#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3e1d s ARG 2 N 0.00 3.59 0.79 2.12 3.52 -1.26 -4.85 118.95 122.86 3e1d s ARG 2 Ca 0.00 0.08 -0.13 0.00 -0.13 0.00 0.00 55.73 55.55 3e1d s ARG 2 Cb 0.00 -3.86 0.18 0.00 -1.56 0.00 0.00 34.95 29.71 3e1d s ARG 2 CO 0.00 -0.94 1.05 1.28 -0.81 0.00 0.00 175.30 175.88 3e1d n LEU 3 N 6.46 0.00 0.12 -0.88 4.77 -1.26 -4.96 117.00 121.25 3e1d n LEU 3 Ca 0.02 -1.15 0.08 0.00 -0.03 0.00 0.00 56.01 54.93 3e1d n LEU 3 Cb 0.48 -0.81 0.42 0.00 -2.33 0.00 0.00 43.42 41.18 3e1d n LEU 3 CO 0.55 -1.30 0.74 -3.20 -1.33 0.00 0.00 177.39 172.85 3e1d n ASN 4 N -3.74 0.40 0.00 -1.43 5.15 -1.26 -1.92 115.26 112.47 3e1d n ASN 4 Ca 0.13 0.69 0.06 0.00 -0.60 0.00 0.00 54.58 54.86 3e1d n ASN 4 Cb 0.46 -0.74 0.36 0.00 -0.53 0.00 0.00 39.78 39.34 3e1d n ASN 4 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 3e1d n THR 5 N -2.04 0.00 -1.25 -0.44 5.66 -1.26 -4.94 114.28 110.01 3e1d n THR 5 Ca -0.01 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.90 3e1d n THR 5 Cb 0.03 -0.69 -0.04 0.00 -1.55 0.00 0.00 70.33 68.08 3e1d n THR 5 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 3e1d n LEU 6 N -0.92 -0.29 -3.92 1.09 4.77 -0.81 -5.01 117.00 111.92 3e1d n LEU 6 Ca 0.09 0.21 -0.10 0.00 -0.03 0.00 0.00 56.01 56.18 3e1d n LEU 6 Cb 0.04 -2.13 -0.12 0.00 -2.33 0.00 0.00 43.42 38.88 3e1d n LEU 6 CO 0.07 -0.78 -0.32 -0.55 -1.33 0.00 0.00 177.39 174.48 3e1d s SER 7 N -2.46 0.11 0.44 -1.43 0.15 -1.26 -5.02 113.70 104.23 3e1d s SER 7 Ca 0.00 -0.25 0.18 0.00 0.70 0.00 0.00 55.95 56.58 3e1d s SER 7 Cb 0.00 0.10 1.02 0.00 -1.71 0.00 0.00 66.02 65.43 3e1d s SER 7 CO 0.00 -0.20 1.94 1.55 1.20 0.00 0.00 173.24 177.73 3e1d h PRO 8 N 5.15 0.00 0.00 5.44 0.13 -1.95 -3.41 132.00 137.36 3e1d h PRO 8 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3e1d h PRO 8 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3e1d h PRO 8 CO 0.44 0.24 0.00 0.00 -0.23 0.00 0.00 178.00 178.45 3e1d n ALA 9 N -2.40 0.00 0.16 -0.56 0.00 -1.26 -4.76 120.51 111.68 3e1d n ALA 9 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3e1d n ALA 9 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.77 3e1d n ALA 9 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3e1d n GLU 10 N 0.00 0.16 0.00 0.00 0.28 -1.26 -4.64 120.64 115.18 3e1d n GLU 10 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 3e1d n GLU 10 Cb 0.00 -1.27 0.00 0.00 1.43 0.00 0.00 31.44 31.60 3e1d n GLU 10 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3e1d n GLY 11 N 0.71 1.04 1.50 -1.84 0.00 -1.26 -5.14 105.19 100.20 3e1d n GLY 11 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.37 3e1d n GLY 11 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3e1d n SER 12 N 0.00 -7.89 -0.03 1.61 2.88 -1.26 -4.78 113.62 104.15 3e1d n SER 12 Ca 0.00 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.61 3e1d n SER 12 Cb 0.00 -3.84 0.00 0.00 -0.75 0.00 0.00 64.21 59.62 3e1d n SER 12 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3e1d n LYS 13 N 0.41 0.08 -1.67 -1.46 4.76 -1.26 -4.90 118.16 114.12 3e1d n LYS 13 Ca 0.00 0.00 -0.53 0.00 -2.87 0.00 0.00 58.31 54.91 3e1d n LYS 13 Cb 0.00 -1.00 -0.06 0.00 -1.84 0.00 0.00 35.03 32.13 3e1d n LYS 13 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3e1d n LYS 14 N -0.45 1.47 0.00 1.97 5.02 -1.26 -4.95 118.16 119.96 3e1d n LYS 14 Ca 0.00 0.54 0.00 0.00 -2.02 0.00 0.00 58.31 56.83 3e1d n LYS 14 Cb 0.00 -2.25 0.00 0.00 -0.02 0.00 0.00 35.03 32.76 3e1d n LYS 14 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3e1d n ALA 15 N 4.61 1.51 0.00 7.82 0.00 -1.26 -5.04 120.51 128.15 3e1d n ALA 15 Ca 0.22 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.49 3e1d n ALA 15 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.65 3e1d n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3e1d n GLY 16 N 0.32 0.19 4.43 0.00 0.00 -1.26 -5.04 105.19 103.82 3e1d n GLY 16 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3e1d n GLY 16 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3e1d n LYS 17 N 0.00 0.00 -3.69 1.61 4.01 -1.26 -4.70 118.16 114.13 3e1d n LYS 17 Ca 0.00 0.00 -0.11 0.00 -0.51 0.00 0.00 58.31 57.69 3e1d n LYS 17 Cb 0.00 -1.41 -0.12 0.00 -0.51 0.00 0.00 35.03 32.99 3e1d n LYS 17 CO 0.00 0.00 0.00 -0.98 -1.11 0.00 0.00 177.40 175.31 3e1d s ARG 18 N 0.00 0.29 -0.39 1.97 3.03 -1.26 -5.11 118.95 117.48 3e1d s ARG 18 Ca 0.00 0.75 0.11 0.00 2.03 0.00 0.00 55.73 58.62 3e1d s ARG 18 Cb 0.00 0.00 0.35 0.00 -1.03 0.00 0.00 34.95 34.27 3e1d s ARG 18 CO 0.00 -0.19 0.83 -0.11 -1.13 0.00 0.00 175.30 174.70 3e1d n LEU 19 N 4.59 0.19 -0.05 -1.89 0.00 -1.26 -4.92 117.00 113.66 3e1d n LEU 19 Ca -0.19 -4.63 -0.10 0.00 0.00 0.00 0.00 56.01 51.09 3e1d n LEU 19 Cb 0.53 0.73 -0.04 0.00 0.00 0.00 0.00 43.42 44.64 3e1d n LEU 19 CO 0.08 2.19 -0.82 0.61 0.00 0.00 0.00 177.39 179.44 3e1d n GLY 20 N 0.26 -0.15 3.34 -3.96 0.00 -1.26 -5.10 105.19 98.32 3e1d n GLY 20 Ca 0.20 -0.05 -0.18 0.00 0.00 0.00 0.00 46.02 45.98 3e1d n GLY 20 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3e1d s ARG 21 N -2.18 1.81 -0.07 1.61 3.52 -1.26 -5.09 118.95 117.29 3e1d s ARG 21 Ca -0.13 -1.95 -0.01 0.00 -0.13 0.00 0.00 55.73 53.51 3e1d s ARG 21 Cb 0.05 0.36 -0.02 0.00 -1.56 0.00 0.00 34.95 33.77 3e1d s ARG 21 CO 0.17 -0.69 0.16 0.41 -0.81 0.00 0.00 175.30 174.54 3e1d n GLY 22 N -0.61 -0.04 3.54 8.12 0.00 -1.26 -4.78 105.19 110.16 3e1d n GLY 22 Ca 0.06 -0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3e1d n GLY 22 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3e1d n ILE 23 N 0.40 0.04 -4.02 -0.61 2.08 -1.26 -4.69 119.36 111.31 3e1d n ILE 23 Ca 0.05 -0.58 0.00 0.00 0.56 0.00 0.00 62.75 62.78 3e1d n ILE 23 Cb 0.01 -2.35 0.00 0.00 -0.75 0.00 0.00 39.64 36.55 3e1d n ILE 23 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3e1d n GLY 24 N 6.09 -1.74 0.01 7.39 0.00 -1.26 -4.32 105.19 111.35 3e1d n GLY 24 Ca 0.40 -1.36 0.12 0.00 0.00 0.00 0.00 46.02 45.18 3e1d n GLY 24 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3e1d n SER 25 N 0.39 0.59 0.00 1.61 7.64 -1.26 -4.99 113.62 117.60 3e1d n SER 25 Ca 0.00 -0.28 0.00 0.00 1.01 0.00 0.00 58.87 59.60 3e1d n SER 25 Cb 0.00 0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 3e1d n SER 25 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3e1d n GLY 26 N 1.46 1.06 2.92 0.23 0.00 -1.26 -4.94 105.19 104.65 3e1d n GLY 26 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 3e1d n GLY 26 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3e1d n LEU 27 N 0.00 6.52 -3.40 0.99 4.77 -1.26 -4.39 117.00 120.23 3e1d n LEU 27 Ca 0.00 -4.57 -0.13 0.00 -0.03 0.00 0.00 56.01 51.28 3e1d n LEU 27 Cb 0.00 -1.51 -0.10 0.00 -2.33 0.00 0.00 43.42 39.48 3e1d n LEU 27 CO 0.00 1.28 -0.12 -0.83 -1.33 0.00 0.00 177.39 176.38 3e1d s GLY 28 N 1.31 -0.25 0.13 -0.72 0.00 -1.26 -4.51 107.32 102.03 3e1d s GLY 28 Ca 0.41 0.45 -0.16 0.00 0.00 0.00 0.00 44.72 45.42 3e1d s GLY 28 CO -0.00 2.53 1.67 0.50 0.00 0.00 0.00 173.10 177.79 3e1d h LYS 29 N 8.24 0.59 -5.20 2.90 1.57 -2.08 -3.48 116.57 119.11 3e1d h LYS 29 Ca -0.17 -0.11 -0.57 0.00 -1.87 0.00 0.00 60.65 57.93 3e1d h LYS 29 Cb 1.14 -0.09 -0.13 0.00 0.08 0.00 0.00 32.23 33.22 3e1d h LYS 29 CO 0.29 0.57 -0.55 0.95 -0.57 0.00 0.00 179.45 180.14 3e1d s THR 30 N -5.51 1.05 0.34 -0.16 -4.23 -1.26 -5.19 115.64 100.68 3e1d s THR 30 Ca -0.13 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.45 3e1d s THR 30 Cb 0.10 -2.50 -0.03 0.00 1.34 0.00 0.00 72.50 71.41 3e1d s THR 30 CO 0.75 0.00 0.30 0.61 -0.54 0.00 0.00 174.62 175.74 3e1d n GLY 31 N -0.94 2.84 0.92 3.99 0.00 -1.26 -4.47 105.19 106.27 3e1d n GLY 31 Ca -0.08 -1.88 0.08 0.00 0.00 0.00 0.00 46.02 44.14 3e1d n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1d n GLY 32 N -0.64 2.22 3.45 -0.02 0.00 -1.26 -4.94 105.19 104.01 3e1d n GLY 32 Ca 0.07 -0.56 -0.43 0.00 0.00 0.00 0.00 46.02 45.10 3e1d n GLY 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3e1d s ARG 33 N -1.07 3.07 6.62 1.61 0.52 -1.26 -4.97 118.95 123.47 3e1d s ARG 33 Ca 0.33 -0.94 0.00 0.00 -0.52 0.00 0.00 55.73 54.60 3e1d s ARG 33 Cb 0.18 -4.04 0.00 0.00 0.52 0.00 0.00 34.95 31.61 3e1d s ARG 33 CO 0.23 -0.98 0.00 0.41 0.02 0.00 0.00 175.30 174.98 3e1d n GLY 34 N 5.15 3.25 2.43 -3.53 0.00 -1.26 -3.48 105.19 107.75 3e1d n GLY 34 Ca -0.08 -0.22 -0.26 0.00 0.00 0.00 0.00 46.02 45.46 3e1d n GLY 34 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3e1d n HIS 35 N 14.00 0.61 -1.75 1.61 8.25 -1.26 -5.07 115.22 131.61 3e1d n HIS 35 Ca 0.00 -3.68 -0.43 0.00 -0.26 0.00 0.00 57.72 53.35 3e1d n HIS 35 Cb 0.00 -0.18 -0.03 0.00 1.12 0.00 0.00 29.99 30.90 3e1d n HIS 35 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3e1d s LYS 36 N -0.92 3.32 1.46 -0.41 1.02 -1.23 -4.81 119.74 118.19 3e1d s LYS 36 Ca 0.33 1.91 0.00 0.00 0.02 0.00 0.00 55.97 58.23 3e1d s LYS 36 Cb 0.08 -4.29 0.00 0.00 -0.52 0.00 0.00 37.83 33.10 3e1d s LYS 36 CO -0.14 -1.88 0.00 0.41 -0.92 0.00 0.00 175.35 172.82 3e1d n GLY 37 N 5.48 -1.27 3.80 -3.33 0.00 -1.26 -4.98 105.19 103.63 3e1d n GLY 37 Ca 0.26 -1.51 -0.35 0.00 0.00 0.00 0.00 46.02 44.42 3e1d n GLY 37 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3e1d s GLN 38 N 0.00 4.37 1.37 1.61 -0.21 -1.26 -4.93 119.66 120.60 3e1d s GLN 38 Ca 0.00 1.11 0.00 0.00 0.02 0.00 0.00 55.36 56.49 3e1d s GLN 38 Cb 0.00 -2.64 0.00 0.00 1.00 0.00 0.00 33.01 31.37 3e1d s GLN 38 CO 0.00 0.23 0.00 1.63 -2.12 0.00 0.00 175.29 175.03 3e1d n LYS 39 N 0.24 -0.01 -1.01 2.91 