#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ntm s TYR 2 N 0.00 3.30 -2.48 2.03 5.04 -1.26 -0.67 117.35 123.30 2ntm s TYR 2 Ca 0.00 -1.43 0.23 0.00 -2.44 0.00 0.00 57.07 53.43 2ntm s TYR 2 Cb 0.00 -2.58 0.57 0.00 0.35 0.00 0.00 41.96 40.30 2ntm s TYR 2 CO 0.00 -0.77 1.47 1.28 -1.34 0.00 0.00 175.55 176.19 2ntm n LEU 3 N 4.87 2.54 0.00 6.97 4.77 -1.26 -4.64 117.00 130.25 2ntm n LEU 3 Ca -0.11 -1.03 0.00 0.00 -0.03 0.00 0.00 56.01 54.84 2ntm n LEU 3 Cb 0.44 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 2ntm n LEU 3 CO 0.35 0.52 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 2ntm n GLY 4 N 1.31 1.58 3.74 -0.72 0.00 -1.26 -1.79 105.19 108.05 2ntm n GLY 4 Ca 0.17 -0.66 -0.41 0.00 0.00 0.00 0.00 46.02 45.12 2ntm n GLY 4 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ntm s ARG 5 N 0.00 4.67 -0.00 1.61 3.00 -1.26 -3.65 118.95 123.32 2ntm s ARG 5 Ca 0.00 1.36 0.06 0.00 0.00 0.00 0.00 55.73 57.15 2ntm s ARG 5 Cb 0.00 -3.35 -0.02 0.00 0.00 0.00 0.00 34.95 31.59 2ntm s ARG 5 CO 0.00 0.31 -0.19 0.42 0.00 0.00 0.00 175.30 175.84 2ntm s ILE 6 N -0.31 1.51 0.09 1.52 1.01 -0.36 -1.94 121.20 122.72 2ntm s ILE 6 Ca 0.43 -0.88 0.04 0.00 0.00 0.00 0.00 60.65 60.24 2ntm s ILE 6 Cb -0.23 -1.27 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 2ntm s ILE 6 CO 0.29 0.37 -0.11 -1.48 0.00 0.00 0.00 174.94 174.01 2ntm s LEU 7 N -0.59 2.39 0.05 2.97 0.05 -0.77 -0.09 118.68 122.69 2ntm s LEU 7 Ca 0.07 -0.78 0.01 0.00 0.05 0.00 0.00 54.13 53.48 2ntm s LEU 7 Cb -0.08 -0.34 -0.03 0.00 -2.05 0.00 0.00 46.19 43.70 2ntm s LEU 7 CO -0.00 -0.23 -0.06 0.00 -0.55 0.00 0.00 176.35 175.50 2ntm s ALA 8 N -2.27 0.54 0.09 1.48 0.00 -0.41 -1.46 121.76 119.73 2ntm s ALA 8 Ca 0.04 -0.85 -0.15 0.00 0.00 0.00 0.00 51.96 51.00 2ntm s ALA 8 Cb -0.04 0.10 0.03 0.00 0.00 0.00 0.00 23.12 23.21 2ntm s ALA 8 CO 0.01 -0.11 0.37 0.54 0.00 0.00 0.00 175.76 176.57 2ntm s VAL 9 N -1.93 0.08 -5.00 0.00 0.11 -0.47 -0.66 120.40 112.53 2ntm s VAL 9 Ca -0.07 -0.63 0.00 0.00 -2.93 0.00 0.00 61.98 58.36 2ntm s VAL 9 Cb -0.06 -1.10 0.00 0.00 -1.53 0.00 0.00 36.38 33.69 2ntm s VAL 9 CO -0.01 -0.35 0.00 0.61 -3.33 0.00 0.00 175.10 172.02 2ntm n GLY 10 N 0.11 0.31 3.15 6.54 0.00 -1.10 -1.53 105.19 112.66 2ntm n GLY 10 Ca -0.17 -1.74 -0.21 0.00 0.00 0.00 0.00 46.02 43.90 2ntm n GLY 10 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ntm s ARG 11 N -1.88 0.99 0.03 1.61 0.52 -1.26 -1.41 118.95 117.54 2ntm s ARG 11 Ca 0.00 -0.73 0.00 0.00 -0.52 0.00 0.00 55.73 54.48 2ntm s ARG 11 Cb 0.00 -1.00 -0.00 0.00 0.52 0.00 0.00 34.95 34.47 2ntm s ARG 11 CO 0.00 0.25 0.01 0.27 0.02 0.00 0.00 175.30 175.86 2ntm n ASN 12 N 2.01 0.61 0.32 0.23 0.23 -0.56 -4.42 115.26 113.68 2ntm n ASN 12 Ca -0.17 -1.16 0.20 0.00 -0.53 0.00 0.00 54.58 52.91 2ntm n ASN 12 Cb 0.55 0.09 1.09 0.00 -2.08 0.00 0.00 39.78 39.44 2ntm n ASN 12 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2ntm h SER 13 N 0.13 0.00 0.30 0.53 4.64 -1.93 -2.77 113.55 114.45 2ntm h SER 13 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2ntm h SER 13 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2ntm h SER 13 CO 0.03 0.00 -1.26 0.59 -0.87 0.00 0.00 176.83 175.33 2ntm n ASN 14 N -3.36 0.54 0.00 4.97 3.02 -1.26 -5.08 115.26 114.08 2ntm n ASN 14 Ca -0.03 -0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.28 2ntm n ASN 14 Cb 0.08 1.09 0.00 0.00 -0.61 0.00 0.00 39.78 40.35 2ntm n ASN 14 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ntm n GLY 15 N 1.35 0.14 3.84 7.41 0.00 -1.05 -4.44 105.19 112.45 2ntm n GLY 15 Ca 0.01 -1.56 -0.30 0.00 0.00 0.00 0.00 46.02 44.17 2ntm n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ntm s SER 16 N -4.00 5.88 0.33 1.61 0.01 -0.17 -1.49 113.70 115.87 2ntm s SER 16 Ca 0.00 0.08 -0.12 0.00 1.31 0.00 0.00 55.95 57.22 2ntm s SER 16 Cb 0.00 -1.68 0.02 0.00 0.21 0.00 0.00 66.02 64.58 2ntm s SER 16 CO 0.00 0.15 0.62 0.72 0.41 0.00 0.00 173.24 175.14 2ntm s PHE 17 N -1.51 0.40 -0.10 2.43 -0.12 -0.50 0.14 117.98 118.72 2ntm s PHE 17 Ca 0.32 -0.85 -0.12 0.00 -0.05 0.00 0.00 56.93 56.23 2ntm s PHE 17 Cb -0.12 0.42 0.03 0.00 -0.63 0.00 0.00 43.02 42.72 2ntm s PHE 17 CO 0.25 -1.28 0.32 0.14 -0.05 0.00 0.00 175.22 174.59 2ntm s VAL 18 N -3.11 0.01 0.06 -2.49 -7.23 -0.73 -2.73 120.40 104.18 2ntm s VAL 18 Ca 0.21 -0.08 0.02 0.00 -1.81 0.00 0.00 61.98 60.32 2ntm s VAL 18 Cb -0.03 -0.47 -0.03 0.00 0.56 0.00 0.00 36.38 36.41 2ntm s VAL 18 CO 0.13 -0.04 -0.07 0.00 -0.31 0.00 0.00 175.10 174.81 2ntm s ALA 19 N -0.06 0.71 -0.06 1.32 0.00 0.17 -1.32 121.76 122.52 2ntm s ALA 19 Ca -0.02 -1.00 -0.09 0.00 0.00 0.00 0.00 51.96 50.85 2ntm s ALA 19 Cb -0.03 0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.21 2ntm s ALA 19 CO 0.01 -0.12 0.23 -0.47 0.00 0.00 0.00 175.76 175.41 2ntm s TYR 20 N -2.33 -0.18 -0.14 0.00 5.04 0.12 -1.29 117.35 118.57 2ntm s TYR 20 Ca -0.01 0.40 -0.07 0.00 -2.44 0.00 0.00 57.07 54.95 2ntm s TYR 20 Cb -0.04 0.06 0.06 0.00 0.35 0.00 0.00 41.96 42.39 2ntm s TYR 20 CO -0.02 -0.21 0.33 0.50 -1.34 0.00 0.00 175.55 174.80 2ntm s ARG 21 N -0.48 0.27 0.12 4.97 3.52 0.87 -0.64 118.95 127.59 2ntm s ARG 21 Ca -0.06 0.71 -0.24 0.00 -0.13 0.00 0.00 55.73 56.01 2ntm s ARG 21 Cb -0.04 -0.02 -0.07 0.00 -1.56 0.00 0.00 34.95 33.26 2ntm s ARG 21 CO 0.01 -0.19 0.73 0.08 -0.81 0.00 0.00 175.30 175.12 2ntm s VAL 22 N 1.64 4.53 -0.04 7.11 1.01 0.30 -1.23 120.40 133.72 2ntm s VAL 22 Ca -0.07 1.59 0.01 0.00 0.00 0.00 0.00 61.98 63.51 2ntm s VAL 22 Cb -0.10 -4.08 0.02 0.00 0.00 0.00 0.00 36.38 32.22 2ntm s VAL 22 CO -0.11 0.49 -0.03 -0.44 0.00 0.00 0.00 175.10 175.01 2ntm s SER 23 N -0.85 0.90 -0.01 3.32 0.01 -1.24 -1.52 113.70 114.30 2ntm s SER 23 Ca 0.35 -0.10 -0.10 0.00 1.31 0.00 0.00 55.95 57.40 2ntm s SER 23 Cb -0.22 -0.40 0.01 0.00 0.21 0.00 0.00 66.02 65.62 2ntm s SER 23 CO 0.24 -0.07 0.21 -0.55 0.41 0.00 0.00 173.24 173.48 2ntm s SER 24 N 1.02 -0.08 -0.20 2.44 0.15 -0.84 -4.17 113.70 112.01 2ntm s SER 24 Ca -0.10 -0.02 -0.15 0.00 0.70 0.00 0.00 55.95 56.37 2ntm s SER 24 Cb -0.14 0.28 -0.09 0.00 -1.71 0.00 0.00 66.02 64.36 2ntm s SER 24 CO -0.01 -0.37 -0.22 0.54 1.20 0.00 0.00 173.24 174.39 2ntm n ARG 25 N 1.55 0.53 -0.30 5.44 1.74 -1.26 -4.66 116.66 119.70 2ntm n ARG 25 Ca -0.21 0.36 0.11 0.00 -0.77 0.00 0.00 57.85 57.33 2ntm n ARG 25 Cb 0.56 -1.56 0.28 0.00 -1.02 0.00 0.00 32.46 30.72 2ntm n ARG 25 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2ntm