.97 -0.01 0.00 0.01 0.00 0.00 72.50 68.69 3dyp s THR 220 CO 0.83 -0.34 0.26 0.00 -0.69 0.00 0.00 174.62 174.69 3dyp s GLN 221 N 1.99 1.17 -0.23 4.92 -2.07 -0.15 -4.88 119.66 120.41 3dyp s GLN 221 Ca 0.10 -1.25 -0.29 0.00 -1.82 0.00 0.00 55.36 52.10 3dyp s GLN 221 Cb -0.17 0.36 0.01 0.00 -1.09 0.00 0.00 33.01 32.11 3dyp s GLN 221 CO 0.12 -0.42 1.08 0.42 -1.32 0.00 0.00 175.29 175.17 3dyp s ILE 222 N -4.00 4.59 -0.62 3.63 1.01 -1.26 -1.13 121.20 123.43 3dyp s ILE 222 Ca 0.20 1.91 0.19 0.00 0.00 0.00 0.00 60.65 62.95 3dyp s ILE 222 Cb 0.04 -4.27 -0.24 0.00 0.01 0.00 0.00 42.46 38.00 3dyp s ILE 222 CO 0.02 -0.21 0.68 -1.54 0.00 0.00 0.00 174.94 173.89 3dyp n SER 223 N 6.45 0.78 -3.56 3.58 3.41 0.00 -4.92 113.62 119.36 3dyp n SER 223 Ca 0.12 -0.65 -0.09 0.00 -0.26 0.00 0.00 58.87 58.00 3dyp n SER 223 Cb 0.46 1.28 -0.04 0.00 -0.26 0.00 0.00 64.21 65.65 3dyp n SER 223 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dyp s ASP 224 N -3.24 -0.32 -0.19 4.04 2.15 -1.19 -4.87 116.67 113.05 3dyp s ASP 224 Ca 0.03 0.22 -0.17 0.00 0.43 0.00 0.00 52.55 53.06 3dyp s ASP 224 Cb 0.14 0.29 0.05 0.00 -0.30 0.00 0.00 42.92 43.10 3dyp s ASP 224 CO 0.78 -0.39 0.50 0.72 -0.17 0.00 0.00 175.17 176.61 3dyp s PHE 225 N -1.82 -0.56 -0.07 -5.34 -0.12 -1.26 -1.44 117.98 107.37 3dyp s PHE 225 Ca 0.02 1.35 0.04 0.00 -0.05 0.00 0.00 56.93 58.29 3dyp s PHE 225 Cb -0.01 0.20 -0.00 0.00 -0.63 0.00 0.00 43.02 42.58 3dyp s PHE 225 CO -0.03 -0.27 -0.20 -1.01 -0.05 0.00 0.00 175.22 173.66 3dyp s HIS 226 N 0.37 2.11 -0.14 3.49 3.76 0.18 -4.82 115.29 120.24 3dyp s HIS 226 Ca -0.01 -0.73 0.01 0.00 -0.15 0.00 0.00 55.06 54.18 3dyp s HIS 226 Cb -0.04 -1.42 -0.00 0.00 1.11 0.00 0.00 32.58 32.23 3dyp s HIS 226 CO -0.01 -0.27 -0.16 0.08 -0.85 0.00 0.00 174.74 173.52 3dyp s VAL 227 N 0.18 2.64 0.13 -0.90 1.01 -1.26 -1.42 120.40 120.78 3dyp s VAL 227 Ca -0.10 -0.79 0.10 0.00 0.00 0.00 0.00 61.98 61.18 3dyp s VAL 227 Cb -0.15 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 3dyp s VAL 227 CO 0.05 0.53 -0.23 0.00 0.00 0.00 0.00 175.10 175.44 3dyp s ALA 228 N 0.62 2.15 -0.12 5.51 0.00 -0.28 -4.86 121.76 124.78 3dyp s ALA 228 Ca -0.09 -1.42 -0.02 0.00 0.00 0.00 0.00 51.96 50.43 3dyp s ALA 228 Cb -0.16 -0.30 0.04 0.00 0.00 0.00 0.00 23.12 22.70 3dyp s ALA 228 CO 0.03 0.42 -0.00 0.95 0.00 0.00 0.00 175.76 177.16 3dyp s THR 229 N -1.32 0.56 0.16 0.00 -4.23 -1.26 -0.87 115.64 108.68 3dyp s THR 229 Ca 0.13 -0.21 0.09 0.00 -1.18 0.00 0.00 61.69 60.52 3dyp s THR 229 Cb -0.09 -0.82 -0.04 0.00 1.34 0.00 0.00 72.50 72.89 3dyp s THR 229 CO 0.06 0.11 -0.13 -0.13 -0.54 0.00 0.00 174.62 173.98 3dyp s ARG 230 N 1.88 1.93 0.25 3.99 0.52 -0.67 -4.80 118.95 122.04 3dyp s ARG 230 Ca 0.03 -1.27 0.04 0.00 -0.52 0.00 0.00 55.73 54.01 3dyp s ARG 230 Cb -0.14 -2.12 -0.05 0.00 0.52 0.00 0.00 34.95 33.16 3dyp s ARG 230 CO -0.07 0.45 -0.02 -0.06 0.02 0.00 0.00 175.30 175.62 3dyp s PHE 231 N -1.54 1.67 0.87 -0.53 0.40 -1.26 -1.06 117.98 116.54 3dyp s PHE 231 Ca 0.22 -0.86 -0.14 0.00 -0.60 0.00 0.00 56.93 55.56 3dyp s PHE 231 Cb -0.09 -0.97 0.20 0.00 0.51 0.00 0.00 43.02 42.66 3dyp s PHE 231 CO 0.13 0.05 1.18 0.27 0.70 0.00 0.00 175.22 177.55 3dyp n ASN 232 N -0.47 0.21 0.21 1.36 6.94 -0.68 -4.94 115.26 117.88 3dyp n ASN 232 Ca -0.05 -1.50 0.05 0.00 -0.02 0.00 0.00 54.58 53.06 3dyp n ASN 232 Cb 0.64 -0.89 0.49 0.00 -2.36 0.00 0.00 39.78 37.65 3dyp n ASN 232 CO 0.00 0.00 0.00 -2.24 -1.03 0.00 0.00 177.26 173.99 3dyp h ASP 233 N -1.49 0.04 -0.22 0.53 2.03 -2.01 -2.71 116.42 112.60 3dyp h ASP 233 Ca -0.38 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 55.91 3dyp h ASP 233 Cb 1.08 -0.01 0.00 0.00 -0.83 0.00 0.00 39.33 39.57 3dyp h ASP 233 CO 0.28 0.21 0.00 -0.90 -1.03 0.00 0.00 179.24 177.80 3dyp n ASP 234 N -4.32 3.34 -1.07 4.15 5.75 -1.26 -4.94 116.55 118.20 3dyp n ASP 234 Ca -0.02 -2.79 -0.14 0.00 -0.01 0.00 0.00 54.79 51.83 3dyp n ASP 234 Cb 0.24 -0.44 -0.06 0.00 -1.03 0.00 0.00 41.12 39.84 3dyp n ASP 234 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 3dyp n PHE 235 N -0.49 0.00 0.94 2.11 3.01 -1.02 -4.86 117.46 117.15 3dyp n PHE 235 Ca 0.17 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.76 3dyp n PHE 235 Cb 0.73 -2.49 0.29 0.00 -0.01 0.00 0.00 39.48 37.99 3dyp n PHE 235 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 3dyp n SER 236 N -0.26 0.46 -3.88 4.37 3.41 -1.26 -4.51 113.62 111.95 3dyp n SER 236 Ca -0.14 -0.10 -0.13 0.00 -0.26 0.00 0.00 58.87 58.24 3dyp n SER 236 Cb 0.46 0.14 -0.14 0.00 -0.26 0.00 0.00 64.21 64.41 3dyp n SER 236 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3dyp s ARG 237 N -3.02 0.09 0.07 4.33 1.81 -1.26 0.17 118.95 121.13 3dyp s ARG 237 Ca 0.11 -0.02 0.02 0.00 -1.72 0.00 0.00 55.73 54.12 3dyp s ARG 237 Cb 0.17 -0.11 -0.03 0.00 -0.45 0.00 0.00 34.95 34.53 3dyp s ARG 237 CO 0.68 0.01 -0.08 0.00 -0.68 0.00 0.00 175.30 175.23 3dyp s ALA 238 N 0.08 0.81 -0.21 2.13 0.00 0.13 -1.69 121.76 123.01 3dyp s ALA 238 Ca -0.01 -1.04 -0.02 0.00 0.00 0.00 0.00 51.96 50.90 3dyp s ALA 238 Cb -0.02 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.19 3dyp s ALA 238 CO -0.00 -0.09 -0.11 0.08 0.00 0.00 0.00 175.76 175.64 3dyp s VAL 239 N -2.30 2.79 -0.20 0.00 1.01 -0.22 -0.47 120.40 121.01 3dyp s VAL 239 Ca -0.00 -0.71 -0.18 0.00 0.00 0.00 0.00 61.98 61.09 3dyp s VAL 239 Cb -0.04 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 3dyp s VAL 239 CO -0.01 0.46 0.48 -0.22 0.00 0.00 0.00 175.10 175.81 3dyp s LEU 240 N 1.39 4.15 -0.18 3.92 0.20 0.30 -1.67 118.68 126.79 3dyp s LEU 240 Ca 0.05 0.63 0.01 0.00 0.69 0.00 0.00 54.13 55.51 3dyp s LEU 240 Cb -0.14 -2.65 0.02 0.00 -0.43 0.00 0.00 46.19 42.98 3dyp s LEU 240 CO -0.07 -0.15 -0.18 -0.70 -0.29 0.00 0.00 176.35 174.96 3dyp s GLU 241 N 1.52 3.04 -0.29 1.98 2.12 -0.05 -0.59 118.70 126.44 3dyp s GLU 241 Ca 0.23 -0.81 0.00 0.00 0.36 0.00 0.00 54.97 54.75 3dyp s GLU 241 Cb -0.15 -2.61 0.06 0.00 0.26 0.00 0.00 34.13 31.68 3dyp s GLU 241 CO 0.09 -0.19 -0.04 0.00 -0.54 0.00 0.00 175.26 174.58 3dyp s ALA 242 N 1.27 2.72 -0.09 6.30 0.00 0.76 -1.12 121.76 131.59 3dyp s ALA 242 Ca 0.04 -1.79 -0.22 0.00 0.00 0.00 0.00 51.96 49.99 3dyp s ALA 242 Cb -0.13 -1.80 -0.04 0.00 0.00 0.00 0.00 23.12 21.15 3dyp s ALA 242 CO -0.11 -1.26 0.63 -2.00 0.00 0.00 0.00 175.76 173.02 3dyp s GLU 243 N 1.18 4.39 -0.03 0.00 2.12 -0.51 -1.08 118.70 124.77 3dyp s GLU 243 Ca -0.06 0.73 0.05 0.00 0.36 0.00 0.00 54.97 56.05 3dyp s GLU 243 Cb -0.20 -3.46 -0.01 0.00 0.26 0.00 0.00 34.13 30.72 3dyp s GLU 243 CO -0.03 0.06 -0.17 0.08 -0.54 0.00 0.00 175.26 174.66 3dyp s VAL 244 N 0.87 1.38 0.16 3.70 1.01 0.14 -0.64 120.40 127.02 3dyp s VAL 244 Ca 0.33 -0.72 0.11 0.00 0.00 0.00 0.00 61.98 61.70 3dyp s VAL 244 Cb -0.17 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 3dyp s VAL 244 CO 0.15 0.39 -0.25 -1.10 0.00 0.00 0.00 175.10 174.29 3dyp s GLN 245 N -0.22 1.48 0.21 2.72 -0.21 -0.52 -1.29 119.66 121.84 3dyp s GLN 245 Ca 0.02 -1.43 0.07 0.00 0.02 0.00 0.00 55.36 54.04 3dyp s GLN 245 Cb -0.09 -1.88 -0.05 0.00 1.00 0.00 0.00 33.01 31.99 3dyp s GLN 245 CO 0.00 0.43 -0.11 0.00 -2.12 0.00 0.00 175.29 173.49 3dyp s MET 246 N -2.37 1.34 0.12 2.91 0.23 -0.18 -0.82 119.30 120.53 3dyp s MET 246 Ca 0.18 -1.62 0.07 0.00 -1.03 0.00 0.00 55.69 53.29 3dyp s MET 246 Cb -0.09 -1.01 -0.04 0.00 -1.53 0.00 0.00 34.83 32.16 3dyp s MET 246 CO 0.08 0.11 -0.18 0.00 -2.03 0.00 0.00 175.02 173.01 3dyp n GLY 248 N 0.80 -0.44 3.69 0.00 0.00 -1.25 -0.98 105.19 107.02 3dyp n GLY 248 Ca -0.17 -2.25 -0.42 0.00 0.00 0.00 0.00 46.02 43.17 3dyp n GLY 248 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3dyp s GLU 249 N -0.45 4.43 0.33 1.61 2.12 -1.26 -5.01 118.70 120.47 3dyp s GLU 249 Ca 0.00 1.50 -0.28 0.00 0.36 0.00 0.00 54.97 56.55 3dyp s GLU 249 Cb 0.00 -3.52 -0.09 0.00 0.26 0.00 0.00 34.13 30.78 3dyp s GLU 249 CO 0.00 -0.30 1.11 -0.51 -0.54 0.00 0.00 175.26 175.02 3dyp s LEU 250 N 1.83 4.40 -0.04 2.70 1.43 -1.26 -5.03 118.68 122.71 3dyp s LEU 250 Ca 0.52 2.24 -0.07 0.00 -1.03 0.00 0.00 54.13 55.79 3dyp s LEU 250 Cb -0.21 -3.81 0.01 0.00 0.03 0.00 0.00 46.19 42.21 3dyp s LEU 250 CO 0.21 -0.31 0.18 -0.13 0.23 0.00 0.00 176.35 176.53 3dyp s ARG 251 N -1.82 0.33 0.62 1.70 1.81 -1.26 -5.03 118.95 115.31 3dyp s ARG 251 Ca 0.49 0.02 0.38 0.00 -1.72 0.00 0.00 55.73 54.91 3dyp s ARG 251 Cb -0.30 0.15 2.04 0.00 -0.45 0.00 0.00 34.95 36.39 3dyp s ARG 251 CO 0.38 -0.06 2.25 -0.44 -0.68 0.00 0.00 175.30 176.75 3dyp h ASP 252 N 5.22 0.00 0.66 0.23 3.32 -2.00 -1.75 116.42 122.10 3dyp h ASP 252 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 3dyp h ASP 252 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 3dyp h ASP 252 CO 0.39 0.02 -0.03 0.00 -1.72 0.00 0.00 179.24 177.90 3dyp n TYR 253 N -3.27 0.00 -2.45 4.55 0.18 -1.26 -4.87 117.16 110.04 3dyp n TYR 253 Ca -0.02 0.00 -0.35 0.00 1.88 0.00 0.00 57.90 59.41 3dyp n TYR 253 Cb 0.14 -0.33 -0.02 0.00 -0.38 0.00 0.00 39.34 38.74 3dyp n TYR 253 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3dyp s LEU 254 N -2.69 3.89 0.07 -3.48 1.43 -0.66 0.04 118.68 117.28 3dyp s LEU 254 Ca 0.24 2.04 -0.06 0.00 -1.03 0.00 0.00 54.13 55.32 3dyp s LEU 254 Cb 0.20 -4.47 -0.01 0.00 0.03 0.00 0.00 46.19 41.93 3dyp s LEU 254 CO 0.49 -0.85 0.11 -0.13 0.23 0.00 0.00 176.35 176.20 3dyp s ARG 255 N -3.07 0.73 -0.05 1.70 1.81 0.71 -4.16 118.95 116.62 3dyp s ARG 255 Ca 0.67 -1.00 0.04 0.00 -1.72 0.00 0.00 55.73 53.72 3dyp s ARG 255 Cb -0.20 0.29 -0.00 0.00 -0.45 0.00 0.00 34.95 34.58 3dyp s ARG 255 CO 0.24 -0.20 -0.17 0.08 -0.68 0.00 0.00 175.30 174.57 3dyp s VAL 256 N -3.68 1.44 -0.10 3.52 1.01 0.13 -1.20 120.40 121.52 3dyp s VAL 256 Ca 0.04 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.34 3dyp s VAL 256 Cb 0.05 -1.24 -0.00 0.00 0.00 0.00 0.00 36.38 35.19 3dyp s VAL 256 CO -0.10 0.41 -0.22 -0.89 0.00 0.00 0.00 175.10 174.31 3dyp s THR 257 N 0.07 2.25 -0.14 3.92 2.01 -0.02 -1.11 115.64 122.62 3dyp s THR 257 Ca -0.05 -0.96 0.02 0.00 0.31 0.00 0.00 61.69 61.02 3dyp s THR 257 Cb -0.12 -1.87 0.01 0.00 0.01 0.00 0.00 72.50 70.53 3dyp s THR 257 CO 0.02 0.55 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.61 3dyp s VAL 258 N 0.28 2.12 0.09 3.82 1.01 0.09 -0.34 120.40 127.48 3dyp s VAL 258 Ca -0.16 -0.96 0.10 0.00 0.00 0.00 0.00 61.98 60.96 3dyp s VAL 258 Cb -0.17 -1.85 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 3dyp s VAL 258 CO 0.08 0.55 -0.26 -0.94 0.00 0.00 0.00 175.10 174.53 3dyp s SER 259 N 0.85 3.10 -0.11 3.32 1.04 -0.02 -1.13 113.70 120.76 3dyp s SER 259 Ca -0.06 -0.67 0.03 0.00 0.48 0.00 0.00 55.95 55.74 3dyp s SER 259 Cb -0.15 -0.23 0.00 0.00 0.10 0.00 0.00 66.02 65.73 3dyp s SER 259 CO -0.03 0.19 -0.23 -0.22 0.98 0.00 0.00 173.24 173.94 3dyp s LEU 260 N -1.67 2.15 0.05 2.42 2.96 0.16 -0.62 118.68 124.13 3dyp s LEU 260 Ca 0.12 -0.55 0.09 0.00 -0.22 0.00 0.00 54.13 53.56 3dyp s LEU 260 Cb -0.10 -1.43 -0.03 0.00 0.50 0.00 0.00 46.19 45.13 3dyp s LEU 260 CO 0.04 0.14 -0.24 0.26 -1.32 0.00 0.00 176.35 175.23 3dyp s TRP 261 N 0.46 2.11 -0.42 5.38 0.52 0.97 0.32 118.94 128.27 3dyp s TRP 261 Ca -0.15 -0.40 0.03 0.00 0.02 0.00 0.00 56.10 55.60 3dyp s TRP 261 Cb -0.17 -1.25 0.11 0.00 -1.15 0.00 0.00 33.47 31.01 3dyp s TRP 261 CO 0.06 0.13 0.15 -1.14 0.02 0.00 0.00 176.95 176.17 3dyp s GLN 262 N -1.29 1.60 7.73 4.98 2.00 0.12 -0.32 119.66 134.48 3dyp s GLN 262 Ca 0.10 -2.12 0.00 0.00 -2.00 0.00 0.00 55.36 51.34 3dyp s GLN 262 Cb -0.10 -3.07 0.00 0.00 0.80 0.00 0.00 33.01 30.64 3dyp s GLN 262 CO 0.02 -1.03 0.00 0.41 -0.50 0.00 0.00 175.29 174.19 3dyp n GLY 263 N 3.78 3.26 0.29 2.59 0.00 -1.26 -1.73 105.19 112.11 3dyp n GLY 263 Ca 0.04 -0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.05 3dyp n GLY 263 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dyp n GLU 264 N 13.42 0.85 -3.22 1.61 1.02 -1.26 -4.87 120.64 128.20 3dyp n GLU 264 Ca 0.00 -0.57 -0.39 0.00 -0.02 0.00 0.00 57.16 56.18 3dyp n GLU 264 Cb 0.00 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 29.88 3dyp n GLU 264 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3dyp s THR 265 N -2.55 4.90 -0.39 2.62 2.01 -0.71 -5.01 115.64 116.52 3dyp s THR 265 Ca 0.21 1.23 -0.21 0.00 0.31 0.00 0.00 61.69 63.23 3dyp s THR 265 Cb 0.19 -3.92 0.01 0.00 0.01 0.00 0.00 72.50 68.78 3dyp s THR 265 CO 0.56 0.43 0.67 -1.58 -0.69 0.00 0.00 174.62 174.01 3dyp s GLN 266 N -0.25 3.55 0.06 4.92 0.74 -1.26 -0.71 119.66 126.71 3dyp s GLN 266 Ca 0.31 -0.05 -0.12 0.00 0.05 0.00 0.00 55.36 55.54 3dyp s GLN 266 Cb -0.18 -3.86 -0.29 0.00 1.10 0.00 0.00 33.01 29.77 3dyp s GLN 266 CO 0.17 -0.87 1.10 0.28 -0.55 0.00 0.00 175.29 175.42 3dyp h VAL 267 N 5.78 1.34 -2.66 1.34 2.07 -0.48 -3.48 116.25 120.16 3dyp h VAL 267 Ca -0.26 -2.67 0.08 0.00 0.82 0.00 0.00 66.70 64.67 3dyp h VAL 267 Cb 1.10 2.84 -0.10 0.00 -1.52 0.00 0.00 31.29 33.61 3dyp h VAL 267 CO 0.88 0.80 0.35 0.00 0.02 0.00 0.00 177.57 179.62 3dyp s ALA 268 N -2.81 -1.59 -0.24 1.67 0.00 -1.07 -4.99 121.76 112.73 3dyp s ALA 268 Ca -0.08 0.38 -0.26 0.00 0.00 0.00 0.00 51.96 51.99 3dyp s ALA 268 Cb 0.06 0.70 0.11 0.00 0.00 0.00 0.00 23.12 23.98 3dyp s ALA 268 CO 0.92 -0.87 0.93 0.45 0.00 0.00 0.00 175.76 177.20 3dyp s SER 269 N -2.76 -0.51 -0.02 0.00 0.15 -1.26 -0.66 113.70 108.64 3dyp s SER 269 Ca 0.07 0.89 -0.09 0.00 0.70 0.00 0.00 55.95 57.52 3dyp s SER 269 Cb -0.02 0.87 0.01 0.00 -1.71 0.00 0.00 66.02 65.16 3dyp s SER 269 CO -0.04 -0.25 0.18 -0.83 1.20 0.00 0.00 173.24 173.50 3dyp s GLY 270 N -0.11 -0.03 0.05 9.45 0.00 -0.28 -4.99 107.32 111.41 3dyp s GLY 270 Ca 0.00 0.10 0.04 0.00 0.00 0.00 0.00 44.72 44.87 3dyp s GLY 270 CO -0.02 -0.04 -0.12 -1.59 0.00 0.00 0.00 173.10 171.33 3dyp s THR 271 N -1.05 0.92 -0.01 0.90 2.01 -1.26 -0.73 115.64 116.42 3dyp s THR 271 Ca -0.11 -1.13 -0.29 0.00 0.31 0.00 0.00 61.69 60.48 3dyp s THR 271 Cb -0.06 -0.90 0.08 0.00 0.01 0.00 0.00 72.50 71.64 3dyp s THR 271 CO 0.02 -0.20 0.74 0.00 -0.69 0.00 0.00 174.62 174.49 3dyp s ALA 272 N -1.15 -1.76 0.75 7.40 0.00 -0.27 -4.98 121.76 121.74 3dyp s ALA 272 Ca -0.03 1.13 -0.12 0.00 0.00 0.00 0.00 51.96 52.94 3dyp s ALA 272 Cb -0.09 0.15 0.04 0.00 0.00 0.00 0.00 23.12 23.22 3dyp s ALA 272 CO 0.01 -0.50 1.13 -1.25 0.00 0.00 0.00 175.76 175.16 3dyp s PRO 273 N -2.04 2.50 0.61 0.00 0.04 -1.26 0.21 135.00 135.07 3dyp s PRO 273 Ca -0.05 0.33 -0.16 0.00 0.04 0.00 0.00 61.00 61.17 3dyp s PRO 273 Cb -0.00 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.52 3dyp s PRO 273 CO 0.01 -1.26 1.09 -0.06 0.04 0.00 0.00 177.00 176.81 3dyp s PHE 274 N -3.44 2.79 0.00 0.56 0.40 -1.26 -4.85 117.98 112.19 3dyp s PHE 274 Ca 0.60 1.53 0.00 0.00 -0.60 0.00 0.00 56.93 58.46 3dyp s PHE 274 Cb -0.11 -3.11 0.00 0.00 0.51 0.00 0.00 43.02 40.31 3dyp s PHE 274 CO 0.51 -1.42 0.00 0.41 0.70 0.00 0.00 175.22 175.42 3dyp n GLY 275 N -0.63 1.90 3.94 4.36 0.00 0.83 -4.95 105.19 110.63 3dyp n GLY 275 Ca 0.10 -0.24 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 3dyp n GLY 275 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dyp s GLY 276 N 0.00 1.71 0.83 -0.02 0.00 0.92 -4.81 107.32 105.94 3dyp s GLY 276 Ca 0.00 -1.10 -0.11 0.00 0.00 0.00 0.00 44.72 43.51 3dyp s GLY 276 CO 0.00 -0.56 1.13 -1.83 0.00 0.00 0.00 173.10 171.85 3dyp s GLU 277 N -5.45 1.69 0.28 2.90 -1.05 -1.26 -4.42 118.70 111.39 3dyp s GLU 277 Ca 0.65 1.42 -0.30 0.00 -0.15 0.00 0.00 54.97 56.59 3dyp s GLU 277 Cb -0.08 -1.81 -0.12 0.00 -0.44 0.00 0.00 34.13 31.68 3dyp s GLU 277 CO 0.47 -2.11 1.63 -0.89 0.95 0.00 0.00 175.26 175.32 3dyp n ILE 278 N -3.71 0.82 -0.09 1.83 5.41 -1.26 -4.23 119.36 118.13 3dyp n ILE 278 Ca 0.11 -0.21 -0.14 0.00 1.00 0.00 0.00 62.75 63.51 3dyp n ILE 278 Cb 0.52 -1.99 -0.07 0.00 -0.71 0.00 0.00 39.64 37.39 3dyp n ILE 278 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 3dyp n ILE 279 N 2.51 0.98 -3.04 1.39 2.08 0.70 -4.88 119.36 119.10 3dyp n ILE 279 Ca 0.10 -0.34 0.00 0.00 0.56 0.00 0.00 62.75 63.07 3dyp n ILE 279 Cb 0.37 -1.29 0.00 0.00 -0.75 0.00 0.00 39.64 37.96 3dyp n ILE 279 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 3dyp n ASP 280 N -3.24 0.00 0.33 4.38 5.68 -0.64 -5.00 116.55 118.05 3dyp n ASP 280 Ca -0.32 -0.73 0.19 0.00 -0.50 0.00 0.00 54.79 53.44 3dyp n ASP 280 Cb 0.80 0.00 1.03 0.00 -1.14 0.00 0.00 41.12 41.81 3dyp n ASP 280 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3dyp h GLU 281 N 0.00 0.00 -0.02 0.11 3.07 -2.04 -0.06 114.58 115.63 3dyp h GLU 281 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3dyp h GLU 281 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3dyp h GLU 281 CO 0.00 0.00 -0.11 0.54 -1.40 0.00 0.00 179.01 178.04 3dyp n ARG 282 N -3.07 1.77 0.00 2.33 5.12 -1.26 -5.07 116.66 116.49 3dyp n ARG 282 Ca -0.02 -1.33 0.00 0.00 -1.93 0.00 0.00 57.85 54.57 3dyp n ARG 282 Cb 0.21 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 30.04 3dyp n ARG 282 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3dyp n GLY 283 N 1.31 0.22 1.26 -0.13 0.00 -0.04 -5.06 105.19 102.75 3dyp n GLY 283 Ca 0.14 -1.97 -0.09 0.00 0.00 0.00 0.00 46.02 44.10 3dyp n GLY 283 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyp n GLY 284 N 0.00 3.75 3.52 -0.02 0.00 -1.26 -0.21 105.19 110.97 3dyp n GLY 284 Ca 0.00 -1.95 -0.43 0.00 0.00 0.00 0.00 46.02 43.64 3dyp n GLY 284 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dyp s TYR 285 N -2.19 3.02 -0.19 1.61 1.51 -1.26 -4.89 117.35 114.96 3dyp s TYR 285 Ca 0.09 0.02 0.29 0.00 -1.01 0.00 0.00 57.07 56.46 3dyp s TYR 285 Cb 0.00 -3.51 1.05 0.00 -0.11 0.00 0.00 41.96 39.39 3dyp s TYR 285 CO 0.07 -0.94 1.84 0.00 -1.11 0.00 0.00 175.55 175.40 3dyp h ALA 286 N 8.94 1.00 -0.55 3.71 0.00 -1.94 0.26 119.26 130.69 3dyp h ALA 286 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3dyp h ALA 286 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3dyp h ALA 286 CO 0.93 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.78 3dyp n ASP 287 N -2.85 5.29 -4.20 0.00 5.75 -1.26 -3.38 116.55 115.89 3dyp n ASP 287 Ca 0.02 -2.80 -0.12 0.00 -0.01 0.00 0.00 54.79 51.88 3dyp n ASP 287 Cb 0.34 -0.66 -0.10 0.00 -1.03 0.00 0.00 41.12 39.67 3dyp n ASP 287 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3dyp s ARG 288 N -2.52 1.08 -0.06 0.11 0.52 -1.14 -1.01 118.95 115.94 3dyp s ARG 288 Ca 0.51 -1.54 -0.29 0.00 -0.52 0.00 0.00 55.73 53.89 3dyp s ARG 288 Cb 0.38 0.04 0.06 0.00 0.52 0.00 0.00 34.95 35.95 3dyp s ARG 288 CO 0.16 -0.25 0.64 0.54 0.02 0.00 0.00 175.30 176.41 3dyp s VAL 289 N -3.92 0.01 -0.17 3.52 0.11 -0.41 -0.12 120.40 119.42 3dyp s VAL 289 Ca 0.28 -0.05 0.00 0.00 -2.93 0.00 0.00 61.98 59.29 3dyp s VAL 289 Cb 0.07 -0.96 0.01 0.00 -1.53 0.00 0.00 36.38 33.97 3dyp s VAL 289 CO 0.06 -0.03 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.74 3dyp s THR 290 N -1.09 2.46 -0.10 5.04 2.01 -1.26 0.23 115.64 122.94 3dyp s THR 290 Ca -0.10 -0.83 -0.04 0.00 0.31 0.00 0.00 61.69 61.02 3dyp s THR 290 Cb -0.01 -2.04 -0.04 0.00 0.01 0.00 0.00 72.50 70.42 3dyp s THR 290 CO 0.09 0.52 0.07 -0.76 -0.69 0.00 0.00 174.62 173.85 3dyp s LEU 291 N 1.01 4.00 -0.17 4.42 2.01 -0.25 -4.93 118.68 124.77 3dyp s LEU 291 Ca -0.02 0.31 0.01 0.00 0.01 0.00 0.00 54.13 54.44 3dyp s LEU 291 Cb -0.15 -1.95 0.02 0.00 0.01 0.00 0.00 46.19 44.13 3dyp s LEU 291 CO -0.04 0.39 -0.18 -0.13 1.01 0.00 0.00 176.35 177.41 3dyp s ARG 292 N -0.96 2.73 -0.10 1.70 0.52 -1.26 -0.17 118.95 121.41 3dyp s ARG 292 Ca 0.14 -0.73 0.03 0.00 -0.52 0.00 0.00 55.73 54.65 3dyp s ARG 292 Cb -0.12 -2.40 -0.01 0.00 0.52 0.00 0.00 34.95 32.94 3dyp s ARG 292 CO 0.03 -0.22 -0.19 -0.51 0.02 0.00 0.00 175.30 174.43 3dyp s LEU 293 N 1.36 2.40 0.03 2.53 1.43 0.24 -4.95 118.68 121.73 3dyp s LEU 293 Ca 0.05 -0.43 -0.20 0.00 -1.03 0.00 0.00 54.13 52.52 3dyp s LEU 293 Cb -0.13 -1.50 -0.06 0.00 0.03 0.00 0.00 46.19 44.53 3dyp s LEU 293 CO -0.12 0.19 0.59 0.20 0.23 0.00 0.00 176.35 177.44 3dyp s ASN 294 N 0.18 7.02 -0.12 2.29 0.01 -1.26 -0.54 114.94 122.53 3dyp s ASN 294 Ca -0.11 1.22 -0.00 0.00 -0.71 0.00 0.00 52.86 53.25 3dyp s ASN 294 Cb -0.16 -2.37 0.03 0.00 0.41 0.00 0.00 41.25 39.16 3dyp s ASN 294 CO 0.06 0.18 -0.07 -0.69 -1.51 0.00 0.00 177.10 175.07 3dyp s VAL 295 N -0.61 1.02 0.03 1.60 1.01 0.38 -4.89 120.40 118.95 3dyp s VAL 295 Ca 0.30 -0.33 -0.21 0.00 0.00 0.00 0.00 61.98 61.75 3dyp s VAL 295 Cb -0.19 -1.07 -0.06 0.00 0.00 0.00 0.00 36.38 35.06 3dyp s VAL 295 CO 0.18 0.33 0.61 -1.61 0.00 0.00 0.00 175.10 174.61 3dyp s GLU 296 N 1.70 4.31 -1.37 2.72 0.41 -1.26 -0.69 118.70 124.51 3dyp s GLU 296 Ca 0.04 0.78 -0.00 0.00 -0.41 0.00 0.00 54.97 55.38 3dyp s GLU 296 Cb -0.13 -3.31 0.00 0.00 -1.78 0.00 0.00 34.13 28.92 3dyp s GLU 296 CO -0.08 0.46 0.52 0.09 -0.49 0.00 0.00 175.26 175.76 3dyp n ASN 297 N 2.36 -0.66 -4.70 -0.19 5.03 0.46 -4.90 115.26 112.65 3dyp n ASN 297 Ca -0.08 -0.94 -0.39 0.00 0.87 0.00 0.00 54.58 54.04 3dyp n ASN 297 Cb 0.51 -3.41 0.03 0.00 -1.02 0.00 0.00 39.78 35.89 3dyp n ASN 297 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 3dyp n PRO 298 N -4.36 1.62 -2.69 3.52 -0.04 -1.26 -4.93 135.00 126.86 3dyp n PRO 298 Ca -0.30 0.59 -0.43 0.00 -0.04 0.00 0.00 63.50 63.32 3dyp n PRO 298 Cb 0.68 -2.43 -0.02 0.00 -0.04 0.00 0.00 33.50 31.69 3dyp n PRO 298 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3dyp s LYS 299 N -2.62 4.29 0.35 0.54 1.02 -1.26 -5.01 119.74 117.04 3dyp s LYS 299 Ca 0.69 1.33 -0.19 0.00 0.02 0.00 0.00 55.97 57.82 3dyp s LYS 299 Cb -0.45 -3.62 -0.10 0.00 -0.52 0.00 0.00 37.83 33.15 3dyp s LYS 299 CO 0.52 -0.55 0.83 -0.51 -0.92 0.00 0.00 175.35 174.72 3dyp s LEU 300 N 2.89 4.09 -0.03 3.17 1.43 -1.26 -4.45 118.68 124.52 3dyp s LEU 300 Ca 0.44 1.50 -0.13 0.00 -1.03 0.00 0.00 54.13 54.91 3dyp s LEU 300 Cb -0.16 -4.17 -0.05 0.00 0.03 0.00 0.00 46.19 41.84 3dyp s LEU 300 CO 0.09 -0.21 0.34 0.86 0.23 0.00 0.00 176.35 177.66 3dyp s TRP 301 N -1.95 3.69 0.32 0.29 -0.00 0.26 -3.91 118.94 117.64 3dyp s TRP 301 Ca 0.55 0.88 -0.14 0.00 -0.00 0.00 0.00 56.10 57.39 3dyp s TRP 301 Cb -0.11 -2.20 0.02 0.00 -0.00 0.00 0.00 33.47 31.18 3dyp s TRP 301 CO 0.17 0.66 0.65 -1.54 -0.00 0.00 0.00 176.95 176.89 3dyp s SER 302 N -1.09 0.08 0.34 5.86 1.04 -0.60 -4.66 113.70 114.65 3dyp s SER 302 Ca 0.22 -1.02 0.14 0.00 0.48 0.00 0.00 55.95 55.77 3dyp s SER 302 Cb -0.15 0.73 0.59 0.00 0.10 0.00 0.00 66.02 67.28 3dyp s SER 302 CO 0.11 -1.42 1.72 0.00 0.98 0.00 0.00 173.24 174.64 3dyp h ALA 303 N 2.07 1.08 -0.33 5.32 0.00 -1.91 -2.30 119.26 123.19 3dyp h ALA 303 Ca -0.27 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.11 3dyp h ALA 303 Cb 1.25 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3dyp h ALA 303 CO 0.35 0.58 -0.22 0.93 0.00 0.00 0.00 179.25 180.89 3dyp h GLU 304 N 0.00 0.74 -2.78 0.00 5.08 -1.94 -3.40 114.58 112.28 3dyp h GLU 304 Ca -0.00 -0.35 -0.53 0.00 -1.00 0.00 0.00 59.36 57.47 3dyp h GLU 304 Cb 0.90 -0.01 -0.40 0.00 0.50 0.00 0.00 28.75 29.75 3dyp h GLU 304 CO 0.06 0.96 -0.79 0.42 -1.00 0.00 0.00 179.01 178.67 3dyp s ILE 305 N -4.52 -0.05 -1.50 3.13 1.01 -1.14 -4.96 121.20 113.18 3dyp s ILE 305 Ca -0.12 -0.85 -0.11 0.00 0.00 0.00 0.00 60.65 59.57 3dyp s ILE 305 Cb 0.09 -1.00 0.01 0.00 0.01 0.00 0.00 42.46 41.57 3dyp s ILE 305 CO 0.83 -0.75 2.53 -0.81 0.00 0.00 0.00 174.94 176.74 3dyp n PRO 306 N 5.14 3.52 -1.80 2.79 -0.04 -0.88 -1.56 135.00 142.17 3dyp n PRO 306 Ca -0.04 -2.63 -0.42 0.00 -0.04 0.00 0.00 63.50 60.37 3dyp n PRO 306 Cb 0.42 -2.96 -0.03 0.00 -0.04 0.00 0.00 33.50 30.89 3dyp n PRO 306 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3dyp s ASN 307 N 2.16 6.44 0.06 3.54 0.01 -1.25 -4.88 114.94 121.02 3dyp s ASN 307 Ca 0.57 2.82 0.03 0.00 -0.71 0.00 0.00 52.86 55.57 3dyp s ASN 307 Cb 0.16 -2.61 -0.03 0.00 0.41 0.00 0.00 41.25 39.18 3dyp s ASN 307 CO -0.07 -0.91 -0.09 -0.76 -1.51 0.00 0.00 177.10 173.76 3dyp s LEU 308 N 0.67 2.32 0.46 0.60 1.43 -1.26 -4.21 118.68 118.70 3dyp s LEU 308 Ca 0.70 -0.66 0.05 0.00 -1.03 0.00 0.00 54.13 53.19 3dyp s LEU 308 Cb -0.48 -0.24 -0.02 0.00 0.03 0.00 0.00 46.19 45.48 3dyp s LEU 308 CO 0.36 -0.22 0.18 -0.31 0.23 0.00 0.00 176.35 176.59 3dyp s TYR 309 N -1.82 2.21 -0.09 0.29 1.51 -0.11 -4.72 117.35 114.61 3dyp s TYR 309 Ca -0.03 -0.73 0.02 0.00 -1.01 0.00 0.00 57.07 55.31 3dyp s TYR 309 Cb -0.07 -1.86 0.01 0.00 -0.11 0.00 0.00 41.96 39.93 3dyp s TYR 309 CO 0.00 0.06 -0.15 0.50 -1.11 0.00 0.00 175.55 174.85 3dyp s ARG 310 N -3.97 2.09 -0.22 -0.62 6.06 0.57 -0.48 118.95 122.37 3dyp s ARG 310 Ca 0.31 -0.53 -0.09 0.00 -2.50 0.00 0.00 55.73 52.93 3dyp s ARG 310 Cb 0.02 -1.75 -0.04 0.00 0.06 0.00 0.00 34.95 33.24 3dyp s ARG 310 CO 0.18 -0.02 0.12 0.00 -2.50 0.00 0.00 175.30 173.07 3dyp s ALA 311 N 0.86 3.47 -0.13 6.12 0.00 -0.37 -0.02 121.76 131.69 3dyp s ALA 311 Ca -0.10 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 50.98 3dyp s ALA 311 Cb -0.15 -2.16 -0.01 0.00 0.00 0.00 0.00 23.12 20.80 3dyp s ALA 311 CO 0.01 -0.13 -0.15 0.08 0.00 0.00 0.00 175.76 175.58 3dyp s VAL 312 N 0.93 2.86 -0.28 0.00 1.01 0.21 -1.09 120.40 124.05 3dyp s VAL 312 Ca 0.06 -0.72 -0.04 0.00 0.00 0.00 0.00 61.98 61.28 3dyp s VAL 312 Cb -0.13 -2.19 0.03 0.00 0.00 0.00 0.00 36.38 34.08 3dyp s VAL 312 CO 0.03 0.52 0.00 -0.69 0.00 0.00 0.00 175.10 174.97 3dyp s VAL 313 N 0.45 3.30 -0.10 2.92 1.01 -0.02 -0.84 120.40 127.13 3dyp s VAL 313 Ca -0.11 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 60.89 3dyp s VAL 313 Cb -0.16 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 3dyp s VAL 313 CO 0.05 0.09 -0.12 -1.61 0.00 0.00 0.00 175.10 173.51 3dyp s GLU 314 N 1.37 3.08 -0.23 2.72 2.02 0.54 -1.21 118.70 126.99 3dyp s GLU 314 Ca -0.00 -0.66 -0.08 0.00 0.02 0.00 0.00 54.97 54.25 3dyp s GLU 314 Cb -0.17 -2.58 -0.04 0.00 0.10 0.00 0.00 34.13 31.44 3dyp s GLU 314 CO -0.01 0.39 0.09 -1.17 0.02 0.00 0.00 175.26 174.58 3dyp s LEU 315 N -0.11 3.74 0.00 1.80 2.96 0.18 -0.84 118.68 126.41 3dyp s LEU 315 Ca -0.01 -0.03 -0.09 0.00 -0.22 0.00 0.00 54.13 53.78 3dyp s LEU 315 Cb -0.14 -1.99 0.03 0.00 0.50 0.00 0.00 46.19 44.60 3dyp s LEU 315 CO 0.03 0.05 0.63 0.00 -1.32 0.00 0.00 176.35 175.75 3dyp n HIS 316 N 4.34 -1.92 -3.70 5.38 1.44 -0.34 -0.33 115.22 120.10 3dyp n HIS 316 Ca -0.16 -2.03 -0.20 0.00 -2.01 0.00 0.00 57.72 53.32 3dyp n HIS 316 Cb 0.52 0.73 -0.02 0.00 0.12 0.00 0.00 29.99 31.35 3dyp n HIS 316 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 3dyp s THR 317 N -2.45 4.26 0.53 0.61 -4.23 0.34 -0.21 115.64 114.50 3dyp s THR 317 Ca 0.21 -1.10 0.24 0.00 -1.18 0.00 0.00 61.69 59.86 3dyp s THR 317 Cb -0.03 -3.46 0.37 0.00 1.34 0.00 0.00 72.50 70.72 3dyp s THR 317 CO 0.16 -0.21 2.03 0.00 -0.54 0.00 0.00 174.62 176.05 3dyp h ALA 318 N 1.07 2.36 -0.02 3.99 0.00 -0.71 0.22 119.26 126.17 3dyp h ALA 318 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3dyp h ALA 318 Cb 1.25 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3dyp h ALA 318 CO 0.56 -0.51 0.00 -0.40 0.00 0.00 0.00 179.25 178.90 3dyp n ASP 319 N -4.35 0.40 0.00 0.00 5.75 -1.26 -4.86 116.55 112.22 3dyp n ASP 319 Ca 0.07 -1.28 0.00 0.00 -0.01 0.00 0.00 54.79 53.56 3dyp n ASP 319 Cb 0.50 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 3dyp n ASP 319 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dyp n GLY 320 N 0.97 0.65 3.69 6.12 0.00 0.78 -5.06 105.19 112.34 3dyp n GLY 320 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 