5.02 -1.26 -4.15 118.16 119.91 3e1d n LYS 39 Ca 0.02 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.08 3e1d n LYS 39 Cb 0.51 -0.01 -0.08 0.00 -0.02 0.00 0.00 35.03 35.44 3e1d n LYS 39 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3e1d n SER 40 N -0.50 6.19 0.00 4.39 7.64 -0.78 -4.78 113.62 125.79 3e1d n SER 40 Ca 0.00 -2.42 0.00 0.00 1.01 0.00 0.00 58.87 57.46 3e1d n SER 40 Cb 0.00 -1.32 0.00 0.00 -1.01 0.00 0.00 64.21 61.88 3e1d n SER 40 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3e1d n ARG 41 N 3.24 0.00 0.00 1.43 3.00 -1.26 -3.17 116.66 119.90 3e1d n ARG 41 Ca 0.54 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 58.38 3e1d n ARG 41 Cb 0.46 -0.96 0.00 0.00 0.00 0.00 0.00 32.46 31.97 3e1d n ARG 41 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 3e1d n SER 42 N 0.52 0.00 -1.10 0.55 7.64 -1.26 -4.95 113.62 115.02 3e1d n SER 42 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3e1d n SER 42 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 3e1d n SER 42 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3e1d n GLY 43 N 1.36 4.38 7.00 0.23 0.00 -1.19 -4.99 105.19 111.98 3e1d n GLY 43 Ca 0.00 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.91 3e1d n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1d n GLY 44 N 5.00 2.14 3.24 -0.02 0.00 -1.26 -1.86 105.19 112.43 3e1d n GLY 44 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.47 3e1d n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1d n GLY 45 N 0.00 -0.19 0.00 -0.02 0.00 -1.26 -4.91 105.19 98.80 3e1d n GLY 45 Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.53 3e1d n GLY 45 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3e1d n VAL 46 N 0.00 0.00 -4.23 1.61 3.14 -1.26 -5.09 118.33 112.51 3e1d n VAL 46 Ca 0.00 0.00 -0.19 0.00 -2.96 0.00 0.00 64.34 61.19 3e1d n VAL 46 Cb 0.00 -0.09 -0.12 0.00 -1.06 0.00 0.00 33.84 32.57 3e1d n VAL 46 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3e1d s ARG 47 N -1.14 0.97 0.32 1.45 3.03 -1.26 -5.11 118.95 117.21 3e1d s ARG 47 Ca 0.00 -1.13 0.17 0.00 2.03 0.00 0.00 55.73 56.80 3e1d s ARG 47 Cb 0.00 -0.96 0.22 0.00 -1.03 0.00 0.00 34.95 33.18 3e1d s ARG 47 CO 0.00 0.20 1.52 0.00 -1.13 0.00 0.00 175.30 175.89 3e1d h ARG 48 N 3.87 0.00 -4.34 3.89 -0.00 -2.07 -3.41 114.38 112.32 3e1d h ARG 48 Ca -0.41 0.00 -0.69 0.00 -0.50 0.00 0.00 59.98 58.38 3e1d h ARG 48 Cb 1.19 0.00 -0.35 0.00 0.00 0.00 0.00 29.97 30.81 3e1d h ARG 48 CO 0.45 0.39 -0.53 0.20 0.00 0.00 0.00 179.97 180.48 3e1d s GLY 49 N -4.40 2.07 0.36 0.04 0.00 -1.26 -5.06 107.32 99.07 3e1d s GLY 49 Ca 0.04 -2.66 -0.07 0.00 0.00 0.00 0.00 44.72 42.03 3e1d s GLY 49 CO 0.72 1.03 0.60 0.33 0.00 0.00 0.00 173.10 175.78 3e1d n PHE 50 N 4.38 -1.82 0.23 1.90 -0.00 -1.26 -5.10 117.46 115.79 3e1d n PHE 50 Ca -0.00 -2.05 0.10 0.00 -0.00 0.00 0.00 57.45 55.50 3e1d n PHE 50 Cb 0.41 0.69 0.50 0.00 -0.00 0.00 0.00 39.48 41.08 3e1d n PHE 50 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.76 177.81 3e1d h GLU 51 N 0.00 0.00 -5.63 -4.13 4.11 -1.99 -3.48 114.58 103.47 3e1d h GLU 51 Ca -0.29 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 58.82 3e1d h GLU 51 Cb 1.16 0.00 0.17 0.00 0.50 0.00 0.00 28.75 30.58 3e1d h GLU 51 CO 0.38 0.23 -0.78 0.41 0.07 0.00 0.00 179.01 179.32 3e1d n GLY 52 N -0.05 -0.46 3.84 1.06 0.00 -1.26 -4.84 105.19 103.47 3e1d n GLY 52 Ca -0.00 0.16 -0.07 0.00 0.00 0.00 0.00 46.02 46.10 3e1d n GLY 52 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3e1d s GLY 53 N -4.25 -0.06 0.00 -0.02 0.00 -1.26 -5.04 107.32 96.70 3e1d s GLY 53 Ca 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 44.72 44.44 3e1d s GLY 53 CO 0.73 -0.12 0.00 -0.18 0.00 0.00 0.00 173.10 173.53 3e1d n GLN 54 N -0.45 -0.00 0.00 2.90 0.00 -1.26 -4.78 117.38 113.78 3e1d n GLN 54 Ca -0.04 -0.00 0.14 0.00 -0.00 0.00 0.00 57.00 57.10 3e1d n GLN 54 Cb 0.59 0.00 0.63 0.00 0.00 0.00 0.00 30.24 31.46 3e1d n GLN 54 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.06 176.94 3e1d n MET 55 N -0.01 1.00 0.00 3.69 1.56 -1.26 -4.41 117.12 117.69 3e1d n MET 55 Ca 0.00 -0.40 0.00 0.00 -0.27 0.00 0.00 57.70 57.03 3e1d n MET 55 Cb 0.00 -1.49 0.00 0.00 2.15 0.00 0.00 33.22 33.88 3e1d n MET 55 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94 3e1d n PRO 56 N -0.65 0.00 -0.17 2.12 -0.02 -1.26 -2.38 135.00 132.64 3e1d n PRO 56 Ca 0.17 0.84 0.22 0.00 -2.02 0.00 0.00 63.50 62.71 3e1d n PRO 56 Cb 0.27 -1.33 0.62 0.00 -0.02 0.00 0.00 33.50 33.04 3e1d n PRO 56 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3e1d h LEU 57 N 0.00 0.19 0.00 2.45 4.07 -1.97 -2.32 115.31 117.73 3e1d h LEU 57 Ca 0.00 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.98 3e1d h LEU 57 Cb 0.00 