n SER 26 N -4.44 3.40 -3.00 0.55 3.41 -1.26 -4.64 113.62 107.65 2ntm n SER 26 Ca -0.25 -1.99 -0.16 0.00 -0.26 0.00 0.00 58.87 56.21 2ntm n SER 26 Cb 0.57 -0.40 -0.01 0.00 -0.26 0.00 0.00 64.21 64.12 2ntm n SER 26 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2ntm n PHE 27 N 1.37 -1.53 1.22 7.33 3.01 -1.26 -4.95 117.46 122.64 2ntm n PHE 27 Ca 0.21 -2.86 0.13 0.00 1.01 0.00 0.00 57.45 55.95 2ntm n PHE 27 Cb 0.55 0.49 0.45 0.00 -0.01 0.00 0.00 39.48 40.95 2ntm n PHE 27 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 2ntm n PRO 28 N 1.18 0.51 -1.50 -1.08 -0.02 -1.26 -4.47 135.00 128.36 2ntm n PRO 28 Ca 0.16 -0.24 -0.40 0.00 -2.02 0.00 0.00 63.50 61.00 2ntm n PRO 28 Cb 0.60 -1.49 -0.02 0.00 -0.02 0.00 0.00 33.50 32.57 2ntm n PRO 28 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2ntm n ASN 29 N -1.03 7.41 -3.88 2.55 5.03 -1.26 -4.84 115.26 119.24 2ntm n ASN 29 Ca 0.11 -2.70 -0.10 0.00 0.87 0.00 0.00 54.58 52.76 2ntm n ASN 29 Cb 0.32 -1.57 -0.09 0.00 -1.02 0.00 0.00 39.78 37.42 2ntm n ASN 29 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2ntm s ARG 30 N 2.11 0.61 0.29 3.52 0.52 -1.26 -1.46 118.95 123.28 2ntm s ARG 30 Ca 0.62 -0.64 -0.03 0.00 -0.52 0.00 0.00 55.73 55.17 2ntm s ARG 30 Cb 0.17 0.25 -0.01 0.00 0.52 0.00 0.00 34.95 35.87 2ntm s ARG 30 CO -0.07 -0.16 0.36 -0.08 0.02 0.00 0.00 175.30 175.37 2ntm s THR 31 N -2.37 0.00 -0.07 0.02 -1.32 -0.38 -4.64 115.64 106.89 2ntm s THR 31 Ca -0.07 -1.72 0.01 0.00 -1.21 0.00 0.00 61.69 58.70 2ntm s THR 31 Cb -0.02 -2.49 -0.03 0.00 -1.51 0.00 0.00 72.50 68.45 2ntm s THR 31 CO -0.03 0.00 -0.08 0.42 -2.21 0.00 0.00 174.62 172.72 2ntm s THR 32 N -3.59 3.65 -0.12 5.08 -4.23 -1.26 -1.26 115.64 113.90 2ntm s THR 32 Ca 0.32 -0.50 0.01 0.00 -1.18 0.00 0.00 61.69 60.35 2ntm s THR 32 Cb 0.02 -2.49 0.02 0.00 1.34 0.00 0.00 72.50 71.39 2ntm s THR 32 CO 0.17 0.60 -0.16 -0.55 -0.54 0.00 0.00 174.62 174.14 2ntm s SER 33 N -0.77 2.59 0.10 3.99 0.15 0.10 -4.96 113.70 114.91 2ntm s SER 33 Ca 0.12 -0.47 -0.27 0.00 0.70 0.00 0.00 55.95 56.03 2ntm s SER 33 Cb -0.11 -1.16 -0.06 0.00 -1.71 0.00 0.00 66.02 62.98 2ntm s SER 33 CO 0.01 0.00 0.86 -0.63 1.20 0.00 0.00 173.24 174.68 2ntm s ILE 34 N 1.11 4.54 0.29 6.45 1.01 -1.26 -1.56 121.20 131.77 2ntm s ILE 34 Ca -0.03 1.85 0.06 0.00 0.00 0.00 0.00 60.65 62.53 2ntm s ILE 34 Cb -0.14 -4.22 -0.02 0.00 0.01 0.00 0.00 42.46 38.08 2ntm s ILE 34 CO -0.04 0.38 0.25 0.00 0.00 0.00 0.00 174.94 175.52 2ntm n GLN 35 N 2.54 0.36 -1.61 2.79 1.13 -0.39 -4.99 117.38 117.20 2ntm n GLN 35 Ca -0.01 -2.86 -0.44 0.00 -1.94 0.00 0.00 57.00 51.75 2ntm n GLN 35 Cb 0.49 2.36 -0.04 0.00 0.11 0.00 0.00 30.24 33.17 2ntm n GLN 35 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2ntm n GLU 36 N -0.54 2.19 -1.29 -1.09 2.13 -1.26 -2.30 120.64 118.47 2ntm n GLU 36 Ca 0.07 0.70 -0.10 0.00 0.66 0.00 0.00 57.16 58.49 2ntm n GLU 36 Cb 0.52 -3.04 -0.04 0.00 0.27 0.00 0.00 31.44 29.15 2ntm n GLU 36 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2ntm n GLU 37 N 8.11 -1.32 -3.67 5.31 -0.58 -1.26 -4.94 120.64 122.29 2ntm n GLU 37 Ca 0.27 0.82 -0.09 0.00 -0.42 0.00 0.00 57.16 57.74 2ntm n GLU 37 Cb 0.40 -5.01 -0.02 0.00 -0.57 0.00 0.00 31.44 26.24 2ntm n GLU 37 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 2ntm s ARG 38 N -2.70 1.50 -0.06 3.49 1.70 -0.97 0.18 118.95 122.09 2ntm s ARG 38 Ca 0.00 -0.73 0.02 0.00 -0.47 0.00 0.00 55.73 54.55 2ntm s ARG 38 Cb 0.00 0.58 0.02 0.00 -0.57 0.00 0.00 34.95 34.97 2ntm s ARG 38 CO 0.00 -0.68 -0.10 0.08 -1.08 0.00 0.00 175.30 173.52 2ntm s VAL 39 N -3.77 1.00 0.12 4.99 1.01 -0.70 -1.26 120.40 121.79 2ntm s VAL 39 Ca 0.07 -0.39 0.08 0.00 0.00 0.00 0.00 61.98 61.74 2ntm s VAL 39 Cb -0.04 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.37 2ntm s VAL 39 CO -0.02 0.33 -0.15 0.00 0.00 0.00 0.00 175.10 175.25 2ntm s ALA 40 N 0.75 2.77 -0.27 5.51 0.00 -0.60 -0.61 121.76 129.31 2ntm s ALA 40 Ca -0.13 -1.33 -0.11 0.00 0.00 0.00 0.00 51.96 50.38 2ntm s ALA 40 Cb -0.15 -0.72 -0.05 0.00 0.00 0.00 0.00 23.12 22.20 2ntm s ALA 40 CO 0.03 0.60 0.20 0.08 0.00 0.00 0.00 175.76 176.67 2ntm s VAL 41 N -1.20 5.31 0.13 0.00 1.01 0.14 0.01 120.40 125.80 2ntm s VAL 41 Ca 0.19 0.22 -0.01 0.00 0.00 0.00 0.00 61.98 62.38 2ntm s VAL 41 Cb -0.11 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 2ntm s VAL 41 CO 0.11 0.26 0.05 0.68 0.00 0.00 0.00 175.10 176.21 2ntm s VAL 42 N 1.61 0.18 0.50 2.92 -7.23 -0.39 -2.29 120.40 115.71 2ntm s VAL 42 Ca 0.08 -1.92 -0.22 0.00 -1.81 0.00 0.00 61.98 58.12 2ntm s VAL 42 Cb -0.15 -2.05 -0.06 0.00 0.56 0.00 0.00 36.38 34.68 2ntm s VAL 42 CO 0.09 -0.47 1.19 -2.84 -0.31 0.00 0.00 175.10 172.76 2ntm s PRO 43 N -4.03 3.50 0.51 4.82 0.02 -1.26 -1.24 135.00 137.32 2ntm s PRO 43 Ca 0.24 1.81 -0.18 0.00 0.02 0.00 0.00 61.00 62.88 2ntm s PRO 43 Cb 0.07 -2.25 -0.08 0.00 0.02 0.00 0.00 34.50 32.27 2ntm s PRO 43 CO 0.02 -0.77 1.01 0.08 -0.33 0.00 0.00 177.00 177.01 2ntm s VAL 44 N -1.56 4.13 -0.02 3.83 1.01 -0.53 -4.73 120.40 122.53 2ntm s VAL 44 Ca 0.68 1.16 -0.40 0.00 0.00 0.00 0.00 61.98 63.43 2ntm s VAL 44 Cb -0.29 -3.54 -0.19 0.00 0.00 0.00 0.00 36.38 32.35 2ntm s VAL 44 CO 0.35 -0.45 1.19 1.21 0.00 0.00 0.00 175.10 177.40 2ntm n GLU 45 N -1.32 0.31 -0.28 2.72 2.13 -1.26 -1.19 120.64 121.74 2ntm n GLU 45 Ca 0.08 0.11 0.00 0.00 0.66 0.00 0.00 57.16 58.01 2ntm n GLU 45 Cb 0.53 -1.65 0.00 0.00 0.27 0.00 0.00 31.44 30.59 2ntm n GLU 45 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ntm n GLY 46 N 1.98 0.66 0.02 8.31 0.00 -1.26 -4.88 105.19 110.01 2ntm n GLY 46 Ca 0.20 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.23 2ntm n GLY 46 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2ntm n HIS 47 N -2.02 0.00 -0.35 1.61 8.25 -0.33 -4.79 115.22 117.59 2ntm n HIS 47 Ca 0.00 -0.33 0.31 0.00 -0.26 0.00 0.00 57.72 57.44 2ntm n HIS 47 Cb 0.00 -0.04 0.57 0.00 1.12 0.00 0.00 29.99 31.64 2ntm n HIS 47 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 2ntm h GLU 48 N 0.00 0.11 -0.53 -0.41 3.07 -1.88 0.40 114.58 115.33 2ntm h GLU 48 Ca 0.00 -0.01 0.12 0.00 -0.50 0.00 0.00 59.36 58.97 2ntm h GLU 48 Cb 0.74 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.60 2ntm h GLU 48 CO 0.00 0.07 0.37 0.00 -1.40 0.00 0.00 179.01 178.05 2ntm h ARG 49 N 0.11 0.18 -1.03 2.33 3.08 -1.95 -2.83 114.38 114.28 2ntm h ARG 49 Ca 0.81 -0.01 0.25 0.00 0.07 0.00 0.00 59.98 61.11 2ntm h