3dyp n GLY 320 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dyp s THR 321 N -2.00 4.79 0.17 2.61 2.01 -1.22 -4.76 115.64 117.24 3dyp s THR 321 Ca 0.00 2.05 -0.30 0.00 0.31 0.00 0.00 61.69 63.75 3dyp s THR 321 Cb 0.00 -4.32 -0.08 0.00 0.01 0.00 0.00 72.50 68.12 3dyp s THR 321 CO 0.00 0.02 1.19 -0.22 -0.69 0.00 0.00 174.62 174.92 3dyp s LEU 322 N 1.91 4.44 -0.24 4.42 2.96 -1.26 -0.50 118.68 130.41 3dyp s LEU 322 Ca 0.49 2.20 -0.16 0.00 -0.22 0.00 0.00 54.13 56.44 3dyp s LEU 322 Cb -0.19 -3.60 -0.13 0.00 0.50 0.00 0.00 46.19 42.77 3dyp s LEU 322 CO 0.19 -0.37 -0.20 -0.38 -1.32 0.00 0.00 176.35 174.27 3dyp n ILE 323 N 2.63 1.52 -3.67 6.68 5.41 0.55 -4.93 119.36 127.56 3dyp n ILE 323 Ca 0.05 -0.21 -0.04 0.00 1.00 0.00 0.00 62.75 63.54 3dyp n ILE 323 Cb 0.45 -1.99 -0.01 0.00 -0.71 0.00 0.00 39.64 37.37 3dyp n ILE 323 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 3dyp s GLU 324 N -2.50 1.02 0.01 0.38 -1.05 -1.00 -4.83 118.70 110.73 3dyp s GLU 324 Ca -0.34 -0.52 0.02 0.00 -0.15 0.00 0.00 54.97 53.98 3dyp s GLU 324 Cb 0.11 0.37 -0.01 0.00 -0.44 0.00 0.00 34.13 34.16 3dyp s GLU 324 CO 0.50 -0.46 -0.06 0.00 0.95 0.00 0.00 175.26 176.18 3dyp s ALA 325 N -3.16 0.51 0.31 -0.84 0.00 0.29 -0.65 121.76 118.23 3dyp s ALA 325 Ca 0.10 -0.41 0.07 0.00 0.00 0.00 0.00 51.96 51.73 3dyp s ALA 325 Cb -0.01 -0.07 -0.06 0.00 0.00 0.00 0.00 23.12 22.98 3dyp s ALA 325 CO -0.01 0.08 -0.05 -1.21 0.00 0.00 0.00 175.76 174.57 3dyp s GLU 326 N -0.57 1.66 0.17 0.00 0.41 -0.35 -1.90 118.70 118.12 3dyp s GLU 326 Ca -0.01 -1.86 -0.24 0.00 -0.41 0.00 0.00 54.97 52.45 3dyp s GLU 326 Cb -0.05 -1.28 0.06 0.00 -1.78 0.00 0.00 34.13 31.08 3dyp s GLU 326 CO 0.00 0.03 0.79 0.00 -0.49 0.00 0.00 175.26 175.58 3dyp s ALA 327 N -2.93 -1.52 0.19 5.21 0.00 -1.26 -0.84 121.76 120.61 3dyp s ALA 327 Ca 0.31 0.19 -0.22 0.00 0.00 0.00 0.00 51.96 52.25 3dyp s ALA 327 Cb 0.05 0.73 0.05 0.00 0.00 0.00 0.00 23.12 23.95 3dyp s ALA 327 CO 0.14 -0.93 0.62 0.00 0.00 0.00 0.00 175.76 175.59 3dyp s ASP 329 N -2.81 7.44 -0.05 0.00 1.01 -1.26 -1.23 116.67 119.77 3dyp s ASP 329 Ca 0.04 1.82 0.06 0.00 0.71 0.00 0.00 52.55 55.18 3dyp s ASP 329 Cb -0.02 -2.57 -0.01 0.00 1.01 0.00 0.00 42.92 41.33 3dyp s ASP 329 CO -0.07 0.07 -0.24 -0.69 0.21 0.00 0.00 175.17 174.46 3dyp s VAL 330 N -1.37 1.94 -0.17 -1.27 1.01 0.37 -4.69 120.40 116.23 3dyp s VAL 330 Ca 0.44 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.42 3dyp s VAL 330 Cb -0.22 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.53 3dyp s VAL 330 CO 0.27 0.54 -0.20 -0.83 0.00 0.00 0.00 175.10 174.89 3dyp s GLY 331 N -0.17 1.40 -0.58 4.51 0.00 -1.26 -0.94 107.32 110.28 3dyp s GLY 331 Ca -0.02 -1.16 -0.27 0.00 0.00 0.00 0.00 44.72 43.26 3dyp s GLY 331 CO 0.03 0.16 1.14 -1.36 0.00 0.00 0.00 173.10 173.08 3dyp s PHE 332 N 1.10 2.63 -0.07 1.90 0.40 -1.26 -4.80 117.98 117.88 3dyp s PHE 332 Ca 0.00 0.31 -0.26 0.00 -0.60 0.00 0.00 56.93 56.38 3dyp s PHE 332 Cb -0.14 -4.43 0.06 0.00 0.51 0.00 0.00 43.02 39.02 3dyp s PHE 332 CO -0.08 -1.56 0.59 -0.98 0.70 0.00 0.00 175.22 173.90 3dyp s ARG 333 N 4.77 0.93 -0.08 0.44 3.03 -1.26 -0.58 118.95 126.20 3dyp s ARG 333 Ca 0.40 0.25 0.03 0.00 2.03 0.00 0.00 55.73 58.44 3dyp s ARG 333 Cb -0.08 0.43 -0.02 0.00 -1.03 0.00 0.00 34.95 34.25 3dyp s ARG 333 CO 0.24 -0.26 -0.18 -2.00 -1.13 0.00 0.00 175.30 171.97 3dyp s GLU 334 N -1.01 2.84 -0.14 3.89 2.12 -1.26 -4.88 118.70 120.26 3dyp s GLU 334 Ca -0.10 -0.77 0.02 0.00 0.36 0.00 0.00 54.97 54.48 3dyp s GLU 334 Cb -0.02 -2.39 0.00 0.00 0.26 0.00 0.00 34.13 31.99 3dyp s GLU 334 CO 0.07 0.39 -0.20 0.08 -0.54 0.00 0.00 175.26 175.06 3dyp s VAL 335 N -0.14 2.27 0.06 3.70 1.01 -1.26 -1.02 120.40 125.02 3dyp s VAL 335 Ca -0.02 -0.91 -0.16 0.00 0.00 0.00 0.00 61.98 60.88 3dyp s VAL 335 Cb -0.14 -1.92 0.03 0.00 0.00 0.00 0.00 36.38 34.35 3dyp s VAL 335 CO 0.04 0.54 0.37 0.00 0.00 0.00 0.00 175.10 176.05 3dyp s ARG 336 N 0.74 0.91 -0.19 2.72 1.70 -0.40 -4.60 118.95 119.83 3dyp s ARG 336 Ca -0.08 -0.47 -0.06 0.00 -0.47 0.00 0.00 55.73 54.64 3dyp s ARG 336 Cb -0.16 0.40 -0.03 0.00 -0.57 0.00 0.00 34.95 34.59 3dyp s ARG 336 CO 0.00 -0.31 0.03 0.42 -1.08 0.00 0.00 175.30 174.36 3dyp s ILE 337 N -2.74 4.32 -0.04 4.99 1.01 -1.26 -0.32 121.20 127.16 3dyp s ILE 337 Ca -0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 60.65 60.41 3dyp s ILE 337 Cb -0.00 -2.95 0.03 0.00 0.01 0.00 0.00 42.46 39.55 3dyp s ILE 337 CO -0.04 0.44 0.09 -0.70 0.00 0.00 0.00 174.94 174.73 3dyp s GLU 338 N 0.69 0.02 -1.40 2.79 2.12 0.35 -4.82 118.70 118.45 3dyp s GLU 338 Ca 0.01 0.29 -0.03 0.00 0.36 0.00 0.00 54.97 55.60 3dyp s GLU 338 Cb -0.14 -0.22 0.02 0.00 0.26 0.00 0.00 34.13 34.05 3dyp s GLU 338 CO 0.02 -0.17 0.28 -1.71 -0.54 0.00 0.00 175.26 173.13 3dyp n ASN 339 N 4.25 -4.93 0.00 -1.70 5.15 -1.26 -1.54 115.26 115.23 3dyp n ASN 339 Ca -0.26 -0.11 0.00 0.00 -0.60 0.00 0.00 54.58 53.61 3dyp n ASN 339 Cb 0.51 -4.07 0.00 0.00 -0.53 0.00 0.00 39.78 35.68 3dyp n ASN 339 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3dyp n GLY 340 N -1.13 0.75 3.25 8.20 0.00 -1.26 -5.04 105.19 109.96 3dyp n GLY 340 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 3dyp n GLY 340 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dyp s LEU 341 N 0.00 2.03 -0.31 0.99 1.43 -0.59 -2.48 118.68 119.76 3dyp s LEU 341 Ca 0.00 -0.45 -0.28 0.00 -1.03 0.00 0.00 54.13 52.37 3dyp s LEU 341 Cb 0.00 -1.25 0.01 0.00 0.03 0.00 0.00 46.19 44.99 3dyp s LEU 341 CO 0.00 0.25 1.03 -0.22 0.23 0.00 0.00 176.35 177.63 3dyp s LEU 342 N -0.28 3.98 0.04 1.79 2.96 -1.26 -0.49 118.68 125.41 3dyp s LEU 342 Ca 0.01 1.02 0.05 0.00 -0.22 0.00 0.00 54.13 55.00 3dyp s LEU 342 Cb -0.12 -3.47 -0.03 0.00 0.50 0.00 0.00 46.19 43.07 3dyp s LEU 342 CO 0.02 -0.82 -0.12 -0.76 -1.32 0.00 0.00 176.35 173.35 3dyp s LEU 343 N 3.50 2.91 -0.14 -0.68 1.43 0.56 -1.88 118.68 124.38 3dyp s LEU 343 Ca 0.43 -0.30 0.01 0.00 -1.03 0.00 0.00 54.13 53.24 3dyp s LEU 343 Cb -0.13 -1.69 0.02 0.00 0.03 0.00 0.00 46.19 44.42 3dyp s LEU 343 CO 0.14 0.25 -0.16 -0.22 0.23 0.00 0.00 176.35 176.60 3dyp s LEU 344 N -1.56 1.77 -1.42 1.79 2.96 0.16 -1.27 118.68 121.11 3dyp s LEU 344 Ca 0.17 -0.49 -0.10 0.00 -0.22 0.00 0.00 54.13 53.49 3dyp s LEU 344 Cb -0.11 -1.20 0.07 0.00 0.50 0.00 0.00 46.19 45.45 3dyp s LEU 344 CO 0.08 -0.02 0.66 0.59 -1.32 0.00 0.00 176.35 176.34 3dyp n ASN 345 N 4.53 -4.51 0.00 3.68 3.02 -0.19 -1.23 115.26 120.56 3dyp n ASN 345 Ca -0.18 -0.50 0.00 0.00 -0.03 0.00 0.00 54.58 53.87 3dyp n ASN 345 Cb 0.50 -3.66 0.00 0.00 -0.61 0.00 0.00 39.78 36.01 3dyp n ASN 345 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dyp n GLY 346 N -1.40 0.53 3.32 7.41 0.00 -1.26 -5.02 105.19 108.78 3dyp n GLY 346 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 3dyp n GLY 346 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dyp s LYS 347 N -0.30 2.07 0.02 1.61 -0.14 -0.36 -4.99 119.74 117.65 3dyp s LYS 347 Ca 0.00 -0.95 -0.30 0.00 -1.36 0.00 0.00 55.97 53.36 3dyp s LYS 347 Cb 0.00 -2.05 -0.04 0.00 -1.68 0.00 0.00 37.83 34.06 3dyp s LYS 347 CO 0.00 0.55 1.15 -1.25 -0.76 0.00 0.00 175.35 175.05 3dyp s PRO 348 N -0.73 4.44 0.61 -1.68 0.04 -1.26 0.39 135.00 136.80 3dyp s PRO 348 Ca 0.10 1.67 -0.13 0.00 0.04 0.00 0.00 61.00 62.68 3dyp s PRO 348 Cb -0.10 -3.42 -0.03 0.00 0.04 0.00 0.00 34.50 30.98 3dyp s PRO 348 CO -0.00 -0.26 1.04 -0.51 0.04 0.00 0.00 177.00 177.30 3dyp s LEU 349 N 1.35 3.36 -0.30 -3.56 1.43 -0.79 -4.92 118.68 115.26 3dyp s LEU 349 Ca 0.56 1.61 0.01 0.00 -1.03 0.00 0.00 54.13 55.29 3dyp s LEU 349 Cb -0.26 -4.50 0.09 0.00 0.03 0.00 0.00 46.19 41.54 3dyp s LEU 349 CO 0.27 -1.04 0.05 -0.22 0.23 0.00 0.00 176.35 175.63 3dyp s LEU 350 N -4.85 2.98 -0.24 1.79 2.96 -1.26 -4.79 118.68 115.27 3dyp s LEU 350 Ca 0.59 -1.65 -0.29 0.00 -0.22 0.00 0.00 54.13 52.56 3dyp s LEU 350 Cb -0.13 -1.14 0.00 0.00 0.50 0.00 0.00 46.19 45.43 3dyp s LEU 350 CO 0.45 -0.36 1.16 -0.63 -1.32 0.00 0.00 176.35 175.65 3dyp s ILE 351 N 1.38 4.43 -0.99 6.68 -1.09 0.35 -4.93 121.20 127.02 3dyp s ILE 351 Ca 0.06 1.69 -0.05 0.00 -2.23 0.00 0.00 60.65 60.13 3dyp s ILE 351 Cb -0.18 -4.21 0.25 0.00 -1.58 0.00 0.00 42.46 36.73 3dyp s ILE 351 CO -0.15 -0.28 0.93 0.54 -1.23 0.00 0.00 174.94 174.74 3dyp n ARG 352 N 6.70 3.03 -3.64 2.79 1.74 -1.26 -2.31 116.66 123.70 3dyp n ARG 352 Ca 0.13 -4.47 -0.21 0.00 -0.77 0.00 0.00 57.85 52.52 3dyp n ARG 352 Cb 0.46 -2.47 -0.04 0.00 -1.02 0.00 0.00 32.46 29.39 3dyp n ARG 352 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3dyp s GLY 353 N 0.40 2.16 -0.06 -0.13 0.00 0.07 -0.67 107.32 109.09 3dyp s GLY 353 Ca 0.29 -1.91 -0.11 0.00 0.00 0.00 0.00 44.72 42.99 3dyp s GLY 353 CO -0.11 -1.72 0.26 0.54 0.00 0.00 0.00 173.10 172.07 3dyp s VAL 354 N -2.49 0.03 0.17 1.40 0.11 -0.83 -1.31 120.40 117.49 3dyp s VAL 354 Ca 0.47 -0.25 -0.21 0.00 -2.93 0.00 0.00 61.98 59.06 3dyp s VAL 354 Cb -0.02 -0.46 -0.08 0.00 -1.53 0.00 0.00 36.38 34.29 3dyp s VAL 354 CO 0.27 -0.14 0.71 0.20 -3.33 0.00 0.00 175.10 172.81 3dyp s ASN 355 N -0.52 7.16 -0.12 3.54 0.01 0.03 -1.49 114.94 123.55 3dyp s ASN 355 Ca -0.06 1.45 -0.04 0.00 -0.71 0.00 0.00 52.86 53.50 3dyp s ASN 355 Cb -0.04 -2.43 0.05 0.00 0.41 0.00 0.00 41.25 39.24 3dyp s ASN 355 CO 0.02 0.14 0.08 -0.60 -1.51 0.00 0.00 177.10 175.22 3dyp s ARG 356 N -1.54 0.01 0.59 -0.60 3.52 -0.90 -0.23 118.95 119.80 3dyp s ARG 356 Ca 0.38 0.10 -0.14 0.00 -0.13 0.00 0.00 55.73 55.94 3dyp s ARG 356 Cb -0.19 -1.30 -0.05 0.00 -1.56 0.00 0.00 34.95 31.85 3dyp s ARG 356 CO 0.22 -0.53 1.02 -1.01 -0.81 0.00 0.00 175.30 174.19 3dyp s HIS 357 N 2.15 3.33 -0.61 5.12 3.76 -1.26 -3.91 115.29 123.87 3dyp s HIS 357 Ca 0.03 1.43 -0.22 0.00 -0.15 0.00 0.00 55.06 56.15 3dyp s HIS 357 Cb -0.14 -2.84 0.07 0.00 1.11 0.00 0.00 32.58 30.77 3dyp s HIS 357 CO -0.07 -0.75 0.89 -1.21 -0.85 0.00 0.00 174.74 172.75 3dyp s GLU 358 N -4.47 3.15 -0.07 1.40 2.02 -1.26 -4.94 118.70 114.52 3dyp s GLU 358 Ca 0.59 -0.79 -0.05 0.00 0.02 0.00 0.00 54.97 54.74 3dyp s GLU 358 Cb -0.12 -4.18 0.03 0.00 0.10 0.00 0.00 34.13 29.96 3dyp s GLU 358 CO 0.41 -1.64 0.18 -1.58 0.02 0.00 0.00 175.26 172.65 3dyp s HIS 359 N 3.69 -0.21 -0.05 1.61 2.46 -1.26 -4.52 115.29 117.02 3dyp s HIS 359 Ca 0.21 0.53 0.03 0.00 0.47 0.00 0.00 55.06 56.31 3dyp s HIS 359 Cb -0.17 0.00 0.01 0.00 -0.13 0.00 0.00 32.58 32.29 3dyp s HIS 359 CO 0.12 -0.15 -0.12 -1.58 -2.47 0.00 0.00 174.74 170.54 3dyp s HIS 360 N 0.76 1.31 0.44 3.88 5.04 0.19 -4.99 115.29 121.93 3dyp s HIS 360 Ca -0.06 -0.41 0.37 0.00 -1.54 0.00 0.00 55.06 53.43 3dyp s HIS 360 Cb -0.07 -0.94 1.89 0.00 0.04 0.00 0.00 32.58 33.50 3dyp s HIS 360 CO -0.04 -0.19 2.19 -1.00 -2.34 0.00 0.00 174.74 173.36 3dyp h PRO 361 N 6.64 0.00 0.00 2.88 0.13 -1.78 0.24 132.00 140.10 3dyp h PRO 361 Ca -0.33 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.51 3dyp h PRO 361 Cb 1.18 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.25 3dyp h PRO 361 CO 0.48 0.03 -2.11 1.28 -0.23 0.00 0.00 178.00 177.45 3dyp n LEU 362 N -3.24 2.73 -0.74 1.56 4.77 -1.26 -1.34 117.00 119.48 3dyp n LEU 362 Ca -0.02 -0.04 0.12 0.00 -0.03 0.00 0.00 56.01 56.04 3dyp n LEU 362 Cb 0.18 -0.66 0.32 0.00 -2.33 0.00 0.00 43.42 40.92 3dyp n LEU 362 CO 0.25 0.76 0.75 1.41 -1.33 0.00 0.00 177.39 179.23 3dyp n HIS 363 N -3.21 0.10 0.00 -1.77 8.25 -1.21 -4.95 115.22 112.43 3dyp n HIS 363 Ca -0.35 -0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.06 3dyp n HIS 363 Cb 0.85 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.96 3dyp n HIS 363 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dyp n GLY 364 N 1.27 2.15 0.99 -1.41 0.00 0.07 -3.20 105.19 105.05 3dyp n GLY 364 Ca 0.17 -0.25 0.08 0.00 0.00 0.00 0.00 46.02 46.02 3dyp n GLY 364 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3dyp n GLN 365 N 6.38 2.90 -2.88 1.61 6.02 -1.26 0.57 117.38 130.71 3dyp n GLN 365 Ca 0.00 -2.38 -0.41 0.00 -0.01 0.00 0.00 57.00 54.20 3dyp n GLN 365 Cb 0.00 -1.46 -0.04 0.00 1.02 0.00 0.00 30.24 29.77 3dyp n GLN 365 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3dyp s VAL 366 N -1.15 4.92 -0.03 5.09 1.01 -1.19 -4.85 120.40 124.19 3dyp s VAL 366 Ca 0.36 1.71 -0.01 0.00 0.00 0.00 0.00 61.98 64.04 3dyp s VAL 366 Cb 0.20 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 3dyp s VAL 366 CO 0.23 0.12 0.06 -0.04 0.00 0.00 0.00 175.10 175.47 3dyp s MET 367 N 1.45 3.05 0.14 2.72 -1.94 -1.26 -4.64 119.30 118.83 3dyp s MET 367 Ca 0.42 -0.45 0.05 0.00 -1.71 0.00 0.00 55.69 54.00 3dyp s MET 367 Cb -0.18 -2.86 -0.04 0.00 2.01 0.00 0.00 34.83 33.76 3dyp s MET 367 CO 0.18 0.67 -0.11 0.16 -0.01 0.00 0.00 175.02 175.91 3dyp s ASP 368 N -1.46 1.80 0.28 3.03 -4.77 -1.26 -5.02 116.67 109.27 3dyp s ASP 368 Ca 0.20 -0.96 -0.00 0.00 -3.30 0.00 0.00 52.55 48.48 3dyp s ASP 368 Cb -0.12 -0.02 0.40 0.00 -1.09 0.00 0.00 42.92 42.09 3dyp s ASP 368 CO 0.10 -0.29 1.79 -0.08 0.70 0.00 0.00 175.17 177.39 3dyp h GLU 369 N 2.96 0.73 -0.56 2.11 4.81 -1.99 -1.47 114.58 121.17 3dyp h GLU 369 Ca -0.37 -0.18 0.01 0.00 -0.13 0.00 0.00 59.36 58.69 3dyp h GLU 369 Cb 1.19 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.45 3dyp h GLU 369 CO 0.60 0.74 0.37 1.96 -0.73 0.00 0.00 179.01 181.95 3dyp h GLN 370 N 0.69 0.72 -0.54 1.92 1.08 -1.99 0.12 115.11 117.11 3dyp h GLN 370 Ca 0.14 -0.04 -0.07 0.00 -1.45 0.00 0.00 58.65 57.22 3dyp h GLN 370 Cb 0.41 -0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 27.65 3dyp h GLN 370 CO 0.01 0.48 0.05 1.15 -0.95 0.00 0.00 178.83 179.58 3dyp h THR 371 N 0.74 1.26 -0.39 -0.54 2.02 -1.90 -0.29 112.91 113.82 3dyp h THR 371 Ca 0.21 -1.02 0.00 0.00 0.77 0.00 0.00 66.41 66.38 3dyp h THR 371 Cb -0.06 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 3dyp h THR 371 CO -0.06 0.37 0.26 0.24 0.37 0.00 0.00 175.52 176.70 3dyp h MET 372 N 0.80 0.51 -0.63 6.66 2.86 -0.59 -0.23 114.93 124.32 3dyp h MET 372 Ca 0.16 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3dyp h MET 372 Cb 0.46 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.97 3dyp h MET 372 CO 0.02 0.34 0.41 0.28 1.06 0.00 0.00 176.91 179.01 3dyp h VAL 373 N 0.52 1.17 -0.59 -2.22 2.07 -0.63 0.58 116.25 117.15 3dyp h VAL 373 Ca 0.14 -0.31 0.05 0.00 0.82 0.00 0.00 66.70 67.40 3dyp h VAL 373 Cb -0.06 0.25 -0.05 0.00 -1.52 0.00 0.00 31.29 29.91 3dyp h VAL 373 CO -0.03 0.16 0.32 -0.61 0.02 0.00 0.00 177.57 177.43 3dyp h GLN 374 N 0.85 0.58 -0.09 1.57 4.15 -0.67 0.27 115.11 121.78 3dyp h GLN 374 Ca 0.23 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.61 3dyp h GLN 374 Cb -0.08 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 27.47 3dyp h GLN 374 CO -0.05 0.39 0.03 -0.44 -1.93 0.00 0.00 178.83 176.83 3dyp h ASP 375 N 0.60 0.12 -0.56 -0.69 3.32 -0.48 -1.61 116.42 117.11 3dyp h ASP 375 Ca 0.26 -0.18 0.04 0.00 0.02 0.00 0.00 57.03 57.17 3dyp h ASP 375 Cb 0.16 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.63 3dyp h ASP 375 CO -0.17 0.27 0.32 0.40 -1.72 0.00 0.00 179.24 178.33 3dyp h ILE 376 N -0.03 1.01 -0.18 0.35 2.04 -0.50 0.92 117.51 121.13 3dyp h ILE 376 Ca 0.03 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 3dyp h ILE 376 Cb 0.18 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 3dyp h ILE 376 CO -0.00 0.11 0.08 -0.07 0.00 0.00 0.00 178.15 178.27 3dyp h LEU 377 N 0.62 0.23 -1.37 1.44 3.38 -0.42 -1.73 115.31 117.47 3dyp h LEU 377 Ca 0.24 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3dyp h LEU 377 Cb 0.09 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3dyp h LEU 377 CO -0.13 0.30 0.27 -0.07 0.09 0.00 0.00 178.44 178.90 3dyp h LEU 378 N 0.15 0.62 0.69 1.67 3.38 -0.76 0.41 115.31 121.48 3dyp h LEU 378 Ca 0.06 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3dyp h LEU 378 Cb 0.13 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 40.73 3dyp h LEU 378 CO -0.01 0.51 -0.34 0.24 0.09 0.00 0.00 178.44 178.93 3dyp h MET 379 N 0.71 -0.90 -0.79 1.13 2.86 -0.52 0.38 114.93 117.81 3dyp h MET 379 Ca 0.18 0.06 0.09 0.00 -2.06 0.00 0.00 59.70 57.97 3dyp h MET 379 Cb 0.03 0.20 -0.07 0.00 0.06 0.00 0.00 31.60 31.83 3dyp h MET 379 CO -0.03 -0.60 0.44 0.87 1.06 0.00 0.00 176.91 178.65 3dyp h LYS 380 N -0.94 0.74 0.00 1.72 1.57 -1.15 0.08 116.57 118.59 3dyp h LYS 380 Ca -0.09 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 3dyp h LYS 380 Cb 0.72 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.86 3dyp h LYS 380 CO 0.15 0.49 -0.11 1.96 -0.57 0.00 0.00 179.45 181.37 3dyp h GLN 381 N 0.76 0.00 -0.62 3.15 4.20 -0.79 -0.86 115.11 120.96 3dyp h GLN 381 Ca 0.38 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.98 3dyp h GLN 381 Cb 0.33 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.04 3dyp h GLN 381 CO -0.24 0.11 0.13 0.09 -0.67 0.00 0.00 178.83 178.25 3dyp n ASN 382 N -3.46 5.04 -1.49 1.46 3.02 0.11 -4.95 115.26 115.00 3dyp n ASN 382 Ca -0.01 -3.11 -0.15 0.00 -0.03 0.00 0.00 54.58 51.28 3dyp n ASN 382 Cb 0.26 -0.70 -0.03 0.00 -0.61 0.00 0.00 39.78 38.70 3dyp n ASN 382 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3dyp n ASN 383 N 0.08 -4.67 -4.85 6.41 3.02 -0.33 -3.87 115.26 111.04 3dyp n ASN 383 Ca 0.34 0.15 -0.34 0.00 -0.03 0.00 0.00 54.58 54.70 3dyp n ASN 383 Cb 1.26 -3.68 -0.06 0.00 -0.61 0.00 0.00 39.78 36.69 3dyp n ASN 383 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3dyp s PHE 384 N -2.67 3.52 0.00 3.10 0.40 -0.43 -4.83 117.98 117.06 3dyp s PHE 384 Ca 0.00 1.05 0.00 0.00 -0.60 0.00 0.00 56.93 57.38 3dyp s PHE 384 Cb 0.00 -2.38 0.00 0.00 0.51 0.00 0.00 43.02 41.15 3dyp s PHE 384 CO 0.00 0.32 0.68 0.27 0.70 0.00 0.00 175.22 177.19 3dyp n ASN 385 N 0.32 1.03 -3.57 1.36 0.23 0.15 -4.22 115.26 110.57 3dyp n ASN 385 Ca -0.02 -1.45 -0.13 0.00 -0.53 0.00 0.00 54.58 52.44 3dyp n ASN 385 Cb 0.52 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.17 3dyp n ASN 385 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3dyp s ALA 386 N -0.45 -1.30 0.00 -2.53 0.00 -1.09 -1.13 121.76 115.26 3dyp s ALA 386 Ca 0.00 0.51 0.01 0.00 0.00 0.00 0.00 51.96 52.47 3dyp s ALA 386 Cb 0.00 0.47 -0.01 0.00 0.00 0.00 0.00 23.12 23.58 3dyp s ALA 386 CO 0.00 -0.55 -0.02 0.54 0.00 0.00 0.00 175.76 175.73 3dyp s VAL 387 N -2.73 0.15 -0.15 0.00 0.11 0.28 -1.97 120.40 116.09 3dyp s VAL 387 Ca -0.04 -0.25 -0.03 0.00 -2.93 0.00 0.00 61.98 58.73 3dyp s VAL 387 Cb -0.00 -0.16 -0.03 0.00 -1.53 0.00 0.00 36.38 34.66 3dyp s VAL 387 CO -0.04 -0.07 -0.04 -0.60 -3.33 0.00 0.00 175.10 171.02 3dyp s ARG 388 N -0.33 3.59 -1.18 1.54 3.52 -0.56 -1.44 118.95 124.09 3dyp s ARG 388 Ca -0.02 -0.53 -0.16 0.00 -0.13 0.00 0.00 55.73 54.89 3dyp s ARG 388 Cb -0.03 -2.88 -0.05 0.00 -1.56 0.00 0.00 34.95 30.44 3dyp s ARG 388 CO -0.00 0.28 2.18 0.00 -0.81 0.00 0.00 175.30 176.95 3dyp s SER 390 N 3.78 6.30 -0.39 0.00 1.04 -1.25 -0.90 113.70 122.27 3dyp s SER 390 Ca 0.52 1.65 0.09 0.00 0.48 0.00 0.00 55.95 58.69 3dyp s SER 390 Cb 0.14 -2.53 0.27 0.00 0.10 0.00 0.00 66.02 64.00 3dyp s SER 390 CO -0.01 -1.31 0.56 1.41 0.98 0.00 0.00 173.24 174.87 3dyp n HIS 391 N 8.69 -0.15 -3.61 5.02 -0.00 -1.26 -4.14 115.22 119.77 3dyp n HIS 391 Ca 0.20 -3.62 -0.01 0.00 -0.00 0.00 0.00 57.72 54.28 3dyp n HIS 391 Cb 0.45 -0.37 -0.01 0.00 -0.00 0.00 0.00 29.99 30.06 3dyp n HIS 391 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.34 177.86 3dyp s TYR 392 N -1.44 -0.07 0.41 4.41 -0.85 -0.08 -4.33 117.35 115.39 3dyp s TYR 392 Ca 0.36 0.01 -0.26 0.00 -0.52 0.00 0.00 57.07 56.67 3dyp s TYR 392 Cb 0.20 0.52 -0.08 0.00 0.38 0.00 0.00 41.96 42.98 3dyp s TYR 392 CO -0.10 -0.17 1.27 -2.14 -1.52 0.00 0.00 175.55 172.88 3dyp s PRO 393 N -2.31 3.96 0.59 -3.49 0.02 -0.82 -4.52 135.00 128.42 3dyp s PRO 393 Ca 0.12 2.07 -0.01 0.00 0.02 0.00 0.00 61.00 63.20 3dyp s PRO 393 Cb 0.02 -2.72 0.04 0.00 0.02 0.00 0.00 34.50 31.86 3dyp s PRO 393 CO -0.04 -0.47 0.83 -0.80 -0.33 0.00 0.00 177.00 176.19 3dyp s ASN 394 N -0.85 5.20 0.30 2.53 0.02 -1.26 -4.82 114.94 116.05 3dyp s ASN 394 Ca 0.57 0.15 -0.28 0.00 -1.02 0.00 0.00 52.86 52.28 3dyp s ASN 394 Cb -0.36 -1.00 -0.14 0.00 0.02 0.00 0.00 41.25 39.78 3dyp s ASN 394 CO 0.46 -1.23 1.05 1.57 0.02 0.00 0.00 177.10 178.97 3dyp n HIS 395 N -2.49 1.42 -0.24 2.20 -0.00 -1.26 -4.82 115.22 110.03 3dyp n HIS 395 Ca 0.07 0.68 0.15 0.00 -0.00 0.00 0.00 57.72 58.62 3dyp n HIS 395 Cb 0.60 -2.27 0.45 0.00 -0.00 0.00 0.00 29.99 28.76 3dyp n HIS 395 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3dyp h PRO 396 N 2.05 0.53 0.00 1.57 0.13 -1.96 -1.33 132.00 132.99 3dyp h PRO 396 Ca -0.41 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.67 3dyp h PRO 396 Cb 1.33 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 3dyp h PRO 396 CO 0.61 0.35 -0.12 1.25 -0.23 0.00 0.00 178.00 179.86 3dyp h LEU 397 N 0.54 0.00 -0.83 1.56 5.85 -2.01 -2.63 115.31 117.79 3dyp h LEU 397 Ca 0.44 0.00 0.11 0.00 0.84 0.00 0.00 57.88 59.27 3dyp h LEU 397 Cb 0.88 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.83 3dyp h LEU 397 CO -0.18 0.12 0.46 -0.25 -0.34 0.00 0.00 178.44 178.25 3dyp h TRP 398 N 0.00 0.83 -0.59 1.25 2.91 -1.57 -1.35 115.95 117.43 3dyp h TRP 398 Ca -0.00 0.03 -0.09 0.00 1.13 0.00 0.00 58.89 59.96 3dyp h TRP 398 Cb 0.41 -0.25 -0.02 0.00 -0.51 0.00 0.00 29.16 28.80 3dyp h TRP 398 CO 0.00 0.29 0.02 1.88 -1.03 0.00 0.00 178.44 179.60 3dyp h TYR 399 N 0.73 1.11 -0.50 2.65 -1.99 -1.62 -1.34 116.97 116.01 3dyp h TYR 399 Ca 0.42 -0.18 0.08 0.00 2.00 0.00 0.00 58.73 61.05 3dyp h TYR 399 Cb 0.46 -0.29 -0.07 0.00 2.00 0.00 0.00 36.73 38.83 3dyp h TYR 399 CO -0.07 0.98 0.11 1.15 -0.00 0.00 0.00 178.16 180.33 3dyp h THR 400 N 0.92 0.73 -0.54 -2.88 2.02 -1.37 0.60 112.91 112.39 3dyp h THR 400 Ca 0.17 -0.09 -0.11 0.00 0.77 0.00 0.00 66.41 67.15 3dyp h THR 400 Cb 0.52 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 3dyp h THR 400 CO 0.03 0.05 -0.11 -0.07 0.37 0.00 0.00 175.52 175.79 3dyp h LEU 401 N 0.25 1.01 -0.84 2.58 3.38 -0.99 -1.70 115.31 119.00 3dyp h LEU 401 Ca 0.25 -0.33 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 3dyp h LEU 401 Cb 0.33 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3dyp h LEU 401 CO -0.32 1.12 -0.13 0.00 0.09 0.00 0.00 178.44 179.20 3dyp h ASP 403 N 0.66 0.84 0.31 0.00 3.32 -0.64 0.60 116.42 121.52 3dyp h ASP 403 Ca 0.11 -0.05 -0.33 0.00 0.02 0.00 0.00 57.03 56.78 3dyp h ASP 403 Cb 0.59 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 3dyp h ASP 403 CO 0.04 0.64 -1.74 0.03 -1.72 0.00 0.00 179.24 176.49 3dyp h ARG 404 N 0.97 0.25 0.00 3.56 3.08 -0.91 -3.34 114.38 117.98 3dyp h ARG 404 Ca 0.26 -0.42 -0.14 0.00 0.07 0.00 0.00 59.98 59.75 3dyp h ARG 404 Cb -0.06 0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 3dyp h ARG 404 CO -0.05 1.09 -0.99 1.88 -1.07 0.00 0.00 179.97 180.83 3dyp h TYR 405 N 0.07 0.00 -0.96 3.04 -1.99 -0.44 -3.45 116.97 113.23 3dyp h TYR 405 Ca -0.32 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.41 3dyp h TYR 405 Cb 2.04 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.77 3dyp h TYR 405 CO 0.07 0.55 0.00 0.41 -0.00 0.00 0.00 178.16 179.19 3dyp n GLY 406 N 1.31 -1.05 2.99 3.88 0.00 0.14 -4.80 105.19 107.66 3dyp n GLY 406 Ca -0.04 -0.59 -0.13 0.00 0.00 0.00 0.00 46.02 45.27 3dyp n GLY 406 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dyp s LEU 407 N 0.00 1.42 0.13 0.99 1.43 -0.80 -4.70 118.68 117.15 3dyp s LEU 407 Ca 0.00 0.25 -0.30 0.00 -1.03 0.00 0.00 54.13 53.05 3dyp s LEU 407 Cb 0.00 0.40 -0.06 0.00 0.03 0.00 0.00 46.19 46.56 3dyp s LEU 407 CO 0.00 -0.06 0.96 -0.31 0.23 0.00 0.00 176.35 177.17 3dyp s TYR 408 N 0.22 3.84 -0.03 0.29 4.12 -0.28 -4.70 117.35 120.82 3dyp s TYR 408 Ca -0.01 1.82 0.07 0.00 0.02 0.00 0.00 57.07 58.97 3dyp s TYR 408 Cb -0.02 -3.04 -0.02 0.00 -1.52 0.00 0.00 41.96 37.36 3dyp s TYR 408 CO -0.01 0.25 -0.24 0.08 0.02 0.00 0.00 175.55 175.66 3dyp s VAL 409 N -0.21 1.90 -0.38 0.71 1.01 0.11 -0.56 120.40 122.98 3dyp s VAL 409 Ca 0.46 -1.02 -0.13 0.00 0.00 0.00 0.00 61.98 61.30 3dyp s VAL 409 Cb -0.24 -1.58 0.02 0.00 0.00 0.00 0.00 36.38 34.58 3dyp s VAL 409 CO 0.30 0.54 0.24 -0.69 0.00 0.00 0.00 175.10 175.49 3dyp s VAL 410 N -0.46 4.91 -0.20 2.92 1.01 -0.52 -1.08 120.40 126.98 3dyp s VAL 410 Ca 0.06 -0.70 -0.19 0.00 0.00 0.00 0.00 61.98 61.16 3dyp s VAL 410 Cb -0.10 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 3dyp s VAL 410 CO 0.00 -0.23 0.53 -0.62 0.00 0.00 0.00 175.10 174.79 3dyp s ASP 411 N 1.62 6.59 -0.10 3.32 2.15 -0.71 -1.46 116.67 128.07 3dyp s ASP 411 Ca 0.04 0.71 0.03 0.00 0.43 0.00 0.00 52.55 53.75 3dyp s ASP 411 Cb -0.19 -2.30 0.01 0.00 -0.30 0.00 0.00 42.92 40.14 3dyp s ASP 411 CO 0.08 -0.19 -0.20 -0.70 -0.17 0.00 0.00 175.17 173.99 3dyp s GLU 412 N 1.65 2.69 0.56 4.34 2.12 -1.26 0.09 118.70 128.89 3dyp s GLU 412 Ca 0.25 -0.75 -0.21 0.00 0.36 0.00 0.00 54.97 54.62 3dyp s GLU 412 Cb -0.15 -2.11 -0.04 0.00 0.26 0.00 0.00 34.13 32.08 3dyp s GLU 412 CO 0.10 0.08 1.33 0.00 -0.54 0.00 0.00 175.26 176.23 3dyp s ALA 413 N 0.57 2.72 -1.34 6.30 0.00 -0.67 -1.95 121.76 127.40 3dyp s ALA 413 Ca -0.14 1.28 -0.16 0.00 0.00 0.00 0.00 51.96 52.94 3dyp s ALA 413 Cb -0.17 -3.55 0.01 0.00 0.00 0.00 0.00 23.12 19.41 3dyp s ALA 413 CO 0.05 -1.38 2.14 -1.71 0.00 0.00 0.00 175.76 174.86 3dyp n ASN 414 N -1.21 3.74 -3.71 0.00 5.15 -1.26 -4.01 115.26 113.97 3dyp n ASN 414 Ca 0.11 -2.82 -0.25 0.00 -0.60 0.00 0.00 54.58 51.03 3dyp n ASN 414 Cb 0.46 -1.59 -0.17 0.00 -0.53 0.00 0.00 39.78 37.95 3dyp n ASN 414 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3dyp s ILE 415 N 3.66 0.24 -0.14 -1.44 1.01 -1.25 -4.76 121.20 118.52 3dyp s ILE 415 Ca 0.49 -0.11 -0.06 0.00 0.00 0.00 0.00 60.65 60.97 3dyp s ILE 415 Cb 0.13 -0.64 0.06 0.00 0.01 0.00 0.00 42.46 42.02 3dyp s ILE 415 CO -0.04 -0.03 0.30 -0.70 0.00 0.00 0.00 174.94 174.47 3dyp s GLU 416 N 2.01 0.22 -0.29 2.79 2.12 0.81 -1.30 118.70 125.05 3dyp s GLU 416 Ca 0.02 0.76 0.14 0.00 0.36 0.00 0.00 54.97 56.24 3dyp s GLU 416 Cb -0.15 0.01 0.48 0.00 0.26 0.00 0.00 34.13 34.73 3dyp s GLU 416 CO -0.07 -0.24 1.14 0.25 -0.54 0.00 0.00 175.26 175.81 3dyp n THR 417 N 4.98 1.95 -0.26 -1.70 -2.24 -1.11 -1.00 114.28 114.91 3dyp n THR 417 Ca -0.13 -3.72 0.20 0.00 -2.27 0.00 0.00 64.05 58.13 3dyp n THR 417 Cb 0.51 -0.12 0.51 0.00 -2.10 0.00 0.00 70.33 69.13 3dyp n THR 417 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 3dyp h ASN 418 N 2.42 0.41 0.52 3.42 -0.73 -1.44 -1.43 115.58 118.75 3dyp h ASN 418 Ca 0.15 0.05 0.00 0.00 1.87 0.00 0.00 56.30 58.36 3dyp h ASN 418 Cb 1.37 -0.03 0.00 0.00 0.27 0.00 0.00 38.32 39.93 3dyp h ASN 418 CO 0.53 0.15 0.00 0.61 -0.37 0.00 0.00 177.43 178.36 3dyp n GLY 419 N -1.51 -1.09 3.82 1.57 0.00 -1.19 -4.80 105.19 101.99 3dyp n GLY 419 Ca 0.20 -0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 3dyp n GLY 419 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dyp s MET 420 N -2.70 2.98 -0.16 1.61 -1.94 -0.54 -4.76 119.30 113.80 3dyp s MET 420 Ca 0.18 0.97 -0.01 0.00 -1.71 0.00 0.00 55.69 55.12 3dyp s MET 420 Cb 0.15 -2.00 0.04 0.00 2.01 0.00 0.00 34.83 35.04 3dyp s MET 420 CO 0.36 -1.06 -0.03 0.08 -0.01 0.00 0.00 175.02 174.36 3dyp s VAL 421 N -3.00 0.87 1.10 -6.03 1.01 -1.26 -3.18 120.40 109.91 3dyp s VAL 421 Ca 0.58 -0.50 -0.18 0.00 0.00 0.00 0.00 61.98 61.89 3dyp s VAL 421 Cb -0.14 -1.12 0.25 0.00 0.00 0.00 0.00 36.38 35.37 3dyp s VAL 421 CO 0.54 0.08 1.19 -2.16 0.00 0.00 0.00 175.10 