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.72 3e1d h LEU 57 CO 0.00 0.08 -0.50 -1.22 -1.08 0.00 0.00 178.44 175.72 3e1d n TYR 58 N -4.40 0.21 0.00 1.13 0.53 -1.16 -4.78 117.16 108.69 3e1d n TYR 58 Ca 0.17 0.06 0.00 0.00 -1.02 0.00 0.00 57.90 57.11 3e1d n TYR 58 Cb 0.75 -0.42 0.00 0.00 -1.03 0.00 0.00 39.34 38.64 3e1d n TYR 58 CO 0.00 0.00 0.00 2.89 -1.02 0.00 0.00 176.86 178.73 3e1d n ARG 59 N -1.73 0.00 -0.05 -0.72 1.85 -1.21 -5.10 116.66 109.71 3e1d n ARG 59 Ca 0.05 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.75 3e1d n ARG 59 Cb 0.37 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 31.72 3e1d n ARG 59 CO 0.00 0.00 0.00 -0.09 -0.01 0.00 0.00 177.63 177.53 3e1d h ARG 60 N 0.00 0.62 -0.21 2.89 2.43 -1.04 -3.39 114.38 115.68 3e1d h ARG 60 Ca 0.00 -0.43 -0.18 0.00 -0.81 0.00 0.00 59.98 58.56 3e1d h ARG 60 Cb 0.00 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 3e1d h ARG 60 CO 0.00 1.05 -0.57 1.37 -1.51 0.00 0.00 179.97 180.31 3e1d h LEU 61 N 0.29 0.86-10.22 3.80 8.10 -1.80 -3.48 115.31 112.86 3e1d h LEU 61 Ca -0.01 -0.58 -0.52 0.00 0.11 0.00 0.00 57.88 56.88 3e1d h LEU 61 Cb 1.08 -0.25 0.14 0.00 -0.44 0.00 0.00 40.66 41.19 3e1d h LEU 61 CO 0.10 1.29 0.35 -2.84 -4.11 0.00 0.00 178.44 173.23 3e1d s PRO 62 N -3.94 2.16 0.28 0.17 0.02 -1.26 -5.01 135.00 127.42 3e1d s PRO 62 Ca -0.11 1.53 -0.12 0.00 0.02 0.00 0.00 61.00 62.32 3e1d s PRO 62 Cb 0.08 -1.86 -0.08 0.00 0.02 0.00 0.00 34.50 32.67 3e1d s PRO 62 CO 0.87 -1.77 0.64 0.21 -0.33 0.00 0.00 177.00 176.63 3e1d s LYS 63 N -4.23 3.88 0.01 5.54 2.20 -1.26 -5.11 119.74 120.77 3e1d s LYS 63 Ca 0.69 0.44 0.04 0.00 -0.36 0.00 0.00 55.97 56.78 3e1d s LYS 63 Cb -0.24 -2.54 -0.01 0.00 -1.51 0.00 0.00 37.83 33.53 3e1d s LYS 63 CO 0.48 0.22 -0.11 0.12 -0.36 0.00 0.00 175.35 175.70 3e1d s PHE 64 N -1.94 0.98 -0.23 4.03 2.19 -1.26 -5.13 117.98 116.62 3e1d s PHE 64 Ca 0.50 -0.26 -0.29 0.00 0.33 0.00 0.00 56.93 57.22 3e1d s PHE 64 Cb -0.11 -0.61 -0.02 0.00 -1.31 0.00 0.00 43.02 40.98 3e1d s PHE 64 CO 0.21 -0.01 1.53 0.20 1.83 0.00 0.00 175.22 178.98 3e1d s GLY 65 N -0.65 1.29 0.00 13.12 0.00 -1.26 -4.93 107.32 114.89 3e1d s GLY 65 Ca 0.02 0.42 0.28 0.00 0.00 0.00 0.00 44.72 45.43 3e1d s GLY 65 CO 0.00 2.89 1.96 0.69 0.00 0.00 0.00 173.10 178.65 3e1d n PHE 66 N 8.11 0.02 -0.99 1.90 3.01 -1.26 -4.94 117.46 123.31 3e1d n PHE 66 Ca 0.18 -0.01 0.00 0.00 1.01 0.00 0.00 57.45 58.63 3e1d n PHE 66 Cb 0.45 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.92 3e1d n PHE 66 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 3e1d n THR 67 N -0.59 0.00 -4.08 4.37 -1.04 -1.26 -4.88 114.28 106.80 3e1d n THR 67 Ca 0.20 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.94 3e1d n THR 67 Cb 0.17 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.62 3e1d n THR 67 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 3e1d s SER 68 N -0.86 5.50 0.44 8.00 0.01 -1.26 -5.11 113.70 120.43 3e1d s SER 68 Ca 0.00 -0.10 -0.22 0.00 1.31 0.00 0.00 55.95 56.94 3e1d s SER 68 Cb 0.00 -1.44 -0.09 0.00 0.21 0.00 0.00 66.02 64.70 3e1d s SER 68 CO 0.00 0.10 1.03 -0.13 0.41 0.00 0.00 173.24 174.65 3e1d s ARG 69 N -2.90 4.00 0.39 12.44 0.52 -1.26 -5.00 118.95 127.14 3e1d s ARG 69 Ca 0.30 1.40 0.12 0.00 -0.52 0.00 0.00 55.73 57.03 3e1d s ARG 69 Cb -0.11 -2.29 0.80 0.00 0.52 0.00 0.00 34.95 33.88 3e1d s ARG 69 CO 0.23 -0.27 1.89 1.57 0.02 0.00 0.00 175.30 178.74 3e1d h LYS 70 N 1.99 0.06 -6.49 3.54 2.10 -2.01 -3.47 116.57 112.28 3e1d h LYS 70 Ca -0.49 -0.02 -0.45 0.00 -2.00 0.00 0.00 60.65 57.69 3e1d h LYS 70 Cb 1.21 -0.01 0.02 0.00 -0.90 0.00 0.00 32.23 32.55 3e1d h LYS 70 CO 0.61 0.33 -0.23 0.00 -2.00 0.00 0.00 179.45 178.16 3e1d s ALA 71 N -4.43 4.01 0.12 0.07 0.00 -1.26 -5.08 121.76 115.19 3e1d s ALA 71 Ca -0.04 -1.27 -0.12 0.00 0.00 0.00 0.00 51.96 50.54 3e1d s ALA 71 Cb 0.15 -1.89 -0.09 0.00 0.00 0.00 0.00 23.12 21.29 3e1d s ALA 71 CO 0.72 -0.19 1.41 0.00 0.00 0.00 0.00 175.76 177.70 3e1d h ALA 72 N 0.67 0.46 -2.79 0.00 0.00 -2.06 -3.46 119.26 112.07 3e1d h ALA 72 Ca -0.46 -0.50 -0.07 0.00 0.00 0.00 0.00 54.91 53.88 3e1d h ALA 72 Cb 1.25 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.86 3e1d h ALA 72 CO 0.55 0.66 -0.15 0.96 0.00 0.00 0.00 179.25 181.27 3e1d s ILE 73 N -4.16 0.01 0.34 0.00 -5.25 -1.26 -5.17 121.20 105.72 3e1d s ILE 73 Ca -0.11 -1.35 -0.18 0.00 -0.99 0.00 0.00 60.65 58.02 3e1d s ILE 73 Cb 0.10 -2.07 0.04 0.00 2.95 0.00 0.00 42.46 43.48 3e1d s ILE 73 CO 0.89 -0.07 0.76 0.28 -1.79 0.00 0.00 174.94 175.01 3e1d s THR 74 N -4.00 0.00 0.00 8.37 -1.32 -1.26 -5.06 115.64 112.37 3e1d s THR 74 Ca 0.21 -1.00 0.00 0.00 -1.21 0.00 0.00 61.69 59.69 3e1d s THR 74 Cb 0.00 -2.53 0.00 0.00 -1.51 0.00 0.00 72.50 68.46 3e1d s THR 74 CO 0.06 