ARG 49 Cb 2.14 -0.04 -0.11 0.00 0.08 0.00 0.00 29.97 32.05 2ntm h ARG 49 CO -0.66 0.12 0.64 -0.44 -1.07 0.00 0.00 179.97 178.56 2ntm h ASP 50 N 0.19 0.55 -0.57 7.04 3.32 -0.58 -0.13 116.42 126.23 2ntm h ASP 50 Ca 0.25 0.10 0.17 0.00 0.02 0.00 0.00 57.03 57.57 2ntm h ASP 50 Cb 0.74 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.29 2ntm h ASP 50 CO -0.04 0.10 0.57 0.58 -1.72 0.00 0.00 179.24 178.73 2ntm h VAL 51 N 0.48 0.36 -0.01 -1.35 2.07 -1.70 -0.24 116.25 115.88 2ntm h VAL 51 Ca 0.61 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.13 2ntm h VAL 51 Cb 1.37 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 2ntm h VAL 51 CO -0.37 0.00 -0.36 0.49 0.02 0.00 0.00 177.57 177.36 2ntm n PHE 52 N -3.76 0.00 0.37 1.57 3.01 -0.06 -3.95 117.46 114.64 2ntm n PHE 52 Ca 0.11 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.65 2ntm n PHE 52 Cb 0.79 -0.11 -0.10 0.00 -0.01 0.00 0.00 39.48 40.04 2ntm n PHE 52 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2ntm n ARG 53 N -0.66 1.21 -3.47 -1.08 1.74 -0.13 -4.88 116.66 109.40 2ntm n ARG 53 Ca 0.11 -0.07 -0.09 0.00 -0.77 0.00 0.00 57.85 57.03 2ntm n ARG 53 Cb 0.37 -1.30 -0.08 0.00 -1.02 0.00 0.00 32.46 30.42 2ntm n ARG 53 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2ntm s ASN 54 N -3.12 0.01 -0.03 0.55 3.84 -1.01 -5.04 114.94 110.13 2ntm s ASN 54 Ca 0.00 0.55 0.03 0.00 0.21 0.00 0.00 52.86 53.64 2ntm s ASN 54 Cb 0.11 1.23 0.13 0.00 -0.55 0.00 0.00 41.25 42.16 2ntm s ASN 54 CO 0.65 -0.27 0.80 -0.81 -2.79 0.00 0.00 177.10 174.67 2ntm n PRO 55 N 5.38 1.55 0.00 0.43 -0.04 -1.26 -3.71 135.00 137.35 2ntm n PRO 55 Ca -0.05 -0.49 0.00 0.00 -0.04 0.00 0.00 63.50 62.91 2ntm n PRO 55 Cb 0.50 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 2ntm n PRO 55 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2ntm n TYR 56 N 0.04 0.00 0.00 0.54 0.53 -1.26 -4.77 117.16 112.24 2ntm n TYR 56 Ca 0.04 -0.29 0.06 0.00 -1.02 0.00 0.00 57.90 56.69 2ntm n TYR 56 Cb 0.33 -0.03 -0.12 0.00 -1.03 0.00 0.00 39.34 38.49 2ntm n TYR 56 CO 0.00 0.00 0.00 0.44 -1.02 0.00 0.00 176.86 176.28 2ntm n ILE 57 N -0.29 0.53 -4.71 -0.72 -5.35 -1.24 -4.90 119.36 102.67 2ntm n ILE 57 Ca 0.00 -0.60 -0.33 0.00 -0.27 0.00 0.00 62.75 61.55 2ntm n ILE 57 Cb 0.20 -0.25 -0.15 0.00 -1.74 0.00 0.00 39.64 37.70 2ntm n ILE 57 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2ntm s ALA 58 N -3.23 2.59 -0.22 -1.28 0.00 -1.26 -4.66 121.76 113.70 2ntm s ALA 58 Ca -0.06 -0.93 -0.36 0.00 0.00 0.00 0.00 51.96 50.61 2ntm s ALA 58 Cb 0.11 -1.22 0.15 0.00 0.00 0.00 0.00 23.12 22.15 2ntm s ALA 58 CO 0.86 0.18 1.26 1.52 0.00 0.00 0.00 175.76 179.57 2ntm s TYR 59 N 0.47 -0.10 0.01 0.00 -0.85 -0.97 -4.86 117.35 111.06 2ntm s TYR 59 Ca -0.10 0.07 -0.30 0.00 -0.52 0.00 0.00 57.07 56.22 2ntm s TYR 59 Cb -0.16 0.51 -0.04 0.00 0.38 0.00 0.00 41.96 42.65 2ntm s TYR 59 CO 0.05 -0.15 1.08 -0.80 -1.52 0.00 0.00 175.55 174.20 2ntm s ASN 60 N -2.05 7.24 -0.05 -0.18 0.01 -1.26 -0.68 114.94 117.96 2ntm s ASN 60 Ca 0.10 1.80 0.19 0.00 -0.71 0.00 0.00 52.86 54.23 2ntm s ASN 60 Cb -0.01 -2.57 -0.23 0.00 0.41 0.00 0.00 41.25 38.85 2ntm s ASN 60 CO -0.04 -0.37 0.48 0.00 -1.51 0.00 0.00 177.10 175.67 2ntm s ILE 62 N -2.94 0.93 -0.02 0.00 1.01 -1.02 -0.84 121.20 118.32 2ntm s ILE 62 Ca -0.07 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.15 2ntm s ILE 62 Cb 0.09 -0.81 0.01 0.00 0.01 0.00 0.00 42.46 41.76 2ntm s ILE 62 CO 0.84 0.28 -0.06 -0.13 0.00 0.00 0.00 174.94 175.87 2ntm s ARG 63 N 0.06 0.73 -0.23 2.79 1.81 0.20 -1.72 118.95 122.59 2ntm s ARG 63 Ca -0.02 -0.20 -0.04 0.00 -1.72 0.00 0.00 55.73 53.75 2ntm s ARG 63 Cb -0.08 -0.71 -0.01 0.00 -0.45 0.00 0.00 34.95 33.70 2ntm s ARG 63 CO 0.01 0.06 -0.02 0.42 -0.68 0.00 0.00 175.30 175.08 2ntm s ILE 64 N 0.30 3.48 -0.27 1.52 -1.09 0.13 -1.02 121.20 124.25 2ntm s ILE 64 Ca -0.04 -0.50 0.00 0.00 -2.23 0.00 0.00 60.65 57.88 2ntm s ILE 64 Cb -0.08 -2.61 0.08 0.00 -1.58 0.00 0.00 42.46 38.26 2ntm s ILE 64 CO 0.00 0.38 0.02 0.68 -1.23 0.00 0.00 174.94 174.79 2ntm s VAL 65 N 1.49 1.30 0.00 2.92 -7.23 0.26 -4.89 120.40 114.25 2ntm s VAL 65 Ca 0.05 -1.36 0.00 0.00 -1.81 0.00 0.00 61.98 58.87 2ntm s VAL 65 Cb -0.15 -1.78 0.00 0.00 0.56 0.00 0.00 36.38 35.01 2ntm s VAL 65 CO -0.02 -0.37 0.00 0.61 -0.31 0.00 0.00 175.10 175.00 2ntm n GLY 66 N 4.72 3.66 0.90 2.32 0.00 -1.26 -1.05 105.19 114.47 2ntm n GLY 66 Ca -0.06 -0.05 0.09 0.00 0.00 0.00 0.00 46.02 46.01 2ntm n GLY 66 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ntm n ASP 67 N 8.06 2.64 -4.42 1.61 5.75 -1.26 -4.88 116.55 124.04 2ntm n ASP 67 Ca 0.00 -1.94 -0.33 0.00 -0.01 0.00 0.00 54.79 52.51 2ntm n ASP 67 Cb 0.00 -0.28 -0.14 0.00 -1.03 0.00 0.00 41.12 39.68 2ntm n ASP 67 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2ntm s THR 68 N -1.44 3.02 -0.12 2.12 2.01 -0.22 -3.82 115.64 117.19 2ntm s THR 68 Ca 0.35 -0.71 -0.01 0.00 0.31 0.00 0.00 61.69 61.63 2ntm s THR 68 Cb 0.19 -2.22 -0.02 0.00 0.01 0.00 0.00 72.50 70.46 2ntm s THR 68 CO 0.25 0.56 -0.10 0.00 -0.69 0.00 0.00 174.62 174.65 2ntm s ALA 69 N -0.25 2.77 -0.02 7.40 0.00 -0.33 -0.57 121.76 130.75 2ntm s ALA 69 Ca 0.01 -0.88 0.07 0.00 0.00 0.00 0.00 51.96 51.16 2ntm s ALA 69 Cb -0.13 -1.29 -0.02 0.00 0.00 0.00 0.00 23.12 21.69 2ntm s ALA 69 CO 0.03 0.31 -0.22 0.08 0.00 0.00 0.00 175.76 175.95 2ntm s VAL 70 N 0.11 1.77 -0.00 0.00 1.01 -0.19 -1.05 120.40 122.06 2ntm s VAL 70 Ca -0.04 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 60.99 2ntm s VAL 70 Cb -0.14 -1.48 0.00 0.00 0.00 0.00 0.00 36.38 34.76 2ntm s VAL 70 CO 0.04 0.50 0.00 0.54 0.00 0.00 0.00 175.10 176.18 2ntm s VAL 71 N -0.43 0.02 0.20 2.92 0.11 0.03 -0.63 120.40 122.63 2ntm s VAL 71 Ca 0.06 0.01 -0.23 0.00 -2.93 0.00 0.00 61.98 58.89 2ntm s VAL 71 Cb -0.10 -0.05 0.05 0.00 -1.53 0.00 0.00 36.38 34.75 2ntm s VAL 71 CO -0.00 0.02 0.80 -0.94 -3.33 0.00 0.00 175.10 171.65 2ntm s SER 72 N 0.14 -0.27 -0.04 3.54 1.04 -0.02 -0.86 113.70 117.24 2ntm s SER 72 Ca -0.01 -0.43 0.19 0.00 0.48 0.00 0.00 55.95 56.18 2ntm s SER 72 Cb -0.02 0.61 0.61 0.00 0.10 0.00 0.00 66.02 67.32 2ntm s SER 72 CO -0.00 -1.11 1.51 -0.46 0.98 0.00 0.00 173.24 174.16 2ntm n ASN 73 N -0.44 3.84 -1.29 7.02 6.94 -1.14 -4.43 115.26 125.77 2ntm n ASN 73 Ca -0.06 -2.14 -0.02 0.00 -0.02 0.00 0.00 54.58 52.34 2ntm n ASN 73 Cb 0.60 -0.48 -0.00 0.00 -2.36 0.00 0.00 39.78 37.54 2ntm n ASN 73 