174.74 3dyp s PRO 422 N 1.73 -0.45 0.45 2.72 0.04 -1.26 -4.83 135.00 133.40 3dyp s PRO 422 Ca 0.01 -0.17 0.13 0.00 0.04 0.00 0.00 61.00 61.01 3dyp s PRO 422 Cb -0.15 -1.70 1.04 0.00 0.04 0.00 0.00 34.50 33.73 3dyp s PRO 422 CO -0.07 -3.18 2.05 1.98 0.04 0.00 0.00 177.00 177.81 3dyp h MET 423 N -2.20 0.34 -0.68 4.56 4.05 -1.86 -2.34 114.93 116.81 3dyp h MET 423 Ca -0.45 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 58.95 3dyp h MET 423 Cb 1.28 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 32.00 3dyp h MET 423 CO 0.37 0.23 0.00 0.27 0.23 0.00 0.00 176.91 178.01 3dyp n ASN 424 N -4.48 3.91 -0.29 1.39 6.94 -1.25 -3.88 115.26 117.60 3dyp n ASN 424 Ca 0.05 -2.51 0.08 0.00 -0.02 0.00 0.00 54.58 52.17 3dyp n ASN 424 Cb 0.22 -0.57 0.23 0.00 -2.36 0.00 0.00 39.78 37.29 3dyp n ASN 424 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 3dyp h ARG 425 N 2.73 0.54 0.14 -3.83 2.43 -1.74 -1.49 114.38 113.16 3dyp h ARG 425 Ca 0.00 -0.03 -0.34 0.00 -0.81 0.00 0.00 59.98 58.80 3dyp h ARG 425 Cb 1.35 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.77 3dyp h ARG 425 CO 0.27 0.36 -1.75 -0.07 -1.51 0.00 0.00 179.97 177.27 3dyp h LEU 426 N 0.56 0.45 -1.17 3.80 3.38 -1.86 -3.35 115.31 117.12 3dyp h LEU 426 Ca 0.47 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3dyp h LEU 426 Cb 0.71 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3dyp h LEU 426 CO -0.39 1.64 0.00 0.71 0.09 0.00 0.00 178.44 180.49 3dyp h THR 427 N 0.08 0.00 -0.42 0.22 1.35 -1.77 -0.75 112.91 111.62 3dyp h THR 427 Ca -0.33 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.18 3dyp h THR 427 Cb 2.05 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 69.69 3dyp h THR 427 CO 0.14 0.00 0.00 -0.67 -0.25 0.00 0.00 175.52 174.74 3dyp n ASP 428 N -2.68 3.43 -4.61 5.36 2.03 -0.58 -1.55 116.55 117.95 3dyp n ASP 428 Ca 0.01 -1.97 -0.36 0.00 0.52 0.00 0.00 54.79 53.00 3dyp n ASP 428 Cb 0.26 -0.27 -0.10 0.00 -0.72 0.00 0.00 41.12 40.28 3dyp n ASP 428 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3dyp s ASP 429 N -1.34 5.71 0.56 1.67 -1.08 -0.29 -4.60 116.67 117.30 3dyp s ASP 429 Ca 0.38 0.04 0.35 0.00 -0.52 0.00 0.00 52.55 52.79 3dyp s ASP 429 Cb 0.22 -2.01 1.55 0.00 -1.46 0.00 0.00 42.92 41.22 3dyp s ASP 429 CO 0.30 0.09 2.06 1.55 0.52 0.00 0.00 175.17 179.69 3dyp h PRO 430 N 7.29 0.00 0.00 4.34 0.13 -1.91 -1.42 132.00 140.43 3dyp h PRO 430 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 3dyp h PRO 430 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3dyp h PRO 430 CO 0.66 0.03 0.00 0.54 -0.23 0.00 0.00 178.00 179.00 3dyp n ARG 431 N -3.16 0.19 -0.06 0.86 1.74 -1.26 -1.65 116.66 113.33 3dyp n ARG 431 Ca -0.00 0.48 0.11 0.00 -0.77 0.00 0.00 57.85 57.67 3dyp n ARG 431 Cb 0.26 -1.92 0.12 0.00 -1.02 0.00 0.00 32.46 29.91 3dyp n ARG 431 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 3dyp n TRP 432 N -2.29 0.15 -0.24 -1.55 7.02 -0.54 -4.48 117.44 115.51 3dyp n TRP 432 Ca 0.01 -0.08 -0.07 0.00 -1.02 0.00 0.00 57.50 56.34 3dyp n TRP 432 Cb 0.19 -0.00 0.04 0.00 -2.42 0.00 0.00 31.31 29.12 3dyp n TRP 432 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 3dyp h LEU 433 N 4.13 0.95 0.11 -0.99 5.85 -1.33 -1.41 115.31 122.63 3dyp h LEU 433 Ca 0.00 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 3dyp h LEU 433 Cb 0.90 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.68 3dyp h LEU 433 CO 0.00 0.89 -0.05 -0.65 -0.34 0.00 0.00 178.44 178.29 3dyp h PRO 434 N 0.96 -0.14 -0.67 5.25 0.11 -1.78 0.68 132.00 136.41 3dyp h PRO 434 Ca 0.22 0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.35 3dyp h PRO 434 Cb 0.27 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.37 3dyp h PRO 434 CO -0.01 -0.08 0.44 0.00 -0.21 0.00 0.00 178.00 178.13 3dyp h ALA 435 N 0.73 0.85 -0.55 -0.75 0.00 -1.74 -1.38 119.26 116.43 3dyp h ALA 435 Ca -0.01 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 3dyp h ALA 435 Cb 0.12 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3dyp h ALA 435 CO 0.02 0.26 -0.01 0.52 0.00 0.00 0.00 179.25 180.04 3dyp h MET 436 N 0.89 0.97 -0.97 0.00 2.86 -0.84 -3.00 114.93 114.84 3dyp h MET 436 Ca 0.25 -0.31 0.04 0.00 -2.06 0.00 0.00 59.70 57.61 3dyp h MET 436 Cb -0.08 -0.09 -0.06 0.00 0.06 0.00 0.00 31.60 31.44 3dyp h MET 436 CO -0.06 0.98 0.63 0.66 1.06 0.00 0.00 176.91 180.18 3dyp h SER 437 N 0.85 1.05 0.26 1.22 4.64 0.14 -1.23 113.55 120.48 3dyp h SER 437 Ca 0.15 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.43 3dyp h SER 437 Cb 0.55 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 62.39 3dyp h SER 437 CO 0.03 0.72 -0.16 -0.33 -0.87 0.00 0.00 176.83 176.22 3dyp h GLU 438 N 1.22 0.00 0.00 4.77 5.08 -1.21 0.26 114.58 124.71 3dyp h GLU 438 Ca 0.39 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.64 3dyp h GLU 438 Cb 0.01 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3dyp h GLU 438 CO -0.13 0.16 -0.49 0.00 -1.00 0.00 0.00 179.01 177.56 3dyp h ARG 439 N 0.00 0.00 0.00 2.33 3.08 -1.18 -1.59 114.38 117.02 3dyp h ARG 439 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 3dyp h ARG 439 Cb 0.34 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.38 3dyp h ARG 439 CO 0.02 0.49 -0.35 0.28 -1.07 0.00 0.00 179.97 179.34 3dyp h VAL 440 N 0.00 0.23 -0.91 2.04 2.07 -1.12 -3.33 116.25 115.22 3dyp h VAL 440 Ca -0.00 -1.22 -0.01 0.00 0.82 0.00 0.00 66.70 66.29 3dyp h VAL 440 Cb 0.95 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 3dyp h VAL 440 CO 0.06 0.08 0.53 0.71 0.02 0.00 0.00 177.57 178.97 3dyp h THR 441 N -1.00 1.26 0.00 2.57 1.35 -0.56 -2.21 112.91 114.32 3dyp h THR 441 Ca -0.03 -0.60 -0.05 0.00 -0.55 0.00 0.00 66.41 65.18 3dyp h THR 441 Cb 0.43 -0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 66.84 3dyp h THR 441 CO -0.02 0.28 -0.24 0.03 -0.25 0.00 0.00 175.52 175.32 3dyp h ARG 442 N 1.27 0.00 -0.18 4.72 3.08 -1.48 -1.37 114.38 120.41 3dyp h ARG 442 Ca 0.32 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.27 3dyp h ARG 442 Cb -0.01 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 3dyp h ARG 442 CO -0.06 0.24 -0.28 1.98 -1.07 0.00 0.00 179.97 180.79 3dyp h MET 443 N 0.00 0.50 -0.61 0.04 4.05 -1.52 -2.43 114.93 114.96 3dyp h MET 443 Ca -0.00 -0.30 -0.04 0.00 -0.28 0.00 0.00 59.70 59.08 3dyp h MET 443 Cb 0.54 0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 31.34 3dyp h MET 443 CO 0.03 0.90 0.25 0.28 0.23 0.00 0.00 176.91 178.60 3dyp h VAL 444 N 0.15 1.23 -0.31 -5.77 2.07 -1.22 -0.53 116.25 111.88 3dyp h VAL 444 Ca 0.02 -0.72 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 3dyp h VAL 444 Cb 0.86 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 3dyp h VAL 444 CO 0.06 0.28 0.17 1.56 0.02 0.00 0.00 177.57 179.67 3dyp h GLN 445 N 0.85 0.41 0.10 1.57 4.20 -1.23 -1.94 115.11 119.07 3dyp h GLN 445 Ca 0.20 -0.03 -0.14 0.00 0.06 0.00 0.00 58.65 58.75 3dyp h GLN 445 Cb 0.20 -0.09 0.02 0.00 0.30 0.00 0.00 27.48 27.91 3dyp h GLN 445 CO -0.02 0.30 -0.59 -0.09 -0.67 0.00 0.00 178.83 177.76 3dyp h ARG 446 N 0.42 0.23 -0.10 1.46 2.43 -0.92 -3.02 114.38 114.88 3dyp h ARG 446 Ca 0.11 -0.38 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 3dyp h ARG 446 Cb 0.00 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 3dyp h ARG 446 CO -0.02 1.17 0.00 -0.25 -1.51 0.00 0.00 179.97 179.36 3dyp n ASP 447 N -4.26 2.54 0.13 -3.80 8.00 -0.25 -4.29 116.55 114.62 3dyp n ASP 447 Ca -0.13 -1.74 0.10 0.00 0.71 0.00 0.00 54.79 53.73 3dyp n ASP 447 Cb 0.73 -0.05 0.49 0.00 -0.02 0.00 0.00 41.12 42.27 3dyp n ASP 447 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 3dyp n ARG 448 N 0.95 0.13 -0.07 -1.24 1.85 -0.74 -1.74 116.66 115.81 3dyp n ARG 448 Ca 0.11 0.56 0.12 0.00 -1.00 0.00 0.00 57.85 57.64 3dyp n ARG 448 Cb 0.43 -1.88 0.32 0.00 -1.05 0.00 0.00 32.46 30.29 3dyp n ARG 448 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3dyp n ASN 449 N -2.15 2.28 -4.65 2.89 3.02 -1.26 -4.87 115.26 110.51 3dyp n ASN 449 Ca -0.00 -1.78 -0.41 0.00 -0.03 0.00 0.00 54.58 52.37 3dyp n ASN 449 Cb 0.08 -0.09 -0.05 0.00 -0.61 0.00 0.00 39.78 39.11 3dyp n ASN 449 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3dyp s HIS 450 N -1.82 3.35 0.40 3.10 3.76 -0.71 -4.85 115.29 118.50 3dyp s HIS 450 Ca 0.34 0.98 0.08 0.00 -0.15 0.00 0.00 55.06 56.31 3dyp s HIS 450 Cb 0.20 -2.89 0.81 0.00 1.11 0.00 0.00 32.58 31.82 3dyp s HIS 450 CO 0.30 -0.26 1.99 -1.00 -0.85 0.00 0.00 174.74 174.91 3dyp h PRO 451 N 7.60 0.42 0.00 8.40 0.13 -1.88 -2.56 132.00 144.11 3dyp h PRO 451 Ca -0.28 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 64.79 3dyp h PRO 451 Cb 1.13 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.18 3dyp h PRO 451 CO 0.80 0.38 -0.03 0.66 -0.23 0.00 0.00 178.00 179.58 3dyp h SER 452 N 0.42 0.00 -3.05 1.44 4.64 -1.87 -3.39 113.55 111.74 3dyp h SER 452 Ca 0.10 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.85 3dyp h SER 452 Cb 0.14 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.18 3dyp h SER 452 CO -0.01 0.03 0.95 -0.69 -0.87 0.00 0.00 176.83 176.24 3dyp s VAL 453 N -4.90 4.17 -0.01 0.95 1.01 -0.97 0.05 120.40 120.70 3dyp s VAL 453 Ca -0.05 1.36 0.09 0.00 0.00 0.00 0.00 61.98 63.38 3dyp s VAL 453 Cb 0.16 -4.09 -0.14 0.00 0.00 0.00 0.00 36.38 32.32 3dyp s VAL 453 CO 0.65 -0.35 0.20 2.30 0.00 0.00 0.00 175.10 177.89 3dyp n ILE 454 N 5.93 0.01 -3.84 2.22 -5.35 -0.24 -4.90 119.36 113.18 3dyp n ILE 454 Ca 0.15 -0.21 -0.12 0.00 -0.27 0.00 0.00 62.75 62.30 3dyp n ILE 454 Cb 0.46 0.28 -0.12 0.00 -1.74 0.00 0.00 39.64 38.52 3dyp n ILE 454 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3dyp s ILE 455 N -2.63 0.02 -0.01 7.28 1.01 -1.18 -3.86 121.20 121.83 3dyp s ILE 455 Ca -0.03 -0.16 -0.05 0.00 0.00 0.00 0.00 60.65 60.40 3dyp s ILE 455 Cb 0.06 -0.22 -0.04 0.00 0.01 0.00 0.00 42.46 42.26 3dyp s ILE 455 CO 0.38 -0.09 0.23 0.26 0.00 0.00 0.00 174.94 175.72 3dyp s TRP 456 N -0.25 3.57 -0.03 3.97 0.52 -0.55 -1.74 118.94 124.43 3dyp s TRP 456 Ca -0.03 0.50 0.05 0.00 0.02 0.00 0.00 56.10 56.64 3dyp s TRP 456 Cb -0.02 -1.93 -0.01 0.00 -1.15 0.00 0.00 33.47 30.35 3dyp s TRP 456 CO 0.00 0.63 -0.18 0.45 0.02 0.00 0.00 176.95 177.87 3dyp s SER 457 N -1.74 2.22 0.00 2.95 0.15 0.11 0.00 113.70 117.39 3dyp s SER 457 Ca 0.27 -0.35 0.12 0.00 0.70 0.00 0.00 55.95 56.68 3dyp s SER 457 Cb -0.13 -0.40 0.69 0.00 -1.71 0.00 0.00 66.02 64.47 3dyp s SER 457 CO 0.16 0.20 1.34 0.18 1.20 0.00 0.00 173.24 176.32 3dyp n LEU 458 N 2.83 0.00 0.00 3.45 4.77 -0.59 -1.67 117.00 125.78 3dyp n LEU 458 Ca -0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 3dyp n LEU 458 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 3dyp n LEU 458 CO 0.24 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 3dyp n GLY 459 N 0.51 0.32 3.40 -0.72 0.00 -1.26 -4.66 105.19 102.80 3dyp n GLY 459 Ca 0.09 -2.00 -0.15 0.00 0.00 0.00 0.00 46.02 43.95 3dyp n GLY 459 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dyp s ASN 460 N -4.00 -0.47 -0.99 1.61 2.47 -0.42 -4.74 114.94 108.40 3dyp s ASN 460 Ca 0.00 0.64 -0.27 0.00 0.42 0.00 0.00 52.86 53.65 3dyp s ASN 460 Cb 0.00 0.66 0.04 0.00 -1.45 0.00 0.00 41.25 40.50 3dyp s ASN 460 CO 0.00 -0.41 0.56 -0.62 -3.72 0.00 0.00 177.10 172.91 3dyp n GLU 461 N 1.69 -0.43 -0.88 0.43 1.02 -1.26 -4.02 120.64 117.19 3dyp n GLU 461 Ca -0.18 0.03 0.05 0.00 -0.02 0.00 0.00 57.16 57.04 3dyp n GLU 461 Cb 0.56 -1.88 0.10 0.00 -0.02 0.00 0.00 31.44 30.20 3dyp n GLU 461 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3dyp n SER 462 N -1.68 1.28 0.00 1.62 7.64 -1.26 -1.28 113.62 119.94 3dyp n SER 462 Ca -0.11 -2.80 0.00 0.00 1.01 0.00 0.00 58.87 56.97 3dyp n SER 462 Cb 0.48 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 3dyp n SER 462 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dyp n GLY 463 N -0.36 0.79 2.82 0.23 0.00 -1.25 -3.94 105.19 103.47 3dyp n GLY 463 Ca 0.11 -0.77 -0.26 0.00 0.00 0.00 0.00 46.02 45.10 3dyp n GLY 463 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3dyp s HIS 464 N 0.00 1.11 0.38 1.61 2.46 -1.26 -3.44 115.29 116.16 3dyp s HIS 464 Ca 0.00 -0.59 0.05 0.00 0.47 0.00 0.00 55.06 54.98 3dyp s HIS 464 Cb 0.00 -1.04 -0.06 0.00 -0.13 0.00 0.00 32.58 31.35 3dyp s HIS 464 CO 0.00 -0.48 0.04 0.20 -2.47 0.00 0.00 174.74 172.04 3dyp s GLY 465 N 1.83 2.37 0.55 1.59 0.00 -1.26 -4.84 107.32 107.57 3dyp s GLY 465 Ca 0.03 -1.93 0.28 0.00 0.00 0.00 0.00 44.72 43.10 3dyp s GLY 465 CO -0.07 -1.96 2.16 0.00 0.00 0.00 0.00 173.10 173.23 3dyp h ALA 466 N 1.88 1.40 -0.13 3.20 0.00 -1.81 -1.06 119.26 122.74 3dyp h ALA 466 Ca -0.42 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 3dyp h ALA 466 Cb 1.25 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3dyp h ALA 466 CO 0.73 0.08 -0.06 -0.91 0.00 0.00 0.00 179.25 179.09 3dyp h ASN 467 N 0.00 0.18 -0.35 0.00 2.35 -1.60 -1.21 115.58 114.95 3dyp h ASN 467 Ca -0.00 -0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.69 3dyp h ASN 467 Cb 0.18 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 3dyp h ASN 467 CO 0.01 0.28 0.08 0.45 -1.65 0.00 0.00 177.43 176.60 3dyp h HIS 468 N 0.19 0.59 -0.77 1.19 3.86 -1.36 -1.09 115.15 117.76 3dyp h HIS 468 Ca 0.04 -0.07 -0.03 0.00 -1.16 0.00 0.00 60.37 59.15 3dyp h HIS 468 Cb 0.24 -0.17 -0.04 0.00 1.06 0.00 0.00 27.41 28.51 3dyp h HIS 468 CO 0.00 0.60 0.34 -0.44 0.86 0.00 0.00 177.93 179.29 3dyp h ASP 469 N 0.41 1.01 -0.45 2.45 3.32 -1.29 0.24 116.42 122.11 3dyp h ASP 469 Ca 0.11 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 56.99 3dyp h ASP 469 Cb 0.31 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 3dyp h ASP 469 CO 0.00 0.87 0.15 0.00 -1.72 0.00 0.00 179.24 178.54 3dyp h ALA 470 N 1.28 0.58 -0.04 3.45 0.00 -1.06 -2.00 119.26 121.47 3dyp h ALA 470 Ca 0.26 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 3dyp h ALA 470 Cb 0.15 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3dyp h ALA 470 CO -0.03 0.23 -0.70 -0.07 0.00 0.00 0.00 179.25 178.68 3dyp h LEU 471 N 0.58 0.24 -0.35 0.00 3.38 -0.78 -0.52 115.31 117.87 3dyp h LEU 471 Ca 0.14 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 57.98 3dyp h LEU 471 Cb 0.25 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3dyp h LEU 471 CO -0.01 0.86 0.17 0.22 0.09 0.00 0.00 178.44 179.78 3dyp h TYR 472 N 0.14 0.32 -0.16 1.13 3.20 -0.40 -1.43 116.97 119.76 3dyp h TYR 472 Ca -0.02 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.76 3dyp h TYR 472 Cb 1.24 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.41 3dyp h TYR 472 CO 0.02 0.17 -0.35 -0.09 -1.64 0.00 0.00 178.16 176.27 3dyp h ARG 473 N 0.36 0.34 -0.28 1.82 9.65 -1.06 -1.29 114.38 123.92 3dyp h ARG 473 Ca 0.15 -0.15 0.04 0.00 -1.10 0.00 0.00 59.98 58.92 3dyp h ARG 473 Cb 0.06 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.59 3dyp h ARG 473 CO -0.10 0.65 0.06 2.35 2.80 0.00 0.00 179.97 185.73 3dyp h TRP 474 N 0.29 0.10 -0.11 2.20 7.01 -0.55 0.32 115.95 125.21 3dyp h TRP 474 Ca 0.03 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.04 3dyp h TRP 474 Cb 0.76 -0.01 -0.00 0.00 -2.10 0.00 0.00 29.16 27.81 3dyp h TRP 474 CO 0.02 0.03 0.05 0.82 -2.79 0.00 0.00 178.44 176.57 3dyp h ILE 475 N 0.17 1.13 -0.65 2.65 2.04 -0.88 0.60 117.51 122.56 3dyp h ILE 475 Ca 0.13 -0.40 0.15 0.00 1.00 0.00 0.00 64.86 65.74 3dyp h ILE 475 Cb 0.13 1.20 -0.04 0.00 -0.74 0.00 0.00 36.82 37.37 3dyp h ILE 475 CO -0.16 0.12 0.45 0.11 0.00 0.00 0.00 178.15 178.67 3dyp h LYS 476 N 0.04 0.20 -0.01 2.37 1.79 -0.93 0.11 116.57 120.13 3dyp h LYS 476 Ca 0.04 -0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.46 3dyp h LYS 476 Cb 0.15 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.76 3dyp h LYS 476 CO -0.00 0.13 -0.14 1.03 -1.08 0.00 0.00 179.45 179.39 3dyp h SER 477 N 0.21 0.13 1.19 0.86 0.87 0.02 -3.30 113.55 113.53 3dyp h SER 477 Ca 0.32 -0.75 -0.12 0.00 -1.23 0.00 0.00 61.79 60.00 3dyp h SER 477 Cb 0.95 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.86 3dyp h SER 477 CO -0.06 0.87 -0.58 -0.37 -0.53 0.00 0.00 176.83 176.16 3dyp h VAL 478 N -0.59 1.07 -2.43 2.23 -1.51 -0.35 -3.41 116.25 111.25 3dyp h VAL 478 Ca -0.02 -2.28 -0.57 0.00 -1.23 0.00 0.00 66.70 62.60 3dyp h VAL 478 Cb 0.88 2.37 -0.38 0.00 -2.13 0.00 0.00 31.29 32.04 3dyp h VAL 478 CO 0.03 0.57 -0.89 -0.62 -1.23 0.00 0.00 177.57 175.42 3dyp s ASP 479 N -6.52 2.12 0.00 4.19 2.15 0.31 -4.94 116.67 113.98 3dyp s ASP 479 Ca 0.02 -2.54 0.14 0.00 0.43 0.00 0.00 52.55 50.60 3dyp s ASP 479 Cb 0.09 -0.33 0.60 0.00 -0.30 0.00 0.00 42.92 42.98 3dyp s ASP 479 CO 0.75 -0.24 1.43 -2.65 -0.17 0.00 0.00 175.17 174.28 3dyp n PRO 480 N 3.51 0.03 0.08 4.34 -0.02 -1.24 -3.43 135.00 138.28 3dyp n PRO 480 Ca 0.20 0.25 0.11 0.00 -2.02 0.00 0.00 63.50 62.04 3dyp n PRO 480 Cb 0.42 -1.50 0.45 0.00 -0.02 0.00 0.00 33.50 32.85 3dyp n PRO 480 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3dyp n SER 481 N -1.47 0.48 -3.87 2.55 3.41 -1.26 -4.75 113.62 108.71 3dyp n SER 481 Ca 0.04 0.60 -0.15 0.00 -0.26 0.00 0.00 58.87 59.10 3dyp n SER 481 Cb 0.15 -0.71 -0.15 0.00 -0.26 0.00 0.00 64.21 63.25 3dyp n SER 481 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3dyp s ARG 482 N -3.18 0.22 0.90 4.33 0.52 -1.22 -4.20 118.95 116.32 3dyp s ARG 482 Ca 0.07 -0.02 -0.10 0.00 -0.52 0.00 0.00 55.73 55.15 3dyp s ARG 482 Cb 0.11 -0.28 0.14 0.00 0.52 0.00 0.00 34.95 35.43 3dyp s ARG 482 CO 0.41 -0.02 1.12 -2.14 0.02 0.00 0.00 175.30 174.70 3dyp s PRO 483 N 0.34 1.16 -0.12 3.54 0.02 -1.25 -4.73 135.00 133.95 3dyp s PRO 483 Ca -0.03 1.39 -0.00 0.00 0.02 0.00 0.00 61.00 62.38 3dyp s PRO 483 Cb -0.06 -1.75 -0.02 0.00 0.02 0.00 0.00 34.50 32.69 3dyp s PRO 483 CO -0.01 -2.48 -0.12 0.08 -0.33 0.00 0.00 177.00 174.14 3dyp s VAL 484 N -2.70 3.17 0.21 3.83 1.01 -1.26 -1.48 120.40 123.19 3dyp s VAL 484 Ca 0.66 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 62.06 3dyp s VAL 484 Cb -0.22 -2.33 -0.05 0.00 0.00 0.00 0.00 36.38 33.79 3dyp s VAL 484 CO 0.58 0.53 -0.08 0.00 0.00 0.00 0.00 175.10 176.13 3dyp s GLN 485 N 0.17 1.32 -0.29 2.72 -2.07 0.10 0.10 119.66 121.71 3dyp s GLN 485 Ca -0.07 -1.62 -0.16 0.00 -1.82 0.00 0.00 55.36 51.69 3dyp s GLN 485 Cb -0.15 -0.88 0.16 0.00 -1.09 0.00 0.00 33.01 31.04 3dyp s GLN 485 CO 0.05 0.05 1.01 -0.47 -1.32 0.00 0.00 175.29 174.61 3dyp s TYR 486 N -3.18 -0.54 -0.22 9.60 5.04 -1.26 -1.55 117.35 125.25 3dyp s TYR 486 Ca 0.24 1.04 0.20 0.00 -2.44 0.00 0.00 57.07 56.11 3dyp s TYR 486 Cb 0.03 0.32 0.01 0.00 0.35 0.00 0.00 41.96 42.66 3dyp s TYR 486 CO 0.07 -0.27 1.08 1.49 -1.34 0.00 0.00 175.55 176.59 3dyp h GLU 487 N 6.24 0.00 -7.10 4.97 4.22 -1.85 -3.43 114.58 117.63 3dyp h GLU 487 Ca -0.26 0.00 -0.56 0.00 0.08 0.00 0.00 59.36 58.63 3dyp h GLU 487 Cb 1.17 0.00 0.16 0.00 0.50 0.00 0.00 28.75 30.58 3dyp h GLU 487 CO 0.18 0.13 0.54 0.20 -2.18 0.00 0.00 179.01 177.88 3dyp s GLY 488 N -4.48 2.87 -0.10 1.92 0.00 -1.26 -0.26 107.32 106.01 3dyp s GLY 488 Ca 0.00 1.25 0.00 0.00 0.00 0.00 0.00 44.72 45.98 3dyp s GLY 488 CO 0.78 1.70 0.00 0.61 0.00 0.00 0.00 173.10 176.19 3dyp n GLY 489 N 0.88 0.47 0.00 0.20 0.00 -1.22 -3.94 105.19 101.58 3dyp n GLY 489 Ca 0.15 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.38 3dyp n GLY 489 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyp n GLY 490 N -2.83 0.98 3.61 -0.02 0.00 -1.21 -4.73 105.19 100.99 3dyp n GLY 490 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3dyp n GLY 490 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dyp n ALA 491 N -0.60 0.00 -2.50 4.61 0.00 0.64 -4.69 120.51 117.96 3dyp n ALA 491 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 3dyp n ALA 491 Cb 0.00 -0.25 0.02 0.00 0.00 0.00 0.00 19.45 19.22 3dyp n ALA 491 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3dyp n ASP 492 N 0.00 1.04 -3.72 0.00 5.68 -1.26 -1.97 116.55 116.32 3dyp n ASP 492 Ca 0.00 -2.03 -0.30 0.00 -0.50 0.00 0.00 54.79 51.96 3dyp n ASP 492 Cb 0.00 -0.31 0.23 0.00 -1.14 0.00 0.00 41.12 39.90 3dyp n ASP 492 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3dyp n THR 493 N 0.43 0.00 1.38 2.12 -2.24 -1.26 -4.91 114.28 109.80 3dyp n THR 493 Ca 0.06 -0.70 0.10 0.00 -2.27 0.00 0.00 64.05 61.24 3dyp n THR 493 Cb 1.13 -1.35 0.59 0.00 -2.10 0.00 0.00 70.33 68.59 3dyp n THR 493 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3dyp n THR 494 N -4.46 0.00 -0.73 4.28 -2.24 -1.26 -2.65 114.28 107.22 3dyp n THR 494 Ca 0.16 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.02 3dyp n THR 494 Cb 0.59 -0.60 0.32 0.00 -2.10 0.00 0.00 70.33 68.55 3dyp n THR 494 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dyp n ALA 495 N -0.95 3.15 -3.29 6.98 0.00 -1.26 -4.94 120.51 120.20 3dyp n ALA 495 Ca 0.15 -1.80 -0.15 0.00 0.00 0.00 0.00 53.44 51.64 3dyp n ALA 495 Cb 0.07 -0.90 -0.15 0.00 0.00 0.00 0.00 19.45 18.47 3dyp n ALA 495 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3dyp s THR 496 N -2.21 0.10 -0.84 0.00 -1.32 -1.08 -4.15 115.64 106.14 3dyp s THR 496 Ca 0.47 0.03 0.25 0.00 -1.21 0.00 0.00 61.69 61.23 3dyp s THR 496 Cb 0.33 -0.15 0.08 0.00 -1.51 0.00 0.00 72.50 71.24 3dyp s THR 496 CO 0.18 0.08 1.48 0.47 -2.21 0.00 0.00 174.62 174.62 3dyp n ASP 497 N 3.60 0.52 -4.14 8.08 8.00 0.12 -4.83 116.55 127.89 3dyp n ASP 497 Ca -0.20 0.07 -0.26 0.00 0.71 0.00 0.00 54.79 55.11 3dyp n ASP 497 Cb 0.55 0.03 -0.16 0.00 -0.02 0.00 0.00 41.12 41.51 3dyp n ASP 497 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3dyp s ILE 498 N -3.07 1.40 -0.20 0.53 1.01 -1.26 -4.50 121.20 115.11 3dyp s ILE 498 Ca 0.10 -0.71 -0.29 0.00 0.00 0.00 0.00 60.65 59.74 3dyp s ILE 498 Cb 0.16 -1.20 -0.02 0.00 0.01 0.00 0.00 42.46 41.41 3dyp s ILE 498 CO 0.67 0.40 1.36 -0.63 0.00 0.00 0.00 174.94 176.75 3dyp s ILE 499 N -0.05 4.09 -0.46 2.92 1.01 0.72 -4.70 121.20 124.73 3dyp s ILE 499 Ca -0.02 1.29 0.09 0.00 0.00 0.00 0.00 60.65 62.01 3dyp s ILE 499 Cb -0.10 -3.95 0.31 0.00 0.01 0.00 0.00 42.46 38.73 3dyp s ILE 499 CO 0.02 -0.25 0.74 0.00 0.00 0.00 0.00 174.94 175.45 3dyp s PRO 501 N -2.40 1.52 -0.21 0.00 0.04 -1.26 -3.43 135.00 129.27 3dyp s PRO 501 Ca 0.41 0.94 -0.03 0.00 0.04 0.00 0.00 61.00 62.36 3dyp s PRO 501 Cb 0.26 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.97 3dyp s PRO 501 CO -0.09 -2.09 -0.07 0.00 0.04 0.00 0.00 177.00 174.80 3dyp s MET 502 N -4.92 3.34 -1.32 4.56 0.23 -1.26 -0.87 119.30 119.06 3dyp s MET 502 Ca 0.63 -0.65 0.00 0.00 -1.03 0.00 0.00 55.69 54.64 3dyp s MET 502 Cb -0.18 -2.94 0.00 0.00 -1.53 0.00 0.00 34.83 30.18 3dyp s MET 502 CO 0.57 -0.17 0.00 0.66 -2.03 0.00 0.00 175.02 174.05 3dyp n TYR 503 N 4.69 -0.30 -2.46 3.16 4.02 -0.08 -4.98 117.16 121.21 3dyp n TYR 503 Ca -0.18 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.31 3dyp n TYR 503 Cb 0.51 -2.69 -0.04 0.00 -0.02 0.00 0.00 39.34 37.10 3dyp n TYR 503 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3dyp s ALA 504 N -2.59 3.37 0.72 -0.72 0.00 -1.26 -4.87 121.76 116.41 3dyp s ALA 504 Ca 0.00 0.90 -0.07 0.00 0.00 0.00 0.00 51.96 52.79 3dyp s ALA 504 Cb 0.00 -3.33 0.08 0.00 0.00 0.00 0.00 23.12 19.87 3dyp s ALA 504 CO 0.00 -0.20 1.04 1.03 0.00 0.00 0.00 175.76 177.62 3dyp s ARG 505 N -1.60 2.05 -0.07 0.00 0.52 -1.26 -4.79 118.95 113.80 3dyp s ARG 505 Ca 0.46 -0.32 -0.27 0.00 -0.52 0.00 0.00 55.73 55.09 3dyp s ARG 505 Cb -0.31 -2.16 -0.22 0.00 0.52 0.00 0.00 34.95 32.78 3dyp s ARG 505 CO 0.40 -1.34 1.05 0.28 0.02 0.00 0.00 175.30 175.71 3dyp h VAL 506 N -0.67 1.50 0.00 3.52 2.07 -1.94 -0.74 116.25 119.98 3dyp h VAL 506 Ca -0.44 -1.59 -0.01 0.00 0.82 0.00 0.00 66.70 65.49 3dyp h VAL 506 Cb 1.31 2.56 -0.00 0.00 -1.52 0.00 0.00 31.29 33.64 3dyp h VAL 506 CO 0.57 0.41 -1.28 0.47 0.02 0.00 0.00 177.57 177.76 3dyp n ASP 507 N -4.77 3.66 -4.67 0.57 8.00 -1.26 -3.29 116.55 114.79 3dyp n ASP 507 Ca -0.09 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.04 3dyp n ASP 507 Cb 0.33 1.23 -0.08 0.00 -0.02 0.00 0.00 41.12 42.58 3dyp n ASP 507 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3dyp s GLU 508 N -2.39 4.14 0.40 -1.24 2.12 -1.26 -4.74 118.70 115.73 3dyp s GLU 508 Ca -0.02 0.04 -0.23 0.00 0.36 0.00 0.00 54.97 55.12 3dyp s GLU 508 Cb 0.04 -3.53 -0.10 0.00 0.26 0.00 0.00 34.13 30.79 3dyp s GLU 508 CO 0.24 0.01 0.97 -0.51 -0.54 0.00 0.00 175.26 175.43 3dyp s ASP 509 N 1.02 6.97 -0.49 -1.70 1.01 -1.26 -3.80 116.67 118.42 3dyp s ASP 509 Ca 0.15 1.80 0.03 0.00 0.71 0.00 0.00 52.55 55.24 3dyp s ASP 509 Cb -0.14 -2.56 0.16 0.00 1.01 0.00 0.00 42.92 41.39 3dyp s ASP 509 CO 0.07 -0.34 0.34 -1.10 0.21 0.00 0.00 175.17 174.34 3dyp s GLN 510 N -2.80 1.37 -1.21 8.23 -0.21 -0.47 -4.91 119.66 119.67 3dyp s GLN 510 Ca 0.59 -2.31 -0.08 0.00 0.02 0.00 0.00 55.36 53.58 3dyp s GLN 510 Cb -0.14 -2.17 -0.08 0.00 1.00 0.00 0.00 33.01 31.62 3dyp s GLN 510 CO 0.18 -1.28 2.59 -0.35 -2.12 0.00 0.00 175.29 174.31 3dyp n PRO 511 N 2.95 2.85 -1.88 2.91 -0.04 -1.26 -0.45 135.00 140.07 3dyp n PRO 511 Ca 0.19 -1.78 -0.38 0.00 -0.04 0.00 0.00 63.50 61.50 3dyp n PRO 511 Cb 0.40 -2.59 0.03 0.00 -0.04 0.00 0.00 33.50 31.30 3dyp n PRO 511 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3dyp s PHE 512 N 2.67 2.40 0.40 0.54 0.40 -1.26 -4.82 117.98 118.31 3dyp s PHE 512 Ca 0.55 1.41 -0.26 0.00 -0.60 0.00 0.00 56.93 58.03 3dyp s PHE 512 Cb 0.15 -3.72 -0.09 0.00 0.51 0.00 0.00 43.02 39.87 3dyp s PHE 512 CO -0.04 -2.63 1.33 -2.14 0.70 0.00 0.00 175.22 172.44 3dyp s PRO 513 N -2.87 3.97 0.00 0.24 0.02 -1.26 -1.95 135.00 133.15 3dyp s PRO 513 Ca 0.70 2.23 0.00 0.00 0.02 0.00 0.00 61.00 63.95 3dyp s PRO 513 Cb -0.38 -2.78 0.00 0.00 0.02 0.00 0.00 34.50 31.36 3dyp s PRO 513 CO 0.45 -0.52 0.00 0.00 -0.33 0.00 0.00 177.00 176.60 3dyp n ALA 514 N 0.16 0.00 -3.07 -1.55 0.00 -1.26 -4.55 120.51 110.23 3dyp n ALA 514 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.25 3dyp n ALA 514 Cb 0.43 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.84 3dyp n ALA 514 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3dyp n VAL 515 N 0.00 1.47 -1.42 0.00 0.24 -1.21 -4.83 118.33 112.58 3dyp n VAL 515 Ca 0.00 -5.08 -0.35 0.00 -2.04 0.00 0.00 64.34 56.87 3dyp n VAL 515 Cb 0.00 -0.89 0.10 0.00 -1.47 0.00 0.00 33.84 31.58 3dyp n VAL 515 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3dyp s PRO 516 N -2.92 2.08 -0.66 7.34 0.04 -0.82 -4.56 135.00 135.51 3dyp s PRO 516 Ca 0.44 1.87 -0.06 0.00 0.04 0.00 0.00 61.00 63.29 3dyp s PRO 516 Cb 0.31 -1.81 0.17 0.00 0.04 0.00 0.00 34.50 33.21 3dyp s PRO 516 CO -0.11 -1.90 0.51 0.15 0.04 0.00 0.00 177.00 175.69 3dyp s LYS 517 N -3.81 2.81 0.72 4.56 1.02 0.40 -4.85 119.74 120.59 3dyp s LYS 517 Ca 0.77 -2.42 -0.13 0.00 0.02 0.00 0.00 55.97 54.21 3dyp s LYS 517 Cb -0.32 -3.93 0.03 0.00 -0.52 0.00 0.00 37.83 33.09 3dyp s LYS 517 CO 0.45 -1.20 1.11 -1.58 -0.92 0.00 0.00 175.35 173.20 3dyp s TRP 518 N 0.16 2.56 0.31 3.18 0.52 -1.26 -1.37 118.94 123.04 3dyp s TRP 518 Ca 0.16 1.56 -0.28 0.00 0.02 0.00 0.00 56.10 57.56 3dyp s TRP 518 Cb -0.18 -3.13 -0.13 0.00 -1.15 0.00 0.00 33.47 28.88 3dyp s TRP 518 CO -0.05 -1.79 1.12 0.45 0.02 0.00 0.00 176.95 176.71 3dyp n SER 519 N -2.97 1.90 -0.03 2.95 2.88 -1.25 -4.38 113.62 112.72 3dyp n SER 519 Ca 0.10 1.19 -0.01 0.00 -1.33 0.00 0.00 58.87 58.81 3dyp n SER 519 Cb 0.52 -1.37 0.26 0.00 -0.75 0.00 0.00 64.21 62.87 3dyp n SER 519 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 3dyp h ILE 520 N 2.20 1.21 -0.56 2.46 3.07 -1.11 0.36 117.51 