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.47 3e1d n ALA 75 N -0.50 0.00 -1.68 11.08 0.00 -1.26 -4.89 120.51 123.25 3e1d n ALA 75 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.03 3e1d n ALA 75 Cb 0.60 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.06 3e1d n ALA 75 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3e1d s GLU 76 N 0.00 3.17 0.00 0.00 0.41 -1.26 -4.45 118.70 116.57 3e1d s GLU 76 Ca 0.00 1.52 0.00 0.00 -0.41 0.00 0.00 54.97 56.08 3e1d s GLU 76 Cb 0.00 -1.99 0.00 0.00 -1.78 0.00 0.00 34.13 30.36 3e1d s GLU 76 CO 0.00 -0.97 0.00 1.51 -0.49 0.00 0.00 175.26 175.31 3e1d n ILE 77 N -1.70 0.00 -4.07 -1.63 0.13 -1.26 -4.68 119.36 106.15 3e1d n ILE 77 Ca 0.11 0.00 -0.12 0.00 -1.10 0.00 0.00 62.75 61.64 3e1d n ILE 77 Cb 0.51 0.00 -0.05 0.00 -0.84 0.00 0.00 39.64 39.26 3e1d n ILE 77 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3e1d s ARG 78 N 3.63 1.67 0.00 9.51 1.70 -1.26 -5.02 118.95 129.18 3e1d s ARG 78 Ca 0.00 -1.54 0.00 0.00 -0.47 0.00 0.00 55.73 53.72 3e1d s ARG 78 Cb 0.00 0.43 0.00 0.00 -0.57 0.00 0.00 34.95 34.81 3e1d s ARG 78 CO 0.00 -0.67 0.00 1.28 -1.08 0.00 0.00 175.30 174.83 3e1d n LEU 79 N -0.45 0.00 -3.25 -1.89 4.32 -1.26 -4.48 117.00 109.99 3e1d n LEU 79 Ca 0.00 0.00 -0.22 0.00 -0.02 0.00 0.00 56.01 55.77 3e1d n LEU 79 Cb 0.62 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.38 3e1d n LEU 79 CO 0.27 -0.02 1.46 -1.54 -1.22 0.00 0.00 177.39 176.35 3e1d n SER 80 N -0.47 1.28 -0.00 -1.43 3.41 -1.26 -1.14 113.62 114.00 3e1d n SER 80 Ca 0.00 -2.28 0.07 0.00 -0.26 0.00 0.00 58.87 56.40 3e1d n SER 80 Cb 0.00 -0.65 -0.09 0.00 -0.26 0.00 0.00 64.21 63.21 3e1d n SER 80 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3e1d n ASP 81 N 6.41 0.93 -3.18 4.04 5.75 -1.26 -4.37 116.55 124.86 3e1d n ASP 81 Ca 0.26 -0.61 -0.45 0.00 -0.01 0.00 0.00 54.79 53.98 3e1d n ASP 81 Cb 0.19 1.18 -0.08 0.00 -1.03 0.00 0.00 41.12 41.38 3e1d n ASP 81 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 3e1d n LEU 82 N -1.51 0.64 -0.44 -2.12 -0.00 -0.29 -1.42 117.00 111.85 3e1d n LEU 82 Ca 0.01 0.60 0.07 0.00 -0.00 0.00 0.00 56.01 56.70 3e1d n LEU 82 Cb 0.26 -0.65 0.15 0.00 -0.00 0.00 0.00 43.42 43.19 3e1d n LEU 82 CO 0.29 -0.57 0.42 0.00 -0.00 0.00 0.00 177.39 177.53 3e1d n ALA 83 N 4.65 2.83 -0.32 1.96 0.00 -1.26 -4.24 120.51 124.13 3e1d n ALA 83 Ca 0.34 -2.76 0.15 0.00 0.00 0.00 0.00 53.44 51.18 3e1d n ALA 83 Cb -0.03 -0.41 0.38 0.00 0.00 0.00 0.00 19.45 19.39 3e1d n ALA 83 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3e1d h LYS 84 N 0.50 0.64 0.00 0.00 3.64 -1.60 -0.55 116.57 119.19 3e1d h LYS 84 Ca -0.02 -0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.18 3e1d h LYS 84 Cb 1.11 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.76 3e1d h LYS 84 CO 0.01 0.42 -0.77 0.28 -2.27 0.00 0.00 179.45 177.12 3e1d h VAL 85 N 0.66 0.97 0.00 2.00 2.07 -1.97 -3.22 116.25 116.76 3e1d h VAL 85 Ca 0.54 -2.43 0.00 0.00 0.82 0.00 0.00 66.70 65.63 3e1d h VAL 85 Cb 0.98 2.45 0.00 0.00 -1.52 0.00 0.00 31.29 33.20 3e1d h VAL 85 CO -0.31 0.55 -0.17 -0.62 0.02 0.00 0.00 177.57 177.04 3e1d n GLU 86 N -3.19 0.14 -0.96 1.57 4.71 -0.97 -4.94 120.64 117.00 3e1d n GLU 86 Ca -0.01 0.09 0.00 0.00 -0.01 0.00 0.00 57.16 57.24 3e1d n GLU 86 Cb 0.80 -1.64 0.00 0.00 -1.01 0.00 0.00 31.44 29.59 3e1d n GLU 86 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3e1d n GLY 87 N 1.40 0.91 0.92 0.62 0.00 -0.54 -4.37 105.19 104.14 3e1d n GLY 87 Ca 0.06 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.52 3e1d n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1d n GLY 88 N -1.54 0.89 0.16 -0.02 0.00 -0.33 -4.98 105.19 99.37 3e1d n GLY 88 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 3e1d n GLY 88 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3e1d h VAL 89 N 0.00 0.00 -2.05 1.61 -1.51 -1.78 -1.05 116.25 111.48 3e1d h VAL 89 Ca 0.00 -0.47 -0.22 0.00 -1.23 0.00 0.00 66.70 64.77 3e1d h VAL 89 Cb 0.00 1.38 -0.07 0.00 -2.13 0.00 0.00 31.29 30.47 3e1d h VAL 89 CO 0.00 0.00 -0.22 0.52 -1.23 0.00 0.00 177.57 176.64 3e1d n VAL 90 N -2.53 -0.12 0.65 7.19 0.31 -1.26 -4.70 118.33 117.87 3e1d n VAL 90 Ca 0.03 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.43 3e1d n VAL 90 Cb 0.35 -1.17 0.35 0.00 -0.91 0.00 0.00 33.84 32.47 3e1d n VAL 90 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3e1d n ASP 91 N -0.60 0.00 0.00 4.52 8.00 -1.26 -4.76 116.55 122.45 3e1d n ASP 91 Ca -0.11 0.11 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3e1d n ASP 91 Cb 0.42 -0.30 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 3e1d n ASP 91 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 3e1d n LEU 92 N -1.30 0.52 -0.87 0.64 7.94 -1.26 -4.86 117.00 117.81 3e1d n