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2ntm n GLY 74 N 1.39 2.67 0.30 4.83 0.00 -1.26 -4.98 105.19 108.14 2ntm n GLY 74 Ca 0.23 -1.31 0.17 0.00 0.00 0.00 0.00 46.02 45.10 2ntm n GLY 74 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2ntm h SER 75 N 0.29 0.00 0.00 1.61 4.64 -1.89 -1.97 113.55 116.23 2ntm h SER 75 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2ntm h SER 75 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2ntm h SER 75 CO 0.06 0.04 0.18 0.00 -0.87 0.00 0.00 176.83 176.24 2ntm n HIS 76 N -3.49 0.45 -0.13 4.77 1.44 -1.26 -0.33 115.22 116.66 2ntm n HIS 76 Ca -0.02 0.23 0.06 0.00 -2.01 0.00 0.00 57.72 55.98 2ntm n HIS 76 Cb 0.15 -0.74 0.38 0.00 0.12 0.00 0.00 29.99 29.90 2ntm n HIS 76 CO 0.00 0.00 0.00 1.15 -2.81 0.00 0.00 176.34 174.68 2ntm h THR 77 N 0.00 1.03 0.00 0.61 2.02 -1.59 0.06 112.91 115.04 2ntm h THR 77 Ca 0.00 -0.23 -0.24 0.00 0.77 0.00 0.00 66.41 66.70 2ntm h THR 77 Cb 0.36 0.30 -0.04 0.00 -1.74 0.00 0.00 68.15 67.03 2ntm h THR 77 CO 0.00 0.12 -1.37 0.44 0.37 0.00 0.00 175.52 175.09 2ntm h ASP 78 N 0.68 0.00 -0.49 4.18 3.32 -0.93 -2.70 116.42 120.48 2ntm h ASP 78 Ca 0.27 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.28 2ntm h ASP 78 Cb 0.20 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 2ntm h ASP 78 CO -0.08 0.95 0.14 0.74 -1.72 0.00 0.00 179.24 179.27 2ntm h THR 79 N 0.00 1.23 -0.09 0.35 2.02 -1.34 -1.13 112.91 113.96 2ntm h THR 79 Ca -0.16 -0.79 -0.10 0.00 0.77 0.00 0.00 66.41 66.13 2ntm h THR 79 Cb 1.87 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 69.09 2ntm h THR 79 CO 0.10 0.29 -0.35 0.40 0.37 0.00 0.00 175.52 176.32 2ntm h ILE 80 N 0.66 1.40 -0.48 3.11 2.04 -1.13 -2.94 117.51 120.17 2ntm h ILE 80 Ca 0.16 -1.72 0.00 0.00 1.00 0.00 0.00 64.86 64.29 2ntm h ILE 80 Cb 0.29 2.26 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 2ntm h ILE 80 CO -0.00 0.50 0.31 0.00 0.00 0.00 0.00 178.15 178.96 2ntm h ALA 81 N 0.45 0.62 -0.66 1.87 0.00 -1.43 -1.87 119.26 118.24 2ntm h ALA 81 Ca -0.02 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.89 2ntm h ALA 81 Cb 1.00 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 2ntm h ALA 81 CO 0.07 0.08 0.38 -0.44 0.00 0.00 0.00 179.25 179.35 2ntm h ASP 82 N 0.65 0.59 -0.47 0.00 5.19 -1.25 0.37 116.42 121.50 2ntm h ASP 82 Ca 0.18 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.59 2ntm h ASP 82 Cb -0.04 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 39.34 2ntm h ASP 82 CO -0.04 0.40 0.23 0.11 -3.12 0.00 0.00 179.24 176.82 2ntm h LYS 83 N 0.73 0.68 -0.24 3.56 1.79 -1.31 0.15 116.57 121.92 2ntm h LYS 83 Ca 0.28 -0.10 0.00 0.00 -2.18 0.00 0.00 60.65 58.66 2ntm h LYS 83 Cb 0.12 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.63 2ntm h LYS 83 CO -0.15 0.58 0.16 0.28 -1.08 0.00 0.00 179.45 179.23 2ntm h VAL 84 N 0.62 1.06 -0.59 0.50 2.07 -0.57 -2.06 116.25 117.27 2ntm h VAL 84 Ca 0.16 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.58 2ntm h VAL 84 Cb 0.12 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 2ntm h VAL 84 CO -0.02 0.06 0.39 0.00 0.02 0.00 0.00 177.57 178.02 2ntm h ALA 85 N 1.09 0.75 0.00 1.67 0.00 0.17 -2.15 119.26 120.79 2ntm h ALA 85 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2ntm h ALA 85 Cb -0.03 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.52 2ntm h ALA 85 CO -0.02 0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.69 2ntm n LEU 86 N -4.68 0.00 -0.71 0.00 4.77 0.49 -4.88 117.00 111.99 2ntm n LEU 86 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2ntm n LEU 86 Cb 0.02 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2ntm n LEU 86 CO 0.35 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 2ntm n GLY 87 N 0.44 -1.42 3.64 -0.72 0.00 -0.81 -5.04 105.19 101.27 2ntm n GLY 87 Ca 0.06 -0.53 -0.10 0.00 0.00 0.00 0.00 46.02 45.44 2ntm n GLY 87 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2ntm s MET 88 N -0.08 0.63 0.58 1.61 0.00 -0.97 -4.86 119.30 116.20 2ntm s MET 88 Ca 0.00 0.77 -0.18 0.00 0.00 0.00 0.00 55.69 56.28 2ntm s MET 88 Cb 0.00 0.29 -0.04 0.00 0.00 0.00 0.00 34.83 35.08 2ntm s MET 88 CO 0.00 -0.08 1.13 0.54 0.00 0.00 0.00 175.02 176.61 2ntm s ASN 89 N 0.40 5.52 0.17 1.11 2.20 -1.26 -4.37 114.94 118.71 2ntm s ASN 89 Ca 0.01 2.15 -0.17 0.00 -0.94 0.00 0.00 52.86 53.91 2ntm s ASN 89 Cb -0.05 -2.57 0.11 0.00 -2.00 0.00 0.00 41.25 36.73 2ntm s ASN 89 CO -0.05 -1.36 1.66 -0.07 -2.94 0.00 0.00 177.10 174.35 2ntm h LEU 90 N 0.87 -0.39 -0.60 3.54 3.38 -1.99 -0.30 115.31 119.82 2ntm h LEU 90 Ca -0.49 0.13 0.06 0.00 0.09 0.00 0.00 57.88 57.66 2ntm h LEU 90 Cb 1.26 0.26 -0.05 0.00 0.09 0.00 0.00 40.66 42.22 2ntm h LEU 90 CO 0.56 -0.14 0.31 -0.09 0.09 0.00 0.00 178.44 179.17 2ntm h ARG 91 N -0.00 0.57 -0.09 1.13 2.43 -1.96 -1.93 114.38 114.52 2ntm h ARG 91 Ca 0.20 -0.03 -0.21 0.00 -0.81 0.00 0.00 59.98 59.13 2ntm h ARG 91 Cb 0.31 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2ntm h ARG 91 CO -0.43 0.38 -0.81 -0.44 -1.51 0.00 0.00 179.97 177.16 2ntm h ASP 92 N 0.59 0.70 -0.08 -3.80 3.32 -1.87 -1.14 116.42 114.14 2ntm h ASP 92 Ca 0.27 -0.48 0.03 0.00 0.02 0.00 0.00 57.03 56.86 2ntm h ASP 92 Cb 0.18 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.49 2ntm h ASP 92 CO -0.18 1.26 -0.09 0.00 -1.72 0.00 0.00 179.24 178.51 2ntm h ALA 93 N 0.72 -0.04 0.06 3.45 0.00 -0.72 0.27 119.26 123.01 2ntm h ALA 93 Ca -0.05 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2ntm h ALA 93 Cb 1.42 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.40 2ntm h ALA 93 CO 0.15 -0.56 -0.03 0.82 0.00 0.00 0.00 179.25 179.63 2ntm h ILE 94 N -0.13 1.11 -0.85 0.00 2.04 -1.37 -2.53 117.51 115.79 2ntm h ILE 94 Ca 0.06 -0.56 0.07 0.00 1.00 0.00 0.00 64.86 65.42 2ntm h ILE 94 Cb 0.21 1.48 -0.06 0.00 -0.74 0.00 0.00 36.82 37.71 2ntm h ILE 94 CO -0.15 0.14 0.52 1.23 0.00 0.00 0.00 178.15 179.89 2ntm h GLY 95 N -0.33 1.29 2.00 5.37 0.00 -0.97 0.39 103.07 110.82 2ntm h GLY 95 Ca -0.01 -0.37 -0.11 0.00 0.00 0.00 0.00 47.33 46.84 2ntm h GLY 95 CO 0.01 0.24 -0.50 -2.00 0.00 0.00 0.00 176.54 174.29 2ntm h LEU 96 N 0.94 0.00 0.16 3.11 5.85 -0.47 -1.05 115.31 123.85 2ntm h LEU 96 Ca 0.38 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.79 2ntm h LEU 96 Cb 0.20 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.24 2ntm h LEU 96 CO -0.18 0.50 -1.46 0.28 -0.34 0.00 0.00 178.44 177.23 2ntm h SER 97 N 0.00 0.54 0.57 1.25 0.02 -0.97 -2.86 113.55 112.10 