125.14 3dyp h ILE 520 Ca -0.42 -0.86 -0.03 0.00 1.55 0.00 0.00 64.86 65.10 3dyp h ILE 520 Cb 1.32 0.94 -0.02 0.00 -0.27 0.00 0.00 36.82 38.78 3dyp h ILE 520 CO 0.61 0.30 0.24 0.11 -1.05 0.00 0.00 178.15 178.36 3dyp h LYS 521 N 0.56 0.83 -0.12 0.16 1.57 -1.83 -2.89 116.57 114.85 3dyp h LYS 521 Ca 0.12 -0.14 -0.16 0.00 -1.87 0.00 0.00 60.65 58.60 3dyp h LYS 521 Cb 0.37 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 3dyp h LYS 521 CO 0.01 0.71 -0.60 -0.22 -0.57 0.00 0.00 179.45 178.78 3dyp h LYS 522 N 0.76 0.41 -0.81 3.15 3.64 -1.70 -3.24 116.57 118.79 3dyp h LYS 522 Ca 0.19 -0.28 0.04 0.00 -1.27 0.00 0.00 60.65 59.33 3dyp h LYS 522 Cb 0.18 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.99 3dyp h LYS 522 CO -0.02 0.89 0.51 2.35 -2.27 0.00 0.00 179.45 180.91 3dyp h TRP 523 N 0.30 0.96 -0.83 1.91 2.91 -0.75 -2.16 115.95 118.29 3dyp h TRP 523 Ca -0.01 0.03 0.16 0.00 1.13 0.00 0.00 58.89 60.20 3dyp h TRP 523 Cb 1.14 -0.31 -0.06 0.00 -0.51 0.00 0.00 29.16 29.41 3dyp h TRP 523 CO 0.04 0.54 0.55 -0.07 -1.03 0.00 0.00 178.44 178.46 3dyp h LEU 524 N 0.98 0.46 -2.84 0.65 3.38 -1.53 -2.33 115.31 114.08 3dyp h LEU 524 Ca 0.33 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.33 3dyp h LEU 524 Cb 0.05 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3dyp h LEU 524 CO -0.13 0.22 0.00 -1.54 0.09 0.00 0.00 178.44 177.09 3dyp n SER 525 N -4.51 4.09 -4.69 -0.43 3.41 -0.83 -4.57 113.62 106.09 3dyp n SER 525 Ca 0.17 -2.10 -0.37 0.00 -0.26 0.00 0.00 58.87 56.31 3dyp n SER 525 Cb 0.57 -0.50 0.06 0.00 -0.26 0.00 0.00 64.21 64.08 3dyp n SER 525 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dyp n LEU 526 N 1.49 5.32 -4.62 1.04 4.77 -0.88 -4.76 117.00 119.36 3dyp n LEU 526 Ca 0.24 0.82 -0.56 0.00 -0.03 0.00 0.00 56.01 56.49 3dyp n LEU 526 Cb 0.67 -1.51 -0.07 0.00 -2.33 0.00 0.00 43.42 40.19 3dyp n LEU 526 CO 0.18 -1.26 0.99 -2.65 -1.33 0.00 0.00 177.39 173.32 3dyp n PRO 527 N -1.62 0.88 0.00 3.23 -0.02 -1.26 -0.26 135.00 135.95 3dyp n PRO 527 Ca 0.15 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 3dyp n PRO 527 Cb 0.48 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 3dyp n PRO 527 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dyp n GLY 528 N 2.94 2.96 3.73 -1.23 0.00 -1.26 -5.01 105.19 107.32 3dyp n GLY 528 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 3dyp n GLY 528 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3dyp s GLU 529 N -0.02 4.54 0.00 1.61 2.56 0.64 -4.94 118.70 123.09 3dyp s GLU 529 Ca 0.00 1.74 0.00 0.00 0.00 0.00 0.00 54.97 56.71 3dyp s GLU 529 Cb 0.00 -3.29 0.00 0.00 2.00 0.00 0.00 34.13 32.84 3dyp s GLU 529 CO 0.00 -0.02 0.10 0.25 -0.56 0.00 0.00 175.26 175.03 3dyp n THR 530 N 2.75 0.00 -1.93 -1.70 -2.24 -1.26 -4.77 114.28 105.14 3dyp n THR 530 Ca 0.04 -0.15 -0.30 0.00 -2.27 0.00 0.00 64.05 61.38 3dyp n THR 530 Cb 0.46 1.49 0.05 0.00 -2.10 0.00 0.00 70.33 70.23 3dyp n THR 530 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3dyp s ARG 531 N -0.09 2.74 0.65 -0.78 0.52 -1.26 -4.12 118.95 116.61 3dyp s ARG 531 Ca 0.00 0.37 -0.11 0.00 -0.52 0.00 0.00 55.73 55.47 3dyp s ARG 531 Cb 0.00 -2.03 -0.02 0.00 0.52 0.00 0.00 34.95 33.42 3dyp s ARG 531 CO 0.00 -1.09 1.04 -1.25 0.02 0.00 0.00 175.30 174.03 3dyp s PRO 532 N -5.36 3.27 -0.12 3.54 0.04 -1.03 -4.79 135.00 130.54 3dyp s PRO 532 Ca 0.58 0.87 0.01 0.00 0.04 0.00 0.00 61.00 62.51 3dyp s PRO 532 Cb -0.11 -2.03 0.02 0.00 0.04 0.00 0.00 34.50 32.41 3dyp s PRO 532 CO 0.51 -0.83 -0.15 -1.17 0.04 0.00 0.00 177.00 175.40 3dyp s LEU 533 N -5.30 1.70 -0.09 -3.56 0.20 -0.04 -0.20 118.68 111.39 3dyp s LEU 533 Ca 0.57 -0.45 -0.02 0.00 0.69 0.00 0.00 54.13 54.92 3dyp s LEU 533 Cb -0.13 -1.12 0.04 0.00 -0.43 0.00 0.00 46.19 44.55 3dyp s LEU 533 CO 0.53 -0.01 0.03 -0.63 -0.29 0.00 0.00 176.35 175.98 3dyp s ILE 534 N 1.17 0.25 0.15 6.68 1.01 -0.39 -1.46 121.20 128.62 3dyp s ILE 534 Ca -0.02 0.08 -0.31 0.00 0.00 0.00 0.00 60.65 60.39 3dyp s ILE 534 Cb -0.14 -0.52 -0.09 0.00 0.01 0.00 0.00 42.46 41.72 3dyp s ILE 534 CO -0.05 0.13 1.49 -0.76 0.00 0.00 0.00 174.94 175.76 3dyp s LEU 535 N 2.02 4.37 0.47 2.97 1.02 -0.51 -4.14 118.68 124.89 3dyp s LEU 535 Ca 0.04 2.51 0.27 0.00 0.02 0.00 0.00 54.13 56.98 3dyp s LEU 535 Cb -0.13 -3.59 0.78 0.00 0.02 0.00 0.00 46.19 43.27 3dyp s LEU 535 CO -0.05 -0.75 1.77 0.00 0.02 0.00 0.00 176.35 177.34 3dyp s GLU 537 N -3.39 0.58 0.24 0.00 2.02 -1.22 -4.26 118.70 112.66 3dyp s GLU 537 Ca 0.05 0.82 -0.22 0.00 0.02 0.00 0.00 54.97 55.64 3dyp s GLU 537 Cb 0.07 0.20 0.03 0.00 0.10 0.00 0.00 34.13 34.53 3dyp s GLU 537 CO 0.61 -0.11 0.71 1.52 0.02 0.00 0.00 175.26 178.02 3dyp s TYR 538 N 0.75 -0.26 -0.83 1.61 -0.85 -0.86 -0.91 117.35 116.00 3dyp s TYR 538 Ca -0.04 -0.13 -0.03 0.00 -0.52 0.00 0.00 57.07 56.35 3dyp s TYR 538 Cb -0.05 0.67 -0.01 0.00 0.38 0.00 0.00 41.96 42.96 3dyp s TYR 538 CO -0.06 -1.12 0.70 0.00 -1.52 0.00 0.00 175.55 173.55 3dyp n ALA 539 N -0.44 -2.60 -1.75 9.51 0.00 -1.26 -0.22 120.51 123.75 3dyp n ALA 539 Ca -0.07 -0.10 -0.43 0.00 0.00 0.00 0.00 53.44 52.84 3dyp n ALA 539 Cb 0.60 -1.83 -0.03 0.00 0.00 0.00 0.00 19.45 18.20 3dyp n ALA 539 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3dyp s HIS 540 N -3.07 1.40 -0.34 0.00 2.46 -0.46 -3.80 115.29 111.49 3dyp s HIS 540 Ca 0.08 0.59 -0.03 0.00 0.47 0.00 0.00 55.06 56.17 3dyp s HIS 540 Cb -0.02 -4.00 0.05 0.00 -0.13 0.00 0.00 32.58 28.48 3dyp s HIS 540 CO 0.81 -3.63 2.67 0.00 -2.47 0.00 0.00 174.74 172.11 3dyp n ALA 541 N 11.25 6.01 -2.63 1.58 0.00 0.18 -4.37 120.51 132.53 3dyp n ALA 541 Ca 0.27 -2.40 -0.42 0.00 0.00 0.00 0.00 53.44 50.89 3dyp n ALA 541 Cb 0.46 -1.93 -0.04 0.00 0.00 0.00 0.00 19.45 17.94 3dyp n ALA 541 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3dyp s MET 542 N -1.29 4.05 4.02 0.00 0.00 -1.26 -3.56 119.30 121.26 3dyp s MET 542 Ca 0.51 0.84 0.00 0.00 0.00 0.00 0.00 55.69 57.04 3dyp s MET 542 Cb 0.32 -3.71 0.00 0.00 0.00 0.00 0.00 34.83 31.44 3dyp s MET 542 CO -0.13 -0.71 0.00 0.41 0.00 0.00 0.00 175.02 174.59 3dyp n GLY 543 N 3.97 0.81 3.54 2.11 0.00 -1.26 -4.21 105.19 110.14 3dyp n GLY 543 Ca 0.07 -0.77 -0.41 0.00 0.00 0.00 0.00 46.02 44.90 3dyp n GLY 543 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dyp s ASN 544 N -4.00 6.32 0.00 1.61 3.84 -1.26 -4.87 114.94 116.57 3dyp s ASN 544 Ca 0.00 -0.99 0.00 0.00 0.21 0.00 0.00 52.86 52.08 3dyp s ASN 544 Cb 0.00 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 38.16 3dyp s ASN 544 CO 0.00 -1.62 0.00 -0.24 -2.79 0.00 0.00 177.10 172.45 3dyp n SER 545 N 8.80 0.00 0.00 -4.21 2.88 -1.26 -4.74 113.62 115.10 3dyp n SER 545 Ca 0.15 -0.53 0.00 0.00 -1.33 0.00 0.00 58.87 57.15 3dyp n SER 545 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 3dyp n SER 545 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3dyp n LEU 546 N 0.00 0.00 -4.69 2.46 4.32 -1.21 -4.76 117.00 113.12 3dyp n LEU 546 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 56.01 55.57 3dyp n LEU 546 Cb 0.00 -0.39 -0.03 0.00 -1.62 0.00 0.00 43.42 41.38 3dyp n LEU 546 CO 0.00 0.00 1.29 -0.83 -1.22 0.00 0.00 177.39 176.63 3dyp s GLY 547 N -2.25 1.60 0.00 -0.72 0.00 0.13 -2.00 107.32 104.08 3dyp s GLY 547 Ca 0.00 1.18 0.00 0.00 0.00 0.00 0.00 44.72 45.90 3dyp s GLY 547 CO 0.00 2.82 0.00 0.61 0.00 0.00 0.00 173.10 176.53 3dyp n GLY 548 N 3.93 0.66 0.34 0.20 0.00 0.12 -3.99 105.19 106.45 3dyp n GLY 548 Ca 0.15 -0.16 0.02 0.00 0.00 0.00 0.00 46.02 46.04 3dyp n GLY 548 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3dyp h PHE 549 N 0.00 0.83 0.00 1.61 3.57 -1.58 -1.77 116.94 119.61 3dyp h PHE 549 Ca 0.00 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 3dyp h PHE 549 Cb 0.00 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 38.45 3dyp h PHE 549 CO 0.00 0.51 -0.17 0.00 -2.23 0.00 0.00 178.31 176.43 3dyp h ALA 550 N 1.59 1.35 -0.79 2.41 0.00 -1.86 -2.20 119.26 119.76 3dyp h ALA 550 Ca 0.25 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3dyp h ALA 550 Cb -0.06 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 3dyp h ALA 550 CO -0.06 0.21 0.34 -0.22 0.00 0.00 0.00 179.25 179.51 3dyp h LYS 551 N 0.00 1.16 -0.42 0.00 3.64 -1.71 -0.04 116.57 119.20 3dyp h LYS 551 Ca -0.00 -0.20 -0.05 0.00 -1.27 0.00 0.00 60.65 59.14 3dyp h LYS 551 Cb 0.39 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 3dyp h LYS 551 CO 0.02 0.93 0.08 1.88 -2.27 0.00 0.00 179.45 180.09 3dyp h TYR 552 N 1.13 0.73 -0.54 1.91 -1.99 -1.43 -2.79 116.97 113.99 3dyp h TYR 552 Ca 0.26 -0.10 -0.07 0.00 2.00 0.00 0.00 58.73 60.83 3dyp h TYR 552 Cb 0.18 -0.20 -0.02 0.00 2.00 0.00 0.00 36.73 38.69 3dyp h TYR 552 CO 0.02 0.70 0.05 -1.49 -0.00 0.00 0.00 178.16 177.43 3dyp h TRP 553 N 0.55 0.93 -0.64 4.88 4.06 -1.41 0.57 115.95 124.88 3dyp h TRP 553 Ca 0.13 -0.12 -0.07 0.00 2.06 0.00 0.00 58.89 60.89 3dyp h TRP 553 Cb 0.35 -0.26 -0.03 0.00 -1.00 0.00 0.00 29.16 28.23 3dyp h TRP 553 CO 0.02 0.82 0.14 0.37 -3.56 0.00 0.00 178.44 176.23 3dyp h GLN 554 N 0.82 1.03 -0.23 0.49 -0.00 -0.97 -1.85 115.11 114.39 3dyp h GLN 554 Ca 0.16 -0.24 -0.12 0.00 -0.00 0.00 0.00 58.65 58.45 3dyp h GLN 554 Cb 0.42 -0.14 -0.00 0.00 0.00 0.00 0.00 27.48 27.77 3dyp h GLN 554 CO 0.01 0.92 -0.31 0.00 0.00 0.00 0.00 178.83 179.46 3dyp h ALA 555 N 1.17 0.35 -0.87 3.38 0.00 -1.09 -1.86 119.26 120.34 3dyp h ALA 555 Ca 0.20 -0.41 0.05 0.00 0.00 0.00 0.00 54.91 54.76 3dyp h ALA 555 Cb 0.37 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 3dyp h ALA 555 CO 0.00 0.38 0.57 0.74 0.00 0.00 0.00 179.25 180.94 3dyp h PHE 556 N 0.32 1.01 -0.01 0.00 0.05 -0.80 0.13 116.94 117.64 3dyp h PHE 556 Ca 0.03 0.03 -0.19 0.00 3.82 0.00 0.00 57.97 61.65 3dyp h PHE 556 Cb 0.89 -0.34 -0.01 0.00 2.00 0.00 0.00 35.95 38.49 3dyp h PHE 556 CO 0.08 0.55 -0.84 0.00 -0.18 0.00 0.00 178.31 177.93 3dyp h ARG 557 N 1.02 0.20 0.00 1.51 3.08 -1.19 -3.29 114.38 115.70 3dyp h ARG 557 Ca 0.36 -0.20 -0.18 0.00 0.07 0.00 0.00 59.98 60.04 3dyp h ARG 557 Cb 0.14 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.22 3dyp h ARG 557 CO -0.13 0.92 -0.84 0.37 -1.07 0.00 0.00 179.97 179.22 3dyp h GLN 558 N 0.11 0.00 -4.83 0.04 4.15 -0.68 -3.43 115.11 110.48 3dyp h GLN 558 Ca -0.04 0.00 -0.67 0.00 0.77 0.00 0.00 58.65 58.71 3dyp h GLN 558 Cb 1.45 0.00 -0.26 0.00 0.21 0.00 0.00 27.48 28.88 3dyp h GLN 558 CO 0.13 0.84 -0.63 0.71 -1.93 0.00 0.00 178.83 177.95 3dyp s TYR 559 N -3.08 3.13 0.21 3.99 1.51 -0.03 -5.00 117.35 118.09 3dyp s TYR 559 Ca 0.00 -0.96 -0.09 0.00 -1.01 0.00 0.00 57.07 55.01 3dyp s TYR 559 Cb 0.11 -2.24 0.31 0.00 -0.11 0.00 0.00 41.96 40.04 3dyp s TYR 559 CO 0.80 -0.56 1.70 -1.35 -1.11 0.00 0.00 175.55 175.03 3dyp h PRO 560 N 8.22 0.25 0.00 -1.71 0.11 -1.84 -0.68 132.00 136.35 3dyp h PRO 560 Ca -0.33 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3dyp h PRO 560 Cb 1.13 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3dyp h PRO 560 CO 0.60 0.17 0.00 0.54 -0.21 0.00 0.00 178.00 179.10 3dyp n ARG 561 N -5.13 0.07 -2.95 1.05 1.74 -1.26 -4.30 116.66 105.89 3dyp n ARG 561 Ca 0.10 0.15 -0.43 0.00 -0.77 0.00 0.00 57.85 56.89 3dyp n ARG 561 Cb 0.34 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.23 3dyp n ARG 561 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3dyp s LEU 562 N -2.89 4.62 -0.31 0.55 1.43 -0.26 -0.86 118.68 120.96 3dyp s LEU 562 Ca 0.12 -0.97 0.10 0.00 -1.03 0.00 0.00 54.13 52.36 3dyp s LEU 562 Cb 0.13 -2.47 0.68 0.00 0.03 0.00 0.00 46.19 44.57 3dyp s LEU 562 CO 0.34 -1.27 1.72 0.00 0.23 0.00 0.00 176.35 177.38 3dyp n GLN 563 N 7.18 3.27 0.00 1.70 6.02 -0.53 -4.64 117.38 130.37 3dyp n GLN 563 Ca -0.04 -3.07 0.00 0.00 -0.01 0.00 0.00 57.00 53.88 3dyp n GLN 563 Cb 0.45 -2.12 0.00 0.00 1.02 0.00 0.00 30.24 29.60 3dyp n GLN 563 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dyp n GLY 564 N -0.41 -0.19 0.00 1.08 0.00 -1.26 -0.49 105.19 103.92 3dyp n GLY 564 Ca 0.39 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.45 3dyp n GLY 564 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyp n GLY 565 N 0.00 -0.75 3.17 -0.02 0.00 -0.98 -1.42 105.19 105.19 3dyp n GLY 565 Ca 0.00 -1.01 -0.35 0.00 0.00 0.00 0.00 46.02 44.66 3dyp n GLY 565 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dyp s PHE 566 N -2.00 3.26 0.52 1.61 0.40 -0.47 -0.75 117.98 120.55 3dyp s PHE 566 Ca 0.00 -1.89 -0.22 0.00 -0.60 0.00 0.00 56.93 54.22 3dyp s PHE 566 Cb 0.00 -2.09 -0.06 0.00 0.51 0.00 0.00 43.02 41.38 3dyp s PHE 566 CO 0.00 -0.81 1.34 0.28 0.70 0.00 0.00 175.22 176.74 3dyp n VAL 567 N 4.61 3.56 -3.60 -0.44 0.31 -0.42 -2.04 118.33 120.31 3dyp n VAL 567 Ca -0.13 -0.50 -0.40 0.00 -0.01 0.00 0.00 64.34 63.29 3dyp n VAL 567 Cb 0.43 -1.66 -0.10 0.00 -0.91 0.00 0.00 33.84 31.61 3dyp n VAL 567 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 3dyp s TRP 568 N -1.28 3.31 0.04 3.52 -0.11 0.70 -0.79 118.94 124.33 3dyp s TRP 568 Ca 0.69 -1.40 -0.00 0.00 1.22 0.00 0.00 56.10 56.61 3dyp s TRP 568 Cb -0.43 -2.84 0.00 0.00 -1.50 0.00 0.00 33.47 28.70 3dyp s TRP 568 CO 0.51 -0.81 0.06 -0.40 -4.62 0.00 0.00 176.95 171.69 3dyp n ASP 569 N 4.94 -0.15 0.27 5.86 5.75 -0.44 0.50 116.55 133.27 3dyp n ASP 569 Ca -0.11 -1.23 -0.12 0.00 -0.01 0.00 0.00 54.79 53.33 3dyp n ASP 569 Cb 0.44 0.29 -0.06 0.00 -1.03 0.00 0.00 41.12 40.75 3dyp n ASP 569 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 3dyp h TRP 570 N 1.12 -0.67 -3.80 2.11 -0.00 -0.84 -1.22 115.95 112.64 3dyp h TRP 570 Ca -0.03 -0.02 -0.49 0.00 -0.00 0.00 0.00 58.89 58.35 3dyp h TRP 570 Cb 0.14 0.22 -0.31 0.00 -0.00 0.00 0.00 29.16 29.21 3dyp h TRP 570 CO 0.00 -0.38 -0.81 0.54 -0.00 0.00 0.00 178.44 177.79 3dyp s VAL 571 N -4.19 1.09 0.24 2.65 0.11 -1.26 -0.98 120.40 118.06 3dyp s VAL 571 Ca -0.12 -0.52 -0.31 0.00 -2.93 0.00 0.00 61.98 58.10 3dyp s VAL 571 Cb 0.01 -0.96 -0.13 0.00 -1.53 0.00 0.00 36.38 33.77 3dyp s VAL 571 CO 0.38 0.33 1.43 0.47 -3.33 0.00 0.00 175.10 174.38 3dyp n ASP 572 N 3.30 2.86 -3.51 3.54 8.00 -0.58 -4.32 116.55 125.83 3dyp n ASP 572 Ca -0.19 1.14 -0.40 0.00 0.71 0.00 0.00 54.79 56.05 3dyp n ASP 572 Cb 0.53 -1.44 -0.00 0.00 -0.02 0.00 0.00 41.12 40.19 3dyp n ASP 572 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dyp n GLN 573 N 2.06 4.48 -3.48 -1.24 6.02 0.10 -4.08 117.38 121.24 3dyp n GLN 573 Ca 0.11 -3.44 -0.28 0.00 -0.01 0.00 0.00 57.00 53.38 3dyp n GLN 573 Cb 0.32 -2.66 -0.03 0.00 1.02 0.00 0.00 30.24 28.88 3dyp n GLN 573 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3dyp s SER 574 N 0.46 6.43 0.09 1.08 1.04 -1.26 -4.72 113.70 116.82 3dyp s SER 574 Ca 0.53 0.61 0.08 0.00 0.48 0.00 0.00 55.95 57.65 3dyp s SER 574 Cb 0.18 -2.10 -0.04 0.00 0.10 0.00 0.00 66.02 64.16 3dyp s SER 574 CO -0.08 -0.13 -0.18 -0.76 0.98 0.00 0.00 173.24 173.07 3dyp s LEU 575 N -3.41 2.67 0.05 2.42 1.43 -0.69 -4.31 118.68 116.83 3dyp s LEU 575 Ca 0.42 -0.51 -0.27 0.00 -1.03 0.00 0.00 54.13 52.74 3dyp s LEU 575 Cb -0.11 -1.54 -0.05 0.00 0.03 0.00 0.00 46.19 44.52 3dyp s LEU 575 CO 0.29 0.20 0.86 -0.63 0.23 0.00 0.00 176.35 177.31 3dyp s ILE 576 N -1.07 4.72 0.29 -0.59 -1.09 -0.45 0.41 121.20 123.41 3dyp s ILE 576 Ca 0.17 1.84 0.09 0.00 -2.23 0.00 0.00 60.65 60.52 3dyp s ILE 576 Cb -0.11 -4.21 -0.06 0.00 -1.58 0.00 0.00 42.46 36.50 3dyp s ILE 576 CO 0.08 0.30 -0.12 -0.54 -1.23 0.00 0.00 174.94 173.43 3dyp s LYS 577 N 0.26 1.63 -0.04 2.79 1.02 0.52 -4.92 119.74 121.00 3dyp s LYS 577 Ca 0.44 -1.79 0.04 0.00 0.02 0.00 0.00 55.97 54.68 3dyp s LYS 577 Cb -0.21 -1.48 -0.00 0.00 -0.52 0.00 0.00 37.83 35.61 3dyp s LYS 577 CO 0.26 0.18 -0.17 0.71 -0.92 0.00 0.00 175.35 175.40 3dyp s TYR 578 N -2.75 1.68 0.31 3.18 1.51 -1.26 0.73 117.35 120.75 3dyp s TYR 578 Ca 0.29 -0.46 -0.04 0.00 -1.01 0.00 0.00 57.07 55.85 3dyp s TYR 578 Cb 0.00 -1.13 0.07 0.00 -0.11 0.00 0.00 41.96 40.80 3dyp s TYR 578 CO 0.13 -0.15 0.43 -0.40 -1.11 0.00 0.00 175.55 174.45 3dyp n ASP 579 N 3.10 0.16 -0.23 2.29 5.68 0.20 -4.81 116.55 122.93 3dyp n ASP 579 Ca -0.18 -1.23 0.03 0.00 -0.50 0.00 0.00 54.79 52.91 3dyp n ASP 579 Cb 0.53 -0.31 0.15 0.00 -1.14 0.00 0.00 41.12 40.35 3dyp n ASP 579 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3dyp h GLU 580 N 0.00 0.41 0.00 0.11 4.11 -2.01 1.12 114.58 118.31 3dyp h GLU 580 Ca -0.14 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.27 3dyp h GLU 580 Cb 0.41 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3dyp h GLU 580 CO 0.11 0.27 0.00 0.09 0.07 0.00 0.00 179.01 179.55 3dyp n ASN 581 N -5.01 0.00 0.00 3.06 3.02 -1.26 -4.83 115.26 110.24 3dyp n ASN 581 Ca 0.12 -1.32 0.00 0.00 -0.03 0.00 0.00 54.58 53.35 3dyp n ASN 581 Cb 0.35 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.52 3dyp n ASN 581 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dyp n GLY 582 N 0.57 0.58 3.81 7.41 0.00 0.38 -5.01 105.19 112.94 3dyp n GLY 582 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 3dyp n GLY 582 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dyp s ASN 583 N -2.00 7.06 0.54 1.61 0.01 -1.26 -4.64 114.94 116.26 3dyp s ASN 583 Ca 0.00 1.29 -0.17 0.00 -0.71 0.00 0.00 52.86 53.27 3dyp s ASN 583 Cb 0.00 -2.37 -0.06 0.00 0.41 0.00 0.00 41.25 39.23 3dyp s ASN 583 CO 0.00 0.22 1.02 -2.16 -1.51 0.00 0.00 177.10 174.66 3dyp s PRO 584 N -1.34 3.70 0.05 -0.60 0.04 -1.26 0.58 135.00 136.17 3dyp s PRO 584 Ca 0.33 1.11 -0.16 0.00 0.04 0.00 0.00 61.00 62.32 3dyp s PRO 584 Cb -0.19 -2.09 0.03 0.00 0.04 0.00 0.00 34.50 32.29 3dyp s PRO 584 CO 0.20 -0.49 0.37 1.67 0.04 0.00 0.00 177.00 178.80 3dyp s TRP 585 N -2.45 -0.20 -0.24 0.56 1.48 0.22 -4.88 118.94 113.43 3dyp s TRP 585 Ca 0.62 0.10 -0.22 0.00 -1.06 0.00 0.00 56.10 55.55 3dyp s TRP 585 Cb -0.13 0.18 -0.02 0.00 -1.16 0.00 0.00 33.47 32.34 3dyp s TRP 585 CO 0.31 -0.56 0.69 -1.12 -4.06 0.00 0.00 176.95 172.21 3dyp s SER 586 N -2.10 6.67 0.12 -2.66 0.01 -1.26 -0.35 113.70 114.12 3dyp s SER 586 Ca -0.04 0.82 0.05 0.00 1.31 0.00 0.00 55.95 58.09 3dyp s SER 586 Cb -0.00 -2.37 -0.04 0.00 0.21 0.00 0.00 66.02 63.82 3dyp s SER 586 CO -0.04 -0.40 0.07 0.00 0.41 0.00 0.00 173.24 173.29 3dyp s ALA 587 N 2.50 3.46 0.00 1.44 0.00 0.17 -4.91 121.76 124.42 3dyp s ALA 587 Ca 0.29 -1.15 0.00 0.00 0.00 0.00 0.00 51.96 51.10 3dyp s ALA 587 Cb -0.15 -1.30 0.00 0.00 0.00 0.00 0.00 23.12 21.66 3dyp s ALA 587 CO 0.08 0.62 0.00 2.48 0.00 0.00 0.00 175.76 178.95 3dyp n TYR 588 N 0.13 0.00 -1.60 0.00 0.18 -1.26 -1.70 117.16 112.91 3dyp n TYR 588 Ca -0.09 0.00 -0.49 0.00 1.88 0.00 0.00 57.90 59.20 3dyp n TYR 588 Cb 0.53 0.00 -0.04 0.00 -0.38 0.00 0.00 39.34 39.45 3dyp n TYR 588 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3dyp n GLY 589 N 2.09 0.26 1.95 -7.48 0.00 -0.71 -1.14 105.19 100.16 3dyp n GLY 589 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.58 3dyp n GLY 589 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyp n GLY 590 N 2.16 2.98 0.00 -0.02 0.00 -1.26 -3.97 105.19 105.08 3dyp n GLY 590 Ca 0.15 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.24 3dyp n GLY 590 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3dyp n ASP 591 N 0.00 0.00 -0.27 1.61 8.00 -0.29 -1.64 116.55 123.95 3dyp n ASP 591 Ca 0.00 -0.14 0.10 0.00 0.71 0.00 0.00 54.79 55.46 3dyp n ASP 591 Cb 0.00 -0.17 0.17 0.00 -0.02 0.00 0.00 41.12 41.10 3dyp n ASP 591 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3dyp n PHE 592 N -1.17 0.23 -0.78 1.24 3.01 -1.26 -4.92 117.46 113.81 3dyp n PHE 592 Ca 0.08 -0.97 0.00 0.00 1.01 0.00 0.00 57.45 57.57 3dyp n PHE 592 Cb 0.09 -0.19 0.00 0.00 -0.01 0.00 0.00 39.48 39.37 3dyp n PHE 592 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3dyp n GLY 593 N -1.21 1.16 3.70 1.37 0.00 -0.65 -4.86 105.19 104.70 3dyp n GLY 593 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3dyp n GLY 593 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3dyp s ASP 594 N -3.10 6.80 -0.21 1.61 -4.77 -1.26 -4.99 116.67 110.75 3dyp s ASP 594 Ca 0.00 2.27 -0.26 0.00 -3.30 0.00 0.00 52.55 51.26 3dyp s ASP 594 Cb 0.00 -2.57 0.07 0.00 -1.09 0.00 0.00 42.92 39.33 3dyp s ASP 594 CO 0.00 -0.72 0.69 0.28 0.70 0.00 0.00 175.17 176.12 3dyp s THR 595 N 1.86 0.00 0.99 2.11 -1.32 -1.26 -4.09 115.64 113.92 3dyp s THR 595 Ca 0.66 -0.01 -0.12 0.00 -1.21 0.00 0.00 61.69 61.01 3dyp s THR 595 Cb -0.35 -0.97 0.18 0.00 -1.51 0.00 0.00 72.50 69.85 3dyp s THR 595 CO 0.29 -0.00 1.08 -2.84 -2.21 0.00 0.00 174.62 170.94 3dyp s PRO 596 N 0.01 0.53 0.20 7.08 0.02 -1.26 -5.16 135.00 136.42 3dyp s PRO 596 Ca -0.03 0.71 -0.09 0.00 0.02 0.00 0.00 61.00 61.62 3dyp s PRO 596 Cb -0.04 -1.73 -0.01 0.00 0.02 0.00 0.00 34.50 32.74 3dyp s PRO 596 CO 0.03 -2.72 0.32 0.54 -0.33 0.00 0.00 177.00 174.85 3dyp s ASN 597 N -3.27 0.01 -0.41 2.53 2.20 -1.26 -4.75 114.94 110.00 3dyp s ASN 597 Ca 0.65 -1.01 0.05 0.00 -0.94 0.00 0.00 52.86 51.61 3dyp s ASN 597 Cb -0.19 0.48 0.50 0.00 -2.00 0.00 0.00 41.25 40.04 3dyp s ASN 597 CO 0.58 -0.98 1.60 0.47 -2.94 0.00 0.00 177.10 175.84 3dyp n ASP 598 N -0.29 4.60 0.00 3.54 8.00 0.13 -4.94 116.55 127.58 3dyp n ASP 598 Ca -0.03 -3.76 0.00 0.00 0.71 0.00 0.00 54.79 51.71 3dyp n ASP 598 Cb 0.63 -0.68 0.00 0.00 -0.02 0.00 0.00 41.12 41.05 3dyp n ASP 598 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 3dyp n ARG 599 N -0.97 0.00 0.00 -1.24 1.85 -1.25 -1.23 116.66 113.81 3dyp n ARG 599 Ca 0.47 0.00 0.12 0.00 -1.00 0.00 0.00 57.85 57.44 3dyp n ARG 599 Cb 1.00 0.00 0.72 0.00 -1.05 0.00 0.00 32.46 33.13 3dyp n ARG 599 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3dyp n GLN 600 N 13.89 0.75 0.00 2.89 0.00 -1.26 -1.73 117.38 131.92 3dyp n GLN 600 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 57.00 57.02 3dyp n GLN 600 Cb 0.00 -1.50 0.12 0.00 0.00 0.00 0.00 30.24 28.86 3dyp n GLN 600 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 3dyp n PHE 601 N -1.00 0.00 1.28 2.61 3.01 -0.36 -1.49 117.46 121.49 3dyp n PHE 601 Ca 0.18 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.78 3dyp n PHE 601 Cb 0.09 -0.24 0.54 0.00 -0.01 0.00 0.00 39.48 39.85 3dyp n PHE 601 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3dyp s MET 603 N -2.63 2.39 -0.05 0.00 -1.94 -0.56 0.00 119.30 116.52 3dyp s MET 603 Ca 0.24 -2.13 0.09 0.00 -1.71 0.00 0.00 55.69 52.18 3dyp s MET 603 Cb 0.19 -3.75 0.16 0.00 2.01 0.00 0.00 34.83 33.44 3dyp s MET 603 CO 0.52 -1.15 1.08 0.09 -0.01 0.00 0.00 175.02 175.55 3dyp n ASN 604 N 4.17 0.95 -4.91 3.03 5.03 -1.26 -4.14 115.26 118.13 3dyp n ASN 604 Ca 0.02 -2.46 -0.27 0.00 0.87 0.00 0.00 54.58 52.74 3dyp n ASN 604 Cb 0.40 -0.30 -0.00 0.00 -1.02 0.00 0.00 39.78 38.86 3dyp n ASN 604 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 3dyp s GLY 605 N -1.83 1.47 0.35 7.41 0.00 -1.23 -1.33 107.32 112.17 3dyp s GLY 605 Ca 0.16 -0.57 0.18 0.00 0.00 0.00 0.00 44.72 44.49 3dyp s GLY 605 CO -0.01 -0.42 1.66 1.41 0.00 0.00 0.00 173.10 175.74 3dyp h LEU 606 N 0.30 0.00 -8.87 0.66 3.38 0.22 -3.43 115.31 107.57 3dyp h LEU 606 Ca -0.47 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 56.93 3dyp h LEU 606 Cb 1.21 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.77 3dyp h LEU 606 CO 0.62 0.40 -0.80 0.68 0.09 0.00 0.00 178.44 179.43 3dyp s VAL 607 N -3.42 1.97 0.89 1.22 -7.23 -0.57 -0.81 120.40 112.45 3dyp s VAL 607 Ca 0.01 -1.92 -0.12 0.00 -1.81 0.00 0.00 61.98 58.15 3dyp s VAL 607 Cb 0.10 -1.90 0.12 0.00 0.56 0.00 0.00 36.38 35.26 3dyp s VAL 607 CO 0.70 -0.23 1.10 -0.36 -0.31 0.00 0.00 175.10 175.99 3dyp s PHE 608 N -1.85 2.41 0.43 2.82 0.40 -0.01 -1.53 117.98 120.64 3dyp s PHE 608 Ca 0.16 1.17 0.19 0.00 -0.60 0.00 0.00 56.93 57.86 3dyp s PHE 608 Cb -0.07 -3.18 1.14 0.00 0.51 0.00 0.00 43.02 41.42 3dyp s PHE 608 CO 0.07 -2.33 1.85 0.00 0.70 0.00 0.00 175.22 175.52 3dyp h ALA 609 N -1.49 2.29 -0.24 5.36 0.00 -1.89 0.23 119.26 123.52 3dyp h ALA 609 Ca -0.50 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3dyp h ALA 609 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3dyp h ALA 609 CO 0.56 -0.58 0.00 -0.40 0.00 0.00 0.00 179.25 178.83 3dyp n ASP 610 N -4.49 1.65 0.00 0.00 5.68 -1.26 -4.47 116.55 113.66 3dyp n ASP 610 Ca 0.20 -2.08 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 3dyp n ASP 610 Cb 0.74 -0.26 0.00 0.00 -1.14 0.00 0.00 41.12 40.46 3dyp n ASP 610 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3dyp n ARG 611 N 0.23 0.00 -2.23 0.11 3.00 0.79 -5.03 116.66 113.54 3dyp n ARG 611 Ca 0.09 0.00 -0.41 0.00 -0.01 0.00 0.00 57.85 57.52 3dyp n ARG 611 Cb 0.30 -1.74 -0.03 0.00 0.00 0.00 0.00 32.46 30.99 3dyp n ARG 611 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 3dyp s THR 612 N -3.33 3.03 0.53 0.55 2.01 -1.26 -4.76 115.64 112.41 3dyp s THR 612 Ca 0.00 0.98 -0.18 0.00 0.31 0.00 0.00 61.69 62.80 3dyp s THR 612 Cb 0.00 -3.62 -0.07 0.00 0.01 0.00 0.00 72.50 68.82 3dyp s THR 612 CO 0.00 0.21 1.04 -2.84 -0.69 0.00 0.00 174.62 172.34 3dyp s PRO 613 N -1.23 3.63 0.53 4.92 0.02 -1.26 -0.83 135.00 140.77 3dyp s PRO 613 Ca 0.50 1.25 -0.05 0.00 0.02 0.00 0.00 61.00 62.72 3dyp s PRO 613 Cb -0.37 -2.08 -0.01 0.00 0.02 0.00 0.00 34.50 32.06 3dyp s PRO 613 CO 0.46 -0.56 0.83 -1.01 -0.33 0.00 0.00 177.00 176.39 3dyp s HIS 614 N -2.23 3.40 0.53 6.54 3.76 0.01 -4.78 115.29 122.52 3dyp s HIS 614 Ca 0.65 0.70 0.21 0.00 -0.15 0.00 0.00 55.06 56.46 3dyp s HIS 614 Cb -0.15 -2.50 1.44 0.00 1.11 0.00 0.00 32.58 32.48 3dyp s HIS 614 CO 0.28 -0.53 2.17 -1.35 -0.85 0.00 0.00 174.74 174.45 3dyp h PRO 615 N 0.06 0.00 -0.01 8.40 0.11 -1.93 -2.31 132.00 136.32 3dyp h PRO 615 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3dyp h PRO 615 Cb 1.