LEU 92 Ca 0.06 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.86 3e1d n LEU 92 Cb 0.12 -0.88 -0.01 0.00 0.53 0.00 0.00 43.42 43.18 3e1d n LEU 92 CO 0.11 -0.29 0.04 0.59 -1.11 0.00 0.00 177.39 176.72 3e1d n ASN 93 N -0.07 -0.16 0.16 1.96 4.13 -1.26 -4.88 115.26 115.13 3e1d n ASN 93 Ca 0.00 0.22 0.12 0.00 1.68 0.00 0.00 54.58 56.60 3e1d n ASN 93 Cb 0.03 -0.19 0.56 0.00 -1.54 0.00 0.00 39.78 38.65 3e1d n ASN 93 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3e1d h THR 94 N 0.33 0.00 -0.33 3.41 1.03 -1.89 -3.33 112.91 112.13 3e1d h THR 94 Ca -0.07 -0.13 0.09 0.00 -0.01 0.00 0.00 66.41 66.29 3e1d h THR 94 Cb 0.28 0.76 -0.01 0.00 -1.07 0.00 0.00 68.15 68.11 3e1d h THR 94 CO 0.12 0.00 0.24 -0.07 -0.01 0.00 0.00 175.52 175.79 3e1d h LEU 95 N 0.00 0.03 -3.25 0.00 -0.00 -1.95 -3.41 115.31 106.73 3e1d h LEU 95 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 57.88 57.63 3e1d h LEU 95 Cb 0.19 -0.01 0.04 0.00 -0.00 0.00 0.00 40.66 40.88 3e1d h LEU 95 CO 0.00 0.02 -0.15 0.29 -0.00 0.00 0.00 178.44 178.60 3e1d n LYS 96 N -4.45 0.00 -4.67 1.13 5.02 -1.25 -5.05 118.16 108.89 3e1d n LYS 96 Ca 0.05 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 56.03 3e1d n LYS 96 Cb 0.38 -0.40 -0.08 0.00 -0.02 0.00 0.00 35.03 34.92 3e1d n LYS 96 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3e1d s ALA 97 N -0.29 3.68 0.00 7.82 0.00 -1.26 -4.47 121.76 127.23 3e1d s ALA 97 Ca 0.25 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.59 3e1d s ALA 97 Cb -0.36 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.10 3e1d s ALA 97 CO 0.20 -0.16 0.00 0.00 0.00 0.00 0.00 175.76 175.81 3e1d n ALA 98 N -1.14 0.00 -0.20 0.00 0.00 -1.26 -1.31 120.51 116.60 3e1d n ALA 98 Ca -0.14 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.22 3e1d n ALA 98 Cb 0.66 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.13 3e1d n ALA 98 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 3e1d h ASN 99 N 0.00 0.76 0.00 0.00 -1.24 -2.04 -3.48 115.58 109.57 3e1d h ASN 99 Ca 0.00 -0.15 0.00 0.00 0.71 0.00 0.00 56.30 56.86 3e1d h ASN 99 Cb 0.00 -0.20 0.00 0.00 0.73 0.00 0.00 38.32 38.85 3e1d h ASN 99 CO 0.00 0.70 0.00 -0.38 -1.29 0.00 0.00 177.43 176.46 3e1d n ILE 100 N -4.52 0.00 -3.74 2.57 5.41 -0.43 -4.92 119.36 113.73 3e1d n ILE 100 Ca 0.03 0.00 -0.23 0.00 1.00 0.00 0.00 62.75 63.55 3e1d n ILE 100 Cb 0.14 0.00 -0.07 0.00 -0.71 0.00 0.00 39.64 39.01 3e1d n ILE 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3e1d n ILE 101 N 0.00 -0.61 -2.62 1.39 0.00 -1.26 -4.62 119.36 111.64 3e1d n ILE 101 Ca 0.00 -0.30 -0.42 0.00 0.00 0.00 0.00 62.75 62.03 3e1d n ILE 101 Cb 0.00 -0.65 -0.03 0.00 0.00 0.00 0.00 39.64 38.96 3e1d n ILE 101 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 3e1d s GLY 102 N -3.79 1.07 -0.10 4.50 0.00 -1.26 -4.98 107.32 102.77 3e1d s GLY 102 Ca 0.07 -1.21 0.02 0.00 0.00 0.00 0.00 44.72 43.61 3e1d s GLY 102 CO 0.70 2.48 -0.17 -0.26 0.00 0.00 0.00 173.10 175.85 3e1d s ILE 103 N 5.11 1.57 -0.46 0.90 -4.36 -1.26 -4.96 121.20 117.74 3e1d s ILE 103 Ca 0.36 -0.71 0.25 0.00 -0.26 0.00 0.00 60.65 60.29 3e1d s ILE 103 Cb -0.09 -1.41 0.33 0.00 1.25 0.00 0.00 42.46 42.54 3e1d s ILE 103 CO 0.19 0.45 1.71 1.56 0.24 0.00 0.00 174.94 179.09 3e1d h GLN 104 N 7.11 0.00 -6.34 0.37 7.50 -1.95 -3.41 115.11 118.39 3e1d h GLN 104 Ca -0.28 0.00 -0.55 0.00 0.50 0.00 0.00 58.65 58.32 3e1d h GLN 104 Cb 1.20 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.71 3e1d h GLN 104 CO 0.48 0.00 0.64 0.42 -1.50 0.00 0.00 178.83 178.87 3e1d s ILE 105 N -3.24 4.33 0.36 2.54 -1.09 -1.26 -4.95 121.20 117.89 3e1d s ILE 105 Ca 0.07 1.65 0.04 0.00 -2.23 0.00 0.00 60.65 60.19 3e1d s ILE 105 Cb 0.08 -4.06 0.23 0.00 -1.58 0.00 0.00 42.46 37.13 3e1d s ILE 105 CO 0.62 0.03 1.98 1.05 -1.23 0.00 0.00 174.94 177.39 3e1d h GLU 106 N 7.26 0.65 0.00 2.79 9.09 -2.00 -3.18 114.58 129.19 3e1d h GLU 106 Ca -0.35 -0.07 0.00 0.00 0.05 0.00 0.00 59.36 58.99 3e1d h GLU 106 Cb 1.17 -0.13 0.00 0.00 -1.65 0.00 0.00 28.75 28.14 3e1d h GLU 106 CO 0.86 0.49 0.00 0.34 0.05 0.00 0.00 179.01 180.75 3e1d n PHE 107 N -4.40 0.00 -1.24 2.06 -0.00 -1.26 -4.83 117.46 107.79 3e1d n PHE 107 Ca 0.04 0.00 -0.59 0.00 -0.00 0.00 0.00 57.45 56.90 3e1d n PHE 107 Cb 0.11 -0.22 -0.12 0.00 -0.00 0.00 0.00 39.48 39.26 3e1d n PHE 107 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3e1d n ALA 108 N -1.22 0.15 -3.26 3.13 0.00 -1.20 -4.82 120.51 113.30 3e1d n ALA 108 Ca 0.01 0.20 -0.41 0.00 0.00 0.00 0.00 53.44 53.23 3e1d n ALA 108 Cb 0.01 -2.03 -0.09 0.00 0.00 0.00 0.00 19.45 17.35 3e1d n ALA 108 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 3e1d s LYS 109 N 5.75 2.67 0.22 0.00 0.00 -1.26 -5.09 119.74 122.02 3e1d s LYS 109 Ca 1.17 -1.51 -0.32 0.00 