2ntm h SER 97 Ca -0.01 -0.65 -0.16 0.00 -0.84 0.00 0.00 61.79 60.13 2ntm h SER 97 Cb 1.00 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.35 2ntm h SER 97 CO 0.07 1.52 -0.73 -0.07 -1.14 0.00 0.00 176.83 176.48 2ntm h LEU 98 N 0.09 0.15 -0.34 5.07 3.38 -0.90 -0.90 115.31 121.86 2ntm h LEU 98 Ca -0.23 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.56 2ntm h LEU 98 Cb 2.05 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.75 2ntm h LEU 98 CO 0.20 0.82 -0.12 0.25 0.09 0.00 0.00 178.44 179.69 2ntm h LEU 99 N 0.08 0.68 -0.15 1.67 5.85 -1.27 -1.77 115.31 120.41 2ntm h LEU 99 Ca -0.02 -0.38 -0.14 0.00 0.84 0.00 0.00 57.88 58.18 2ntm h LEU 99 Cb 1.28 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.13 2ntm h LEU 99 CO 0.10 0.91 -0.45 0.00 -0.34 0.00 0.00 178.44 178.67 2ntm h ALA 100 N 0.79 0.26 0.06 1.25 0.00 -1.45 -3.36 119.26 116.82 2ntm h ALA 100 Ca 0.08 -0.48 -0.27 0.00 0.00 0.00 0.00 54.91 54.24 2ntm h ALA 100 Cb 0.63 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2ntm h ALA 100 CO 0.04 0.39 -1.36 0.52 0.00 0.00 0.00 179.25 178.84 2ntm h MET 101 N 0.21 0.13 -1.65 0.00 2.86 -1.22 -3.50 114.93 111.75 2ntm h MET 101 Ca -0.01 -0.23 0.20 0.00 -2.06 0.00 0.00 59.70 57.60 2ntm h MET 101 Cb 1.07 0.08 -0.05 0.00 0.06 0.00 0.00 31.60 32.76 2ntm h MET 101 CO 0.10 0.99 -0.29 -3.47 1.06 0.00 0.00 176.91 175.30 2ntm n ASP 102 N -3.36 -4.38 -4.76 1.22 4.64 -0.66 -4.82 116.55 104.43 2ntm n ASP 102 Ca -0.10 0.32 -0.33 0.00 -1.38 0.00 0.00 54.79 53.29 2ntm n ASP 102 Cb 1.01 -2.25 0.06 0.00 -1.04 0.00 0.00 41.12 38.91 2ntm n ASP 102 CO 0.00 0.00 0.00 -0.72 -0.82 0.00 0.00 177.20 175.66 2ntm s TYR 103 N -1.73 2.48 0.02 -0.67 -0.85 -1.26 -4.44 117.35 110.89 2ntm s TYR 103 Ca 0.00 1.57 -0.30 0.00 -0.52 0.00 0.00 57.07 57.82 2ntm s TYR 103 Cb 0.00 -3.22 -0.04 0.00 0.38 0.00 0.00 41.96 39.07 2ntm s TYR 103 CO 0.00 -1.91 1.10 -1.21 -1.52 0.00 0.00 175.55 172.01 2ntm s GLU 104 N -4.13 4.48 -1.18 -3.49 2.02 0.21 -4.93 118.70 111.68 2ntm s GLU 104 Ca 0.68 1.59 -0.10 0.00 0.02 0.00 0.00 54.97 57.16 2ntm s GLU 104 Cb -0.22 -3.42 -0.07 0.00 0.10 0.00 0.00 34.13 30.52 2ntm s GLU 104 CO 0.44 -0.19 2.35 1.63 0.02 0.00 0.00 175.26 179.51 2ntm n LYS 105 N 4.07 2.58 -1.63 1.61 4.76 -1.26 -3.04 118.16 125.24 2ntm n LYS 105 Ca 0.08 -1.88 0.00 0.00 -2.87 0.00 0.00 58.31 53.63 2ntm n LYS 105 Cb 0.48 -2.73 0.00 0.00 -1.84 0.00 0.00 35.03 30.94 2ntm n LYS 105 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2ntm n ASP 106 N 4.76 1.59 -0.33 4.39 5.68 -1.26 -4.98 116.55 126.39 2ntm n ASP 106 Ca 0.57 -0.91 0.16 0.00 -0.50 0.00 0.00 54.79 54.11 2ntm n ASP 106 Cb 0.23 0.00 0.39 0.00 -1.14 0.00 0.00 41.12 40.61 2ntm n ASP 106 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 2ntm h GLU 107 N 0.00 0.60 -0.39 0.11 4.57 -2.03 -2.71 114.58 114.74 2ntm h GLU 107 Ca 0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2ntm h GLU 107 Cb 0.00 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.45 2ntm h GLU 107 CO 0.00 0.40 0.00 1.28 -1.18 0.00 0.00 179.01 179.51 2ntm n LEU 108 N -4.72 3.65 -4.12 1.64 4.77 -1.26 -4.97 117.00 112.00 2ntm n LEU 108 Ca 0.24 -2.43 -0.34 0.00 -0.03 0.00 0.00 56.01 53.44 2ntm n LEU 108 Cb 0.67 -0.41 -0.01 0.00 -2.33 0.00 0.00 43.42 41.34 2ntm n LEU 108 CO 0.23 0.73 0.02 0.59 -1.33 0.00 0.00 177.39 177.63 2ntm n ASN 109 N 0.33 -3.84 -4.67 -1.43 3.02 -1.02 -4.76 115.26 102.89 2ntm n ASN 109 Ca 0.18 -0.93 -0.59 0.00 -0.03 0.00 0.00 54.58 53.21 2ntm n ASN 109 Cb 0.68 -3.15 -0.08 0.00 -0.61 0.00 0.00 39.78 36.63 2ntm n ASN 109 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2ntm n THR 110 N -4.49 0.13 -1.69 3.41 -1.04 -1.17 -4.45 114.28 104.98 2ntm n THR 110 Ca 0.06 -0.02 -0.33 0.00 -2.04 0.00 0.00 64.05 61.72 2ntm n THR 110 Cb 0.50 -0.82 0.06 0.00 -1.82 0.00 0.00 70.33 68.25 2ntm n THR 110 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2ntm s PRO 111 N 2.34 2.66 -0.21 -2.82 0.02 -1.26 0.63 135.00 136.35 2ntm s PRO 111 Ca 0.96 1.48 -0.12 0.00 0.02 0.00 0.00 61.00 63.33 2ntm s PRO 111 Cb -1.17 -1.92 -0.05 0.00 0.02 0.00 0.00 34.50 31.38 2ntm s PRO 111 CO 0.64 -1.38 0.24 1.03 -0.33 0.00 0.00 177.00 177.21 2ntm s ARG 112 N -4.04 4.14 0.21 5.54 0.52 -0.82 -4.74 118.95 119.77 2ntm s ARG 112 Ca 0.69 -0.08 0.10 0.00 -0.52 0.00 0.00 55.73 55.92 2ntm s ARG 112 Cb -0.22 -3.51 -0.04 0.00 0.52 0.00 0.00 34.95 31.69 2ntm s ARG 112 CO 0.42 0.08 -0.15 0.96 0.02 0.00 0.00 175.30 176.63 2ntm s ILE 113 N 0.98 2.81 0.03 1.52 -4.36 -1.26 -0.91 121.20 120.01 2ntm s ILE 113 Ca 0.12 -1.92 -0.28 0.00 -0.26 0.00 0.00 60.65 58.31 2ntm s ILE 113 Cb -0.13 -2.40 0.10 0.00 1.25 0.00 0.00 42.46 41.27 2ntm s ILE 113 CO 0.05 -0.18 0.90 0.00 0.24 0.00 0.00 174.94 175.95 2ntm s ALA 114 N -1.86 -1.79 -0.09 2.27 0.00 0.23 -2.89 121.76 117.63 2ntm s ALA 114 Ca 0.25 0.84 -0.30 0.00 0.00 0.00 0.00 51.96 52.75 2ntm s ALA 114 Cb -0.08 0.46 0.10 0.00 0.00 0.00 0.00 23.12 23.60 2ntm s ALA 114 CO 0.14 -0.76 0.83 0.00 0.00 0.00 0.00 175.76 175.97 2ntm s ALA 115 N -3.15 -1.84 0.00 0.00 0.00 -0.04 0.09 121.76 116.83 2ntm s ALA 115 Ca 0.06 1.38 -0.04 0.00 0.00 0.00 0.00 51.96 53.36 2ntm s ALA 115 Cb -0.01 -0.25 -0.00 0.00 0.00 0.00 0.00 23.12 22.86 2ntm s ALA 115 CO -0.07 -0.38 0.08 0.00 0.00 0.00 0.00 175.76 175.39 2ntm s ALA 116 N -1.38 -0.17 -0.13 0.00 0.00 -0.14 -0.79 121.76 119.15 2ntm s ALA 116 Ca -0.06 -0.21 -0.11 0.00 0.00 0.00 0.00 51.96 51.59 2ntm s ALA 116 Cb -0.00 0.07 0.04 0.00 0.00 0.00 0.00 23.12 23.23 2ntm s ALA 116 CO 0.04 -0.16 0.34 -1.50 0.00 0.00 0.00 175.76 174.48 2ntm s ILE 117 N -1.15 -0.01 0.00 0.00 2.07 -0.22 -1.01 121.20 120.88 2ntm s ILE 117 Ca -0.13 0.02 0.00 0.00 -1.41 0.00 0.00 60.65 59.14 2ntm s ILE 117 Cb -0.07 -0.48 0.00 0.00 0.13 0.00 0.00 42.46 42.04 2ntm s ILE 117 CO 0.01 0.01 0.00 -0.46 -1.91 0.00 0.00 174.94 172.59 2ntm n ASN 118 N 3.18 0.75 0.16 4.50 0.23 -0.50 -1.19 115.26 122.40 2ntm n ASN 118 Ca -0.15 -0.25 0.12 0.00 -0.53 0.00 0.00 54.58 53.77 2ntm n ASN 118 Cb 0.57 0.00 0.58 0.00 -2.08 0.00 0.00 39.78 38.84 2ntm n ASN 118 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2ntm h GLY 119 N 0.00 0.00 0.00 4.83 0.00 -2.02 -3.35 103.07 102.53 2ntm h GLY 119 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 2ntm h GLY 119 CO 0.00 0.00 -1.14 1.44 0.00 0.00 0.00 176.54 176.84 2ntm n SER 120 N -2.30 1.12 -4.25 0.19 7.64 -1.26 -5.10 113.62 109.65 2ntm n SER 120 Ca -0.00 0.18 -0.25 