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 3dyp h PRO 615 CO 0.61 0.02 0.00 0.00 -0.21 0.00 0.00 178.00 178.43 3dyp h ALA 616 N 1.98 1.78 -0.87 -0.75 0.00 -1.85 -2.49 119.26 117.06 3dyp h ALA 616 Ca -0.00 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.99 3dyp h ALA 616 Cb 0.04 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 3dyp h ALA 616 CO 0.00 -0.01 0.56 1.25 0.00 0.00 0.00 179.25 181.06 3dyp h LEU 617 N 0.00 0.82 -1.03 0.00 5.85 -1.59 -0.54 115.31 118.81 3dyp h LEU 617 Ca 0.00 0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.63 3dyp h LEU 617 Cb 0.01 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 3dyp h LEU 617 CO -0.00 0.51 -0.44 0.00 -0.34 0.00 0.00 178.44 178.17 3dyp h THR 618 N 0.92 1.32 -0.68 1.05 1.03 -1.65 0.12 112.91 115.01 3dyp h THR 618 Ca 0.38 -1.54 -0.08 0.00 -0.01 0.00 0.00 66.41 65.17 3dyp h THR 618 Cb 0.30 1.77 -0.03 0.00 -1.07 0.00 0.00 68.15 69.12 3dyp h THR 618 CO -0.15 0.45 0.12 -0.08 -0.01 0.00 0.00 175.52 175.85 3dyp h GLU 619 N 0.09 1.12 -0.11 0.00 4.57 -1.23 -1.63 114.58 117.38 3dyp h GLU 619 Ca 0.01 -0.29 -0.01 0.00 -1.18 0.00 0.00 59.36 57.88 3dyp h GLU 619 Cb 0.81 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 29.26 3dyp h GLU 619 CO 0.06 1.01 0.04 0.00 -1.18 0.00 0.00 179.01 178.95 3dyp h ALA 620 N 1.06 0.15 -0.60 2.92 0.00 -0.54 -1.57 119.26 120.68 3dyp h ALA 620 Ca 0.21 -0.10 0.11 0.00 0.00 0.00 0.00 54.91 55.12 3dyp h ALA 620 Cb 0.43 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.10 3dyp h ALA 620 CO 0.01 -0.26 0.16 -0.22 0.00 0.00 0.00 179.25 178.94 3dyp h LYS 621 N 0.02 0.29 -0.18 0.00 3.64 -0.54 -0.79 116.57 119.01 3dyp h LYS 621 Ca 0.04 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 3dyp h LYS 621 Cb 0.18 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 3dyp h LYS 621 CO -0.00 0.19 0.03 1.25 -2.27 0.00 0.00 179.45 178.65 3dyp h HIS 622 N 0.30 0.32 0.00 1.91 2.76 -1.14 -2.95 115.15 116.35 3dyp h HIS 622 Ca 0.31 -0.05 -0.04 0.00 -2.20 0.00 0.00 60.37 58.40 3dyp h HIS 622 Cb 0.45 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.31 3dyp h HIS 622 CO -0.22 0.46 -0.20 1.96 -1.30 0.00 0.00 177.93 178.63 3dyp h GLN 623 N 0.09 0.00 -0.60 5.26 1.08 -1.01 -2.64 115.11 117.30 3dyp h GLN 623 Ca 0.06 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 3dyp h GLN 623 Cb 0.31 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.74 3dyp h GLN 623 CO 0.00 0.20 0.00 1.04 -0.95 0.00 0.00 178.83 179.12 3dyp n GLN 624 N -3.60 2.79 -1.34 1.46 6.02 -0.33 -4.96 117.38 117.42 3dyp n GLN 624 Ca -0.01 -1.90 -0.36 0.00 -0.01 0.00 0.00 57.00 54.72 3dyp n GLN 624 Cb 0.34 -1.67 0.08 0.00 1.02 0.00 0.00 30.24 30.01 3dyp n GLN 624 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3dyp n GLN 625 N 0.69 0.47 0.00 -1.09 6.02 -1.00 -4.87 117.38 117.60 3dyp n GLN 625 Ca 0.17 0.21 0.12 0.00 -0.01 0.00 0.00 57.00 57.49 3dyp n GLN 625 Cb 0.62 -2.12 0.07 0.00 1.02 0.00 0.00 30.24 29.83 3dyp n GLN 625 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3dyp n PHE 626 N -2.44 0.00 -4.77 1.08 3.01 -1.26 -4.88 117.46 108.19 3dyp n PHE 626 Ca 0.12 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.33 3dyp n PHE 626 Cb 0.49 -0.00 -0.16 0.00 -0.01 0.00 0.00 39.48 39.80 3dyp n PHE 626 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 3dyp s PHE 627 N -2.14 1.67 0.06 1.38 0.40 -1.26 0.19 117.98 118.28 3dyp s PHE 627 Ca 0.25 -0.53 0.04 0.00 -0.60 0.00 0.00 56.93 56.09 3dyp s PHE 627 Cb 0.19 -1.15 -0.04 0.00 0.51 0.00 0.00 43.02 42.54 3dyp s PHE 627 CO 0.38 -0.21 -0.04 -0.65 0.70 0.00 0.00 175.22 175.40 3dyp s GLN 628 N 0.24 2.49 0.09 0.44 -1.52 -0.21 -4.94 119.66 116.24 3dyp s GLN 628 Ca -0.08 -0.82 0.05 0.00 -1.95 0.00 0.00 55.36 52.56 3dyp s GLN 628 Cb -0.13 -2.50 -0.03 0.00 -0.22 0.00 0.00 33.01 30.13 3dyp s GLN 628 CO 0.03 0.56 -0.13 -0.06 -0.25 0.00 0.00 175.29 175.44 3dyp s PHE 629 N -1.18 1.18 0.03 0.91 0.40 -1.26 -0.34 117.98 117.72 3dyp s PHE 629 Ca 0.22 -0.54 0.00 0.00 -0.60 0.00 0.00 56.93 56.01 3dyp s PHE 629 Cb -0.11 -0.65 -0.02 0.00 0.51 0.00 0.00 43.02 42.75 3dyp s PHE 629 CO 0.14 0.05 -0.04 1.03 0.70 0.00 0.00 175.22 177.10 3dyp s ARG 630 N -2.25 0.40 -0.07 0.44 0.52 0.58 -4.96 118.95 113.62 3dyp s ARG 630 Ca 0.02 -0.74 0.05 0.00 -0.52 0.00 0.00 55.73 54.55 3dyp s ARG 630 Cb -0.07 0.05 -0.01 0.00 0.52 0.00 0.00 34.95 35.44 3dyp s ARG 630 CO 0.02 -0.04 -0.24 -1.17 0.02 0.00 0.00 175.30 173.89 3dyp s LEU 631 N -1.72 2.05 -0.25 2.53 2.96 -1.26 -0.76 118.68 122.23 3dyp s LEU 631 Ca -0.11 -0.51 -0.02 0.00 -0.22 0.00 0.00 54.13 53.27 3dyp s LEU 631 Cb -0.07 -1.34 0.11 0.00 0.50 0.00 0.00 46.19 45.39 3dyp s LEU 631 CO -0.02 0.21 0.24 -0.55 -1.32 0.00 0.00 176.35 174.92 3dyp s SER 632 N -0.02 1.83 1.73 3.68 0.15 0.55 -4.99 113.70 116.62 3dyp s SER 632 Ca -0.07 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 55.96 3dyp s SER 632 Cb -0.15 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.50 3dyp s SER 632 CO 0.05 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.73 3dyp n GLY 633 N 5.31 1.76 0.75 9.45 0.00 -1.26 0.14 105.19 121.34 3dyp n GLY 633 Ca -0.04 0.19 0.12 0.00 0.00 0.00 0.00 46.02 46.29 3dyp n GLY 633 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3dyp n GLN 634 N 1.98 1.94 -3.54 1.61 -0.06 -1.26 -4.88 117.38 113.17 3dyp n GLN 634 Ca 0.00 -1.51 -0.37 0.00 -2.00 0.00 0.00 57.00 53.12 3dyp n GLN 634 Cb 0.00 -1.47 -0.09 0.00 -4.06 0.00 0.00 30.24 24.63 3dyp n GLN 634 CO 0.00 0.00 0.00 0.99 -0.20 0.00 0.00 177.06 177.85 3dyp s THR 635 N -2.10 5.29 -0.18 1.69 2.01 0.38 0.11 115.64 122.84 3dyp s THR 635 Ca 0.28 0.41 -0.04 0.00 0.31 0.00 0.00 61.69 62.66 3dyp s THR 635 Cb 0.20 -3.60 -0.02 0.00 0.01 0.00 0.00 72.50 69.09 3dyp s THR 635 CO 0.36 0.31 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.93 3dyp s ILE 636 N 1.14 3.73 -0.21 1.82 1.01 -0.50 0.20 121.20 128.39 3dyp s ILE 636 Ca 0.13 -0.40 -0.04 0.00 0.00 0.00 0.00 60.65 60.33 3dyp s ILE 636 Cb -0.14 -2.66 -0.01 0.00 0.01 0.00 0.00 42.46 39.66 3dyp s ILE 636 CO 0.06 0.46 -0.03 -0.70 0.00 0.00 0.00 174.94 174.73 3dyp s GLU 637 N 0.77 3.46 -0.18 2.79 2.12 0.06 -0.69 118.70 127.02 3dyp s GLU 637 Ca -0.01 -0.59 -0.07 0.00 0.36 0.00 0.00 54.97 54.66 3dyp s GLU 637 Cb -0.14 -3.04 -0.04 0.00 0.26 0.00 0.00 34.13 31.17 3dyp s GLU 637 CO 0.02 -0.13 0.04 0.08 -0.54 0.00 0.00 175.26 174.74 3dyp s VAL 638 N 1.32 4.56 -0.05 3.70 1.01 -0.51 -0.31 120.40 130.13 3dyp s VAL 638 Ca 0.04 -0.11 0.06 0.00 0.00 0.00 0.00 61.98 61.97 3dyp s VAL 638 Cb -0.14 -3.05 -0.01 0.00 0.00 0.00 0.00 36.38 33.17 3dyp s VAL 638 CO -0.01 0.45 -0.25 -0.89 0.00 0.00 0.00 175.10 174.40 3dyp s THR 639 N 0.52 2.09 -0.04 3.92 2.01 0.54 -1.24 115.64 123.44 3dyp s THR 639 Ca 0.02 -1.07 -0.18 0.00 0.31 0.00 0.00 61.69 60.77 3dyp s THR 639 Cb -0.13 -1.75 -0.05 0.00 0.01 0.00 0.00 72.50 70.58 3dyp s THR 639 CO 0.01 0.57 0.50 -0.55 -0.69 0.00 0.00 174.62 174.47 3dyp s SER 640 N -0.29 6.84 0.00 3.53 0.15 -0.42 -1.05 113.70 122.45 3dyp s SER 640 Ca 0.00 0.99 0.23 0.00 0.70 0.00 0.00 55.95 57.88 3dyp s SER 640 Cb -0.13 -2.31 0.34 0.00 -1.71 0.00 0.00 66.02 62.21 3dyp s SER 640 CO 0.02 0.13 1.34 -0.62 1.20 0.00 0.00 173.24 175.32 3dyp n GLU 641 N 2.77 2.42 -2.04 5.44 1.02 0.51 -2.41 120.64 128.35 3dyp n GLU 641 Ca -0.09 -2.15 -0.39 0.00 -0.02 0.00 0.00 57.16 54.51 3dyp n GLU 641 Cb 0.51 -1.49 0.01 0.00 -0.02 0.00 0.00 31.44 30.45 3dyp n GLU 641 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3dyp s TYR 642 N -1.64 2.70 -0.12 -0.32 1.51 -1.25 -4.78 117.35 113.44 3dyp s TYR 642 Ca 0.35 1.43 0.19 0.00 -1.01 0.00 0.00 57.07 58.02 3dyp s TYR 642 Cb 0.22 -3.63 -0.22 0.00 -0.11 0.00 0.00 41.96 38.22 3dyp s TYR 642 CO 0.31 -2.14 0.52 1.28 -1.11 0.00 0.00 175.55 174.40 3dyp n LEU 643 N -0.32 0.37 0.00 -1.29 4.77 -1.26 -1.74 117.00 117.53 3dyp n LEU 643 Ca 0.06 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 3dyp n LEU 643 Cb 0.45 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 3dyp n LEU 643 CO 0.53 0.19 -0.34 0.49 -1.33 0.00 0.00 177.39 176.93 3dyp n PHE 644 N -2.66 0.00 -3.41 -1.77 0.99 -1.26 -4.83 117.46 104.52 3dyp n PHE 644 Ca -0.15 0.00 -0.29 0.00 -0.00 0.00 0.00 57.45 57.01 3dyp n PHE 644 Cb 0.85 0.05 -0.04 0.00 -1.00 0.00 0.00 39.48 39.34 3dyp n PHE 644 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.76 175.78 3dyp s ARG 645 N -1.78 3.65 0.53 -1.08 1.70 -1.26 -4.73 118.95 115.97 3dyp s ARG 645 Ca 0.00 0.01 -0.09 0.00 -0.47 0.00 0.00 55.73 55.18 3dyp s ARG 645 Cb 0.00 -2.68 -0.04 0.00 -0.57 0.00 0.00 34.95 31.66 3dyp s ARG 645 CO 0.00 0.27 0.89 -1.01 -1.08 0.00 0.00 175.30 174.37 3dyp s HIS 646 N -1.99 3.57 -1.40 5.89 3.76 -1.26 -3.42 115.29 120.45 3dyp s HIS 646 Ca 0.44 1.05 -0.15 0.00 -0.15 0.00 0.00 55.06 56.25 3dyp s HIS 646 Cb -0.11 -2.50 0.01 0.00 1.11 0.00 0.00 32.58 31.09 3dyp s HIS 646 CO 0.28 -0.42 2.23 -1.13 -0.85 0.00 0.00 174.74 174.85 3dyp n SER 647 N -2.31 3.98 -0.81 1.40 3.41 -0.43 -4.64 113.62 114.21 3dyp n SER 647 Ca 0.03 -2.81 0.04 0.00 -0.26 0.00 0.00 58.87 55.87 3dyp n SER 647 Cb 0.55 -1.60 0.16 0.00 -0.26 0.00 0.00 64.21 63.05 3dyp n SER 647 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3dyp n ASP 648 N 6.10 2.29 -2.71 4.04 5.68 -1.26 -3.82 116.55 126.88 3dyp n ASP 648 Ca 0.53 -2.18 -0.08 0.00 -0.50 0.00 0.00 54.79 52.56 3dyp n ASP 648 Cb 0.38 -0.38 0.08 0.00 -1.14 0.00 0.00 41.12 40.06 3dyp n ASP 648 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 3dyp n ASN 649 N 0.36 -0.52 -3.75 -1.12 5.15 -1.26 -5.05 115.26 109.07 3dyp n ASN 649 Ca 0.11 -2.65 -0.13 0.00 -0.60 0.00 0.00 54.58 51.31 3dyp n ASN 649 Cb 0.44 0.40 -0.10 0.00 -0.53 0.00 0.00 39.78 39.99 3dyp n ASN 649 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3dyp s GLU 650 N -1.20 0.53 0.01 1.20 8.01 -1.25 -4.08 118.70 121.92 3dyp s GLU 650 Ca 0.25 0.25 0.01 0.00 0.01 0.00 0.00 54.97 55.49 3dyp s GLU 650 Cb 0.42 0.25 -0.01 0.00 -4.31 0.00 0.00 34.13 30.47 3dyp s GLU 650 CO -0.04 -0.10 -0.04 -0.48 0.01 0.00 0.00 175.26 174.61 3dyp s LEU 651 N -0.38 2.10 -0.26 1.80 2.34 0.79 -2.11 118.68 122.97 3dyp s LEU 651 Ca -0.05 -0.24 -0.15 0.00 0.06 0.00 0.00 54.13 53.75 3dyp s LEU 651 Cb -0.03 -0.11 -0.04 0.00 -0.56 0.00 0.00 46.19 45.45 3dyp s LEU 651 CO 0.02 -0.08 0.38 -0.22 -1.06 0.00 0.00 176.35 175.40 3dyp s LEU 652 N -0.65 4.06 -0.15 1.48 2.96 0.49 -0.53 118.68 126.35 3dyp s LEU 652 Ca -0.04 0.34 -0.05 0.00 -0.22 0.00 0.00 54.13 54.15 3dyp s LEU 652 Cb -0.05 -2.45 -0.04 0.00 0.50 0.00 0.00 46.19 44.16 3dyp s LEU 652 CO -0.00 -0.16 0.04 -2.28 -1.32 0.00 0.00 176.35 172.62 3dyp s HIS 653 N 1.93 3.23 0.10 5.38 5.65 0.44 -1.03 115.29 130.99 3dyp s HIS 653 Ca 0.16 0.09 0.06 0.00 0.25 0.00 0.00 55.06 55.62 3dyp s HIS 653 Cb -0.16 -1.97 -0.03 0.00 -1.18 0.00 0.00 32.58 29.24 3dyp s HIS 653 CO 0.09 0.27 -0.15 1.67 -0.65 0.00 0.00 174.74 175.97 3dyp s TRP 654 N -0.12 1.40 -0.18 3.88 1.48 -0.21 -0.63 118.94 124.57 3dyp s TRP 654 Ca 0.06 -0.49 -0.12 0.00 -1.06 0.00 0.00 56.10 54.49 3dyp s TRP 654 Cb -0.12 -0.76 0.06 0.00 -1.16 0.00 0.00 33.47 31.48 3dyp s TRP 654 CO 0.01 0.12 0.46 1.41 -4.06 0.00 0.00 176.95 174.90 3dyp s MET 655 N -2.14 0.48 -0.14 3.25 -2.45 -0.32 -1.14 119.30 116.84 3dyp s MET 655 Ca 0.04 0.78 -0.01 0.00 -1.25 0.00 0.00 55.69 55.25 3dyp s MET 655 Cb -0.08 0.10 -0.01 0.00 1.25 0.00 0.00 34.83 36.08 3dyp s MET 655 CO 0.03 -0.12 -0.12 0.08 1.05 0.00 0.00 175.02 175.94 3dyp s VAL 656 N 0.99 3.11 0.04 10.11 1.01 0.23 -1.06 120.40 134.82 3dyp s VAL 656 Ca -0.06 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.32 3dyp s VAL 656 Cb -0.06 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 3dyp s VAL 656 CO -0.08 0.51 -0.10 0.00 0.00 0.00 0.00 175.10 175.42 3dyp s ALA 657 N 0.48 0.83 -0.36 5.51 0.00 -0.63 -0.56 121.76 127.04 3dyp s ALA 657 Ca -0.09 -0.74 -0.10 0.00 0.00 0.00 0.00 51.96 51.03 3dyp s ALA 657 Cb -0.16 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 22.91 3dyp s ALA 657 CO 0.04 0.10 0.19 -1.17 0.00 0.00 0.00 175.76 174.92 3dyp s LEU 658 N -1.24 4.56 -1.42 0.00 2.96 0.38 -1.27 118.68 122.65 3dyp s LEU 658 Ca -0.03 -0.92 -0.02 0.00 -0.22 0.00 0.00 54.13 52.94 3dyp s LEU 658 Cb -0.08 -2.00 0.01 0.00 0.50 0.00 0.00 46.19 44.62 3dyp s LEU 658 CO 0.01 -0.34 0.49 0.47 -1.32 0.00 0.00 176.35 175.66 3dyp n ASP 659 N 4.97 -0.76 0.00 3.68 8.00 -0.98 -0.40 116.55 131.07 3dyp n ASP 659 Ca -0.12 -0.98 0.00 0.00 0.71 0.00 0.00 54.79 54.40 3dyp n ASP 659 Cb 0.46 -3.18 0.00 0.00 -0.02 0.00 0.00 41.12 38.39 3dyp n ASP 659 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dyp n GLY 660 N -1.89 3.15 3.62 0.44 0.00 -1.26 -4.88 105.19 104.37 3dyp n GLY 660 Ca -0.27 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 3dyp n GLY 660 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dyp s LYS 661 N -0.36 4.06 0.22 1.61 1.02 0.47 -4.67 119.74 122.09 3dyp s LYS 661 Ca 0.00 0.15 -0.32 0.00 0.02 0.00 0.00 55.97 55.82 3dyp s LYS 661 Cb 0.00 -3.64 -0.12 0.00 -0.52 0.00 0.00 37.83 33.55 3dyp s LYS 661 CO 0.00 -0.27 1.71 -2.30 -0.92 0.00 0.00 175.35 173.57 3dyp n PRO 662 N 5.28 2.75 -0.04 -1.68 -0.02 -1.26 0.14 135.00 140.17 3dyp n PRO 662 Ca -0.07 0.99 -0.05 0.00 -2.02 0.00 0.00 63.50 62.35 3dyp n PRO 662 Cb 0.50 -2.83 -0.04 0.00 -0.02 0.00 0.00 33.50 31.12 3dyp n PRO 662 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3dyp n LEU 663 N 3.76 2.39 -3.57 2.45 -0.00 0.28 -4.85 117.00 117.47 3dyp n LEU 663 Ca 0.15 -0.04 -0.06 0.00 -0.00 0.00 0.00 56.01 56.07 3dyp n LEU 663 Cb 0.35 -0.20 -0.02 0.00 -0.00 0.00 0.00 43.42 43.55 3dyp n LEU 663 CO 0.64 0.54 0.90 0.00 -0.00 0.00 0.00 177.39 179.48 3dyp s ALA 664 N -2.16 -1.99 0.19 1.96 0.00 -0.98 -5.00 121.76 113.78 3dyp s ALA 664 Ca -0.09 1.43 -0.23 0.00 0.00 0.00 0.00 51.96 53.06 3dyp s ALA 664 Cb 0.03 -0.01 0.07 0.00 0.00 0.00 0.00 23.12 23.21 3dyp s ALA 664 CO 0.20 -0.60 0.97 -1.54 0.00 0.00 0.00 175.76 174.79 3dyp s SER 665 N -2.20 -0.09 0.03 0.00 1.04 -1.26 0.75 113.70 111.97 3dyp s SER 665 Ca 0.08 -0.59 -0.19 0.00 0.48 0.00 0.00 55.95 55.72 3dyp s SER 665 Cb -0.01 0.53 0.06 0.00 0.10 0.00 0.00 66.02 66.71 3dyp s SER 665 CO -0.06 -1.03 0.88 0.61 0.98 0.00 0.00 173.24 174.62 3dyp n GLY 666 N -0.57 0.46 3.04 7.32 0.00 -0.29 -4.96 105.19 110.20 3dyp n GLY 666 Ca -0.05 -1.02 -0.11 0.00 0.00 0.00 0.00 46.02 44.85 3dyp n GLY 666 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3dyp s GLU 667 N -2.02 0.36 -0.02 1.61 -1.05 -1.26 -1.04 118.70 115.29 3dyp s GLU 667 Ca 0.20 -0.37 0.01 0.00 -0.15 0.00 0.00 54.97 54.66 3dyp s GLU 667 Cb -0.01 0.15 0.02 0.00 -0.44 0.00 0.00 34.13 33.84 3dyp s GLU 667 CO 0.01 -0.08 -0.01 0.08 0.95 0.00 0.00 175.26 176.21 3dyp s VAL 668 N -1.16 0.22 0.36 1.83 1.01 -0.19 -5.00 120.40 117.47 3dyp s VAL 668 Ca -0.13 -0.01 -0.26 0.00 0.00 0.00 0.00 61.98 61.58 3dyp s VAL 668 Cb -0.07 -0.26 -0.09 0.00 0.00 0.00 0.00 36.38 35.96 3dyp s VAL 668 CO 0.00 0.12 1.14 -2.16 0.00 0.00 0.00 175.10 174.20 3dyp s PRO 669 N 0.59 4.25 -0.09 2.72 0.04 -1.26 -0.38 135.00 140.87 3dyp s PRO 669 Ca -0.06 1.79 -0.16 0.00 0.04 0.00 0.00 61.00 62.61 3dyp s PRO 669 Cb -0.09 -2.81 -0.05 0.00 0.04 0.00 0.00 34.50 31.59 3dyp s PRO 669 CO -0.01 -0.14 0.40 -0.51 0.04 0.00 0.00 177.00 176.78 3dyp s LEU 670 N -2.21 4.34 -0.41 -3.56 1.43 -0.90 -4.77 118.68 112.62 3dyp s LEU 670 Ca 0.53 0.79 0.06 0.00 -1.03 0.00 0.00 54.13 54.47 3dyp s LEU 670 Cb -0.30 -2.56 0.20 0.00 0.03 0.00 0.00 46.19 43.56 3dyp s LEU 670 CO 0.38 0.15 0.42 -0.67 0.23 0.00 0.00 176.35 176.86 3dyp n ASP 671 N 2.95 -0.41 -4.34 2.29 2.03 -1.26 -4.73 116.55 113.08 3dyp n ASP 671 Ca -0.11 -2.52 -0.32 0.00 0.52 0.00 0.00 54.79 52.36 3dyp n ASP 671 Cb 0.52 -0.46 -0.15 0.00 -0.72 0.00 0.00 41.12 40.31 3dyp n ASP 671 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3dyp s VAL 672 N -0.33 2.66 0.67 5.18 1.01 -1.26 -4.91 120.40 123.42 3dyp s VAL 672 Ca 0.34 -0.83 -0.13 0.00 0.00 0.00 0.00 61.98 61.36 3dyp s VAL 672 Cb 0.09 -2.05 0.00 0.00 0.00 0.00 0.00 36.38 34.41 3dyp s VAL 672 CO -0.17 0.55 1.08 0.00 0.00 0.00 0.00 175.10 176.56 3dyp s ALA 673 N 0.02 2.58 0.14 5.51 0.00 -1.26 -1.32 121.76 127.42 3dyp s ALA 673 Ca -0.06 0.32 -0.35 0.00 0.00 0.00 0.00 51.96 51.87 3dyp s ALA 673 Cb -0.15 -3.24 -0.15 0.00 0.00 0.00 0.00 23.12 19.58 3dyp s ALA 673 CO 0.05 -1.19 1.38 -0.35 0.00 0.00 0.00 175.76 175.64 3dyp n PRO 674 N -2.68 1.50 -0.67 0.00 -0.04 -1.22 0.43 135.00 132.32 3dyp n PRO 674 Ca 0.09 0.54 0.00 0.00 -0.04 0.00 0.00 63.50 64.09 3dyp n PRO 674 Cb 0.53 -2.19 0.00 0.00 -0.04 0.00 0.00 33.50 31.80 3dyp n PRO 674 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3dyp n GLN 675 N 2.57 0.00 -1.46 0.54 1.13 -0.71 -4.93 117.38 114.51 3dyp n GLN 675 Ca 0.17 0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 55.09 3dyp n GLN 675 Cb 0.24 -3.66 0.08 0.00 0.11 0.00 0.00 30.24 27.00 3dyp n GLN 675 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dyp n GLY 676 N -2.00 0.05 3.23 1.08 0.00 0.17 -4.71 105.19 103.02 3dyp n GLY 676 Ca 0.00 -1.90 -0.17 0.00 0.00 0.00 0.00 46.02 43.95 3dyp n GLY 676 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dyp s LYS 677 N -4.08 0.99 -0.03 1.61 1.02 -1.26 -1.31 119.74 116.68 3dyp s LYS 677 Ca 0.37 -1.24 0.01 0.00 0.02 0.00 0.00 55.97 55.14 3dyp s LYS 677 Cb -0.02 -0.82 0.02 0.00 -0.52 0.00 0.00 37.83 36.49 3dyp s LYS 677 CO 0.25 0.15 -0.03 -1.14 -0.92 0.00 0.00 175.35 173.66 3dyp s GLN 678 N -2.75 0.61 -0.13 1.68 0.74 -0.37 -4.87 119.66 114.58 3dyp s GLN 678 Ca 0.09 -0.05 -0.09 0.00 0.05 0.00 0.00 55.36 55.35 3dyp s GLN 678 Cb -0.04 -0.67 -0.04 0.00 1.10 0.00 0.00 33.01 33.35 3dyp s GLN 678 CO 0.02 -0.08 0.18 -0.51 -0.55 0.00 0.00 175.29 174.36 3dyp s LEU 679 N 0.85 4.35 -0.15 3.68 1.43 -1.26 -1.42 118.68 126.15 3dyp s LEU 679 Ca -0.10 0.48 0.00 0.00 -1.03 0.00 0.00 54.13 53.48 3dyp s LEU 679 Cb -0.13 -2.16 0.03 0.00 0.03 0.00 0.00 46.19 43.95 3dyp s LEU 679 CO -0.00 0.32 -0.11 -0.63 0.23 0.00 0.00 176.35 176.16 3dyp s ILE 680 N -0.60 1.40 -0.20 -0.59 1.01 0.13 -4.99 121.20 117.36 3dyp s ILE 680 Ca 0.15 -0.61 -0.20 0.00 0.00 0.00 0.00 60.65 59.99 3dyp s ILE 680 Cb -0.12 -1.39 -0.03 0.00 0.01 0.00 0.00 42.46 40.93 3dyp s ILE 680 CO 0.04 0.35 0.57 -0.70 0.00 0.00 0.00 174.94 175.20 3dyp s GLU 681 N 1.54 4.20 0.45 2.79 2.56 -1.26 -1.41 118.70 127.58 3dyp s GLU 681 Ca 0.03 0.51 -0.21 0.00 0.00 0.00 0.00 54.97 55.31 3dyp s GLU 681 Cb -0.14 -3.57 -0.10 0.00 2.00 0.00 0.00 34.13 32.33 3dyp s GLU 681 CO -0.09 -0.19 0.98 -0.51 -0.56 0.00 0.00 175.26 174.89 3dyp s LEU 682 N 1.74 3.90 0.84 2.70 1.43 0.29 -5.00 118.68 124.59 3dyp s LEU 682 Ca 0.26 1.77 -0.12 0.00 -1.03 0.00 0.00 54.13 55.02 3dyp s LEU 682 Cb -0.16 -4.55 0.10 0.00 0.03 0.00 0.00 46.19 41.62 3dyp s LEU 682 CO 0.10 -0.52 1.11 -2.16 0.23 0.00 0.00 176.35 175.11 3dyp s PRO 683 N -3.22 1.69 0.03 1.29 0.04 -1.26 -4.87 135.00 128.70 3dyp s PRO 683 Ca 0.64 0.58 -0.36 0.00 0.04 0.00 0.00 61.00 61.90 3dyp s PRO 683 Cb -0.12 -1.88 -0.15 0.00 0.04 0.00 0.00 34.50 32.40 3dyp s PRO 683 CO 0.16 -1.88 1.59 -1.91 0.04 0.00 0.00 177.00 175.00 3dyp n GLU 684 N -3.60 1.73 -3.05 4.56 2.13 -1.26 -4.89 120.64 116.27 3dyp n GLU 684 Ca 0.07 0.63 -0.44 0.00 0.66 0.00 0.00 57.16 58.08 3dyp n GLU 684 Cb 0.57 -2.36 -0.05 0.00 0.27 0.00 0.00 31.44 29.87 3dyp n GLU 684 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3dyp s LEU 685 N 1.72 4.87 0.23 4.31 1.43 -1.26 -5.00 118.68 124.98 3dyp s LEU 685 Ca 0.86 -1.01 -0.30 0.00 -1.03 0.00 0.00 54.13 52.64 3dyp s LEU 685 Cb -0.81 -2.45 -0.15 0.00 0.03 0.00 0.00 46.19 42.81 3dyp s LEU 685 CO 0.47 -1.11 1.06 -0.81 0.23 0.00 0.00 176.35 176.19 3dyp n PRO 686 N 6.68 1.23 -0.74 1.29 -0.04 -1.26 -4.88 135.00 137.27 3dyp n PRO 686 Ca -0.06 0.43 -0.32 0.00 -0.04 0.00 0.00 63.50 63.51 3dyp n PRO 686 Cb 0.45 -1.85 0.14 0.00 -0.04 0.00 0.00 33.50 32.20 3dyp n PRO 686 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3dyp n GLN 687 N 1.22 -0.54 -4.63 0.54 1.13 -1.26 -4.98 117.38 108.86 3dyp n GLN 687 Ca 0.12 -0.11 -0.33 0.00 -1.94 0.00 0.00 57.00 54.74 3dyp n GLN 687 Cb 0.28 -1.97 -0.12 0.00 0.11 0.00 0.00 30.24 28.55 3dyp n GLN 687 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 3dyp s PRO 688 N -3.88 2.55 -1.15 -1.09 0.04 -1.26 -5.04 135.00 125.17 3dyp s PRO 688 Ca 0.59 -0.69 -0.07 0.00 0.04 0.00 0.00 61.00 60.87 3dyp s PRO 688 Cb -0.21 -2.47 0.25 0.00 0.04 0.00 0.00 34.50 32.12 3dyp s PRO 688 CO 0.65 0.62 1.53 0.39 0.04 0.00 0.00 177.00 180.23 3dyp n GLU 689 N 1.94 4.00 0.00 4.56 -0.58 -1.26 -4.91 120.64 124.39 3dyp n GLU 689 Ca -0.17 -4.20 0.00 0.00 -0.42 0.00 0.00 57.16 52.38 3dyp n GLU 689 Cb 0.53 -2.68 0.00 0.00 -0.57 0.00 0.00 31.44 28.72 3dyp n GLU 689 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 3dyp n SER 690 N 2.62 0.00 -4.73 1.62 3.41 -1.26 -5.14 113.62 110.13 3dyp n SER 690 Ca 0.30 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.60 3dyp n SER 690 Cb 0.36 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.42 3dyp n SER 690 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyp s ALA 691 N -2.00 1.97 0.00 7.33 0.00 -1.26 -4.81 121.76 122.99 3dyp s ALA 691 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.39 3dyp s ALA 691 Cb 0.00 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.77 3dyp s ALA 691 CO 0.00 -2.12 0.00 0.41 0.00 0.00 0.00 175.76 174.05 3dyp n GLY 692 N -0.59 2.85 3.55 0.00 0.00 -0.19 -4.94 105.19 105.89 3dyp n GLY 692 Ca 0.10 -1.78 -0.35 0.00 0.00 0.00 0.00 46.02 43.99 3dyp n GLY 692 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dyp s GLN 693 N -1.84 3.84 0.12 1.61 2.00 -1.26 -0.15 119.66 123.97 3dyp s GLN 693 Ca 0.00 -0.40 -0.21 0.00 -2.00 0.00 0.00 55.36 52.75 3dyp s GLN 693 Cb 0.00 -3.26 -0.07 0.00 0.80 0.00 0.00 33.01 30.48 3dyp s GLN 693 CO 0.00 0.08 0.64 -0.51 -0.50 0.00 0.00 175.29 175.00 3dyp s LEU 694 N 0.90 4.51 -0.03 3.68 1.43 0.02 -2.33 118.68 126.87 3dyp s LEU 694 Ca 0.04 1.37 0.04 0.00 -1.03 0.00 0.00 54.13 54.55 3dyp s LEU 694 Cb -0.14 -3.10 -0.00 0.00 0.03 0.00 0.00 46.19 42.98 3dyp s LEU 694 CO 0.03 0.22 -0.16 0.26 0.23 0.00 0.00 176.35 176.93 3dyp s TRP 695 N -1.19 1.54 -0.20 0.29 0.52 -0.39 0.31 118.94 119.82 3dyp s TRP 695 Ca 0.33 -0.40 -0.07 0.00 0.02 0.00 0.00 56.10 55.97 3dyp s TRP 695 Cb -0.20 -1.03 -0.04 0.00 -1.15 0.00 0.00 33.47 31.05 3dyp s TRP 695 CO 0.21 -0.12 0.06 -1.17 0.02 0.00 0.00 176.95 175.95 3dyp s LEU 696 N -0.03 3.69 -0.03 2.99 2.96 -0.07 -1.60 118.68 126.59 3dyp s LEU 696 Ca -0.01 -0.01 0.06 0.00 -0.22 0.00 0.00 54.13 53.95 3dyp s LEU 696 Cb -0.10 -1.94 -0.01 0.00 0.50 0.00 0.00 46.19 44.64 3dyp s LEU 696 CO 0.01 0.12 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.05 3dyp s THR 697 N 0.69 1.76 0.08 3.68 2.01 -0.23 -0.89 115.64 122.75 3dyp s THR 697 Ca 0.03 -0.93 0.07 0.00 0.31 0.00 0.00 61.69 61.17 3dyp s THR 697 Cb -0.13 -1.48 -0.03 0.00 0.01 0.00 0.00 72.50 70.87 3dyp s THR 697 CO 0.02 0.50 -0.19 0.68 -0.69 0.00 0.00 174.62 174.94 3dyp s VAL 698 N -0.33 1.52 0.02 3.82 -7.23 -0.06 -1.17 120.40 116.97 3dyp s VAL 698 Ca 0.03 -1.38 0.01 0.00 -1.81 0.00 0.00 61.98 58.83 3dyp s VAL 698 Cb -0.10 -1.38 -0.02 0.00 0.56 0.00 0.00 36.38 35.44 3dyp s VAL 698 CO 0.01 -0.04 -0.03 -0.13 -0.31 0.00 0.00 175.10 174.60 3dyp s ARG 699 N -1.66 0.30 -0.24 4.82 0.52 0.20 -1.66 118.95 121.22 3dyp s ARG 699 Ca 0.04 -0.47 -0.07 0.00 -0.52 0.00 0.00 55.73 54.71 3dyp s ARG 699 Cb -0.10 -0.04 -0.03 0.00 0.52 0.00 0.00 34.95 35.31 3dyp s ARG 699 CO 0.03 -0.01 0.05 0.08 0.02 0.00 0.00 175.30 175.47 3dyp s VAL 700 N -1.02 4.15 -0.01 3.52 1.01 0.42 -0.42 120.40 128.05 3dyp s VAL 700 Ca -0.10 -0.23 0.08 0.00 0.00 0.00 0.00 61.98 61.73 3dyp s VAL 700 Cb -0.07 -2.93 -0.02 0.00 0.00 0.00 0.00 36.38 33.36 3dyp s VAL 700 CO -0.00 0.36 -0.24 -0.69 0.00 0.00 0.00 175.10 174.53 3dyp s VAL 701 N 1.49 2.20 -0.40 2.92 1.01 0.31 -0.46 120.40 127.48 3dyp s VAL 701 Ca 0.06 -1.11 -0.14 0.00 0.00 0.00 0.00 61.98 60.79 3dyp s VAL 701 Cb -0.15 -1.79 0.02 0.00 0.00 0.00 0.00 36.38 34.46 3dyp s VAL 701 CO 0.02 0.55 0.28 -1.10 0.00 0.00 0.00 175.10 174.85 3dyp s GLN 702 N -0.73 3.03 0.38 2.72 -0.21 0.09 -0.15 119.66 124.79 3dyp s GLN 702 Ca 0.11 -0.97 0.11 0.00 0.02 0.00 0.00 55.36 54.62 3dyp s GLN 702 Cb -0.10 -3.92 0.77 0.00 1.00 0.00 0.00 33.01 30.76 3dyp s GLN 702 CO -0.00 -0.70 1.89 -1.35 -2.12 0.00 0.00 175.29 173.01 3dyp h PRO 703 N 8.59 0.15 -6.09 2.91 0.11 -1.89 0.28 132.00 136.06 3dyp h PRO 703 Ca -0.27 -0.04 -0.65 0.00 0.11 0.00 0.00 66.00 65.14 3dyp h PRO 703 Cb 1.12 -0.02 -0.10 0.00 0.11 0.00 0.00 31.00 32.12 3dyp h PRO 703 CO 0.71 0.37 -0.59 -0.80 -0.21 0.00 0.00 178.00 177.47 3dyp s ASN 704 N -6.91 5.56 0.75 -2.05 0.02 -1.26 -3.88 114.94 107.16 3dyp s ASN 704 Ca -0.05 0.07 -0.13 0.00 -1.02 0.00 0.00 52.86 51.74 3dyp s ASN 704 Cb 0.15 -1.54 0.05 0.00 0.02 0.00 0.00 41.25 39.92 3dyp s ASN 704 CO 0.73 0.23 1.13 0.00 0.02 0.00 0.00 177.10 179.21 3dyp s ALA 705 N -1.26 2.17 0.27 0.60 0.00 -1.26 -4.42 121.76 117.87 3dyp s ALA 705 Ca 0.25 0.54 0.04 0.00 0.00 0.00 0.00 51.96 52.79 3dyp s ALA 705 Cb -0.12 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.63 3dyp s ALA 705 CO 0.17 -1.78 0.13 0.25 0.00 0.00 0.00 175.76 174.53 3dyp n THR 706 N -3.09 0.00 0.32 0.00 -2.24 0.82 -4.87 114.28 105.21 3dyp n THR 706 Ca 0.11 -1.69 0.21 0.00 -2.27 0.00 0.00 64.05 60.40 3dyp n THR 706 Cb 0.52 0.68 1.03 0.00 -2.10 0.00 0.00 70.33 70.45 3dyp n THR 706 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dyp h ALA 707 N 1.56 1.00 0.00 6.98 0.00 -2.00 -3.21 119.26 123.59 3dyp h ALA 707 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3dyp h ALA 707 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3dyp h ALA 707 CO 0.32 0.00 0.00 -2.67 0.00 0.00 0.00 179.25 176.90 3dyp n TRP 708 N -3.08 0.00 -3.66 0.00 4.27 -1.26 -5.06 117.44 108.65 3dyp n TRP 708 Ca -0.02 -0.15 -0.11 0.00 -3.89 0.00 0.00 57.50 53.34 3dyp n TRP 708 Cb 0.16 -0.01 -0.05 0.00 -1.36 0.00 0.00 31.31 30.04 3dyp n TRP 708 CO 0.00 0.00 0.00 -1.54 -2.29 0.00 0.00 177.69 173.86 3dyp s SER 709 N -0.29 -0.23 0.40 -0.67 1.04 -1.21 -4.63 113.70 108.11 3dyp s SER 709 Ca 0.00 -0.23 -0.00 0.00 0.48 0.00 0.00 55.95 56.20 3dyp s SER 709 Cb 0.00 0.45 -0.02 0.00 0.10 0.00 0.00 66.02 66.54 3dyp s SER 709 CO 0.00 -0.78 0.62 -1.61 0.98 0.00 0.00 173.24 172.45 3dyp s GLU 710 N -3.34 3.34 0.34 4.02 2.02 -1.26 -0.13 118.70 123.69 3dyp s GLU 710 Ca 0.00 -0.33 -0.29 0.00 0.02 0.00 0.00 54.97 54.38 3dyp s GLU 710 Cb 0.01 -2.59 -0.12 0.00 0.10 0.00 0.00 34.13 31.53 3dyp s GLU 710 CO -0.09 -0.05 1.43 0.00 0.02 0.00 0.00 175.26 176.58 3dyp n ALA 711 N -1.95 1.92 -0.00 5.21 0.00 -1.26 -1.62 120.51 122.80 3dyp n ALA 711 Ca -0.02 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.78 3dyp n ALA 711 Cb 0.57 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.66 3dyp n ALA 711 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dyp n GLY 712 N 0.93 0.56 3.63 0.00 0.00 0.98 -4.91 105.19 106.38 3dyp n GLY 712 Ca 0.04 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.56 3dyp n GLY 712 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3dyp n HIS 713 N -2.00 1.82 -3.33 1.61 -0.00 -0.64 -4.55 115.22 108.13 3dyp n HIS 713 Ca 0.00 0.49 -0.39 0.00 0.46 0.00 0.00 57.72 58.28 3dyp n HIS 713 Cb 0.00 -2.42 -0.08 0.00 -0.12 0.00 0.00 29.99 27.37 3dyp n HIS 713 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 3dyp s ILE 714 N 1.10 5.14 -0.68 3.57 1.01 -1.26 -0.73 121.20 129.35 3dyp s ILE 714 Ca 0.85 0.71 0.18 0.00 0.00 0.00 0.00 60.65 62.39 3dyp s ILE 714 Cb -0.88 -3.75 -0.22 0.00 0.01 0.00 0.00 42.46 37.62 3dyp s ILE 714 CO 0.46 0.15 0.69 -1.54 0.00 0.00 0.00 174.94 174.71 3dyp n SER 715 N 5.26 0.82 -3.51 3.58 3.41 0.39 -5.01 113.62 118.57 3dyp n SER 715 Ca -0.07 -0.73 -0.12 0.00 -0.26 0.00 0.00 58.87 57.70 3dyp n SER 715 Cb 0.50 1.19 -0.04 0.00 -0.26 0.00 0.00 64.21 65.61 3dyp n SER 715 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyp s ALA 716 N -2.85 -1.80 0.20 7.33 0.00 -1.22 -4.69 121.76 118.72 3dyp s ALA 716 Ca 0.04 1.14 -0.18 0.00 0.00 0.00 0.00 51.96 52.96 3dyp s ALA 716 Cb 0.13 0.12 0.03 0.00 0.00 0.00 0.00 23.12 23.40 3dyp s ALA 716 CO 0.76 -0.54 0.54 1.67 0.00 0.00 0.00 175.76 178.19 3dyp s TRP 717 N -2.30 -0.14 0.00 0.00 -2.14 -1.26 -0.43 118.94 112.66 3dyp s TRP 717 Ca -0.01 -0.20 -0.28 0.00 2.66 0.00 0.00 56.10 58.27 3dyp s TRP 717 Cb -0.01 0.42 0.08 0.00 -3.10 0.00 0.00 33.47 30.86 3dyp s TRP 717 CO -0.03 -0.94 0.70 -1.14 -2.66 0.00 0.00 176.95 172.89 3dyp s GLN 718 N -3.87 1.06 0.17 3.25 2.00 -0.67 -4.98 119.66 116.62 3dyp s GLN 718 Ca 0.09 0.00 0.05 0.00 -2.00 0.00 0.00 55.36 53.50 3dyp s GLN 718 Cb -0.01 0.49 -0.05 0.00 0.80 0.00 0.00 33.01 34.24 3dyp s GLN 718 CO -0.03 -0.38 -0.09 -0.65 -0.50 0.00 0.00 175.29 173.64 3dyp s GLN 719 N -2.04 1.16 -0.02 1.67 -0.21 -1.26 -0.88 119.66 118.07 3dyp s GLN 719 Ca -0.06 -1.51 -0.09 0.00 0.02 0.00 0.00 55.36 53.72 3dyp s GLN 719 Cb -0.00 -0.72 0.01 0.00 1.00 0.00 0.00 33.01 33.30 3dyp s GLN 719 CO 0.01 0.07 0.18 -1.58 -2.12 0.00 0.00 175.29 171.86 3dyp s TRP 720 N -3.27 -0.06 0.27 0.91 0.51 -0.07 -4.99 118.94 112.23 3dyp s TRP 720 Ca 0.20 0.11 -0.26 0.00 -2.12 0.00 0.00 