0.00 0.00 0.00 55.97 55.30 3e1d s LYS 109 Cb -1.47 -3.90 -0.13 0.00 0.00 0.00 0.00 37.83 32.33 3e1d s LYS 109 CO 0.65 -1.03 1.50 1.55 0.00 0.00 0.00 175.35 178.02 3e1d n VAL 110 N 4.99 0.58 -4.44 1.79 3.14 -1.26 -4.92 118.33 118.20 3e1d n VAL 110 Ca -0.10 -0.15 -0.23 0.00 -2.96 0.00 0.00 64.34 60.90 3e1d n VAL 110 Cb 0.42 -1.58 -0.08 0.00 -1.06 0.00 0.00 33.84 31.54 3e1d n VAL 110 CO 0.00 0.00 0.00 0.27 -6.46 0.00 0.00 176.83 170.64 3e1d s ILE 111 N 0.34 0.48 0.25 1.55 -5.25 -1.26 -5.05 121.20 112.26 3e1d s ILE 111 Ca 0.72 -2.00 -0.16 0.00 -0.99 0.00 0.00 60.65 58.22 3e1d s ILE 111 Cb -0.64 -2.43 0.01 0.00 2.95 0.00 0.00 42.46 42.36 3e1d s ILE 111 CO 0.45 0.00 0.54 -1.48 -1.79 0.00 0.00 174.94 172.66 3e1d s LEU 112 N -3.52 0.15 -0.14 0.37 2.34 -1.26 -4.43 118.68 112.19 3e1d s LEU 112 Ca 0.29 -0.78 0.11 0.00 0.06 0.00 0.00 54.13 53.81 3e1d s LEU 112 Cb 0.03 2.06 -0.16 0.00 -0.56 0.00 0.00 46.19 47.56 3e1d s LEU 112 CO 0.17 -1.18 0.03 0.00 -1.06 0.00 0.00 176.35 174.31 3e1d n ALA 113 N -0.39 1.66 0.00 1.48 0.00 -1.26 -4.85 120.51 117.15 3e1d n ALA 113 Ca -0.03 -0.88 0.00 0.00 0.00 0.00 0.00 53.44 52.53 3e1d n ALA 113 Cb 0.61 -0.02 0.00 0.00 0.00 0.00 0.00 19.45 20.04 3e1d n ALA 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3e1d n GLY 114 N 2.22 0.67 3.55 0.00 0.00 -1.26 -5.03 105.19 105.33 3e1d n GLY 114 Ca -0.23 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 3e1d n GLY 114 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3e1d s GLU 115 N 0.00 3.29 -0.74 1.61 2.56 -1.26 -4.96 118.70 119.19 3e1d s GLU 115 Ca 0.00 -0.16 -0.23 0.00 0.00 0.00 0.00 54.97 54.58 3e1d s GLU 115 Cb 0.00 -4.13 0.07 0.00 2.00 0.00 0.00 34.13 32.07 3e1d s GLU 115 CO 0.00 -1.92 1.09 0.08 -0.56 0.00 0.00 175.26 173.95 3e1d s VAL 116 N 5.17 4.24 -0.87 3.70 1.01 -1.26 -4.59 120.40 127.80 3e1d s VAL 116 Ca 0.35 -0.43 -0.20 0.00 0.00 0.00 0.00 61.98 61.71 3e1d s VAL 116 Cb -0.09 -4.77 -0.22 0.00 0.00 0.00 0.00 36.38 31.29 3e1d s VAL 116 CO 0.18 -1.58 2.36 0.41 0.00 0.00 0.00 175.10 176.47 3e1d n THR 117 N 6.03 -0.01 -0.46 3.92 -1.04 -1.26 -4.90 114.28 116.56 3e1d n THR 117 Ca 0.04 -0.45 0.38 0.00 -2.04 0.00 0.00 64.05 61.98 3e1d n THR 117 Cb 0.47 -1.06 0.68 0.00 -1.82 0.00 0.00 70.33 68.60 3e1d n THR 117 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 3e1d h THR 118 N 7.48 0.20 0.00 12.58 1.35 -1.95 0.47 112.91 133.04 3e1d h THR 118 Ca -0.03 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.80 3e1d h THR 118 Cb 1.14 0.09 0.00 0.00 -1.73 0.00 0.00 68.15 67.66 3e1d h THR 118 CO 1.34 0.02 0.00 -2.65 -0.25 0.00 0.00 175.52 173.98 3e1d n PRO 119 N -4.47 0.43 -1.73 4.72 -0.02 -1.26 -4.87 135.00 127.81 3e1d n PRO 119 Ca 0.35 0.00 -0.61 0.00 -2.02 0.00 0.00 63.50 61.22 3e1d n PRO 119 Cb 1.43 -1.41 -0.08 0.00 -0.02 0.00 0.00 33.50 33.41 3e1d n PRO 119 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3e1d n VAL 120 N -0.91 0.19 -3.26 -1.45 0.31 0.15 -4.80 118.33 108.56 3e1d n VAL 120 Ca 0.09 -0.03 -0.45 0.00 -0.01 0.00 0.00 64.34 63.93 3e1d n VAL 120 Cb 0.04 -0.96 -0.00 0.00 -0.91 0.00 0.00 33.84 32.01 3e1d n VAL 120 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3e1d s THR 121 N 3.35 5.77 -0.55 2.52 -4.23 -0.40 -4.98 115.64 117.12 3e1d s THR 121 Ca 1.01 -3.13 -0.35 0.00 -1.18 0.00 0.00 61.69 58.04 3e1d s THR 121 Cb -1.23 -4.64 -0.17 0.00 1.34 0.00 0.00 72.50 67.80 3e1d s THR 121 CO 0.72 -1.24 1.99 0.52 -0.54 0.00 0.00 174.62 176.06 3e1d n VAL 122 N 3.25 0.00 -3.47 2.29 0.31 -1.26 -4.46 118.33 114.99 3e1d n VAL 122 Ca 0.25 0.00 -0.23 0.00 -0.01 0.00 0.00 64.34 64.35 3e1d n VAL 122 Cb 0.41 -0.43 0.03 0.00 -0.91 0.00 0.00 33.84 32.93 3e1d n VAL 122 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3e1d s ARG 123 N 5.90 2.29 0.00 5.55 1.81 -1.26 -4.98 118.95 128.26 3e1d s ARG 123 Ca 1.08 -1.83 0.00 0.00 -1.72 0.00 0.00 55.73 53.26 3e1d s ARG 123 Cb -1.24 -2.37 0.00 0.00 -0.45 0.00 0.00 34.95 30.89 3e1d s ARG 123 CO 0.53 -0.73 0.00 0.41 -0.68 0.00 0.00 175.30 174.83 3e1d n GLY 124 N -2.00 1.02 0.00 -3.53 0.00 -1.26 -5.03 105.19 94.39 3e1d n GLY 124 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3e1d n GLY 124 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3e1d n LEU 125 N 0.00 0.00 -4.01 0.99 -0.00 -1.26 -4.66 117.00 108.07 3e1d n LEU 125 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 56.01 55.91 3e1d n LEU 125 Cb 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.31 3e1d n LEU 125 CO 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 177.39 177.02 3e1d s ARG 126 N -1.67 0.38 0.00 1.47 1.70 -1.26 -5.04 118.95 114.52 3e1d s ARG 126 Ca 0.00 -0.67 0.00 0.00 -0.47 0.00 0.00 55.73 54.59 3e1d s ARG 126 Cb 0.00 0.01 0.00 0.00 -0.57 0.00 0.00 34.95 34.39 3e1d s ARG 126 CO 0.00 -0.03 0.00 0.28 -1.08 0.00 0.00 175.30 174.47 3e1d n VAL 127 N 1.50 0.00 0.00 4.99 0.31 -1.26 -4.60 118.33 119.27 3e1d n VAL 127 Ca -0.23 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 3e1d n VAL 127 Cb 0.55 -0.