0.00 1.01 0.00 0.00 58.87 59.81 2ntm n SER 120 Cb 0.12 -0.42 -0.09 0.00 -1.01 0.00 0.00 64.21 62.81 2ntm n SER 120 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2ntm s GLU 121 N -2.30 1.87 -0.11 1.43 2.02 -1.26 -5.12 118.70 115.24 2ntm s GLU 121 Ca -0.15 -2.12 -0.10 0.00 0.02 0.00 0.00 54.97 52.62 2ntm s GLU 121 Cb 0.04 -0.73 0.03 0.00 0.10 0.00 0.00 34.13 33.57 2ntm s GLU 121 CO 0.20 -0.39 0.28 0.00 0.02 0.00 0.00 175.26 175.37 2ntm s ALA 122 N -3.22 -0.70 0.01 5.21 0.00 -1.26 -1.41 121.76 120.39 2ntm s ALA 122 Ca 0.26 0.80 0.02 0.00 0.00 0.00 0.00 51.96 53.04 2ntm s ALA 122 Cb 0.04 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.69 2ntm s ALA 122 CO 0.14 -0.13 -0.07 -0.06 0.00 0.00 0.00 175.76 175.64 2ntm s PHE 123 N 0.17 0.60 0.01 0.00 0.40 -0.18 0.49 117.98 119.47 2ntm s PHE 123 Ca -0.00 -0.20 0.06 0.00 -0.60 0.00 0.00 56.93 56.19 2ntm s PHE 123 Cb -0.02 -0.38 -0.02 0.00 0.51 0.00 0.00 43.02 43.12 2ntm s PHE 123 CO 0.00 -0.02 -0.17 -1.50 0.70 0.00 0.00 175.22 174.23 2ntm s ILE 124 N -0.43 1.34 0.10 0.64 2.07 0.33 -0.97 121.20 124.28 2ntm s ILE 124 Ca -0.00 -0.88 -0.14 0.00 -1.41 0.00 0.00 60.65 58.22 2ntm s ILE 124 Cb -0.04 -1.15 0.02 0.00 0.13 0.00 0.00 42.46 41.42 2ntm s ILE 124 CO -0.00 0.25 0.32 -0.83 -1.91 0.00 0.00 174.94 172.77 2ntm s GLY 125 N -0.73 -0.14 0.03 1.50 0.00 0.11 -0.58 107.32 107.51 2ntm s GLY 125 Ca 0.06 -0.19 -0.11 0.00 0.00 0.00 0.00 44.72 44.48 2ntm s GLY 125 CO 0.00 -0.42 0.22 -1.50 0.00 0.00 0.00 173.10 171.40 2ntm s ILE 126 N -3.55 0.09 -0.05 0.90 2.07 0.19 -0.60 121.20 120.26 2ntm s ILE 126 Ca 0.02 -0.77 0.00 0.00 -1.41 0.00 0.00 60.65 58.49 2ntm s ILE 126 Cb 0.02 -0.82 0.02 0.00 0.13 0.00 0.00 42.46 41.82 2ntm s ILE 126 CO -0.10 -0.43 -0.03 0.54 -1.91 0.00 0.00 174.94 173.01 2ntm s VAL 127 N -2.25 0.49 0.00 4.00 0.11 -0.09 -1.03 120.40 121.63 2ntm s VAL 127 Ca -0.07 -0.05 0.00 0.00 -2.93 0.00 0.00 61.98 58.92 2ntm s VAL 127 Cb -0.02 -0.56 0.00 0.00 -1.53 0.00 0.00 36.38 34.27 2ntm s VAL 127 CO -0.02 0.23 0.00 0.35 -3.33 0.00 0.00 175.10 172.33 2ntm n THR 128 N 4.36 0.00 0.58 5.04 -2.24 -0.14 -1.94 114.28 119.95 2ntm n THR 128 Ca -0.20 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.70 2ntm n THR 128 Cb 0.51 0.00 0.25 0.00 -2.10 0.00 0.00 70.33 68.99 2ntm n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ntm n ALA 129 N -3.00 2.68 0.76 6.98 0.00 -1.26 -3.69 120.51 122.99 2ntm n ALA 129 Ca 0.00 -0.16 0.08 0.00 0.00 0.00 0.00 53.44 53.36 2ntm n ALA 129 Cb 0.00 -1.28 -0.01 0.00 0.00 0.00 0.00 19.45 18.15 2ntm n ALA 129 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2ntm n ASP 130 N -2.19 1.57 0.00 0.00 8.00 -1.26 -5.07 116.55 117.61 2ntm n ASP 130 Ca 0.04 -1.29 0.00 0.00 0.71 0.00 0.00 54.79 54.25 2ntm n ASP 130 Cb 0.44 0.54 0.00 0.00 -0.02 0.00 0.00 41.12 42.08 2ntm n ASP 130 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ntm n GLY 131 N 1.22 -1.26 3.06 0.44 0.00 -1.24 -5.14 105.19 102.27 2ntm n GLY 131 Ca 0.07 -0.86 -0.13 0.00 0.00 0.00 0.00 46.02 45.10 2ntm n GLY 131 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ntm s LEU 132 N 0.00 0.99 -0.17 0.99 2.96 -1.26 -0.97 118.68 121.22 2ntm s LEU 132 Ca 0.00 0.43 -0.10 0.00 -0.22 0.00 0.00 54.13 54.24 2ntm s LEU 132 Cb 0.00 0.68 0.06 0.00 0.50 0.00 0.00 46.19 47.43 2ntm s LEU 132 CO 0.00 -0.10 0.43 -0.32 -1.32 0.00 0.00 176.35 175.04 2ntm s MET 133 N 0.47 0.42 -0.06 1.98 -2.45 -0.20 -5.02 119.30 114.44 2ntm s MET 133 Ca -0.03 0.78 -0.01 0.00 -1.25 0.00 0.00 55.69 55.18 2ntm s MET 133 Cb -0.04 0.02 0.03 0.00 1.25 0.00 0.00 34.83 36.08 2ntm s MET 133 CO -0.02 -0.14 0.01 0.08 1.05 0.00 0.00 175.02 175.99 2ntm s VAL 134 N 1.25 0.29 0.04 10.11 1.01 -1.26 -0.63 120.40 131.20 2ntm s VAL 134 Ca -0.08 0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.07 2ntm s VAL 134 Cb -0.07 -0.45 -0.03 0.00 0.00 0.00 0.00 36.38 35.83 2ntm s VAL 134 CO -0.11 0.24 -0.05 -0.94 0.00 0.00 0.00 175.10 174.24 2ntm s SER 135 N 1.91 0.57 0.46 3.32 1.04 0.25 -4.97 113.70 116.28 2ntm s SER 135 Ca 0.04 -0.61 -0.25 0.00 0.48 0.00 0.00 55.95 55.60 2ntm s SER 135 Cb -0.12 0.09 -0.08 0.00 0.10 0.00 0.00 66.02 66.00 2ntm s SER 135 CO -0.04 -0.31 1.44 -0.60 0.98 0.00 0.00 173.24 174.70 2ntm s ARG 136 N -1.97 3.66 -0.16 4.02 3.52 -1.26 -0.51 118.95 126.25 2ntm s ARG 136 Ca -0.09 2.44 -0.22 0.00 -0.13 0.00 0.00 55.73 57.73 2ntm s ARG 136 Cb -0.07 -2.64 -0.03 0.00 -1.56 0.00 0.00 34.95 30.65 2ntm s ARG 136 CO -0.02 -0.85 0.68 0.08 -0.81 0.00 0.00 175.30 174.38 2ntm s VAL 137 N -1.20 5.01 -0.11 7.11 1.01 0.18 -4.79 120.40 127.61 2ntm s VAL 137 Ca 0.61 1.32 -0.31 0.00 0.00 0.00 0.00 61.98 63.60 2ntm s VAL 137 Cb -0.44 -4.00 -0.09 0.00 0.00 0.00 0.00 36.38 31.85 2ntm s VAL 137 CO 0.57 0.14 2.04 -0.81 0.00 0.00 0.00 175.10 177.04 2ntm n PRO 138 N 4.69 2.26 -0.05 2.72 -0.04 -1.26 -4.70 135.00 138.61 2ntm n PRO 138 Ca -0.01 0.77 0.23 0.00 -0.04 0.00 0.00 63.50 64.45 2ntm n PRO 138 Cb 0.50 -2.92 0.71 0.00 -0.04 0.00 0.00 33.50 31.75 2ntm n PRO 138 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2ntm h GLU 139 N 11.65 0.00 -0.14 0.54 4.39 -1.97 -0.80 114.58 128.26 2ntm h GLU 139 Ca -0.45 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.25 2ntm h GLU 139 Cb 1.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.91 2ntm h GLU 139 CO 0.96 0.00 0.00 -0.85 -1.16 0.00 0.00 179.01 177.96 2ntm n GLU 140 N -4.25 1.32 -3.65 2.33 0.00 -1.26 -4.81 120.64 110.32 2ntm n GLU 140 Ca 0.12 -0.50 -0.01 0.00 0.00 0.00 0.00 57.16 56.77 2ntm n GLU 140 Cb 0.73 -1.11 -0.07 0.00 0.00 0.00 0.00 31.44 30.99 2ntm n GLU 140 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.13 177.05 2ntm s THR 141 N -1.81 0.00 0.86 3.84 -1.32 -0.30 -5.12 115.64 111.78 2ntm s THR 141 Ca 0.10 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.47 2ntm s THR 141 Cb 0.05 -1.00 0.11 0.00 -1.51 0.00 0.00 72.50 70.15 2ntm s THR 141 CO 0.07 0.00 1.10 -2.84 -2.21 0.00 0.00 174.62 170.74 2ntm s PRO 142 N 0.55 1.55 0.06 7.08 0.02 -1.26 -4.34 135.00 138.67 2ntm s PRO 142 Ca -0.00 1.18 -0.08 0.00 0.02 0.00 0.00 61.00 62.12 2ntm s PRO 142 Cb -0.04 -1.81 -0.00 0.00 0.02 0.00 0.00 34.50 32.66 2ntm s PRO 142 CO -0.13 -2.14 0.16 0.14 -0.33 0.00 0.00 177.00 174.70 2ntm s VAL 143 N -2.82 0.14 0.18 3.83 -7.23 -0.58 -2.21 120.40 111.70 2ntm s VAL 143 Ca 0.63 -1.13 0.01 0.00 -1.81 0.00 0.00 61.98 59.68 2ntm s VAL 143 Cb -0.19 -1.15 -0.05 0.00 0.56 0.00 0.00 36.38 