56.10 54.03 3dyp s TRP 720 Cb 0.02 0.01 -0.09 0.00 -0.81 0.00 0.00 33.47 32.60 3dyp s TRP 720 CO 0.03 -0.26 0.88 1.03 -0.51 0.00 0.00 176.95 178.12 3dyp s ARG 721 N -1.00 4.58 0.00 4.98 0.52 -1.26 -0.89 118.95 125.88 3dyp s ARG 721 Ca -0.11 1.26 0.00 0.00 -0.52 0.00 0.00 55.73 56.36 3dyp s ARG 721 Cb -0.06 -2.97 0.00 0.00 0.52 0.00 0.00 34.95 32.44 3dyp s ARG 721 CO 0.02 0.39 0.00 1.28 0.02 0.00 0.00 175.30 177.01 3dyp n LEU 722 N 0.91 0.00 -4.73 2.53 4.77 0.15 -4.87 117.00 115.76 3dyp n LEU 722 Ca -0.01 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.63 3dyp n LEU 722 Cb 0.49 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.67 3dyp n LEU 722 CO 0.45 0.00 0.80 0.00 -1.33 0.00 0.00 177.39 177.31 3dyp s ALA 723 N -2.53 2.19 -0.02 -1.18 0.00 -1.26 -4.57 121.76 114.39 3dyp s ALA 723 Ca 0.00 0.85 0.04 0.00 0.00 0.00 0.00 51.96 52.86 3dyp s ALA 723 Cb 0.00 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.66 3dyp s ALA 723 CO 0.00 -1.76 -0.15 -2.00 0.00 0.00 0.00 175.76 171.85 3dyp s GLU 724 N -3.89 1.30 -0.28 0.00 2.12 -1.26 -0.80 118.70 115.89 3dyp s GLU 724 Ca 0.74 -0.53 0.03 0.00 0.36 0.00 0.00 54.97 55.57 3dyp s GLU 724 Cb -0.28 -1.22 0.07 0.00 0.26 0.00 0.00 34.13 32.95 3dyp s GLU 724 CO 0.44 0.29 -0.06 -0.80 -0.54 0.00 0.00 175.26 174.58 3dyp s ASN 725 N -0.22 4.56 0.43 -1.70 0.01 0.78 -4.97 114.94 113.84 3dyp s ASN 725 Ca 0.03 -1.56 -0.25 0.00 -0.71 0.00 0.00 52.86 50.37 3dyp s ASN 725 Cb -0.07 -1.58 -0.08 0.00 0.41 0.00 0.00 41.25 39.92 3dyp s ASN 725 CO 0.00 -0.24 1.21 -0.76 -1.51 0.00 0.00 177.10 175.80 3dyp s LEU 726 N 1.07 4.13 -0.03 0.60 1.43 -1.26 -1.02 118.68 123.60 3dyp s LEU 726 Ca -0.04 2.44 -0.30 0.00 -1.03 0.00 0.00 54.13 55.19 3dyp s LEU 726 Cb -0.20 -4.06 -0.03 0.00 0.03 0.00 0.00 46.19 41.93 3dyp s LEU 726 CO -0.05 -0.83 1.08 -0.55 0.23 0.00 0.00 176.35 176.23 3dyp s SER 727 N -1.08 7.20 0.00 2.29 0.15 -1.26 -4.86 113.70 116.14 3dyp s SER 727 Ca 0.60 1.73 0.00 0.00 0.70 0.00 0.00 55.95 58.98 3dyp s SER 727 Cb -0.33 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.42 3dyp s SER 727 CO 0.41 -0.43 0.89 1.33 1.20 0.00 0.00 173.24 176.64 3dyp n VAL 728 N 4.24 0.78 -2.72 4.45 0.24 -1.26 -5.00 118.33 119.06 3dyp n VAL 728 Ca 0.08 -0.88 -0.43 0.00 -2.04 0.00 0.00 64.34 61.07 3dyp n VAL 728 Cb 0.48 0.61 -0.03 0.00 -1.47 0.00 0.00 33.84 33.44 3dyp n VAL 728 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3dyp s THR 729 N -0.78 4.40 0.18 3.34 -4.23 -1.26 -4.98 115.64 112.31 3dyp s THR 729 Ca 0.00 1.09 -0.33 0.00 -1.18 0.00 0.00 61.69 61.27 3dyp s THR 729 Cb 0.00 -4.47 -0.14 0.00 1.34 0.00 0.00 72.50 69.23 3dyp s THR 729 CO 0.00 -0.81 1.48 0.18 -0.54 0.00 0.00 174.62 174.94 3dyp n LEU 730 N 7.30 2.92 0.00 4.79 4.32 -1.26 -4.95 117.00 130.12 3dyp n LEU 730 Ca 0.09 1.11 0.00 0.00 -0.02 0.00 0.00 56.01 57.19 3dyp n LEU 730 Cb 0.48 -1.40 0.00 0.00 -1.62 0.00 0.00 43.42 40.88 3dyp n LEU 730 CO 0.65 -0.46 0.29 -0.81 -1.22 0.00 0.00 177.39 175.84 3dyp n PRO 731 N 2.79 0.00 0.00 3.23 -0.04 -1.26 -5.02 135.00 134.70 3dyp n PRO 731 Ca 0.15 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 64.06 3dyp n PRO 731 Cb 0.29 -1.07 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 3dyp n PRO 731 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dyp n ALA 732 N -1.15 0.00 -1.43 0.55 0.00 -1.26 -5.12 120.51 112.09 3dyp n ALA 732 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 53.44 52.91 3dyp n ALA 732 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 3dyp n ALA 732 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dyp n ALA 733 N 0.00 0.81 -1.41 0.00 0.00 -1.26 -4.84 120.51 113.81 3dyp n ALA 733 Ca 0.00 0.03 -0.46 0.00 0.00 0.00 0.00 53.44 53.01 3dyp n ALA 733 Cb 0.00 -2.43 -0.02 0.00 0.00 0.00 0.00 19.45 17.00 3dyp n ALA 733 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3dyp n SER 734 N 8.98 -1.16 0.19 0.00 3.41 -1.26 -4.83 113.62 118.95 3dyp n SER 734 Ca 0.42 1.08 0.06 0.00 -0.26 0.00 0.00 58.87 60.17 3dyp n SER 734 Cb 0.17 -0.99 0.37 0.00 -0.26 0.00 0.00 64.21 63.50 3dyp n SER 734 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 3dyp h HIS 735 N 1.01 0.00 -4.52 7.33 3.86 -1.89 -3.46 115.15 117.47 3dyp h HIS 735 Ca -0.31 0.00 -0.42 0.00 -1.16 0.00 0.00 60.37 58.48 3dyp h HIS 735 Cb 1.43 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 29.76 3dyp h HIS 735 CO 0.41 0.36 -0.53 0.00 0.86 0.00 0.00 177.93 179.03 3dyp s ALA 736 N -3.73 1.81 -0.11 2.45 0.00 -1.26 -5.15 121.76 115.77 3dyp s ALA 736 Ca -0.01 -1.88 0.01 0.00 0.00 0.00 0.00 51.96 50.08 3dyp s ALA 736 Cb 0.12 1.36 0.02 0.00 0.00 0.00 0.00 23.12 24.61 3dyp s ALA 736 CO 0.69 -0.60 -0.11 -1.50 0.00 0.00 0.00 175.76 174.23 3dyp s ILE 737 N -3.61 1.25 0.62 0.00 2.07 -1.26 -4.05 121.20 116.22 3dyp s ILE 737 Ca 0.38 -0.47 -0.18 0.00 -1.41 0.00 0.00 60.65 58.98 3dyp s ILE 737 Cb 0.04 -1.19 -0.02 0.00 0.13 0.00 0.00 42.46 41.41 3dyp s ILE 737 CO 0.22 0.40 1.19 -2.84 -1.91 0.00 0.00 174.94 172.00 3dyp s PRO 738 N 1.28 2.84 -0.04 3.50 0.02 -1.26 -4.94 135.00 136.40 3dyp s PRO 738 Ca -0.02 1.75 0.02 0.00 0.02 0.00 0.00 61.00 62.78 3dyp s PRO 738 Cb -0.14 -1.92 -0.03 0.00 0.02 0.00 0.00 34.50 32.43 3dyp s PRO 738 CO -0.05 -1.29 -0.08 -1.58 -0.33 0.00 0.00 177.00 173.68 3dyp s HIS 739 N -1.75 2.89 -0.20 6.54 2.46 -0.04 -4.77 115.29 120.43 3dyp s HIS 739 Ca 0.75 -0.02 -0.08 0.00 0.47 0.00 0.00 55.06 56.18 3dyp s HIS 739 Cb -0.29 -1.66 -0.04 0.00 -0.13 0.00 0.00 32.58 30.46 3dyp s HIS 739 CO 0.36 0.33 0.08 -1.17 -2.47 0.00 0.00 174.74 171.86 3dyp s LEU 740 N -1.04 3.82 -0.28 8.88 2.96 -1.26 -1.02 118.68 130.75 3dyp s LEU 740 Ca 0.14 0.06 -0.05 0.00 -0.22 0.00 0.00 54.13 54.05 3dyp s LEU 740 Cb -0.11 -1.98 0.01 0.00 0.50 0.00 0.00 46.19 44.61 3dyp s LEU 740 CO 0.04 0.14 0.04 -0.89 -1.32 0.00 0.00 176.35 174.35 3dyp s THR 741 N 0.59 3.71 -0.15 3.68 2.01 0.15 -4.99 115.64 120.63 3dyp s THR 741 Ca 0.04 -0.71 -0.07 0.00 0.31 0.00 0.00 61.69 61.27 3dyp s THR 741 Cb -0.13 -2.88 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 3dyp s THR 741 CO 0.01 0.15 0.08 -0.89 -0.69 0.00 0.00 174.62 173.28 3dyp s THR 742 N 1.47 4.97 0.32 -0.82 2.01 -1.26 -1.91 115.64 120.42 3dyp s THR 742 Ca 0.03 0.02 0.03 0.00 0.31 0.00 0.00 61.69 62.08 3dyp s THR 742 Cb -0.17 -3.20 -0.06 0.00 0.01 0.00 0.00 72.50 69.09 3dyp s THR 742 CO 0.01 0.52 0.07 -0.94 -0.69 0.00 0.00 174.62 173.59 3dyp s SER 743 N -0.20 2.19 0.18 3.53 1.04 0.20 -5.02 113.70 115.61 3dyp s SER 743 Ca 0.08 -1.41 -0.13 0.00 0.48 0.00 0.00 55.95 54.97 3dyp s SER 743 Cb -0.12 0.03 0.12 0.00 0.10 0.00 0.00 66.02 66.16 3dyp s SER 743 CO 0.01 -0.67 1.80 -0.33 0.98 0.00 0.00 173.24 175.03 3dyp h GLU 744 N 2.13 0.53 -0.01 4.02 4.39 -2.03 -3.13 114.58 120.49 3dyp h GLU 744 Ca -0.40 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.27 3dyp h GLU 744 Cb 1.25 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 3dyp h GLU 744 CO 0.66 0.35 -0.68 0.00 -1.16 0.00 0.00 179.01 178.19 3dyp n MET 745 N -4.85 0.50 -3.87 2.33 0.00 -1.26 -4.82 117.12 105.16 3dyp n MET 745 Ca 0.04 -0.39 -0.09 0.00 0.00 0.00 0.00 57.70 57.27 3dyp n MET 745 Cb 0.11 -1.49 -0.07 0.00 0.00 0.00 0.00 33.22 31.77 3dyp n MET 745 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 3dyp s ASP 746 N -2.77 0.13 -0.21 3.17 1.01 -1.18 0.06 116.67 116.87 3dyp s ASP 746 Ca 0.14 -0.65 -0.01 0.00 0.71 0.00 0.00 52.55 52.74 3dyp s ASP 746 Cb 0.17 0.33 0.01 0.00 1.01 0.00 0.00 42.92 44.44 3dyp s ASP 746 CO 0.71 -0.71 -0.10 -0.36 0.21 0.00 0.00 175.17 174.92 3dyp s PHE 747 N -3.76 2.93 0.02 4.23 2.99 0.29 -0.63 117.98 124.05 3dyp s PHE 747 Ca 0.04 -1.38 0.06 0.00 0.00 0.00 0.00 56.93 55.65 3dyp s PHE 747 Cb 0.05 -2.02 -0.03 0.00 0.00 0.00 0.00 43.02 41.01 3dyp s PHE 747 CO -0.10 -0.69 -0.15 0.00 -0.00 0.00 0.00 175.22 174.27 3dyp s ILE 749 N -0.91 1.34 -0.02 0.00 1.09 -0.17 -0.68 121.20 121.86 3dyp s ILE 749 Ca 0.15 -0.65 0.07 0.00 -1.10 0.00 0.00 60.65 59.12 3dyp s ILE 749 Cb -0.11 -1.17 -0.02 0.00 -1.06 0.00 0.00 42.46 40.11 3dyp s ILE 749 CO 0.05 0.39 -0.22 -1.61 -0.10 0.00 0.00 174.94 173.45 3dyp s GLU 750 N 0.21 1.90 -0.24 2.79 8.01 -0.19 -1.44 118.70 129.75 3dyp s GLU 750 Ca -0.07 -0.80 -0.02 0.00 0.01 0.00 0.00 54.97 54.08 3dyp s GLU 750 Cb -0.13 -1.80 0.12 0.00 -4.31 0.00 0.00 34.13 28.02 3dyp s GLU 750 CO 0.03 0.46 0.30 -1.17 0.01 0.00 0.00 175.26 174.89 3dyp s LEU 751 N -0.46 -0.34 0.00 1.80 2.96 0.17 -0.86 118.68 121.96 3dyp s LEU 751 Ca 0.07 -0.23 0.00 0.00 -0.22 0.00 0.00 54.13 53.74 3dyp s LEU 751 Cb -0.09 0.67 0.00 0.00 0.50 0.00 0.00 46.19 47.27 3dyp s LEU 751 CO -0.00 -0.34 0.00 0.61 -1.32 0.00 0.00 176.35 175.30 3dyp n GLY 752 N 5.33 3.00 1.78 7.98 0.00 -1.26 -1.33 105.19 120.69 3dyp n GLY 752 Ca -0.04 -0.21 0.02 0.00 0.00 0.00 0.00 46.02 45.80 3dyp n GLY 752 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3dyp n ASN 753 N 5.53 4.95 -4.57 1.61 6.94 -1.26 -4.91 115.26 123.54 3dyp n ASN 753 Ca 0.00 -2.90 -0.30 0.00 -0.02 0.00 0.00 54.58 51.36 3dyp n ASN 753 Cb 0.00 -0.68 -0.10 0.00 -2.36 0.00 0.00 39.78 36.64 3dyp n ASN 753 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3dyp s LYS 754 N -2.59 2.16 -0.01 -3.83 1.02 -0.44 0.60 119.74 116.65 3dyp s LYS 754 Ca 0.48 -0.99 -0.02 0.00 0.02 0.00 0.00 55.97 55.45 3dyp s LYS 754 Cb 0.37 -2.32 -0.00 0.00 -0.52 0.00 0.00 37.83 35.36 3dyp s LYS 754 CO 0.13 0.52 0.05 0.50 -0.92 0.00 0.00 175.35 175.63 3dyp s ARG 755 N -2.10 0.18 -0.00 1.68 3.52 -0.81 -0.66 118.95 120.76 3dyp s ARG 755 Ca 0.21 -0.15 0.05 0.00 -0.13 0.00 0.00 55.73 55.71 3dyp s ARG 755 Cb -0.11 0.08 -0.01 0.00 -1.56 0.00 0.00 34.95 33.34 3dyp s ARG 755 CO 0.13 -0.03 -0.15 -1.58 -0.81 0.00 0.00 175.30 172.85 3dyp s TRP 756 N -0.51 1.36 -0.10 5.12 0.51 -0.52 -0.49 118.94 124.31 3dyp s TRP 756 Ca -0.06 -0.27 0.01 0.00 -2.12 0.00 0.00 56.10 53.66 3dyp s TRP 756 Cb -0.04 -0.86 0.02 0.00 -0.81 0.00 0.00 33.47 31.78 3dyp s TRP 756 CO 0.00 -0.01 -0.11 -1.14 -0.51 0.00 0.00 176.95 175.18 3dyp s GLN 757 N -0.47 1.73 -0.25 4.98 0.74 -0.14 -0.99 119.66 125.25 3dyp s GLN 757 Ca 0.05 -0.37 -0.05 0.00 0.05 0.00 0.00 55.36 55.04 3dyp s GLN 757 Cb -0.06 -1.59 -0.00 0.00 1.10 0.00 0.00 33.01 32.45 3dyp s GLN 757 CO -0.00 -0.13 0.02 -0.06 -0.55 0.00 0.00 175.29 174.57 3dyp s PHE 758 N 1.21 3.06 -0.06 1.67 0.40 0.11 -0.65 117.98 123.72 3dyp s PHE 758 Ca -0.04 -0.90 -0.30 0.00 -0.60 0.00 0.00 56.93 55.09 3dyp s PHE 758 Cb -0.14 -2.18 -0.03 0.00 0.51 0.00 0.00 43.02 41.18 3dyp s PHE 758 CO -0.03 -0.53 1.20 1.21 0.70 0.00 0.00 175.22 177.77 3dyp s ASN 759 N 1.50 7.05 0.54 1.36 3.84 -0.63 -0.54 114.94 128.05 3dyp s ASN 759 Ca 0.04 1.81 0.33 0.00 0.21 0.00 0.00 52.86 55.25 3dyp s ASN 759 Cb -0.16 -2.56 1.33 0.00 -0.55 0.00 0.00 41.25 39.31 3dyp s ASN 759 CO -0.00 -0.58 1.97 0.03 -2.79 0.00 0.00 177.10 175.73 3dyp h ARG 760 N 7.46 0.00 0.06 0.43 3.08 -0.69 0.22 114.38 124.93 3dyp h ARG 760 Ca -0.34 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.37 3dyp h ARG 760 Cb 1.16 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.17 3dyp h ARG 760 CO 0.88 0.02 -1.96 1.04 -1.07 0.00 0.00 179.97 178.89 3dyp n GLN 761 N -3.13 0.70 0.02 0.04 6.02 -1.26 -4.32 117.38 115.44 3dyp n GLN 761 Ca 0.01 0.25 -0.13 0.00 -0.01 0.00 0.00 57.00 57.11 3dyp n GLN 761 Cb 0.32 -1.71 -0.14 0.00 1.02 0.00 0.00 30.24 29.73 3dyp n GLN 761 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3dyp h SER 762 N 0.03 0.19 0.00 1.08 4.64 -1.92 -3.44 113.55 114.13 3dyp h SER 762 Ca -0.39 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 60.59 3dyp h SER 762 Cb 2.03 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 64.06 3dyp h SER 762 CO 0.07 1.29 0.00 0.61 -0.87 0.00 0.00 176.83 177.93 3dyp n GLY 763 N 1.65 0.53 3.50 -0.77 0.00 0.77 -4.77 105.19 106.09 3dyp n GLY 763 Ca -0.18 -0.29 -0.24 0.00 0.00 0.00 0.00 46.02 45.31 3dyp n GLY 763 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dyp s PHE 764 N -2.00 2.36 -0.42 1.61 0.40 -1.24 -4.92 117.98 113.76 3dyp s PHE 764 Ca 0.00 -0.31 -0.28 0.00 -0.60 0.00 0.00 56.93 55.74 3dyp s PHE 764 Cb 0.00 -1.03 -0.00 0.00 0.51 0.00 0.00 43.02 42.50 3dyp s PHE 764 CO 0.00 0.70 1.61 -1.17 0.70 0.00 0.00 175.22 177.06 3dyp s LEU 765 N -3.51 3.50 0.02 -0.37 2.96 -1.26 -1.61 118.68 118.40 3dyp s LEU 765 Ca 0.30 0.89 0.22 0.00 -0.22 0.00 0.00 54.13 55.32 3dyp s LEU 765 Cb -0.05 -3.35 -0.20 0.00 0.50 0.00 0.00 46.19 43.09 3dyp s LEU 765 CO 0.16 -1.69 0.74 -1.54 -1.32 0.00 0.00 176.35 172.70 3dyp n SER 766 N 9.94 0.41 -3.63 3.68 3.41 0.17 -1.95 113.62 125.65 3dyp n SER 766 Ca 0.19 -0.20 -0.16 0.00 -0.26 0.00 0.00 58.87 58.44 3dyp n SER 766 Cb 0.48 1.39 -0.07 0.00 -0.26 0.00 0.00 64.21 65.75 3dyp n SER 766 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3dyp s GLN 767 N -3.34 0.87 -0.07 4.33 2.00 -1.17 -4.44 119.66 117.85 3dyp s GLN 767 Ca -0.02 0.07 -0.04 0.00 -2.00 0.00 0.00 55.36 53.36 3dyp s GLN 767 Cb 0.14 0.40 0.03 0.00 0.80 0.00 0.00 33.01 34.38 3dyp s GLN 767 CO 0.87 -0.26 0.16 1.41 -0.50 0.00 0.00 175.29 176.97 3dyp s MET 768 N -1.22 0.15 0.05 1.67 -2.45 -1.26 -0.97 119.30 115.28 3dyp s MET 768 Ca -0.12 0.31 0.08 0.00 -1.25 0.00 0.00 55.69 54.71 3dyp s MET 768 Cb -0.02 -0.04 -0.03 0.00 1.25 0.00 0.00 34.83 35.99 3dyp s MET 768 CO 0.07 -0.09 -0.22 -1.58 1.05 0.00 0.00 175.02 174.25 3dyp s TRP 769 N 0.63 1.91 -0.33 4.11 0.51 0.36 -0.32 118.94 125.81 3dyp s TRP 769 Ca -0.05 -0.39 -0.02 0.00 -2.12 0.00 0.00 56.10 53.53 3dyp s TRP 769 Cb -0.06 -1.13 0.07 0.00 -0.81 0.00 0.00 33.47 31.54 3dyp s TRP 769 CO -0.03 0.12 0.05 0.42 -0.51 0.00 0.00 176.95 177.00 3dyp s ILE 770 N -0.86 3.04 0.00 2.03 1.01 -0.35 -1.92 121.20 124.15 3dyp s ILE 770 Ca 0.08 -1.58 0.00 0.00 0.00 0.00 0.00 60.65 59.15 3dyp s ILE 770 Cb -0.09 -2.85 0.00 0.00 0.01 0.00 0.00 42.46 39.53 3dyp s ILE 770 CO 0.02 -0.27 0.00 0.61 0.00 0.00 0.00 174.94 175.31 3dyp n GLY 771 N 4.60 1.93 1.39 6.18 0.00 0.20 -0.92 105.19 118.56 3dyp n GLY 771 Ca -0.10 -0.46 0.10 0.00 0.00 0.00 0.00 46.02 45.57 3dyp n GLY 771 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dyp n ASP 772 N 5.07 4.05 -4.57 1.61 5.75 -1.26 -4.89 116.55 122.31 3dyp n ASP 772 Ca 0.00 -2.16 -0.41 0.00 -0.01 0.00 0.00 54.79 52.21 3dyp n ASP 772 Cb 0.00 -0.51 -0.08 0.00 -1.03 0.00 0.00 41.12 39.51 3dyp n ASP 772 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3dyp s LYS 773 N -1.36 3.74 0.33 0.11 -0.14 -0.09 -5.06 119.74 117.26 3dyp s LYS 773 Ca 0.48 -0.02 -0.29 0.00 -1.36 0.00 0.00 55.97 54.78 3dyp s LYS 773 Cb 0.27 -3.77 -0.10 0.00 -1.68 0.00 0.00 37.83 32.55 3dyp s LYS 773 CO 0.29 -0.58 1.31 0.15 -0.76 0.00 0.00 175.35 175.76 3dyp s LYS 774 N 2.40 4.36 -0.01 1.68 1.02 -1.26 -1.21 119.74 126.73 3dyp s LYS 774 Ca 0.20 2.21 0.13 0.00 0.02 0.00 0.00 55.97 58.53 3dyp s LYS 774 Cb -0.15 -3.08 -0.17 0.00 -0.52 0.00 0.00 37.83 33.91 3dyp s LYS 774 CO 0.12 -0.19 0.43 1.04 -0.92 0.00 0.00 175.35 175.84 3dyp n GLN 775 N 0.89 1.69 -4.29 1.68 1.13 0.56 -4.74 117.38 114.30 3dyp n GLN 775 Ca 0.00 -0.05 -0.30 0.00 -1.94 0.00 0.00 57.00 54.71 3dyp n GLN 775 Cb 0.42 -1.20 -0.10 0.00 0.11 0.00 0.00 30.24 29.47 3dyp n GLN 775 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3dyp s LEU 776 N -3.20 3.07 -0.13 1.08 1.43 -1.26 0.12 118.68 119.79 3dyp s LEU 776 Ca 0.00 -0.33 0.11 0.00 -1.03 0.00 0.00 54.13 52.89 3dyp s LEU 776 Cb 0.09 -1.84 -0.16 0.00 0.03 0.00 0.00 46.19 44.32 3dyp s LEU 776 CO 0.54 0.20 0.04 0.18 0.23 0.00 0.00 176.35 177.54 3dyp n LEU 777 N 0.91 0.03 -4.05 1.79 4.77 0.23 -4.62 117.00 116.06 3dyp n LEU 777 Ca -0.14 -0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.70 3dyp n LEU 777 Cb 0.52 0.30 -0.12 0.00 -2.33 0.00 0.00 43.42 41.80 3dyp n LEU 777 CO 0.33 0.32 -0.41 -0.89 -1.33 0.00 0.00 177.39 175.41 3dyp s THR 778 N -2.31 0.55 0.99 -5.08 2.01 -1.05 -4.94 115.64 105.82 3dyp s THR 778 Ca -0.06 -0.93 -0.11 0.00 0.31 0.00 0.00 61.69 60.89 3dyp s THR 778 Cb 0.04 -0.58 0.19 0.00 0.01 0.00 0.00 72.50 72.15 3dyp s THR 778 CO 0.52 -0.28 1.10 -2.84 -0.69 0.00 0.00 174.62 172.42 3dyp s PRO 779 N -1.31 0.42 -0.39 4.92 0.02 -1.26 -3.74 135.00 133.65 3dyp s PRO 779 Ca -0.07 1.21 -0.25 0.00 0.02 0.00 0.00 61.00 61.91 3dyp s PRO 779 Cb -0.09 -1.68 0.02 0.00 0.02 0.00 0.00 34.50 32.77 3dyp s PRO 779 CO 0.00 -2.93 0.90 -1.17 -0.33 0.00 0.00 177.00 173.47 3dyp s LEU 780 N -6.75 4.02 0.08 -5.54 2.96 -0.82 -4.49 118.68 108.14 3dyp s LEU 780 Ca 0.67 0.44 0.04 0.00 -0.22 0.00 0.00 54.13 55.05 3dyp s LEU 780 Cb -0.23 -3.21 -0.03 0.00 0.50 0.00 0.00 46.19 43.22 3dyp s LEU 780 CO 0.60 -0.88 -0.11 -0.13 -1.32 0.00 0.00 176.35 174.51 3dyp s ARG 781 N 3.48 0.78 0.75 1.98 0.52 -0.25 -4.20 118.95 122.01 3dyp s ARG 781 Ca 0.37 -1.02 -0.14 0.00 -0.52 0.00 0.00 55.73 54.41 3dyp s ARG 781 Cb -0.12 -0.58 0.05 0.00 0.52 0.00 0.00 34.95 34.83 3dyp s ARG 781 CO 0.20 0.11 1.19 -0.51 0.02 0.00 0.00 175.30 176.31 3dyp s ASP 782 N -2.07 4.12 -0.02 0.23 1.11 -1.26 -0.24 116.67 118.53 3dyp s ASP 782 Ca 0.00 2.29 -0.00 0.00 0.18 0.00 0.00 52.55 55.02 3dyp s ASP 782 Cb -0.06 -2.58 0.03 0.00 1.07 0.00 0.00 42.92 41.37 3dyp s ASP 782 CO 0.01 -2.31 0.03 -1.58 1.18 0.00 0.00 175.17 172.50 3dyp s GLN 783 N -4.05 -0.03 0.00 8.23 0.74 0.50 -4.74 119.66 120.31 3dyp s GLN 783 Ca 0.72 0.19 0.00 0.00 0.05 0.00 0.00 55.36 56.33 3dyp s GLN 783 Cb -0.27 -0.24 0.00 0.00 1.10 0.00 0.00 33.01 33.59 3dyp s GLN 783 CO 0.47 -0.17 0.78 1.19 -0.55 0.00 0.00 175.29 177.01 3dyp n PHE 784 N 4.17 0.00 -4.38 1.67 3.01 -1.26 -1.88 117.46 118.79 3dyp n PHE 784 Ca -0.28 -0.29 -0.19 0.00 1.01 0.00 0.00 57.45 57.71 3dyp n PHE 784 Cb 0.50 -0.03 -0.10 0.00 -0.01 0.00 0.00 39.48 39.84 3dyp n PHE 784 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 3dyp s THR 785 N -0.57 1.19 0.08 4.37 -4.23 -1.26 -3.18 115.64 112.04 3dyp s THR 785 Ca 0.00 -2.04 0.03 0.00 -1.18 0.00 0.00 61.69 58.49 3dyp s THR 785 Cb 0.00 -2.50 -0.03 0.00 1.34 0.00 0.00 72.50 71.30 3dyp s THR 785 CO 0.00 -0.22 -0.08 0.00 -0.54 0.00 0.00 174.62 173.78 3dyp s ARG 786 N -3.85 0.75 -0.05 3.99 1.70 -1.26 -4.76 118.95 115.46 3dyp s ARG 786 Ca 0.31 -1.09 -0.30 0.00 -0.47 0.00 0.00 55.73 54.19 3dyp s ARG 786 Cb 0.06 -0.37 -0.06 0.00 -0.57 0.00 0.00 34.95 34.02 3dyp s ARG 786 CO 0.11 0.04 1.73 0.00 -1.08 0.00 0.00 175.30 176.11 3dyp s ALA 787 N -2.46 3.55 0.20 7.88 0.00 -1.26 -4.86 121.76 124.82 3dyp s ALA 787 Ca 0.03 0.97 -0.32 0.00 0.00 0.00 0.00 51.96 52.63 3dyp s ALA 787 Cb -0.03 -3.79 -0.13 0.00 0.00 0.00 0.00 23.12 19.17 3dyp s ALA 787 CO -0.01 -1.53 1.53 -0.35 0.00 0.00 0.00 175.76 175.40 3dyp n PRO 788 N 7.32 2.21 -1.72 0.00 -0.04 -1.26 -1.58 135.00 139.92 3dyp n PRO 788 Ca 0.18 0.79 -0.29 0.00 -0.04 0.00 0.00 63.50 64.15 3dyp n PRO 788 Cb 0.43 -2.53 0.11 0.00 -0.04 0.00 0.00 33.50 31.46 3dyp n PRO 788 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dyp s LEU 789 N 0.51 2.33 0.27 1.53 1.43 -1.26 -4.60 118.68 118.89 3dyp s LEU 789 Ca 0.73 0.92 -0.01 0.00 -1.03 0.00 0.00 54.13 54.74 3dyp s LEU 789 Cb -0.64 -3.36 0.47 0.00 0.03 0.00 0.00 46.19 42.69 3dyp s LEU 789 CO 0.42 -2.14 1.85 0.44 0.23 0.00 0.00 176.35 177.15 3dyp h ASP 790 N -1.22 0.95 0.78 2.29 3.32 -1.87 0.02 116.42 120.69 3dyp h ASP 790 Ca -0.48 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 56.55 3dyp h ASP 790 Cb 1.32 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 3dyp h ASP 790 CO 0.64 0.56 -0.24 0.78 -1.72 0.00 0.00 179.24 179.25 3dyp h ASN 791 N 1.05 0.00 1.03 6.45 2.35 -1.85 0.25 115.58 124.87 3dyp h ASN 791 Ca 0.46 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 56.06 3dyp h ASN 791 Cb 0.33 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 3dyp h ASN 791 CO -0.22 0.24 -0.71 0.44 -1.65 0.00 0.00 177.43 175.53 3dyp h ASP 792 N 0.00 0.00 0.10 5.81 3.32 -1.35 -3.34 116.42 120.96 3dyp h ASP 792 Ca -0.00 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.87 3dyp h ASP 792 Cb 0.70 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.25 3dyp h ASP 792 CO 0.03 0.71 -0.83 0.40 -1.72 0.00 0.00 179.24 177.83 3dyp h ILE 793 N 0.00 1.42 0.00 0.35 2.04 -0.68 -0.19 117.51 120.45 3dyp h ILE 793 Ca -0.01 -2.45 0.00 0.00 1.00 0.00 0.00 64.86 63.40 3dyp h ILE 793 Cb 1.41 3.07 0.00 0.00 -0.74 0.00 0.00 36.82 40.56 3dyp h ILE 793 CO 0.09 0.67 0.00 0.61 0.00 0.00 0.00 178.15 179.52 3dyp n GLY 794 N 1.66 2.51 0.83 5.37 0.00 0.02 -1.59 105.19 113.98 3dyp n GLY 794 Ca -0.17 -0.42 0.11 0.00 0.00 0.00 0.00 46.02 45.54 3dyp n GLY 794 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3dyp n VAL 795 N 0.00 0.34 -1.68 1.61 0.24 -1.26 -4.90 118.33 112.68 3dyp n VAL 795 Ca 0.00 -0.53 -0.41 0.00 -2.04 0.00 0.00 64.34 61.37 3dyp n VAL 795 Cb 0.00 0.65 0.02 0.00 -1.47 0.00 0.00 33.84 33.03 3dyp n VAL 795 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 3dyp n SER 796 N 0.86 2.25 -3.91 -1.34 2.88 -0.62 -4.79 113.62 108.94 3dyp n SER 796 Ca 0.17 1.07 -0.11 0.00 -1.33 0.00 0.00 58.87 58.68 3dyp n SER 796 Cb 0.45 -1.48 -0.12 0.00 -0.75 0.00 0.00 64.21 62.32 3dyp n SER 796 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 3dyp s GLU 797 N -2.26 0.23 0.33 -1.46 2.12 -0.10 -4.86 118.70 112.70 3dyp s GLU 797 Ca 0.63 -0.31 0.08 0.00 0.36 0.00 0.00 54.97 55.73 3dyp s GLU 797 Cb -0.50 0.09 0.81 0.00 0.26 0.00 0.00 34.13 34.79 3dyp s GLU 797 CO 0.56 -0.04 1.80 0.00 -0.54 0.00 0.00 175.26 177.04 3dyp h ALA 798 N 5.16 1.80 0.00 6.30 0.00 -1.99 1.09 119.26 131.61 3dyp h ALA 798 Ca -0.29 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3dyp h ALA 798 Cb 1.21 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3dyp h ALA 798 CO 0.44 -0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.55 3dyp h THR 799 N 0.70 0.00 -1.19 0.00 1.03 -2.00 -3.39 112.91 108.06 3dyp h THR 799 Ca 0.55 -0.66 -0.19 0.00 -0.01 0.00 0.00 66.41 66.10 3dyp h THR 799 Cb 0.94 1.64 -0.20 0.00 -1.07 0.00 0.00 68.15 69.46 3dyp h THR 799 CO -0.32 0.00 -0.54 -0.60 -0.01 0.00 0.00 175.52 174.05 3dyp s ARG 800 N -3.20 1.00 0.28 0.00 3.52 0.36 -5.13 118.95 115.77 3dyp s ARG 800 Ca 0.08 -1.03 -0.30 0.00 -0.13 0.00 0.00 55.73 54.35 3dyp s ARG 800 Cb 0.09 -0.20 -0.12 0.00 -1.56 0.00 0.00 34.95 33.16 3dyp s ARG 800 CO 0.60 -1.31 1.52 -0.89 -0.81 0.00 0.00 175.30 174.42 3dyp n ILE 801 N 3.24 1.02 -3.47 4.11 2.08 -0.12 -0.93 119.36 125.30 3dyp n ILE 801 Ca 0.18 -0.26 -0.43 0.00 0.56 0.00 0.00 62.75 62.81 3dyp n ILE 801 Cb 0.55 -1.78 -0.07 0.00 -0.75 0.00 0.00 39.64 37.58 3dyp n ILE 801 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3dyp s ASP 802 N 0.40 5.88 0.31 4.38 -1.08 -1.26 -4.81 116.67 120.49 3dyp s ASP 802 Ca 0.65 -1.89 0.22 0.00 -0.52 0.00 0.00 52.55 51.01 3dyp s ASP 802 Cb -0.55 -2.08 1.13 0.00 -1.46 0.00 0.00 42.92 39.96 3dyp s ASP 802 CO 0.49 -0.75 1.68 -0.81 0.52 0.00 0.00 175.17 176.30 3dyp n PRO 803 N 5.00 0.16 0.17 4.34 -0.04 -1.26 -1.44 135.00 141.93 3dyp n PRO 803 Ca -0.10 0.58 0.12 0.00 -0.04 0.00 0.00 63.50 64.07 3dyp n PRO 803 Cb 0.41 -1.94 0.20 0.00 -0.04 0.00 0.00 33.50 32.13 3dyp n PRO 803 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 3dyp h ASN 804 N 0.00 0.00 -4.08 3.54 -0.00 -1.95 -3.36 115.58 109.73 3dyp h ASN 804 Ca 0.00 -0.02 -0.53 0.00 -0.00 0.00 0.00 56.30 55.75 3dyp h ASN 804 Cb 0.10 0.00 0.11 0.00 -0.00 0.00 0.00 38.32 38.53 3dyp h ASN 804 CO 0.00 0.01 0.50 0.00 -0.00 0.00 0.00 177.43 177.94 3dyp s ALA 805 N -3.20 2.64 0.17 1.57 0.00 -0.52 -4.74 121.76 117.68 3dyp s ALA 805 Ca 0.07 1.08 -0.15 0.00 0.00 0.00 0.00 51.96 52.96 3dyp s ALA 805 Cb 0.08 -3.47 0.12 0.00 0.00 0.00 0.00 23.12 19.85 3dyp s ALA 805 CO 0.67 -1.17 1.69 -1.49 0.00 0.00 0.00 175.76 175.46 3dyp h TRP 806 N 1.13 -0.03 -0.96 0.00 4.06 -1.78 0.12 115.95 118.50 3dyp h TRP 806 Ca -0.50 0.03 0.07 0.00 2.06 0.00 0.00 58.89 60.54 3dyp h TRP 806 Cb 1.30 0.08 -0.06 0.00 -1.00 0.00 0.00 29.16 29.47 3dyp h TRP 806 CO 0.47 -0.09 0.62 -0.24 -3.56 0.00 0.00 178.44 175.64 3dyp h VAL 807 N 0.11 1.07 -0.06 1.49 3.04 -1.38 -0.43 116.25 120.09 3dyp h VAL 807 Ca 0.21 -0.38 -0.16 0.00 -1.01 0.00 0.00 66.70 65.36 3dyp h VAL 807 Cb 0.29 -0.12 -0.01 0.00 -2.01 0.00 0.00 31.29 29.44 3dyp h VAL 807 CO -0.34 0.20 -0.65 -0.33 -1.01 0.00 0.00 177.57 175.43 3dyp h GLU 808 N 1.09 0.24 -0.42 4.17 4.39 -1.57 0.11 114.58 122.60 3dyp h GLU 808 Ca 0.41 -0.18 -0.06 0.00 0.34 0.00 0.00 59.36 59.87 3dyp h GLU 808 Cb 0.20 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.87 3dyp h GLU 808 CO -0.16 0.81 0.02 0.00 -1.16 0.00 0.00 179.01 178.52 3dyp h ARG 809 N 0.17 0.73 -0.49 2.33 3.08 -0.31 -1.47 114.38 118.42 3dyp h ARG 809 Ca -0.01 -0.23 -0.05 0.00 0.07 0.00 0.00 59.98 59.76 3dyp h ARG 809 Cb 1.18 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.14 3dyp h ARG 809 CO 0.10 0.80 0.10 -1.49 -1.07 0.00 0.00 179.97 178.41 3dyp h TRP 810 N 0.57 0.85 0.03 3.04 6.55 -0.89 -1.12 115.95 124.98 3dyp h TRP 810 Ca 0.12 -0.11 -0.00 0.00 0.95 0.00 0.00 58.89 59.85 3dyp h TRP 810 Cb 0.46 -0.24 0.00 0.00 -0.86 0.00 0.00 29.16 28.52 3dyp h TRP 810 CO 0.04 0.77 -0.01 0.87 -1.05 0.00 0.00 178.44 179.05 3dyp h LYS 811 N 0.68 -0.04 -0.51 0.49 1.57 -0.68 -1.15 116.57 116.94 3dyp h LYS 811 Ca 0.15 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.98 3dyp h LYS 811 Cb 0.37 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.66 3dyp h LYS 811 CO 0.01 -0.02 0.34 0.00 -0.57 0.00 0.00 179.45 179.20 3dyp h ALA 812 N 0.93 1.84 -0.00 3.86 0.00 -1.20 0.60 119.26 125.29 3dyp h ALA 812 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3dyp h ALA 812 Cb 0.03 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3dyp h ALA 812 CO 0.01 0.09 -0.03 0.00 0.00 0.00 0.00 179.25 179.31 3dyp n ALA 813 N -2.49 2.48 -0.72 0.00 0.00 -0.43 -4.90 120.51 114.44 3dyp n ALA 813 Ca 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.37 3dyp n ALA 813 Cb 0.20 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.20 3dyp n ALA 813 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dyp n GLY 814 N 1.41 0.62 0.36 0.00 0.00 0.20 -4.85 105.19 102.93 3dyp n GLY 814 Ca 0.10 -0.20 0.07 0.00 0.00 0.00 0.00 46.02 45.99 3dyp n GLY 814 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3dyp h HIS 815 N 0.00 0.86 0.00 1.61 3.86 -1.40 0.23 115.15 120.30 3dyp h HIS 815 Ca 0.00 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 3dyp h HIS 815 Cb 0.00 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.19 3dyp h HIS 815 CO 0.00 0.42 -0.31 0.66 0.86 0.00 0.00 177.93 179.56 3dyp n TYR 816 N -4.50 0.28 0.46 2.45 4.02 -1.26 -3.92 117.16 114.68 3dyp n TYR 816 Ca 0.13 0.08 0.07 0.00 -0.01 0.00 0.00 57.90 58.17 3dyp n TYR 816 Cb 0.28 -0.53 -0.09 0.00 -0.02 0.00 0.00 39.34 38.99 3dyp n TYR 816 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 3dyp n GLN 817 N -1.76 1.95 -1.70 -0.72 1.13 -0.14 -5.02 117.38 111.11 3dyp n GLN 817 Ca 0.05 -0.04 -0.42 0.00 -1.94 0.00 0.00 57.00 54.66 3dyp n GLN 817 Cb 0.38 -1.19 0.00 0.00 0.11 0.00 0.00 30.24 29.54 3dyp n GLN 817 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3dyp n ALA 818 N -1.50 1.35 -2.44 -1.58 0.00 0.62 -5.00 120.51 111.96 3dyp n ALA 818 Ca 0.01 0.32 -0.27 0.00 0.00 0.00 0.00 53.44 53.51 3dyp n ALA 818 Cb 0.25 -2.27 -0.15 0.00 0.00 0.00 0.00 19.45 17.29 3dyp n ALA 818 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 3dyp s GLU 819 N -2.01 1.55 0.08 0.00 -1.05 -1.21 -4.89 118.70 111.16 3dyp s GLU 819 Ca 0.57 -0.90 -0.31 0.00 -0.15 0.00 0.00 