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.99 3e1d n VAL 127 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3e1d n THR 128 N -2.10 0.00 -0.09 2.52 -1.04 -1.26 -2.55 114.28 109.76 3e1d n THR 128 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.89 3e1d n THR 128 Cb 0.00 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.43 3e1d n THR 128 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 3e1d n LYS 129 N 0.00 0.47 0.19 -2.82 4.81 -1.26 -4.87 118.16 114.67 3e1d n LYS 129 Ca 0.00 0.10 0.14 0.00 -0.87 0.00 0.00 58.31 57.68 3e1d n LYS 129 Cb 0.00 -1.35 0.53 0.00 0.02 0.00 0.00 35.03 34.23 3e1d n LYS 129 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 3e1d h GLY 130 N 1.37 0.00 0.48 3.14 0.00 -1.89 -3.29 103.07 102.88 3e1d h GLY 130 Ca -0.39 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 3e1d h GLY 130 CO -0.06 0.00 -0.23 0.00 0.00 0.00 0.00 176.54 176.25 3e1d h ALA 131 N 2.19 -0.86 -0.04 3.60 0.00 -1.75 -2.93 119.26 119.46 3e1d h ALA 131 Ca 0.00 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.78 3e1d h ALA 131 Cb 0.51 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3e1d h ALA 131 CO 0.00 -0.82 0.31 0.00 0.00 0.00 0.00 179.25 178.74 3e1d h ARG 132 N -0.85 0.00 0.00 0.00 2.47 -1.84 -1.65 114.38 112.50 3e1d h ARG 132 Ca -0.07 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 3e1d h ARG 132 Cb 0.49 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.81 3e1d h ARG 132 CO 0.11 0.00 -0.54 0.00 0.56 0.00 0.00 179.97 180.10 3e1d h ALA 133 N 1.42 0.65 -3.00 0.04 0.00 -1.62 -3.43 119.26 113.31 3e1d h ALA 133 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3e1d h ALA 133 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3e1d h ALA 133 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 3e1d n ALA 134 N -1.85 1.50 0.18 0.00 0.00 -0.68 -4.98 120.51 114.68 3e1d n ALA 134 Ca 0.03 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.50 3e1d n ALA 134 Cb 0.45 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.01 3e1d n ALA 134 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3e1d n ILE 135 N -0.50 1.62 -0.23 0.00 -5.35 -0.82 -2.36 119.36 111.71 3e1d n ILE 135 Ca 0.00 0.41 0.11 0.00 -0.27 0.00 0.00 62.75 62.99 3e1d n ILE 135 Cb 0.00 -1.31 0.38 0.00 -1.74 0.00 0.00 39.64 36.97 3e1d n ILE 135 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3e1d h GLU 136 N 0.00 0.66 -0.25 6.28 4.57 -1.77 0.11 114.58 124.17 3e1d h GLU 136 Ca 0.00 -0.04 -0.10 0.00 -1.18 0.00 0.00 59.36 58.04 3e1d h GLU 136 Cb 0.09 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.52 3e1d h GLU 136 CO 0.00 0.44 -0.28 0.00 -1.18 0.00 0.00 179.01 177.99 3e1d h ALA 137 N 1.60 1.05 -0.00 2.92 0.00 -1.79 -3.38 119.26 119.65 3e1d h ALA 137 Ca 0.40 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3e1d h ALA 137 Cb 0.59 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3e1d h ALA 137 CO -0.16 0.58 -0.13 0.00 0.00 0.00 0.00 179.25 179.54 3e1d n ALA 138 N -2.49 2.52 0.00 0.00 0.00 -1.15 -4.92 120.51 114.47 3e1d n ALA 138 Ca -0.01 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.19 3e1d n ALA 138 Cb 0.43 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.73 3e1d n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3e1d n GLY 139 N 0.83 0.00 4.09 0.00 0.00 -0.95 -4.69 105.19 104.47 3e1d n GLY 139 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3e1d n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1d n GLY 140 N 0.00 0.00 3.40 -0.02 0.00 0.33 -4.96 105.19 103.95 3e1d n GLY 140 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3e1d n GLY 140 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3e1d n LYS 141 N -0.56 0.13 -0.01 1.61 -0.00 -1.26 -4.80 118.16 113.26 3e1d n LYS 141 Ca 0.00 0.08 0.01 0.00 -0.00 0.00 0.00 58.31 58.40 3e1d n LYS 141 Cb 0.00 -1.72 -0.05 0.00 -0.00 0.00 0.00 35.03 33.26 3e1d n LYS 141 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.40 177.84 3e1d n ILE 142 N -2.62 0.14 -3.53 0.58 -5.35 -1.26 -4.72 119.36 102.60 3e1d n ILE 142 Ca 0.08 -0.18 0.00 0.00 -0.27 0.00 0.00 62.75 62.39 3e1d n ILE 142 Cb 0.51 -0.08 0.00 0.00 -1.74 0.00 0.00 39.64 38.33 3e1d n ILE 142 CO 0.00 0.00 0.00 -1.84 -1.76 0.00 0.00 176.55 172.95 3e1d n GLU 143 N -1.89 0.00 0.00 6.28 0.28 -1.26 -4.13 120.64 119.91 3e1d n GLU 143 Ca -0.04 0.00 0.05 0.00 -0.16 0.00 0.00 57.16 57.01 3e1d n GLU 143 Cb 0.35 0.00 0.04 0.00 1.43 0.00 0.00 31.44 33.26 3e1d n GLU 143 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12