35.55 2ntm s VAL 143 CO 0.57 -0.62 0.03 -0.72 -0.31 0.00 0.00 175.10 174.05 2ntm s TYR 144 N -3.27 1.20 0.03 2.82 -0.85 -0.44 -1.37 117.35 115.47 2ntm s TYR 144 Ca 0.00 -1.10 -0.21 0.00 -0.52 0.00 0.00 57.07 55.24 2ntm s TYR 144 Cb 0.02 -0.68 0.05 0.00 0.38 0.00 0.00 41.96 41.73 2ntm s TYR 144 CO -0.08 -0.31 0.49 -1.50 -1.52 0.00 0.00 175.55 172.63 2ntm s ILE 145 N -3.77 0.04 0.31 -3.49 2.07 -0.54 -1.75 121.20 114.07 2ntm s ILE 145 Ca 0.27 -0.30 0.03 0.00 -1.41 0.00 0.00 60.65 59.24 2ntm s ILE 145 Cb 0.07 -0.94 -0.04 0.00 0.13 0.00 0.00 42.46 41.68 2ntm s ILE 145 CO 0.05 -0.17 0.15 -0.94 -1.91 0.00 0.00 174.94 172.12 2ntm s SER 146 N -1.86 1.71 0.14 4.50 1.04 -0.31 -1.85 113.70 117.07 2ntm s SER 146 Ca -0.06 -1.55 0.01 0.00 0.48 0.00 0.00 55.95 54.82 2ntm s SER 146 Cb -0.01 0.36 -0.10 0.00 0.10 0.00 0.00 66.02 66.37 2ntm s SER 146 CO -0.00 -0.87 1.31 0.71 0.98 0.00 0.00 173.24 175.37 2ntm h THR 147 N 2.17 1.51 -4.12 2.02 1.35 -1.11 -3.36 112.91 111.36 2ntm h THR 147 Ca -0.34 -2.79 -0.69 0.00 -0.55 0.00 0.00 66.41 62.03 2ntm h THR 147 Cb 1.25 2.61 -0.24 0.00 -1.73 0.00 0.00 68.15 70.04 2ntm h THR 147 CO 0.54 0.81 -0.88 -0.31 -0.25 0.00 0.00 175.52 175.44 2ntm s TYR 148 N -3.04 2.31 0.00 4.73 4.12 -0.74 -4.41 117.35 120.32 2ntm s TYR 148 Ca -0.03 -0.40 0.00 0.00 0.02 0.00 0.00 57.07 56.66 2ntm s TYR 148 Cb 0.09 -1.32 0.00 0.00 -1.52 0.00 0.00 41.96 39.21 2ntm s TYR 148 CO 0.84 0.22 0.00 0.39 0.02 0.00 0.00 175.55 177.03 2ntm n GLU 149 N 1.38 0.00 -2.11 -0.62 -0.58 -1.26 -4.44 120.64 113.00 2ntm n GLU 149 Ca -0.17 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.15 2ntm n GLU 149 Cb 0.52 0.00 -0.00 0.00 -0.57 0.00 0.00 31.44 31.39 2ntm n GLU 149 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 2ntm n GLN 150 N 0.00 4.00 0.00 3.49 -0.06 -1.26 -4.73 117.38 118.82 2ntm n GLN 150 Ca 0.00 -3.39 0.00 0.00 -2.00 0.00 0.00 57.00 51.61 2ntm n GLN 150 Cb 0.00 -2.81 0.00 0.00 -4.06 0.00 0.00 30.24 23.37 2ntm n GLN 150 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 2ntm n THR 151 N 2.75 0.00 -3.85 1.69 -2.24 -1.26 -1.16 114.28 110.21 2ntm n THR 151 Ca 0.52 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 62.18 2ntm n THR 151 Cb 0.31 -0.27 -0.12 0.00 -2.10 0.00 0.00 70.33 68.14 2ntm n THR 151 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2ntm s GLU 152 N -1.45 0.18 0.32 -0.78 -1.05 -1.26 -4.95 118.70 109.72 2ntm s GLU 152 Ca 0.00 0.01 -0.23 0.00 -0.15 0.00 0.00 54.97 54.61 2ntm s GLU 152 Cb 0.00 0.08 -0.16 0.00 -0.44 0.00 0.00 34.13 33.61 2ntm s GLU 152 CO 0.00 -0.03 0.23 -2.30 0.95 0.00 0.00 175.26 174.11 2ntm n PRO 153 N 2.72 0.00 -3.71 -4.83 -0.02 -1.26 -4.79 135.00 123.11 2ntm n PRO 153 Ca -0.14 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.22 2ntm n PRO 153 Cb 0.58 -0.97 -0.12 0.00 -0.02 0.00 0.00 33.50 32.98 2ntm n PRO 153 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ntm s ALA 154 N -1.40 -0.72 0.51 3.55 0.00 -0.72 -4.94 121.76 118.05 2ntm s ALA 154 Ca 0.59 1.16 -0.22 0.00 0.00 0.00 0.00 51.96 53.48 2ntm s ALA 154 Cb -0.71 -0.80 -0.07 0.00 0.00 0.00 0.00 23.12 21.53 2ntm s ALA 154 CO 0.58 -0.31 1.14 0.00 0.00 0.00 0.00 175.76 177.18 2ntm n ALA 155 N 4.46 0.78 -3.69 0.00 0.00 -1.26 -1.33 120.51 119.47 2ntm n ALA 155 Ca -0.21 0.14 -0.10 0.00 0.00 0.00 0.00 53.44 53.26 2ntm n ALA 155 Cb 0.53 -2.20 -0.11 0.00 0.00 0.00 0.00 19.45 17.67 2ntm n ALA 155 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2ntm s THR 156 N -1.34 -0.14 -1.03 0.00 -1.32 -0.94 -4.84 115.64 106.03 2ntm s THR 156 Ca 0.69 0.12 -0.21 0.00 -1.21 0.00 0.00 61.69 61.08 2ntm s THR 156 Cb -0.46 -0.59 0.08 0.00 -1.51 0.00 0.00 72.50 70.01 2ntm s THR 156 CO 0.52 0.05 1.39 -1.61 -2.21 0.00 0.00 174.62 172.75 2ntm s GLU 157 N 1.61 3.65 -0.56 7.08 0.41 -1.26 -3.99 118.70 125.64 2ntm s GLU 157 Ca -0.08 -1.44 -0.16 0.00 -0.41 0.00 0.00 54.97 52.87 2ntm s GLU 157 Cb -0.09 -5.24 0.13 0.00 -1.78 0.00 0.00 34.13 27.15 2ntm s GLU 157 CO -0.12 -2.07 0.55 0.12 -0.49 0.00 0.00 175.26 173.24 2ntm s PHE 158 N 4.13 3.24 -0.09 1.61 5.36 -1.26 -5.02 117.98 125.95 2ntm s PHE 158 Ca 0.43 -1.28 -0.12 0.00 -0.96 0.00 0.00 56.93 55.00 2ntm s PHE 158 Cb -0.01 -3.83 -0.05 0.00 -0.34 0.00 0.00 43.02 38.79 2ntm s PHE 158 CO -0.08 -1.06 0.28 0.15 -1.46 0.00 0.00 175.22 173.05 2ntm s LYS 159 N 1.69 3.87 0.00 10.12 1.02 -1.26 -4.84 119.74 130.34 2ntm s LYS 159 Ca 0.05 0.13 0.00 0.00 0.02 0.00 0.00 55.97 56.17 2ntm s LYS 159 Cb -0.28 -3.28 0.00 0.00 -0.52 0.00 0.00 37.83 33.75 2ntm s LYS 159 CO 0.03 0.58 0.00 0.00 -0.92 0.00 0.00 175.35 175.04 2ntm n ALA 160 N 2.42 0.00 -1.37 5.17 0.00 -1.26 -4.76 120.51 120.71 2ntm n ALA 160 Ca -0.15 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.36 2ntm n ALA 160 Cb 0.53 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.13 2ntm n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ntm n GLY 161 N -0.01 4.47 3.60 0.00 0.00 -1.26 -4.63 105.19 107.36 2ntm n GLY 161 Ca 0.00 -1.09 -0.08 0.00 0.00 0.00 0.00 46.02 44.85 2ntm n GLY 161 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ntm s SER 162 N -2.81 -0.27 0.37 1.61 1.04 -1.26 -5.00 113.70 107.38 2ntm s SER 162 Ca 0.32 0.30 0.13 0.00 0.48 0.00 0.00 55.95 57.18 2ntm s SER 162 Cb 0.29 0.23 0.95 0.00 0.10 0.00 0.00 66.02 67.59 2ntm s SER 162 CO -0.01 -0.24 1.82 1.55 0.98 0.00 0.00 173.24 177.33 2ntm h PRO 163 N 2.44 0.54 -0.47 4.02 0.13 -1.86 -0.49 132.00 136.30 2ntm h PRO 163 Ca -0.15 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 2ntm h PRO 163 Cb 1.17 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 2ntm h PRO 163 CO 0.28 0.35 0.30 0.93 -0.23 0.00 0.00 178.00 179.63 2ntm h GLU 164 N 0.55 0.62 0.20 0.86 3.07 -1.89 0.14 114.58 118.13 2ntm h GLU 164 Ca 0.52 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.32 2ntm h GLU 164 Cb 1.09 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.87 2ntm h GLU 164 CO -0.26 0.44 -0.10 0.93 -1.40 0.00 0.00 179.01 178.62 2ntm h GLU 165 N 0.63 -0.26 -0.29 2.33 5.08 -1.53 -1.45 114.58 119.08 2ntm h GLU 165 Ca 0.17 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.61 2ntm h GLU 165 Cb -0.04 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.21 2ntm h GLU 165 CO -0.03 -0.07 -0.12 0.00 -1.00 0.00 0.00 179.01 177.78 2ntm h ALA 166 N 0.37 0.13 -0.94 3.43 0.00 -1.09 -0.52 119.26 120.64 2ntm h ALA 166 Ca -0.03 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2ntm h ALA 166 Cb 