54.97 54.19 3dyp s GLU 819 Cb -0.54 -1.61 -0.09 0.00 -0.44 0.00 0.00 34.13 31.44 3dyp s GLU 819 CO 0.61 0.42 1.83 0.00 0.95 0.00 0.00 175.26 179.07 3dyp s ALA 820 N -0.70 3.69 -0.17 -0.84 0.00 -1.26 -2.96 121.76 119.51 3dyp s ALA 820 Ca 0.08 1.34 -0.01 0.00 0.00 0.00 0.00 51.96 53.37 3dyp s ALA 820 Cb -0.09 -3.77 -0.01 0.00 0.00 0.00 0.00 23.12 19.25 3dyp s ALA 820 CO 0.01 -1.31 -0.11 0.00 0.00 0.00 0.00 175.76 174.35 3dyp s ALA 821 N 3.30 2.65 0.16 0.00 0.00 0.23 -4.94 121.76 123.15 3dyp s ALA 821 Ca 0.81 -1.05 -0.30 0.00 0.00 0.00 0.00 51.96 51.43 3dyp s ALA 821 Cb -0.43 -1.40 -0.08 0.00 0.00 0.00 0.00 23.12 21.22 3dyp s ALA 821 CO 0.37 -0.10 1.23 -1.17 0.00 0.00 0.00 175.76 176.08 3dyp s LEU 822 N 0.92 4.42 -0.11 0.00 2.96 -1.26 -1.23 118.68 124.38 3dyp s LEU 822 Ca -0.02 2.22 0.06 0.00 -0.22 0.00 0.00 54.13 56.17 3dyp s LEU 822 Cb -0.15 -3.60 -0.11 0.00 0.50 0.00 0.00 46.19 42.83 3dyp s LEU 822 CO -0.01 -0.43 -0.02 0.18 -1.32 0.00 0.00 176.35 174.75 3dyp n LEU 823 N 2.92 1.13 -3.63 -0.68 4.77 0.87 -4.93 117.00 117.46 3dyp n LEU 823 Ca 0.06 -0.03 -0.15 0.00 -0.03 0.00 0.00 56.01 55.87 3dyp n LEU 823 Cb 0.45 -0.02 -0.07 0.00 -2.33 0.00 0.00 43.42 41.45 3dyp n LEU 823 CO 0.56 0.44 0.35 -1.58 -1.33 0.00 0.00 177.39 175.83 3dyp s GLN 824 N -2.26 0.82 -0.29 3.23 0.74 -0.71 -4.90 119.66 116.29 3dyp s GLN 824 Ca -0.10 0.70 0.01 0.00 0.05 0.00 0.00 55.36 56.02 3dyp s GLN 824 Cb 0.04 0.40 0.15 0.00 1.10 0.00 0.00 33.01 34.69 3dyp s GLN 824 CO 0.38 -0.15 0.35 0.00 -0.55 0.00 0.00 175.29 175.32 3dyp s THR 826 N 2.44 2.19 -0.03 0.00 -4.23 0.08 -4.96 115.64 111.12 3dyp s THR 826 Ca 0.10 -2.31 0.02 0.00 -1.18 0.00 0.00 61.69 58.32 3dyp s THR 826 Cb -0.13 -2.30 0.01 0.00 1.34 0.00 0.00 72.50 71.42 3dyp s THR 826 CO -0.32 -0.41 -0.06 0.00 -0.54 0.00 0.00 174.62 173.30 3dyp s ALA 827 N -2.68 0.65 0.06 3.99 0.00 -1.26 -0.44 121.76 122.09 3dyp s ALA 827 Ca 0.28 -0.16 0.02 0.00 0.00 0.00 0.00 51.96 52.11 3dyp s ALA 827 Cb -0.02 -0.31 -0.03 0.00 0.00 0.00 0.00 23.12 22.76 3dyp s ALA 827 CO 0.13 0.06 -0.08 -0.51 0.00 0.00 0.00 175.76 175.36 3dyp s ASP 828 N 0.46 1.05 -0.10 0.00 1.01 0.11 -4.98 116.67 114.22 3dyp s ASP 828 Ca -0.06 -0.70 -0.02 0.00 0.71 0.00 0.00 52.55 52.48 3dyp s ASP 828 Cb -0.10 0.04 -0.03 0.00 1.01 0.00 0.00 42.92 43.84 3dyp s ASP 828 CO 0.00 -0.27 -0.02 0.42 0.21 0.00 0.00 175.17 175.52 3dyp s THR 829 N -2.06 4.13 0.57 -1.27 -4.23 -1.26 -0.45 115.64 111.07 3dyp s THR 829 Ca -0.02 -0.30 0.06 0.00 -1.18 0.00 0.00 61.69 60.24 3dyp s THR 829 Cb -0.05 -2.75 0.05 0.00 1.34 0.00 0.00 72.50 71.09 3dyp s THR 829 CO -0.01 0.57 0.46 -0.76 -0.54 0.00 0.00 174.62 174.34 3dyp s LEU 830 N -0.51 2.64 0.21 4.79 1.43 0.27 -4.95 118.68 122.56 3dyp s LEU 830 Ca 0.08 -1.27 -0.10 0.00 -1.03 0.00 0.00 54.13 51.81 3dyp s LEU 830 Cb -0.12 -1.13 0.29 0.00 0.03 0.00 0.00 46.19 45.27 3dyp s LEU 830 CO 0.02 -1.20 1.69 0.00 0.23 0.00 0.00 176.35 177.08 3dyp h ALA 831 N 0.63 0.66 0.00 4.21 0.00 -2.03 -3.19 119.26 119.55 3dyp h ALA 831 Ca -0.35 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3dyp h ALA 831 Cb 1.31 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.34 3dyp h ALA 831 CO 0.55 -0.35 -0.10 -0.40 0.00 0.00 0.00 179.25 178.95 3dyp n ASP 832 N -5.19 1.83 -3.84 0.00 5.75 -1.26 -5.04 116.55 108.79 3dyp n ASP 832 Ca 0.09 -2.76 -0.06 0.00 -0.01 0.00 0.00 54.79 52.04 3dyp n ASP 832 Cb 0.34 -0.35 -0.02 0.00 -1.03 0.00 0.00 41.12 40.06 3dyp n ASP 832 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3dyp s ALA 833 N -2.14 -1.29 -0.03 2.12 0.00 -1.21 -3.07 121.76 116.15 3dyp s ALA 833 Ca 0.23 -0.24 0.08 0.00 0.00 0.00 0.00 51.96 52.03 3dyp s ALA 833 Cb 0.20 0.81 -0.02 0.00 0.00 0.00 0.00 23.12 24.12 3dyp s ALA 833 CO 0.02 -1.04 -0.25 0.08 0.00 0.00 0.00 175.76 174.57 3dyp s VAL 834 N -3.81 2.09 -0.17 0.00 1.01 -0.61 0.95 120.40 119.86 3dyp s VAL 834 Ca 0.11 -1.09 0.01 0.00 0.00 0.00 0.00 61.98 61.02 3dyp s VAL 834 Cb -0.05 -1.73 0.02 0.00 0.00 0.00 0.00 36.38 34.62 3dyp s VAL 834 CO 0.06 0.58 -0.20 -0.22 0.00 0.00 0.00 175.10 175.32 3dyp s LEU 835 N -0.57 2.12 -0.17 3.92 2.96 0.41 -0.20 118.68 127.15 3dyp s LEU 835 Ca 0.09 -0.64 -0.06 0.00 -0.22 0.00 0.00 54.13 53.30 3dyp s LEU 835 Cb -0.10 -1.47 -0.04 0.00 0.50 0.00 0.00 46.19 45.08 3dyp s LEU 835 CO -0.00 0.01 0.02 -0.63 -1.32 0.00 0.00 176.35 174.43 3dyp s ILE 836 N 1.22 4.46 -0.08 6.68 -1.09 -0.22 0.08 121.20 132.25 3dyp s ILE 836 Ca 0.03 -0.16 0.05 0.00 -2.23 0.00 0.00 60.65 58.34 3dyp s ILE 836 Cb -0.13 -2.98 -0.01 0.00 -1.58 0.00 0.00 42.46 37.76 3dyp s ILE 836 CO -0.11 0.48 -0.23 -0.89 -1.23 0.00 0.00 174.94 172.96 3dyp s THR 837 N 0.26 2.22 0.05 2.92 2.01 0.42 -1.08 115.64 122.43 3dyp s THR 837 Ca 0.01 -0.99 0.00 0.00 0.31 0.00 0.00 61.69 61.03 3dyp s THR 837 Cb -0.13 -1.83 -0.03 0.00 0.01 0.00 0.00 72.50 70.52 3dyp s THR 837 CO 0.01 0.56 -0.05 0.42 -0.69 0.00 0.00 174.62 174.88 3dyp s THR 838 N 0.03 0.36 -0.04 -0.82 -4.23 -0.20 -0.74 115.64 110.00 3dyp s THR 838 Ca -0.09 -1.47 -0.03 0.00 -1.18 0.00 0.00 61.69 58.92 3dyp s THR 838 Cb -0.15 -1.07 0.02 0.00 1.34 0.00 0.00 72.50 72.64 3dyp s THR 838 CO 0.05 -0.73 0.11 0.00 -0.54 0.00 0.00 174.62 173.51 3dyp s ALA 839 N -2.75 -0.21 0.07 3.99 0.00 0.00 -1.41 121.76 121.46 3dyp s ALA 839 Ca -0.01 0.41 0.03 0.00 0.00 0.00 0.00 51.96 52.39 3dyp s ALA 839 Cb -0.01 -0.27 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 3dyp s ALA 839 CO -0.05 -0.09 -0.09 -1.01 0.00 0.00 0.00 175.76 174.52 3dyp s HIS 840 N 0.54 0.88 -0.01 0.00 3.76 -0.33 -0.09 115.29 120.04 3dyp s HIS 840 Ca -0.04 -0.58 0.08 0.00 -0.15 0.00 0.00 55.06 54.36 3dyp s HIS 840 Cb -0.06 -0.51 -0.02 0.00 1.11 0.00 0.00 32.58 33.11 3dyp s HIS 840 CO -0.02 -0.05 -0.24 0.00 -0.85 0.00 0.00 174.74 173.58 3dyp s ALA 841 N -1.90 1.99 -0.22 -1.40 0.00 -0.37 -1.15 121.76 118.72 3dyp s ALA 841 Ca -0.02 -1.05 -0.04 0.00 0.00 0.00 0.00 51.96 50.84 3dyp s ALA 841 Cb -0.06 -0.49 -0.01 0.00 0.00 0.00 0.00 23.12 22.55 3dyp s ALA 841 CO -0.00 0.49 -0.02 -1.58 0.00 0.00 0.00 175.76 174.64 3dyp s TRP 842 N -0.59 2.99 0.21 0.00 0.51 0.69 0.74 118.94 123.49 3dyp s TRP 842 Ca 0.09 -0.74 0.06 0.00 -2.12 0.00 0.00 56.10 53.38 3dyp s TRP 842 Cb -0.09 -2.11 -0.05 0.00 -0.81 0.00 0.00 33.47 30.41 3dyp s TRP 842 CO -0.00 -0.44 -0.08 -0.65 -0.51 0.00 0.00 176.95 175.26 3dyp s GLN 843 N 1.35 1.30 -0.22 4.98 -0.21 -1.16 -0.00 119.66 125.71 3dyp s GLN 843 Ca 0.04 -1.61 -0.10 0.00 0.02 0.00 0.00 55.36 53.71 3dyp s GLN 843 Cb -0.14 -0.87 0.08 0.00 1.00 0.00 0.00 33.01 33.08 3dyp s GLN 843 CO -0.01 0.06 0.50 -1.58 -2.12 0.00 0.00 175.29 172.14 3dyp s HIS 844 N -3.18 -0.86 -1.52 0.91 2.46 0.19 -3.32 115.29 109.96 3dyp s HIS 844 Ca 0.24 1.67 -0.06 0.00 0.47 0.00 0.00 55.06 57.37 3dyp s HIS 844 Cb 0.03 0.42 0.05 0.00 -0.13 0.00 0.00 32.58 32.95 3dyp s HIS 844 CO 0.07 -0.47 0.49 1.04 -2.47 0.00 0.00 174.74 173.40 3dyp n GLN 845 N 4.83 -2.96 -0.92 2.88 3.00 -1.26 0.64 117.38 123.59 3dyp n GLN 845 Ca -0.16 0.35 0.00 0.00 -0.01 0.00 0.00 57.00 57.18 3dyp n GLN 845 Cb 0.53 -4.60 0.00 0.00 0.00 0.00 0.00 30.24 26.16 3dyp n GLN 845 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3dyp n GLY 846 N -1.86 0.48 3.73 1.08 0.00 -1.26 -5.01 105.19 102.34 3dyp n GLY 846 Ca -0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 3dyp n GLY 846 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dyp s LYS 847 N -0.54 3.04 -0.36 1.61 2.20 0.21 -5.05 119.74 120.85 3dyp s LYS 847 Ca 0.00 -0.40 -0.25 0.00 -0.36 0.00 0.00 55.97 54.96 3dyp s LYS 847 Cb 0.00 -2.85 0.01 0.00 -1.51 0.00 0.00 37.83 33.48 3dyp s LYS 847 CO 0.00 0.70 0.89 0.99 -0.36 0.00 0.00 175.35 177.56 3dyp s THR 848 N -0.97 4.64 -0.17 3.43 2.01 -1.26 0.54 115.64 123.86 3dyp s THR 848 Ca 0.16 1.15 -0.24 0.00 0.31 0.00 0.00 61.69 63.06 3dyp s THR 848 Cb -0.12 -4.29 -0.22 0.00 0.01 0.00 0.00 72.50 67.89 3dyp s THR 848 CO 0.05 -0.47 0.49 -0.07 -0.69 0.00 0.00 174.62 173.93 3dyp h LEU 849 N 9.92 0.00 -8.16 4.42 3.38 -0.78 -3.41 115.31 120.69 3dyp h LEU 849 Ca -0.23 -0.74 -0.18 0.00 0.09 0.00 0.00 57.88 56.82 3dyp h LEU 849 Cb 1.08 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.65 3dyp h LEU 849 CO 0.96 1.18 -0.70 -0.36 0.09 0.00 0.00 178.44 179.60 3dyp s PHE 850 N -2.26 0.50 -0.06 1.13 0.40 -1.11 -1.67 117.98 114.91 3dyp s PHE 850 Ca -0.22 -0.74 0.02 0.00 -0.60 0.00 0.00 56.93 55.39 3dyp s PHE 850 Cb 0.01 -0.33 0.01 0.00 0.51 0.00 0.00 43.02 43.22 3dyp s PHE 850 CO 0.61 -0.22 -0.12 0.42 0.70 0.00 0.00 175.22 176.62 3dyp s ILE 851 N -2.49 1.07 -0.13 0.64 1.01 -0.06 -0.22 121.20 121.02 3dyp s ILE 851 Ca -0.04 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.19 3dyp s ILE 851 Cb -0.02 -0.98 0.01 0.00 0.01 0.00 0.00 42.46 41.47 3dyp s ILE 851 CO -0.04 0.34 -0.21 -0.55 0.00 0.00 0.00 174.94 174.48 3dyp s SER 852 N 0.63 2.95 -0.10 3.58 0.15 -0.30 -0.70 113.70 119.91 3dyp s SER 852 Ca -0.13 -0.56 0.02 0.00 0.70 0.00 0.00 55.95 55.98 3dyp s SER 852 Cb -0.15 -1.36 -0.01 0.00 -1.71 0.00 0.00 66.02 62.79 3dyp s SER 852 CO 0.03 0.07 -0.17 -0.13 1.20 0.00 0.00 173.24 174.24 3dyp s ARG 853 N 0.81 3.02 0.13 5.44 0.52 -0.09 -1.19 118.95 127.58 3dyp s ARG 853 Ca -0.08 -0.76 -0.01 0.00 -0.52 0.00 0.00 55.73 54.36 3dyp s ARG 853 Cb -0.16 -2.44 -0.04 0.00 0.52 0.00 0.00 34.95 32.83 3dyp s ARG 853 CO -0.01 0.31 0.03 0.15 0.02 0.00 0.00 175.30 175.81 3dyp s LYS 854 N 0.06 0.92 0.03 3.54 1.02 -0.50 -0.49 119.74 124.32 3dyp s LYS 854 Ca -0.07 -1.43 0.04 0.00 0.02 0.00 0.00 55.97 54.53 3dyp s LYS 854 Cb -0.15 0.15 -0.02 0.00 -0.52 0.00 0.00 37.83 37.29 3dyp s LYS 854 CO 0.05 -0.22 -0.13 0.95 -0.92 0.00 0.00 175.35 175.09 3dyp s THR 855 N -3.96 1.00 -0.14 2.17 -4.23 -0.86 -1.03 115.64 108.60 3dyp s THR 855 Ca 0.22 -0.90 0.01 0.00 -1.18 0.00 0.00 61.69 59.83 3dyp s THR 855 Cb 0.07 -0.91 0.02 0.00 1.34 0.00 0.00 72.50 73.02 3dyp s THR 855 CO 0.01 0.01 -0.14 -0.31 -0.54 0.00 0.00 174.62 173.65 3dyp s TYR 856 N -0.79 2.07 -0.23 3.99 1.51 -0.24 -1.24 117.35 122.42 3dyp s TYR 856 Ca 0.01 -1.12 -0.00 0.00 -1.01 0.00 0.00 57.07 54.95 3dyp s TYR 856 Cb -0.07 -1.53 0.03 0.00 -0.11 0.00 0.00 41.96 40.27 3dyp s TYR 856 CO 0.01 -0.62 -0.11 0.50 -1.11 0.00 0.00 175.55 174.23 3dyp s ARG 857 N 1.40 2.84 -0.23 -0.62 3.52 0.49 -1.05 118.95 125.29 3dyp s ARG 857 Ca 0.02 -0.96 -0.07 0.00 -0.13 0.00 0.00 55.73 54.59 3dyp s ARG 857 Cb -0.13 -2.86 -0.03 0.00 -1.56 0.00 0.00 34.95 30.37 3dyp s ARG 857 CO -0.09 -0.35 0.06 0.42 -0.81 0.00 0.00 175.30 174.53 3dyp s ILE 858 N 1.30 4.34 0.56 4.11 1.01 0.73 -1.01 121.20 132.22 3dyp s ILE 858 Ca 0.01 -0.17 0.04 0.00 0.00 0.00 0.00 60.65 60.53 3dyp s ILE 858 Cb -0.16 -3.01 0.04 0.00 0.01 0.00 0.00 42.46 39.34 3dyp s ILE 858 CO -0.07 0.37 0.36 -0.90 0.00 0.00 0.00 174.94 174.70 3dyp n ASP 859 N 4.64 2.89 0.29 3.58 5.68 -1.04 -1.58 116.55 131.02 3dyp n ASP 859 Ca -0.16 -2.98 0.18 0.00 -0.50 0.00 0.00 54.79 51.32 3dyp n ASP 859 Cb 0.52 0.02 0.91 0.00 -1.14 0.00 0.00 41.12 41.42 3dyp n ASP 859 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 3dyp h GLY 860 N 0.75 0.00 0.55 6.12 0.00 -1.68 0.93 103.07 109.74 3dyp h GLY 860 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.96 3dyp h GLY 860 CO 0.58 0.00 -0.24 -1.14 0.00 0.00 0.00 176.54 175.74 3dyp n SER 861 N -3.16 0.79 0.00 0.19 3.41 -1.26 -4.06 113.62 109.53 3dyp n SER 861 Ca -0.01 -0.69 0.00 0.00 -0.26 0.00 0.00 58.87 57.91 3dyp n SER 861 Cb 0.32 0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 3dyp n SER 861 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dyp n GLY 862 N 1.35 0.97 3.80 5.00 0.00 0.32 -4.99 105.19 111.64 3dyp n GLY 862 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 3dyp n GLY 862 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dyp s GLN 863 N -0.31 4.37 -0.31 1.61 -0.21 -1.26 -4.54 119.66 119.01 3dyp s GLN 863 Ca 0.00 0.96 -0.06 0.00 0.02 0.00 0.00 55.36 56.27 3dyp s GLN 863 Cb 0.00 -3.10 0.02 0.00 1.00 0.00 0.00 33.01 30.93 3dyp s GLN 863 CO 0.00 0.51 0.08 1.41 -2.12 0.00 0.00 175.29 175.18 3dyp s MET 864 N -1.47 2.93 -0.25 2.91 -2.45 0.12 -2.48 119.30 118.61 3dyp s MET 864 Ca 0.37 -0.96 -0.18 0.00 -1.25 0.00 0.00 55.69 53.67 3dyp s MET 864 Cb -0.20 -3.39 -0.03 0.00 1.25 0.00 0.00 34.83 32.47 3dyp s MET 864 CO 0.23 -0.51 0.53 0.00 1.05 0.00 0.00 175.02 176.31 3dyp s ALA 865 N 1.46 3.59 -0.22 4.11 0.00 -0.18 -0.35 121.76 130.17 3dyp s ALA 865 Ca 0.01 -0.55 -0.04 0.00 0.00 0.00 0.00 51.96 51.38 3dyp s ALA 865 Cb -0.18 -2.89 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 3dyp s ALA 865 CO 0.02 -0.70 -0.04 0.42 0.00 0.00 0.00 175.76 175.47 3dyp s ILE 866 N 2.22 3.45 -0.14 0.00 1.01 0.37 -0.38 121.20 127.74 3dyp s ILE 866 Ca 0.22 -0.47 -0.03 0.00 0.00 0.00 0.00 60.65 60.38 3dyp s ILE 866 Cb -0.16 -2.57 -0.03 0.00 0.01 0.00 0.00 42.46 39.72 3dyp s ILE 866 CO 0.09 0.42 -0.04 -0.89 0.00 0.00 0.00 174.94 174.52 3dyp s THR 867 N 1.42 3.90 -0.10 2.92 2.01 -0.38 -0.52 115.64 124.89 3dyp s THR 867 Ca 0.05 -0.37 0.02 0.00 0.31 0.00 0.00 61.69 61.70 3dyp s THR 867 Cb -0.14 -2.68 0.01 0.00 0.01 0.00 0.00 72.50 69.70 3dyp s THR 867 CO -0.02 0.52 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.59 3dyp s VAL 868 N 0.06 1.48 -0.17 3.82 1.01 0.10 -2.03 120.40 124.67 3dyp s VAL 868 Ca -0.00 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.35 3dyp s VAL 868 Cb -0.13 -1.35 0.03 0.00 0.00 0.00 0.00 36.38 34.93 3dyp s VAL 868 CO 0.03 0.44 -0.14 -1.81 0.00 0.00 0.00 175.10 173.61 3dyp s ASP 869 N 0.94 3.03 0.06 3.32 1.01 0.36 -1.20 116.67 124.18 3dyp s ASP 869 Ca -0.08 -0.66 0.08 0.00 0.71 0.00 0.00 52.55 52.61 3dyp s ASP 869 Cb -0.15 -1.27 -0.03 0.00 1.01 0.00 0.00 42.92 42.48 3dyp s ASP 869 CO -0.01 -0.07 -0.21 -0.69 0.21 0.00 0.00 175.17 174.41 3dyp s VAL 870 N 1.41 2.62 -0.06 -1.27 1.01 0.15 -0.91 120.40 123.34 3dyp s VAL 870 Ca 0.03 -1.31 0.05 0.00 0.00 0.00 0.00 61.98 60.74 3dyp s VAL 870 Cb -0.14 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 3dyp s VAL 870 CO -0.10 0.30 -0.20 -1.61 0.00 0.00 0.00 175.10 173.48 3dyp s GLU 871 N -1.53 2.61 -0.16 2.72 2.02 0.12 -1.13 118.70 123.35 3dyp s GLU 871 Ca 0.14 -0.81 0.01 0.00 0.02 0.00 0.00 54.97 54.33 3dyp s GLU 871 Cb -0.10 -2.29 0.03 0.00 0.10 0.00 0.00 34.13 31.86 3dyp s GLU 871 CO 0.05 0.46 -0.15 0.08 0.02 0.00 0.00 175.26 175.72 3dyp s VAL 872 N -0.32 1.69 0.29 2.63 1.01 0.36 -0.88 120.40 125.18 3dyp s VAL 872 Ca 0.02 -0.76 -0.29 0.00 0.00 0.00 0.00 61.98 60.95 3dyp s VAL 872 Cb -0.13 -1.60 -0.13 0.00 0.00 0.00 0.00 36.38 34.52 3dyp s VAL 872 CO 0.02 0.43 1.15 0.00 0.00 0.00 0.00 175.10 176.70 3dyp n ALA 873 N 4.72 0.37 0.24 5.51 0.00 -0.67 -4.63 120.51 126.05 3dyp n ALA 873 Ca -0.17 0.39 0.08 0.00 0.00 0.00 0.00 53.44 53.73 3dyp n ALA 873 Cb 0.49 -2.12 0.58 0.00 0.00 0.00 0.00 19.45 18.40 3dyp n ALA 873 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3dyp h SER 874 N 2.46 0.00 -0.30 0.00 4.64 -1.94 -2.23 113.55 116.18 3dyp h SER 874 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 3dyp h SER 874 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3dyp h SER 874 CO 0.63 0.17 0.00 -0.90 -0.87 0.00 0.00 176.83 175.86 3dyp n ASP 875 N -4.06 2.38 -4.89 4.97 5.75 -1.26 -4.88 116.55 114.56 3dyp n ASP 875 Ca -0.02 -1.86 -0.30 0.00 -0.01 0.00 0.00 54.79 52.59 3dyp n ASP 875 Cb 0.25 -0.20 -0.04 0.00 -1.03 0.00 0.00 41.12 40.10 3dyp n ASP 875 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 3dyp s THR 876 N -1.61 5.02 0.37 2.12 -1.32 -0.84 -5.01 115.64 114.36 3dyp s THR 876 Ca 0.34 0.19 -0.27 0.00 -1.21 0.00 0.00 61.69 60.73 3dyp s THR 876 Cb 0.19 -3.67 -0.11 0.00 -1.51 0.00 0.00 72.50 67.39 3dyp s THR 876 CO 0.27 -0.15 1.32 -0.81 -2.21 0.00 0.00 174.62 173.03 3dyp n PRO 877 N -0.43 2.18 -1.66 7.08 -0.04 -1.26 -4.85 135.00 136.02 3dyp n PRO 877 Ca -0.01 0.77 -0.47 0.00 -0.04 0.00 0.00 63.50 63.74 3dyp n PRO 877 Cb 0.53 -2.40 -0.05 0.00 -0.04 0.00 0.00 33.50 31.54 3dyp n PRO 877 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3dyp n HIS 878 N 0.22 2.17 -1.73 0.54 8.25 -1.26 -4.91 115.22 118.50 3dyp n HIS 878 Ca 0.04 0.29 -0.32 0.00 -0.26 0.00 0.00 57.72 57.48 3dyp n HIS 878 Cb 0.37 -2.53 0.04 0.00 1.12 0.00 0.00 29.99 29.00 3dyp n HIS 878 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3dyp s PRO 879 N 1.24 2.93 0.45 -0.41 0.04 -1.26 -4.86 135.00 133.13 3dyp s PRO 879 Ca 0.81 1.18 0.18 0.00 0.04 0.00 0.00 61.00 63.21 3dyp s PRO 879 Cb -0.73 -1.98 1.07 0.00 0.04 0.00 0.00 34.50 32.90 3dyp s PRO 879 CO 0.41 -1.12 1.98 0.00 0.04 0.00 0.00 177.00 178.31 3dyp h ALA 880 N -0.20 1.51 -2.34 8.56 0.00 -1.90 -3.41 119.26 121.48 3dyp h ALA 880 Ca -0.45 -0.19 0.16 0.00 0.00 0.00 0.00 54.91 54.43 3dyp h ALA 880 Cb 1.23 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.89 3dyp h ALA 880 CO 0.55 0.26 0.48 -0.98 0.00 0.00 0.00 179.25 179.56 3dyp s ARG 881 N -4.41 1.12 -0.29 0.00 1.70 -1.23 -0.51 118.95 115.33 3dyp s ARG 881 Ca -0.03 -0.58 -0.04 0.00 -0.47 0.00 0.00 55.73 54.61 3dyp s ARG 881 Cb 0.15 0.41 0.10 0.00 -0.57 0.00 0.00 34.95 35.03 3dyp s ARG 881 CO 0.67 -0.51 0.14 0.42 -1.08 0.00 0.00 175.30 174.95 3dyp s ILE 882 N -3.26 -0.10 0.00 4.99 1.01 -0.55 -4.23 121.20 119.06 3dyp s ILE 882 Ca 0.11 -0.73 0.00 0.00 0.00 0.00 0.00 60.65 60.02 3dyp s ILE 882 Cb -0.01 -0.98 0.00 0.00 0.01 0.00 0.00 42.46 41.48 3dyp s ILE 882 CO -0.00 -0.70 0.00 0.61 0.00 0.00 0.00 174.94 174.84 3dyp n GLY 883 N 5.26 2.24 3.37 6.18 0.00 -0.79 -0.43 105.19 121.02 3dyp n GLY 883 Ca -0.06 -0.94 -0.20 0.00 0.00 0.00 0.00 46.02 44.82 3dyp n GLY 883 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dyp s LEU 884 N 0.00 2.55 0.08 0.99 1.43 0.98 -0.37 118.68 124.33 3dyp s LEU 884 Ca 0.00 -1.00 -0.08 0.00 -1.03 0.00 0.00 54.13 52.02 3dyp s LEU 884 Cb 0.00 -0.80 -0.00 0.00 0.03 0.00 0.00 46.19 45.42 3dyp s LEU 884 CO 0.00 -0.10 0.17 0.54 0.23 0.00 0.00 176.35 177.19 3dyp s ASN 885 N -3.28 0.14 0.16 2.29 4.22 0.67 -0.92 114.94 118.22 3dyp s ASN 885 Ca 0.23 -0.63 -0.23 0.00 -2.14 0.00 0.00 52.86 50.09 3dyp s ASN 885 Cb -0.02 0.32 0.06 0.00 1.28 0.00 0.00 41.25 42.89 3dyp s ASN 885 CO 0.09 -0.68 0.69 0.00 -2.04 0.00 0.00 177.10 175.15 3dyp s GLN 887 N -3.68 2.71 0.39 0.00 0.74 -1.25 -1.05 119.66 117.53 3dyp s GLN 887 Ca 0.04 -1.11 -0.25 0.00 0.05 0.00 0.00 55.36 54.09 3dyp s GLN 887 Cb -0.02 -3.38 -0.09 0.00 1.10 0.00 0.00 33.01 30.63 3dyp s GLN 887 CO -0.07 -0.60 1.12 -0.51 -0.55 0.00 0.00 175.29 174.68 3dyp s LEU 888 N 1.40 4.21 0.25 3.68 1.43 0.10 0.77 118.68 130.52 3dyp s LEU 888 Ca -0.01 2.23 0.11 0.00 -1.03 0.00 0.00 54.13 55.42 3dyp s LEU 888 Cb -0.19 -4.04 0.23 0.00 0.03 0.00 0.00 46.19 42.22 3dyp s LEU 888 CO 0.02 -0.56 1.53 0.00 0.23 0.00 0.00 176.35 177.57 3dyp h ALA 889 N 2.70 0.79 -2.22 4.21 0.00 -0.58 -1.67 119.26 122.49 3dyp h ALA 889 Ca -0.48 -0.62 -0.47 0.00 0.00 0.00 0.00 54.91 53.34 3dyp h ALA 889 Cb 1.23 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 3dyp h ALA 889 CO 0.63 0.85 -0.43 -0.65 0.00 0.00 0.00 179.25 179.65 3dyp s GLN 890 N -3.32 3.44 -0.09 0.00 1.11 -1.26 -4.11 119.66 115.43 3dyp s GLN 890 Ca -0.00 -0.74 0.03 0.00 0.01 0.00 0.00 55.36 54.66 3dyp s GLN 890 Cb 0.11 -2.89 -0.02 0.00 -1.01 0.00 0.00 33.01 29.21 3dyp s GLN 890 CO 0.77 0.43 -0.17 0.08 0.01 0.00 0.00 175.29 176.40 3dyp s VAL 891 N -1.97 2.72 0.16 1.09 1.01 -1.26 -3.58 120.40 118.57 3dyp s VAL 891 Ca 0.34 -0.81 0.09 0.00 0.00 0.00 0.00 61.98 61.60 3dyp s VAL 891 Cb -0.09 -2.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 3dyp s VAL 891 CO 0.29 0.56 -0.19 0.00 0.00 0.00 0.00 175.10 175.75 3dyp s ALA 892 N -0.06 2.05 0.15 5.51 0.00 -1.26 -5.04 121.76 123.11 3dyp s ALA 892 Ca -0.04 -1.48 -0.11 0.00 0.00 0.00 0.00 51.96 50.34 3dyp s ALA 892 Cb -0.14 -0.21 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 3dyp s ALA 892 CO 0.04 0.28 1.52 0.93 0.00 0.00 0.00 175.76 178.53 3dyp h GLU 893 N 3.36 0.97 -5.68 0.00 4.39 -2.00 -3.42 114.58 112.20 3dyp h GLU 893 Ca -0.43 -0.44 -0.52 0.00 0.34 0.00 0.00 59.36 58.31 3dyp h GLU 893 Cb 1.20 -0.02 -0.14 0.00 -0.10 0.00 0.00 28.75 29.70 3dyp h GLU 893 CO 0.49 1.11 -0.70 1.03 -1.16 0.00 0.00 179.01 179.78 3dyp s ARG 894 N -4.59 1.56 -0.09 2.33 1.81 -1.26 -1.58 118.95 117.13 3dyp s ARG 894 Ca -0.11 -1.76 0.01 0.00 -1.72 0.00 0.00 55.73 52.15 3dyp s ARG 894 Cb 0.12 -1.31 0.02 0.00 -0.45 0.00 0.00 34.95 33.33 3dyp s ARG 894 CO 0.87 0.12 -0.11 0.08 -0.68 0.00 0.00 175.30 175.59 3dyp s VAL 895 N -2.88 1.14 -0.08 3.52 1.01 0.14 -4.54 120.40 118.71 3dyp s VAL 895 Ca 0.28 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.85 3dyp s VAL 895 Cb 0.01 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.32 3dyp s VAL 895 CO 0.12 0.37 -0.15 0.21 0.00 0.00 0.00 175.10 175.65 3dyp s ASN 896 N 1.05 2.17 0.10 3.32 3.84 -0.93 -0.63 114.94 123.85 3dyp s ASN 896 Ca -0.07 -0.37 -0.11 0.00 0.21 0.00 0.00 52.86 52.52 3dyp s ASN 896 Cb -0.15 -0.99 0.01 0.00 -0.55 0.00 0.00 41.25 39.58 3dyp s ASN 896 CO -0.01 0.04 0.24 -1.66 -2.79 0.00 0.00 177.10 172.92 3dyp s TRP 897 N 0.75 0.06 -0.36 0.43 -2.14 -0.40 0.28 118.94 117.55 3dyp s TRP 897 Ca -0.12 -0.45 -0.01 0.00 2.66 0.00 0.00 56.10 58.17 3dyp s TRP 897 Cb -0.16 0.02 0.09 0.00 -3.10 0.00 0.00 33.47 30.32 3dyp s TRP 897 CO 0.03 -0.58 0.11 -1.17 -2.66 0.00 0.00 176.95 172.67 3dyp s LEU 898 N -2.81 4.68 0.00 -4.66 2.96 0.79 0.04 118.68 119.67 3dyp s LEU 898 Ca 0.04 -1.77 0.00 0.00 -0.22 0.00 0.00 54.13 52.18 3dyp s LEU 898 Cb 0.04 -1.76 0.00 0.00 0.50 0.00 0.00 46.19 44.97 3dyp s LEU 898 CO -0.11 -0.41 0.00 0.61 -1.32 0.00 0.00 176.35 175.12 3dyp n GLY 899 N 4.55 -0.58 3.76 7.98 0.00 -0.56 -0.37 105.19 119.97 3dyp n GLY 899 Ca -0.05 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 44.90 3dyp n GLY 899 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dyp s LEU 900 N 0.00 4.60 0.00 0.99 1.43 -0.93 -1.75 118.68 123.02 3dyp s LEU 900 Ca 0.00 1.79 0.00 0.00 -1.03 0.00 0.00 54.13 54.89 3dyp s LEU 900 Cb 0.00 -3.48 0.00 0.00 0.03 0.00 0.00 46.19 42.74 3dyp s LEU 900 CO 0.00 0.14 0.00 0.61 0.23 0.00 0.00 176.35 177.33 3dyp n GLY 901 N 1.69 -0.77 0.16 -3.19 0.00 0.14 -4.44 105.19 98.78 3dyp n GLY 901 Ca -0.03 -0.73 0.12 0.00 0.00 0.00 0.00 46.02 45.38 3dyp n GLY 901 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dyp h PRO 902 N 0.00 0.00 -7.38 1.61 0.13 -1.94 0.24 132.00 124.65 3dyp h PRO 902 Ca 0.00 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.66 3dyp h PRO 902 Cb 0.00 0.00 0.08 0.00 0.13 0.00 0.00 31.00 31.21 3dyp h PRO 902 CO 0.00 0.00 0.30 -0.65 -0.23 0.00 0.00 178.00 177.42 3dyp s GLN 903 N -3.27 2.34 0.21 0.86 -0.21 -1.26 -4.99 119.66 113.35 3dyp s GLN 903 Ca 0.04 -0.01 -0.31 0.00 0.02 0.00 0.00 55.36 55.10 3dyp s GLN 903 Cb 0.08 -2.10 -0.15 0.00 1.00 0.00 0.00 33.01 31.84 3dyp s GLN 903 CO 0.72 -1.22 1.17 -1.91 -2.12 0.00 0.00 175.29 171.93 3dyp n GLU 904 N -2.99 1.36 -3.75 2.91 2.13 -1.26 -4.88 120.64 114.16 3dyp n GLU 904 Ca 0.07 0.48 -0.13 0.00 0.66 0.00 0.00 57.16 58.24 3dyp n GLU 904 Cb 0.60 -1.97 -0.09 0.00 0.27 0.00 0.00 31.44 30.24 3dyp n GLU 904 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3dyp s ASN 905 N -0.09 -0.26 0.30 4.31 2.20 0.12 -4.92 114.94 116.60 3dyp s ASN 905 Ca 0.69 0.31 0.06 0.00 -0.94 0.00 0.00 52.86 52.98 3dyp s ASN 905 Cb -0.78 0.46 -0.06 0.00 -2.00 0.00 0.00 41.25 38.87 3dyp s ASN 905 CO 0.54 -0.34 -0.02 -0.31 -2.94 0.00 0.00 177.10 174.02 3dyp s TYR 906 N -0.81 2.01 0.28 1.54 1.51 -0.85 -3.70 117.35 117.34 3dyp s TYR 906 Ca -0.09 -0.76 0.02 0.00 -1.01 0.00 0.00 57.07 55.23 3dyp s TYR 906 Cb -0.04 -1.22 0.59 0.00 -0.11 0.00 0.00 41.96 41.18 3dyp s TYR 906 CO 0.03 0.23 1.82 -1.35 -1.11 0.00 0.00 175.55 175.17 3dyp h PRO 907 N 2.19 0.89 -0.62 -1.71 0.11 -1.86 0.21 132.00 131.21 3dyp h PRO 907 Ca -0.41 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3dyp h PRO 907 Cb 1.24 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3dyp h PRO 907 CO 0.69 0.59 0.00 -0.40 -0.21 0.00 0.00 178.00 178.67 3dyp n ASP 908 N -4.67 3.33 -3.03 -2.05 5.75 -1.26 -4.36 116.55 110.25 3dyp n ASP 908 Ca 0.20 -2.00 -0.16 0.00 -0.01 0.00 0.00 54.79 52.81 3dyp n ASP 908 Cb 0.41 -0.41 -0.01 0.00 -1.03 0.00 0.00 41.12 40.08 3dyp n ASP 908 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 3dyp n ARG 909 N 1.32 0.87 -0.17 0.11 0.63 0.70 -0.70 116.66 119.43 3dyp n ARG 909 Ca 0.21 -2.80 0.01 0.00 -0.92 0.00 0.00 57.85 54.35 3dyp n ARG 909 Cb 0.52 -1.40 0.01 0.00 0.45 0.00 0.00 32.46 32.05 3dyp n ARG 909 CO 0.00 0.00 0.00 1.47 -2.51 0.00 0.00 177.63 176.59 3dyp n LEU 910 N 0.84 0.46 -0.04 6.15 -0.00 -0.96 -2.02 117.00 121.43 3dyp n LEU 910 Ca 0.18 -0.85 -0.05 0.00 -0.00 0.00 0.00 56.01 55.29 3dyp n LEU 910 Cb 0.63 -0.04 0.16 0.00 -0.00 0.00 0.00 43.42 44.16 3dyp n LEU 910 CO 0.14 0.21 0.75 0.71 -0.00 0.00 0.00 177.39 179.19 3dyp h THR 911 N 3.63 1.26 0.00 1.47 1.35 -1.91 -2.77 112.91 115.94 3dyp h THR 911 Ca 0.00 -1.25 -0.06 0.00 -0.55 0.00 0.00 66.41 64.56 3dyp h THR 911 Cb 1.06 1.23 -0.01 0.00 -1.73 0.00 0.00 68.15 68.70 3dyp h THR 911 CO 0.00 0.41 -0.26 0.00 -0.25 0.00 0.00 175.52 175.41 3dyp h ALA 912 N 1.22 0.96 -2.53 6.62 0.00 -1.88 -3.45 119.26 120.20 3dyp h ALA 912 Ca 0.09 -0.24 -0.50 0.00 0.00 0.00 0.00 54.91 54.26 3dyp h ALA 912 Cb 0.66 -0.04 0.06 0.00 0.00 0.00 0.00 17.79 18.47 3dyp h ALA 912 CO 0.05 0.33 0.42 0.00 0.00 0.00 0.00 179.25 180.05 3dyp s ALA 913 N -3.51 2.72 0.10 0.00 0.00 -1.05 -4.99 121.76 115.03 3dyp s ALA 913 Ca 0.01 0.75 0.09 0.00 0.00 0.00 0.00 51.96 52.82 3dyp s ALA 913 Cb 0.10 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 3dyp s ALA 913 CO 0.66 -0.71 -0.20 0.00 0.00 0.00 0.00 175.76 175.51 3dyp s PHE 915 N -1.08 3.28 0.01 0.00 5.36 -1.26 -0.68 117.98 123.61 3dyp s PHE 915 Ca 0.16 1.23 -0.02 0.00 -0.96 0.00 0.00 56.93 57.34 3dyp s PHE 915 Cb -0.10 -3.27 0.01 0.00 -0.34 0.00 0.00 43.02 39.32 3dyp s PHE 915 CO 0.08 -0.52 0.10 -3.47 -1.46 0.00 0.00 175.22 169.95 3dyp n ASP 916 N 6.30 -0.15 -4.53 6.13 -0.08 -0.72 -4.94 116.55 118.57 3dyp n ASP 916 Ca 0.09 -1.07 -0.40 0.00 -1.51 0.00 0.00 54.79 51.90 3dyp n ASP 916 Cb 0.47 0.24 -0.11 0.00 2.34 0.00 0.00 41.12 44.06 3dyp n ASP 916 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 3dyp s ARG 917 N -2.00 3.55 0.20 -0.67 6.06 -1.26 -1.50 118.95 123.33 3dyp s ARG 917 Ca 0.02 -0.60 0.10 0.00 -2.50 0.00 0.00 55.73 52.75 3dyp s ARG 917 Cb -0.00 -3.75 -0.04 0.00 0.06 0.00 0.00 34.95 31.21 3dyp s ARG 917 CO 0.00 -0.40 -0.15 -1.58 -2.50 0.00 0.00 175.30 170.67 3dyp s TRP 918 N 1.72 2.48 -0.16 5.12 0.52 0.11 -4.96 118.94 123.76 3dyp s TRP 918 Ca 0.06 -0.28 -0.06 0.00 0.02 0.00 0.00 56.10 55.84 3dyp s TRP 918 Cb -0.17 -1.20 0.08 0.00 -1.15 0.00 0.00 33.47 31.03 3dyp s TRP 918 CO 0.10 0.54 0.33 0.34 0.02 0.00 0.00 176.95 178.28 3dyp s ASP 919 N -2.90 0.10 0.12 2.95 -1.08 -1.26 -1.28 116.67 113.33 3dyp s ASP 919 Ca 0.24 0.75 0.01 0.00 -0.52 0.00 0.00 52.55 53.03 3dyp s ASP 919 Cb -0.08 0.99 -0.04 0.00 -1.46 0.00 0.00 42.92 42.32 3dyp s ASP 919 CO 0.13 -0.24 -0.02 -0.76 0.52 0.00 0.00 175.17 174.80 3dyp s LEU 920 N 2.51 2.28 0.51 -1.34 1.43 0.20 -4.96 118.68 119.31 3dyp s LEU 920 Ca 0.00 -1.09 -0.23 0.00 -1.03 0.00 0.00 54.13 51.79 3dyp s LEU 920 Cb -0.12 0.00 -0.06 0.00 0.03 0.00 0.00 46.19 46.05 3dyp s LEU 920 CO -0.11 -0.55 1.34 -2.16 0.23 0.00 0.00 176.35 175.11 3dyp s PRO 921 N -3.90 3.34 0.29 1.29 0.04 -1.26 0.28 135.00 135.08 3dyp s PRO 921 Ca 0.17 2.20 0.03 0.00 0.04 0.00 0.00 61.00 63.44 3dyp s PRO 921 Cb 0.06 -2.36 0.65 0.00 0.04 0.00 0.00 34.50 32.89 3dyp s PRO 921 CO -0.02 -1.02 1.78 1.25 0.04 0.00 0.00 177.00 179.04 3dyp h LEU 922 N 1.72 0.74 -2.04 -3.56 5.85 -1.55 -1.82 115.31 114.65 3dyp h LEU 922 Ca -0.51 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.28 3dyp h LEU 922 Cb 1.29 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.27 3dyp h LEU 922 CO 0.58 0.30 -0.09 0.77 -0.34 0.00 0.00 178.44 179.66 3dyp h SER 923 N 0.76 0.00 0.44 1.25 4.64 -1.91 0.11 113.55 118.85 3dyp h SER 923 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 3dyp h SER 923 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 3dyp h SER 923 CO -0.36 0.09 0.00 0.47 -0.87 0.00 0.00 176.83 176.16 3dyp n ASP 924 N -3.72 0.37 -0.50 4.97 8.00 -0.68 -1.45 116.55 123.53 3dyp n ASP 924 Ca -0.02 0.61 0.09 0.00 0.71 0.00 0.00 54.79 56.18 3dyp n ASP 924 Cb 0.20 -0.68 0.32 0.00 -0.02 0.00 0.00 41.12 40.94 3dyp n ASP 924 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3dyp n MET 925 N -1.93 1.65 -4.93 -1.24 2.81 0.40 -4.73 117.12 109.15 3dyp n MET 925 Ca 0.02 -0.99 -0.27 0.00 -1.81 0.00 0.00 57.70 54.65 3dyp n MET 925 Cb 0.15 -1.34 -0.16 0.00 -0.71 0.00 0.00 33.22 31.16 3dyp n MET 925 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 3dyp s TYR 926 N -1.75 1.81 -0.29 2.03 5.04 -0.53 -4.50 117.35 119.17 3dyp s TYR 926 Ca 0.28 -0.47 -0.09 0.00 -2.44 0.00 0.00 57.07 54.35 3dyp s TYR 926 Cb 0.15 -1.20 -0.02 0.00 0.35 0.00 0.00 41.96 41.24 3dyp s TYR 926 CO 0.22 -0.13 0.13 0.99 -1.34 0.00 0.00 175.55 175.42 3dyp s THR 927 N -0.15 4.61 -1.50 4.34 2.01 -1.26 -4.97 115.64 118.71 3dyp s THR 927 Ca -0.00 -0.26 -0.10 0.00 0.31 0.00 0.00 61.69 61.64 3dyp s THR 927 Cb -0.10 -3.27 -0.07 0.00 0.01 0.00 0.00 72.50 69.07 3dyp s THR 927 CO 0.01 0.18 2.74 -0.81 -0.69 0.00 0.00 174.62 176.06 3dyp n PRO 928 N 4.97 3.35 -1.84 4.92 -0.04 -1.26 -4.89 135.00 140.22 3dyp n PRO 928 Ca -0.15 -2.16 -0.41 0.00 -0.04 0.00 0.00 63.50 60.74 3dyp n PRO 928 Cb 0.50 -2.83 -0.01 0.00 -0.04 0.00 0.00 33.50 31.12 3dyp n PRO 928 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3dyp s TYR 929 N 2.52 2.73 0.21 0.54 1.51 -1.26 -4.87 117.35 118.73 3dyp s TYR 929 Ca 0.63 1.02 -0.09 0.00 -1.01 0.00 0.00 57.07 57.61 3dyp s TYR 929 Cb 0.16 -3.99 0.25 0.00 -0.11 0.00 0.00 41.96 38.27 3dyp s TYR 929 CO -0.06 -3.11 1.79 0.28 -1.11 0.00 0.00 175.55 173.34 3dyp h VAL 930 N 3.21 0.93 -3.15 0.71 2.07 -1.96 -3.26 116.25 114.80 3dyp h VAL 930 Ca -0.49 -0.21 -0.67 0.00 0.82 0.00 0.00 66.70 66.14 3dyp h VAL 930 Cb 1.23 0.25 -0.17 0.00 -1.52 0.00 0.00 31.29 31.08 3dyp h VAL 930 CO 0.72 0.11 0.15 0.12 0.02 0.00 0.00 177.57 178.69 3dyp s PHE 931 N -6.09 2.99 0.62 1.57 5.36 -1.26 -0.29 117.98 120.87 3dyp s PHE 931 Ca -0.13 -0.55 -0.17 0.00 -0.96 0.00 0.00 56.93 55.12 3dyp s PHE 931 Cb 0.16 -3.73 -0.02 0.00 -0.34 0.00 0.00 43.02 39.09 3dyp s PHE 931 CO 0.76 -1.16 1.12 -2.14 -1.46 0.00 0.00 175.22 172.34 3dyp s PRO 932 N 2.89 3.00 0.10 10.12 0.02 -1.23 -4.95 135.00 144.95 3dyp s PRO 932 Ca 0.17 1.48 -0.07 0.00 0.02 0.00 0.00 61.00 62.59 3dyp s PRO 932 Cb -0.19 -1.97 0.03 0.00 0.02 0.00 0.00 34.50 32.39 3dyp s PRO 932 CO 0.12 -1.11 0.36 -1.13 -0.33 0.00 0.00 177.00 174.91 3dyp n SER 933 N -2.00 -0.74 -4.64 2.53 3.41 -1.26 -4.77 113.62 106.16 3dyp n SER 933 Ca 0.11 -1.44 -0.48 0.00 -0.26 0.00 0.00 58.87 56.80 3dyp n SER 933 Cb 0.52 1.21 -0.04 0.00 -0.26 0.00 0.00 64.21 65.63 3dyp n SER 933 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3dyp n GLU 934 N -0.25 1.76 -3.74 4.33 4.07 -0.62 -4.93 120.64 121.27 3dyp n GLU 934 Ca -0.02 0.63 -0.09 0.00 -0.06 0.00 0.00 57.16 57.63 3dyp n GLU 934 Cb 0.22 -2.32 -0.02 0.00 -0.06 0.00 0.00 31.44 29.26 3dyp n GLU 934 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 3dyp s ASN 935 N 0.57 -0.32 0.00 4.31 2.20 -1.26 -4.90 114.94 115.54 3dyp s ASN 935 Ca 0.77 -0.46 0.00 0.00 -0.94 0.00 0.00 52.86 52.23 3dyp s ASN 935 Cb -0.76 0.67 0.00 0.00 -2.00 0.00 0.00 41.25 39.16 3dyp s ASN 935 CO 0.44 -1.20 0.00 0.61 -2.94 0.00 0.00 177.10 174.01 3dyp n GLY 936 N -0.42 0.47 3.73 0.45 0.00 -1.26 -4.80 105.19 103.36 3dyp n GLY 936 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 3dyp n GLY 936 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dyp s LEU 937 N 0.00 3.33 -0.04 0.99 2.96 -1.26 -4.58 118.68 120.09 3dyp s LEU 937 Ca 0.00 2.32 0.02 0.00 -0.22 0.00 0.00 54.13 56.25 3dyp s LEU 937 Cb 0.00 -4.59 0.01 0.00 0.50 0.00 0.00 46.19 42.11 3dyp s LEU 937 CO 0.00 -2.19 -0.08 -0.13 -1.32 0.00 0.00 176.35 172.63 3dyp s ARG 938 N -3.91 1.00 0.50 1.98 3.00 -0.38 0.11 118.95 121.25 3dyp s ARG 938 Ca 0.74 -0.25 0.05 0.00 0.00 0.00 0.00 55.73 56.27 3dyp s ARG 938 Cb -0.28 -0.93 0.05 0.00 0.00 0.00 0.00 34.95 33.79 3dyp s ARG 938 CO 0.45 0.04 0.43 0.00 0.00 0.00 0.00 175.30 176.22 3dyp n GLY 940 N -1.00 -0.52 3.68 0.00 0.00 -1.18 -2.18 105.19 104.00 3dyp n GLY 940 Ca 0.01 0.13 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 3dyp n GLY 940 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dyp s THR 941 N -3.13 5.36 -0.06 2.61 2.01 -0.24 -3.53 115.64 118.66 3dyp s THR 941 Ca 0.36 0.22 0.19 0.00 0.31 0.00 0.00 61.69 62.77 3dyp s THR 941 Cb -0.17 -3.51 -0.28 0.00 0.01 0.00 0.00 72.50 68.55 3dyp s THR 941 CO 0.45 0.36 0.34 0.54 -0.69 0.00 0.00 174.62 175.62 3dyp n ARG 942 N 4.09 0.70 -3.71 4.92 5.12 0.51 -0.59 116.66 127.69 3dyp n ARG 942 Ca -0.15 -0.14 -0.11 0.00 -1.93 0.00 0.00 57.85 55.52 3dyp n ARG 942 Cb 0.52 -1.46 -0.11 0.00 -1.16 0.00 0.00 32.46 30.26 3dyp n ARG 942 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 3dyp s GLU 943 N -3.13 0.42 -0.05 5.56 2.12 -1.14 -1.51 118.70 120.97 3dyp s GLU 943 Ca -0.07 0.72 0.02 0.00 0.36 0.00 0.00 54.97 56.00 3dyp s GLU 943 Cb 0.11 0.06 0.01 0.00 0.26 0.00 0.00 34.13 34.57 3dyp s GLU 943 CO 0.79 -0.12 -0.11 -1.17 -0.54 0.00 0.00 175.26 174.10 3dyp s LEU 944 N 1.00 1.69 -0.07 2.70 2.96 0.12 -0.15 118.68 126.94 3dyp s LEU 944 Ca -0.06 -0.25 0.04 0.00 -0.22 0.00 0.00 54.13 53.64 3dyp s LEU 944 Cb -0.07 -0.71 0.00 0.00 0.50 0.00 0.00 46.19 45.91 3dyp s LEU 944 CO -0.08 0.05 -0.19 0.20 -1.32 0.00 0.00 176.35 175.01 3dyp s ASN 945 N 0.45 2.47 -0.21 3.68 0.01 0.14 -0.58 114.94 120.90 3dyp s ASN 945 Ca -0.09 -0.42 -0.05 0.00 -0.71 0.00 0.00 52.86 51.59 3dyp s ASN 945 Cb -0.13 -0.93 0.11 0.00 0.41 0.00 0.00 41.25 40.70 3dyp s ASN 945 CO 0.02 0.14 0.39 -0.47 -1.51 0.00 0.00 177.10 175.67 3dyp s TYR 946 N 0.26 -0.77 0.00 2.20 5.04 -0.50 -2.19 117.35 121.38 3dyp s TYR 946 Ca -0.11 1.19 0.00 0.00 -2.44 0.00 0.00 57.07 55.71 3dyp s TYR 946 Cb -0.15 0.16 0.00 0.00 0.35 0.00 0.00 41.96 42.32 3dyp s TYR 946 CO 0.05 -0.57 0.00 0.41 -1.34 0.00 0.00 175.55 174.10 3dyp n GLY 947 N 5.38 2.68 0.60 8.97 0.00 -1.26 -0.90 105.19 120.65 3dyp n GLY 947 Ca -0.06 -0.39 0.09 0.00 0.00 0.00 0.00 46.02 45.65 3dyp n GLY 947 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dyp n PRO 948 N 13.64 1.77 -3.74 1.61 -0.04 -1.26 -4.89 135.00 142.08 3dyp n PRO 948 Ca 0.00 -1.17 -0.32 0.00 -0.04 0.00 0.00 63.50 61.96 3dyp n PRO 948 Cb 0.00 -1.35 -0.05 0.00 -0.04 0.00 0.00 33.50 32.07 3dyp n PRO 948 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3dyp s HIS 949 N -1.68 3.51 -0.03 0.54 3.76 -0.08 0.60 115.29 121.92 3dyp s HIS 949 Ca 0.29 0.50 0.01 0.00 -0.15 0.00 0.00 55.06 55.71 3dyp s HIS 949 Cb 0.15 -1.95 0.02 0.00 1.11 0.00 0.00 32.58 31.91 3dyp s HIS 949 CO 0.22 0.51 -0.04 -1.14 -0.85 0.00 0.00 174.74 173.44 3dyp s GLN 950 N -2.40 0.59 -0.10 1.40 0.74 -0.35 -1.41 119.66 118.13 3dyp s GLN 950 Ca 0.36 -0.10 0.04 0.00 0.05 0.00 0.00 55.36 55.72 3dyp s GLN 950 Cb -0.13 -0.63 -0.00 0.00 1.10 0.00 0.00 33.01 33.35 3dyp s GLN 950 CO 0.23 -0.03 -0.23 -1.58 -0.55 0.00 0.00 175.29 173.13 3dyp s TRP 951 N 0.60 2.58 0.04 1.67 0.51 0.25 -0.27 118.94 124.32 3dyp s TRP 951 Ca -0.07 -1.03 0.09 0.00 -2.12 0.00 0.00 56.10 52.97 3dyp s TRP 951 Cb -0.11 -1.72 -0.03 0.00 -0.81 0.00 0.00 33.47 30.80 3dyp s TRP 951 CO -0.00 -0.41 -0.26 1.03 -0.51 0.00 0.00 176.95 176.79 3dyp s ARG 952 N 0.36 1.81 0.00 4.98 0.52 0.45 -0.70 118.95 126.37 3dyp s ARG 952 Ca -0.18 -1.10 0.00 0.00 -0.52 0.00 0.00 55.73 53.93 3dyp s ARG 952 Cb -0.18 -1.97 0.00 0.00 0.52 0.00 0.00 34.95 33.32 3dyp s ARG 952 CO 0.08 0.51 0.00 0.41 0.02 0.00 0.00 175.30 176.32 3dyp n GLY 953 N 1.81 -0.61 2.85 -3.53 0.00 -0.57 -0.52 105.19 104.62 3dyp n GLY 953 Ca -0.17 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.60 3dyp n GLY 953 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dyp s ASP 954 N -4.00 -0.11 0.35 1.61 2.15 -1.23 -4.20 116.67 111.24 3dyp s ASP 954 Ca 0.00 -1.56 0.07 0.00 0.43 0.00 0.00 52.55 51.49 3dyp s ASP 954 Cb 0.00 1.12 -0.03 0.00 -0.30 0.00 0.00 42.92 43.72 3dyp s ASP 954 CO 0.00 -0.18 0.27 0.72 -0.17 0.00 0.00 175.17 175.81 3dyp s PHE 955 N 1.27 1.80 0.07 -5.34 -0.12 0.25 -4.88 117.98 111.02 3dyp s PHE 955 Ca 0.21 -1.64 0.08 0.00 -0.05 0.00 0.00 56.93 55.53 3dyp s PHE 955 Cb -0.07 -0.79 -0.03 0.00 -0.63 0.00 0.00 43.02 41.50 3dyp s PHE 955 CO -0.06 -0.82 -0.19 -0.65 -0.05 0.00 0.00 175.22 173.46 3dyp s GLN 956 N -3.43 1.95 0.11 1.99 -1.52 0.27 -1.08 119.66 117.96 3dyp s GLN 956 Ca 0.38 -1.06 -0.08 0.00 -1.95 0.00 0.00 55.36 52.66 3dyp s GLN 956 Cb 0.02 -2.15 -0.01 0.00 -0.22 0.00 0.00 33.01 30.65 3dyp s GLN 956 CO 0.27 0.52 0.19 -0.59 -0.25 0.00 0.00 175.29 175.43 3dyp s PHE 957 N -0.99 0.31 0.03 0.91 -0.12 -0.22 0.43 117.98 118.33 3dyp s PHE 957 Ca 0.16 -0.73 0.00 0.00 -0.05 0.00 0.00 56.93 56.31 3dyp s PHE 957 Cb -0.10 -0.12 -0.02 0.00 -0.63 0.00 0.00 43.02 42.14 3dyp s PHE 957 CO 0.07 -0.58 -0.04 0.54 -0.05 0.00 0.00 175.22 175.16 3dyp s ASN 958 N -2.91 0.40 -0.15 1.98 2.20 -0.53 -1.25 114.94 114.69 3dyp s ASN 958 Ca 0.10 -0.59 -0.06 0.00 -0.94 0.00 0.00 52.86 51.37 3dyp s ASN 958 Cb 0.05 0.10 0.06 0.00 -2.00 0.00 0.00 41.25 39.46 3dyp s ASN 958 CO -0.07 -0.33 0.32 -0.51 -2.94 0.00 0.00 177.10 173.58 3dyp s ILE 959 N -1.84 -0.24 0.20 0.54 2.07 -1.26 -0.95 121.20 119.72 3dyp s ILE 959 Ca -0.11 0.17 -0.22 0.00 -1.41 0.00 0.00 60.65 59.08 3dyp s ILE 959 Cb -0.07 -0.51 0.07 0.00 0.13 0.00 0.00 42.46 42.08 3dyp s ILE 959 CO -0.02 0.07 0.96 -0.94 -1.91 0.00 0.00 174.94 173.10 3dyp s SER 960 N 1.85 -0.08 0.00 4.50 1.04 -0.78 -4.58 113.70 115.64 3dyp s SER 960 Ca -0.05 -0.62 0.12 0.00 0.48 0.00 0.00 55.95 55.88 3dyp s SER 960 Cb -0.11 0.55 0.54 0.00 0.10 0.00 0.00 66.02 67.10 3dyp s SER 960 CO -0.10 -1.06 1.38 0.54 0.98 0.00 0.00 173.24 174.97 3dyp n ARG 961 N -0.57 1.37 -5.08 4.02 5.12 -1.26 0.37 116.66 120.63 3dyp n ARG 961 Ca -0.05 -0.57 -0.30 0.00 -1.93 0.00 0.00 57.85 55.00 3dyp n ARG 961 Cb 0.60 -1.24 -0.17 0.00 -1.16 0.00 0.00 32.46 30.50 3dyp n ARG 961 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 3dyp s TYR 962 N -1.83 2.30 0.74 -1.55 1.51 -1.26 -0.06 117.35 117.19 3dyp s TYR 962 Ca 0.21 -0.91 -0.11 0.00 -1.01 0.00 0.00 57.07 55.25 3dyp s TYR 962 Cb 0.10 -1.55 0.04 0.00 -0.11 0.00 0.00 41.96 40.44 3dyp s TYR 962 CO 0.16 -0.37 1.08 -1.54 -1.11 0.00 0.00 175.55 173.77 3dyp s SER 963 N 0.37 4.79 0.33 2.29 1.04 -1.26 -4.82 113.70 116.43 3dyp s SER 963 Ca -0.17 1.78 0.02 0.00 0.48 0.00 0.00 55.95 58.07 3dyp s SER 963 Cb -0.17 -2.52 0.57 0.00 0.10 0.00 0.00 66.02 64.00 3dyp s SER 963 CO 0.07 -1.84 1.91 1.56 0.98 0.00 0.00 173.24 175.92 3dyp h GLN 964 N -0.92 0.68 -0.13 4.02 1.08 -1.99 -2.04 115.11 115.82 3dyp h GLN 964 Ca -0.44 -0.11 0.03 0.00 -1.45 0.00 0.00 58.65 56.69 3dyp h GLN 964 Cb 1.23 -0.12 -0.04 0.00 -0.05 0.00 0.00 27.48 28.50 3dyp h GLN 964 CO 0.53 0.59 -0.08 0.37 -0.95 0.00 0.00 178.83 179.29 3dyp h GLN 965 N 0.67 -0.08 -0.66 1.46 4.15 -1.98 0.29 115.11 118.96 3dyp h GLN 965 Ca 0.16 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.57 3dyp h GLN 965 Cb 0.19 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.87 3dyp h GLN 965 CO -0.01 -0.05 0.36 0.37 -1.93 0.00 0.00 178.83 177.57 3dyp h GLN 966 N -0.08 0.91 -0.69 1.69 4.15 -1.84 -0.06 115.11 119.20 3dyp h GLN 966 Ca 0.08 -0.11 -0.05 0.00 0.77 0.00 0.00 58.65 59.35 3dyp h GLN 966 Cb 0.20 -0.18 -0.03 0.00 0.21 0.00 0.00 27.48 27.68 3dyp h GLN 966 CO -0.19 0.69 0.25 -0.07 -1.93 0.00 0.00 178.83 177.58 3dyp h LEU 967 N 0.90 0.95 -0.67 -2.39 3.38 -0.79 -0.77 115.31 115.93 3dyp h LEU 967 Ca 0.23 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 3dyp h LEU 967 Cb 0.04 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 3dyp h LEU 967 CO -0.04 0.87 -0.10 0.00 0.09 0.00 0.00 178.44 179.26 3dyp h MET 968 N 1.01 0.00 -0.10 1.13 -0.00 0.17 -2.86 114.93 114.28 3dyp h MET 968 Ca 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.93 3dyp h MET 968 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.83 3dyp h MET 968 CO -0.02 0.10 0.00 0.39 -0.00 0.00 0.00 176.91 177.39 3dyp n GLU 969 N -3.17 1.90 -4.98 -0.10 1.02 -0.09 -4.86 120.64 110.36 3dyp n GLU 969 Ca 0.02 -1.32 -0.32 0.00 -0.02 0.00 0.00 57.16 55.52 3dyp n GLU 969 Cb 0.47 -1.46 -0.16 0.00 -0.02 0.00 0.00 31.44 30.27 3dyp n GLU 969 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3dyp s THR 970 N -1.89 2.25 -0.64 2.62 2.01 -0.38 -5.03 115.64 114.58 3dyp s THR 970 Ca 0.35 -0.94 0.24 0.00 0.31 0.00 0.00 61.69 61.64 3dyp s THR 970 Cb 0.20 -1.89 -0.04 0.00 0.01 0.00 0.00 72.50 70.79 3dyp s THR 970 CO 0.31 0.55 1.17 -1.54 -0.69 0.00 0.00 174.62 174.42 3dyp n SER 971 N 3.69 0.65 -3.91 3.53 3.41 -1.26 -4.20 113.62 115.53 3dyp n SER 971 Ca -0.19 -0.06 -0.16 0.00 -0.26 0.00 0.00 58.87 58.20 3dyp n SER 971 Cb 0.53 0.49 -0.15 0.00 -0.26 0.00 0.00 64.21 64.82 3dyp n SER 971 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3dyp s HIS 972 N -3.18 0.41 0.48 7.33 3.76 -1.26 -4.38 115.29 118.46 3dyp s HIS 972 Ca 0.05 -0.07 0.14 0.00 -0.15 0.00 0.00 55.06 55.03 3dyp s HIS 972 Cb 0.14 -0.32 1.14 0.00 1.11 0.00 0.00 32.58 34.65 3dyp s HIS 972 CO 0.76 -0.05 2.09 0.07 -0.85 0.00 0.00 174.74 176.76 3dyp h ARG 973 N 6.42 0.19 0.00 1.40 0.11 -0.86 -1.70 114.38 119.94 3dyp h ARG 973 Ca -0.32 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 59.75 3dyp h ARG 973 Cb 1.18 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 32.21 3dyp h ARG 973 CO 0.50 0.13 0.00 -2.39 0.10 0.00 0.00 179.97 178.30 3dyp n HIS 974 N -4.50 0.80 0.82 4.08 1.44 -1.26 -1.91 115.22 114.69 3dyp n HIS 974 Ca 0.01 0.34 0.12 0.00 -2.01 0.00 0.00 57.72 56.19 3dyp n HIS 974 Cb 0.16 -1.05 0.19 0.00 0.12 0.00 0.00 29.99 29.41 3dyp n HIS 974 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3dyp n LEU 975 N -2.25 2.97 -4.80 2.39 4.77 -0.64 -4.92 117.00 114.52 3dyp n LEU 975 Ca 0.01 -1.11 -0.34 0.00 -0.03 0.00 0.00 56.01 54.54 3dyp n LEU 975 Cb 0.17 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 3dyp n LEU 975 CO 0.17 0.55 0.72 -0.76 -1.33 0.00 0.00 177.39 176.74 3dyp s LEU 976 N -1.81 3.86 -0.03 2.23 1.43 -0.80 -5.05 118.68 118.50 3dyp s LEU 976 Ca 0.33 1.93 0.02 0.00 -1.03 0.00 0.00 54.13 55.38 3dyp s LEU 976 Cb 0.21 -4.55 0.00 0.00 0.03 0.00 0.00 46.19 41.89 3dyp s LEU 976 CO 0.31 -0.77 -0.09 -1.38 0.23 0.00 0.00 176.35 174.64 3dyp s HIS 977 N -1.97 0.99 0.18 0.29 -3.43 -1.26 -5.11 115.29 104.99 3dyp s HIS 977 Ca 0.67 -0.26 -0.32 0.00 -0.80 0.00 0.00 55.06 54.35 3dyp s HIS 977 Cb -0.17 -0.72 -0.12 0.00 -1.43 0.00 0.00 32.58 30.15 3dyp s HIS 977 CO 0.20 -0.12 1.70 0.00 -2.00 0.00 0.00 174.74 174.53 3dyp n ALA 978 N 3.35 2.40 -1.95 -1.38 0.00 -1.26 -4.81 120.51 116.86 3dyp n ALA 978 Ca -0.19 0.40 -0.26 0.00 0.00 0.00 0.00 53.44 53.40 3dyp n ALA 978 Cb 0.54 -2.49 0.11 0.00 0.00 0.00 0.00 19.45 17.61 3dyp n ALA 978 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3dyp s GLU 979 N 1.32 1.66 0.44 0.00 2.02 0.91 -5.01 118.70 120.03 3dyp s GLU 979 Ca 0.77 -0.63 -0.24 0.00 0.02 0.00 0.00 54.97 54.89 3dyp s GLU 979 Cb -0.55 -2.17 -0.08 0.00 0.10 0.00 0.00 34.13 31.44 3dyp s GLU 979 CO 0.34 -1.57 1.21 -2.00 0.02 0.00 0.00 175.26 173.26 3dyp s GLU 980 N -5.34 3.82 2.79 1.61 2.12 -1.26 -4.78 118.70 117.67 3dyp s GLU 980 Ca 0.65 1.90 0.00 0.00 0.36 0.00 0.00 54.97 57.88 3dyp s GLU 980 Cb -0.07 -2.53 0.00 0.00 0.26 0.00 0.00 34.13 31.79 3dyp s GLU 980 CO 0.46 -0.53 0.00 0.41 -0.54 0.00 0.00 175.26 175.06 3dyp n GLY 981 N 0.56 -0.08 2.91 -1.50 0.00 -1.26 -4.84 105.19 100.99 3dyp n GLY 981 Ca 0.06 -1.00 -0.20 0.00 0.00 0.00 0.00 46.02 44.88 3dyp n GLY 981 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dyp s THR 982 N 0.00 0.57 -0.13 2.61 2.01 -0.63 -4.69 115.64 115.39 3dyp s THR 982 Ca 0.00 -0.16 -0.22 0.00 0.31 0.00 0.00 61.69 61.62 3dyp s THR 982 Cb 0.00 -0.59 -0.03 0.00 0.01 0.00 0.00 72.50 71.89 3dyp s THR 982 CO 0.00 0.23 0.67 0.26 -0.69 0.00 0.00 174.62 175.09 3dyp s TRP 983 N 0.83 3.48 -0.13 4.92 0.52 0.16 0.02 118.94 128.74 3dyp s TRP 983 Ca -0.12 1.10 0.03 0.00 0.02 0.00 0.00 56.10 57.13 3dyp s TRP 983 Cb -0.14 -2.81 0.00 0.00 -1.15 0.00 0.00 33.47 29.38 3dyp s TRP 983 CO 0.01 -0.04 -0.22 -1.17 0.02 0.00 0.00 176.95 175.54 3dyp s LEU 984 N 1.37 2.15 -0.20 2.99 2.96 -0.21 -1.87 118.68 125.86 3dyp s LEU 984 Ca 0.33 -0.57 -0.01 0.00 -0.22 0.00 0.00 54.13 53.66 3dyp s LEU 984 Cb -0.17 -1.45 0.01 0.00 0.50 0.00 0.00 46.19 45.09 3dyp s LEU 984 CO 0.14 0.11 -0.12 0.20 -1.32 0.00 0.00 176.35 175.36 3dyp s ASN 985 N 0.62 3.69 -0.19 3.68 0.01 -0.12 -1.78 114.94 120.85 3dyp s ASN 985 Ca -0.12 -0.52 0.01 0.00 -0.71 0.00 0.00 52.86 51.52 3dyp s ASN 985 Cb -0.16 -1.60 0.04 0.00 0.41 0.00 0.00 41.25 39.93 3dyp s ASN 985 CO 0.03 -0.01 -0.12 -0.51 -1.51 0.00 0.00 177.10 174.98 3dyp s ILE 986 N 1.37 1.74 -0.18 0.60 2.07 -0.10 -1.45 121.20 125.25 3dyp s ILE 986 Ca 0.05 -1.00 -0.07 0.00 -1.41 0.00 0.00 60.65 58.22 3dyp s ILE 986 Cb -0.14 -1.75 -0.04 0.00 0.13 0.00 0.00 42.46 40.66 3dyp s ILE 986 CO -0.08 0.25 0.06 -1.81 -1.91 0.00 0.00 174.94 171.44 3dyp s ASP 987 N 1.37 5.55 0.23 4.50 1.01 0.17 -0.01 116.67 129.48 3dyp s ASP 987 Ca -0.00 0.05 -0.00 0.00 0.71 0.00 0.00 52.55 53.31 3dyp s ASP 987 Cb -0.16 -1.95 0.23 0.00 1.01 0.00 0.00 42.92 42.06 3dyp s ASP 987 CO -0.09 0.16 1.59 1.23 0.21 0.00 0.00 175.17 178.28 3dyp h GLY 988 N 6.77 0.55 -4.78 0.21 0.00 -1.03 0.78 103.07 105.57 3dyp h GLY 988 Ca -0.36 -0.56 -0.14 0.00 0.00 0.00 0.00 47.33 46.27 3dyp h GLY 988 CO 0.69 0.51 -0.38 -1.36 0.00 0.00 0.00 176.54 176.00 3dyp s PHE 989 N -4.17 -0.13 -0.02 5.60 0.40 -0.99 -4.65 117.98 114.02 3dyp s PHE 989 Ca -0.07 0.23 -0.04 0.00 -0.60 0.00 0.00 56.93 56.45 3dyp s PHE 989 Cb 0.12 0.05 0.00 0.00 0.51 0.00 0.00 43.02 43.71 3dyp s PHE 989 CO 0.82 -0.30 0.09 -1.58 0.70 0.00 0.00 175.22 174.94 3dyp s HIS 990 N -1.02 -0.03 0.53 0.36 2.46 -1.26 -1.49 115.29 114.83 3dyp s HIS 990 Ca -0.11 0.09 -0.19 0.00 0.47 0.00 0.00 55.06 55.32 3dyp s HIS 990 Cb -0.05 -0.01 -0.06 0.00 -0.13 0.00 0.00 32.58 32.33 3dyp s HIS 990 CO 0.02 -0.11 1.07 1.41 -2.47 0.00 0.00 174.74 174.67 3dyp s MET 991 N -0.37 3.55 0.96 2.88 1.75 0.33 -4.77 119.30 123.63 3dyp s MET 991 Ca -0.04 1.39 -0.11 0.00 -1.25 0.00 0.00 55.69 55.68 3dyp s MET 991 Cb -0.03 -2.05 0.17 0.00 2.84 0.00 0.00 34.83 35.76 3dyp s MET 991 CO 0.00 -0.65 1.10 0.20 -0.65 0.00 0.00 175.02 175.02 3dyp s GLY 992 N -2.12 1.63 0.02 2.11 0.00 -0.51 -4.69 107.32 103.76 3dyp s GLY 992 Ca 0.68 0.21 0.22 0.00 0.00 0.00 0.00 44.72 45.83 3dyp s GLY 992 CO 0.26 0.72 0.68 0.29 0.00 0.00 0.00 173.10 175.05 3dyp n ILE 993 N -4.27 0.13 -4.74 0.90 -5.35 -1.26 -4.94 119.36 99.83 3dyp n ILE 993 Ca 0.08 -0.44 0.00 0.00 -0.27 0.00 0.00 62.75 62.12 3dyp n ILE 993 Cb 0.53 0.05 0.00 0.00 -1.74 0.00 0.00 39.64 38.48 3dyp n ILE 993 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dyp n GLY 994 N 1.28 0.18 0.00 3.28 0.00 -1.26 -4.77 105.19 103.89 3dyp n GLY 994 Ca -0.02 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.03 3dyp n GLY 994 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyp n GLY 995 N 0.00 -0.16 0.42 -0.02 0.00 -1.26 -0.70 105.19 103.48 3dyp n GLY 995 Ca 0.00 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.30 3dyp n GLY 995 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3dyp h ASP 996 N 0.00 0.37 -5.22 1.61 3.32 -1.79 -1.20 116.42 113.50 3dyp h ASP 996 Ca 0.00 0.10 -0.07 0.00 0.02 0.00 0.00 57.03 57.09 3dyp h ASP 996 Cb 0.00 0.05 -0.07 0.00 0.22 0.00 0.00 39.33 39.53 3dyp h ASP 996 CO 0.00 -0.01 -0.03 1.51 -1.72 0.00 0.00 179.24 178.99 3dyp s ASP 997 N -4.99 0.06 -0.23 6.45 1.47 -1.26 -4.04 116.67 114.12 3dyp s ASP 997 Ca -0.08 -1.00 0.11 0.00 1.18 0.00 0.00 52.55 52.75 3dyp s ASP 997 Cb 0.27 0.65 0.44 0.00 -0.34 0.00 0.00 42.92 43.95 3dyp s ASP 997 CO 0.80 -1.27 1.20 -1.20 0.68 0.00 0.00 175.17 175.38 3dyp n SER 998 N -0.69 3.05 0.00 2.11 7.64 -1.26 -4.62 113.62 119.84 3dyp n SER 998 Ca -0.02 -3.62 0.00 0.00 1.01 0.00 0.00 58.87 56.24 3dyp n SER 998 Cb 0.61 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 3dyp n SER 998 CO 0.00 0.00 0.00 -2.67 -3.01 0.00 0.00 175.04 169.36 3dyp n TRP 999 N -0.82 0.00 -3.73 1.43 2.14 -1.26 -4.21 117.44 110.98 3dyp n TRP 999 Ca 0.28 -0.02 -0.11 0.00 2.07 0.00 0.00 57.50 59.73 3dyp n TRP 999 Cb 0.84 -0.00 -0.06 0.00 -0.81 0.00 0.00 31.31 31.28 3dyp n TRP 999 CO 0.00 0.00 0.00 -1.54 2.07 0.00 0.00 177.69 178.22 3dyp s SER 1000N -0.03 -0.12 0.17 -0.67 1.04 -1.26 -4.46 113.70 108.37 3dyp s SER 1000Ca 0.00 -0.30 -0.33 0.00 0.48 0.00 0.00 55.95 55.79 3dyp s SER 1000Cb 0.00 0.39 -0.13 0.00 0.10 0.00 0.00 66.02 66.38 3dyp s SER 1000CO 0.00 -0.71 1.61 -2.65 0.98 0.00 0.00 173.24 172.47 3dyp n PRO 1001N 0.22 2.28 0.00 4.02 -0.02 -1.26 -4.79 135.00 135.44 3dyp n PRO 1001Ca -0.17 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 3dyp n PRO 1001Cb 0.61 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 3dyp n PRO 1001CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3dyp n SER 1002N 3.54 0.78 -4.67 2.55 3.41 -1.26 -4.99 113.62 112.97 3dyp n SER 1002Ca 0.17 -1.34 -0.42 0.00 -0.26 0.00 0.00 58.87 57.02 3dyp n SER 1002Cb 0.30 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.21 3dyp n SER 1002CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3dyp s VAL 1003N -0.34 4.85 0.48 -3.33 1.01 -1.26 -4.32 120.40 117.49 3dyp s VAL 1003Ca 0.00 1.72 -0.24 0.00 0.00 0.00 0.00 61.98 63.46 3dyp s VAL 1003Cb 0.00 -4.18 -0.07 0.00 0.00 0.00 0.00 36.38 32.13 3dyp s VAL 1003CO 0.00 0.01 1.40 -0.55 0.00 0.00 0.00 175.10 175.96 3dyp s SER 1004N 1.15 5.68 0.35 3.32 0.15 -1.26 -4.84 113.70 118.24 3dyp s SER 1004Ca 0.40 2.86 0.13 0.00 0.70 0.00 0.00 55.95 60.04 3dyp s SER 1004Cb -0.17 -2.65 0.97 0.00 -1.71 0.00 0.00 66.02 62.46 3dyp s SER 1004CO 0.13 -1.30 1.74 0.00 1.20 0.00 0.00 173.24 175.00 3dyp h ALA 1005N 2.04 1.95 0.00 5.45 0.00 -1.96 0.43 119.26 127.16 3dyp h ALA 1005Ca -0.51 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3dyp h ALA 1005Cb 1.28 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3dyp h ALA 1005CO 0.60 -0.41 0.00 -0.85 0.00 0.00 0.00 179.25 178.59 3dyp n GLU 1006N -4.81 0.16 -0.20 0.00 0.00 -1.26 -1.94 120.64 112.60 3dyp n GLU 1006Ca 0.27 0.44 0.07 0.00 0.00 0.00 0.00 57.16 57.94 3dyp n GLU 1006Cb 0.80 -1.84 0.18 0.00 0.00 0.00 0.00 31.44 30.59 3dyp n GLU 1006CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 3dyp n PHE 1007N -2.15 0.52 -3.41 -1.84 3.01 0.15 -4.97 117.46 108.77 3dyp n PHE 1007Ca 0.02 -0.43 -0.37 0.00 1.01 0.00 0.00 57.45 57.68 3dyp n PHE 1007Cb 0.19 -0.02 -0.06 0.00 -0.01 0.00 0.00 39.48 39.58 3dyp n PHE 1007CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 3dyp s GLN 1008N -1.03 3.99 -1.27 -1.08 -0.21 -0.82 -1.42 119.66 117.81 3dyp s GLN 1008Ca 0.28 0.49 -0.14 0.00 0.02 0.00 0.00 55.36 56.01 3dyp s GLN 1008Cb 0.15 -3.12 0.14 0.00 1.00 0.00 0.00 33.01 31.18 3dyp s GLN 1008CO 0.20 0.60 1.67 1.28 -2.12 0.00 0.00 175.29 176.93 3dyp n LEU 1009N 1.40 5.61 -0.72 2.90 4.77 -1.26 -4.67 117.00 125.03 3dyp n LEU 1009Ca -0.10 -4.35 0.06 0.00 -0.03 0.00 0.00 56.01 51.60 3dyp n LEU 1009Cb 0.52 -1.62 0.17 0.00 -2.33 0.00 0.00 43.42 40.15 3dyp n LEU 1009CO 0.40 0.77 0.63 -1.54 -1.33 0.00 0.00 177.39 176.33 3dyp n SER 1010N 5.94 2.99 0.28 -1.43 3.41 -1.26 -4.33 113.62 119.22 3dyp n SER 1010Ca 0.42 -1.96 0.18 0.00 -0.26 0.00 0.00 58.87 57.25 3dyp n SER 1010Cb 0.42 -0.25 0.88 0.00 -0.26 0.00 0.00 64.21 65.00 3dyp n SER 1010CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyp h ALA 1011N 2.35 1.00 0.00 7.33 0.00 -1.98 -3.47 119.26 124.49 3dyp h ALA 1011Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dyp h ALA 1011Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3dyp h ALA 1011CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3dyp n GLY 1012N -0.58 1.97 3.14 0.00 0.00 -1.26 -4.89 105.19 103.57 3dyp n GLY 1012Ca -0.01 -0.25 -0.27 0.00 0.00 0.00 0.00 46.02 45.49 3dyp n GLY 1012CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dyp s ARG 1013N 0.00 2.02 0.00 1.61 0.52 -1.26 -0.49 118.95 121.36 3dyp s ARG 1013Ca 0.00 -0.64 0.02 0.00 -0.52 0.00 0.00 55.73 54.60 3dyp s ARG 1013Cb 0.00 -1.69 -0.01 0.00 0.52 0.00 0.00 34.95 33.77 3dyp s ARG 1013CO 0.00 0.20 -0.07 0.71 0.02 0.00 0.00 175.30 176.16 3dyp s TYR 1014N 0.19 0.64 -0.01 -0.53 1.51 -0.28 -4.97 117.35 113.90 3dyp s TYR 1014Ca -0.08 -0.18 0.03 0.00 -1.01 0.00 0.00 57.07 55.83 3dyp s TYR 1014Cb -0.14 -0.41 -0.01 0.00 -0.11 0.00 0.00 41.96 41.30 3dyp s TYR 1014CO 0.04 -0.02 -0.11 -1.58 -1.11 0.00 0.00 175.55 172.77 3dyp s HIS 1015N -0.37 1.00 0.11 2.71 2.46 -1.26 0.29 115.29 120.24 3dyp s HIS 1015Ca 0.01 -0.20 -0.16 0.00 0.47 0.00 0.00 55.06 55.18 3dyp s HIS 1015Cb -0.04 -0.65 0.03 0.00 -0.13 0.00 0.00 32.58 31.79 3dyp s HIS 1015CO -0.00 -0.03 0.38 1.52 -2.47 0.00 0.00 174.74 174.15 3dyp s TYR 1016N -0.22 -0.19 -0.06 3.88 -0.85 -0.34 -5.01 117.35 114.56 3dyp s TYR 1016Ca 0.04 -0.09 -0.09 0.00 -0.52 0.00 0.00 57.07 56.41 3dyp s TYR 1016Cb -0.05 0.23 0.02 0.00 0.38 0.00 0.00 41.96 42.54 3dyp s TYR 1016CO -0.00 -0.66 0.22 1.14 -1.52 0.00 0.00 175.55 174.73 3dyp s GLN 1017N -3.57 0.35 0.04 -3.49 -2.07 -1.26 0.02 119.66 109.68 3dyp s GLN 1017Ca 0.02 0.14 0.01 0.00 -1.82 0.00 0.00 55.36 53.70 3dyp s GLN 1017Cb 0.02 0.16 -0.03 0.00 -1.09 0.00 0.00 33.01 32.07 3dyp s GLN 1017CO -0.10 -0.06 -0.05 -0.51 -1.32 0.00 0.00 175.29 173.25 3dyp s LEU 1018N -0.31 2.33 -0.16 2.60 1.43 0.32 -4.31 118.68 120.58 3dyp s LEU 1018Ca -0.04 -0.68 0.01 0.00 -1.03 0.00 0.00 54.13 52.39 3dyp s LEU 1018Cb -0.03 0.04 0.00 0.00 0.03 0.00 0.00 46.19 46.23 3dyp s LEU 1018CO 0.01 -0.36 -0.16 -0.69 0.23 0.00 0.00 176.35 175.37 3dyp s VAL 1019N -2.22 2.51 -0.19 -1.59 1.01 0.32 0.14 120.40 120.37 3dyp s VAL 1019Ca -0.06 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.07 3dyp s VAL 1019Cb -0.04 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 3dyp s VAL 1019CO -0.03 0.52 -0.05 0.86 0.00 0.00 0.00 175.10 176.40 3dyp s TRP 1020N 0.94 2.96 0.24 5.22 -0.11 0.53 -0.41 118.94 128.30 3dyp s TRP 1020Ca -0.03 -0.65 -0.03 0.00 1.22 0.00 0.00 56.10 56.61 3dyp s TRP 1020Cb -0.15 -2.02 -0.03 0.00 -1.50 0.00 0.00 33.47 29.77 3dyp s TRP 1020CO -0.03 -0.31 0.25 0.00 -4.62 0.00 0.00 176.95 172.23 3dyp s GLN 1022N -3.97 3.61 0.00 0.00 0.74 -1.26 -1.21 119.66 117.58 3dyp s GLN 1022Ca 0.35 -0.08 0.00 0.00 0.05 0.00 0.00 55.36 55.68 3dyp s GLN 1022Cb 0.04 -2.93 0.00 0.00 1.10 0.00 0.00 33.01 31.22 3dyp s GLN 1022CO 0.14 0.53 0.31 1.17 -0.55 0.00 0.00 175.29 176.89