0.31 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 2ntm h ALA 166 CO 0.05 -0.51 0.60 0.00 0.00 0.00 0.00 179.25 179.38 2ntm h ALA 167 N 1.18 1.19 -0.57 0.00 0.00 -0.90 -2.14 119.26 118.03 2ntm h ALA 167 Ca 0.15 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 2ntm h ALA 167 Cb 0.30 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2ntm h ALA 167 CO -0.34 0.61 -0.01 1.49 0.00 0.00 0.00 179.25 181.00 2ntm h GLU 168 N 1.28 0.99 -0.13 0.00 4.57 -0.44 -2.87 114.58 117.99 2ntm h GLU 168 Ca 0.34 -0.31 -0.02 0.00 -1.18 0.00 0.00 59.36 58.19 2ntm h GLU 168 Cb -0.11 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 28.38 2ntm h GLU 168 CO -0.07 0.98 -0.01 0.35 -1.18 0.00 0.00 179.01 179.08 2ntm h PHE 169 N 0.91 0.26 0.00 0.92 3.57 -0.78 0.35 116.94 122.17 2ntm h PHE 169 Ca 0.16 -0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.60 2ntm h PHE 169 Cb 0.54 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 2ntm h PHE 169 CO 0.04 0.50 -0.07 0.97 -2.23 0.00 0.00 178.31 177.51 2ntm h ILE 170 N -0.05 0.29 0.00 1.41 2.10 -1.42 -0.24 117.51 119.61 2ntm h ILE 170 Ca 0.04 -0.48 -0.00 0.00 1.08 0.00 0.00 64.86 65.49 2ntm h ILE 170 Cb 0.40 1.37 -0.00 0.00 -1.09 0.00 0.00 36.82 37.50 2ntm h ILE 170 CO 0.01 0.07 -0.07 0.25 -1.08 0.00 0.00 178.15 177.33 2ntm h LEU 171 N 0.00 0.00 -0.16 2.19 5.85 -1.22 -3.45 115.31 118.53 2ntm h LEU 171 Ca -0.00 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.65 2ntm h LEU 171 Cb 0.36 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.39 2ntm h LEU 171 CO 0.01 0.57 0.00 0.29 -0.34 0.00 0.00 178.44 178.97 2ntm n LYS 172 N -4.75 5.07 -2.39 1.25 5.02 0.12 -4.61 118.16 117.88 2ntm n LYS 172 Ca -0.02 -0.08 -0.24 0.00 -2.02 0.00 0.00 58.31 55.95 2ntm n LYS 172 Cb 0.07 -0.54 0.08 0.00 -0.02 0.00 0.00 35.03 34.62 2ntm n LYS 172 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2ntm s GLY 173 N -0.75 1.75 0.00 0.72 0.00 -0.10 -4.05 107.32 104.89 2ntm s GLY 173 Ca 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 44.72 43.44 2ntm s GLY 173 CO 0.00 -0.82 0.00 0.61 0.00 0.00 0.00 173.10 172.89 2ntm n GLY 174 N -2.85 1.81 0.09 0.20 0.00 -1.26 -1.16 105.19 102.02 2ntm n GLY 174 Ca 0.11 -0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.11 2ntm n GLY 174 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2ntm n GLU 175 N 13.53 0.15 0.07 1.61 0.00 -1.26 -2.60 120.64 132.13 2ntm n GLU 175 Ca 0.00 0.30 0.12 0.00 0.00 0.00 0.00 57.16 57.58 2ntm n GLU 175 Cb 0.00 -1.75 0.47 0.00 0.00 0.00 0.00 31.44 30.16 2ntm n GLU 175 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2ntm n PHE 176 N -2.03 0.52 -0.33 -1.84 3.01 -0.31 -2.97 117.46 113.52 2ntm n PHE 176 Ca 0.04 0.17 -0.04 0.00 1.01 0.00 0.00 57.45 58.63 2ntm n PHE 176 Cb 0.28 -0.77 0.08 0.00 -0.01 0.00 0.00 39.48 39.06 2ntm n PHE 176 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2ntm h ALA 177 N 2.60 1.12 0.00 4.37 0.00 -1.19 -2.45 119.26 123.71 2ntm h ALA 177 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2ntm h ALA 177 Cb 0.53 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2ntm h ALA 177 CO 0.00 0.60 0.00 0.00 0.00 0.00 0.00 179.25 179.85 2ntm n ALA 178 N -2.38 1.72 -2.70 0.00 0.00 -1.16 -4.71 120.51 111.28 2ntm n ALA 178 Ca 0.09 -0.06 -0.39 0.00 0.00 0.00 0.00 53.44 53.09 2ntm n ALA 178 Cb 0.07 -1.24 -0.06 0.00 0.00 0.00 0.00 19.45 18.23 2ntm n ALA 178 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2ntm s PHE 179 N -2.88 3.49 0.57 0.00 0.08 -0.93 -4.85 117.98 113.46 2ntm s PHE 179 Ca 0.09 0.96 -0.09 0.00 0.12 0.00 0.00 56.93 58.01 2ntm s PHE 179 Cb 0.10 -2.66 -0.04 0.00 -0.57 0.00 0.00 43.02 39.85 2ntm s PHE 179 CO 0.26 0.07 0.95 0.95 -0.10 0.00 0.00 175.22 177.34 2ntm s THR 180 N 0.97 4.76 -0.96 0.64 -4.23 0.15 -4.58 115.64 112.39 2ntm s THR 180 Ca 0.29 0.68 -0.00 0.00 -1.18 0.00 0.00 61.69 61.47 2ntm s THR 180 Cb -0.16 -3.86 -0.01 0.00 1.34 0.00 0.00 72.50 69.82 2ntm s THR 180 CO 0.12 -1.02 0.81 1.41 -0.54 0.00 0.00 174.62 175.39 2ntm n HIS 181 N -2.51 -1.80 -2.29 3.99 8.25 -1.26 -4.65 115.22 114.95 2ntm n HIS 181 Ca 0.04 0.76 -0.42 0.00 -0.26 0.00 0.00 57.72 57.84 2ntm n HIS 181 Cb 0.54 -4.45 -0.03 0.00 1.12 0.00 0.00 29.99 27.18 2ntm n HIS 181 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 2ntm s PRO 182 N -5.02 4.36 0.00 -0.41 0.02 -1.26 -2.00 135.00 130.69 2ntm s PRO 182 Ca 0.03 1.92 0.00 0.00 0.02 0.00 0.00 61.00 62.98 2ntm s PRO 182 Cb -0.00 -3.35 0.00 0.00 0.02 0.00 0.00 34.50 31.17 2ntm s PRO 182 CO 0.59 -0.39 0.00 0.28 -0.33 0.00 0.00 177.00 177.15 2ntm n VAL 183 N 4.08 0.00 -4.16 3.83 0.31 -0.57 -4.91 118.33 116.91 2ntm n VAL 183 Ca 0.11 0.28 -0.10 0.00 -0.01 0.00 0.00 64.34 64.62 2ntm n VAL 183 Cb 0.44 -1.26 -0.10 0.00 -0.91 0.00 0.00 33.84 32.01 2ntm n VAL 183 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2ntm s THR 184 N -0.90 0.16 0.07 2.52 -1.32 -1.22 -3.93 115.64 111.01 2ntm s THR 184 Ca 0.00 -1.92 -0.07 0.00 -1.21 0.00 0.00 61.69 58.49 2ntm s THR 184 Cb 0.00 -2.06 -0.01 0.00 -1.51 0.00 0.00 72.50 68.92 2ntm s THR 184 CO 0.00 -0.46 0.14 0.00 -2.21 0.00 0.00 174.62 172.09 2ntm s ALA 185 N -4.01 -0.09 0.20 11.08 0.00 -0.84 -0.54 121.76 127.56 2ntm s ALA 185 Ca 0.24 -0.69 -0.19 0.00 0.00 0.00 0.00 51.96 51.33 2ntm s ALA 185 Cb 0.07 0.41 0.04 0.00 0.00 0.00 0.00 23.12 23.63 2ntm s ALA 185 CO 0.02 -0.45 0.56 0.00 0.00 0.00 0.00 175.76 175.89 2ntm s ALA 186 N -3.64 -1.10 0.07 0.00 0.00 0.19 -1.69 121.76 115.59 2ntm s ALA 186 Ca 0.03 -0.09 -0.27 0.00 0.00 0.00 0.00 51.96 51.64 2ntm s ALA 186 Cb 0.04 0.85 0.09 0.00 0.00 0.00 0.00 23.12 24.10 2ntm s ALA 186 CO -0.10 -0.82 0.82 0.00 0.00 0.00 0.00 175.76 175.66 2ntm s ALA 187 N -3.85 -1.72 -0.07 0.00 0.00 -0.79 0.14 121.76 115.46 2ntm s ALA 187 Ca 0.08 0.72 0.01 0.00 0.00 0.00 0.00 51.96 52.77 2ntm s ALA 187 Cb -0.02 0.58 0.02 0.00 0.00 0.00 0.00 23.12 23.70 2ntm s ALA 187 CO -0.04 -0.77 -0.07 0.00 0.00 0.00 0.00 175.76 174.88 2ntm s ALA 188 N -3.33 1.01 0.08 0.00 0.00 -0.43 -2.25 121.76 116.84 2ntm s ALA 188 Ca 0.05 -0.29 0.09 0.00 0.00 0.00 0.00 51.96 51.82 2ntm s ALA 188 Cb -0.01 -0.61 -0.03 0.00 0.00 0.00 0.00 23.12 22.47 2ntm s ALA 188 CO -0.08 -0.10 -0.25 0.12 0.00 0.00 0.00 175.76 175.45 2ntm s PHE 189 N 1.10 2.18 -0.17 0.00 5.36 -0.57 -1.77 117.98 124.11 2ntm s PHE 189 Ca -0.07 -0.40 -0.04 0.00 -0.96 0.00 0.00 56.93 55.46 2ntm s PHE 189 Cb -0.14 -1.25 0.06 0.00 -0.34 0.00 0.00 43.02 41.35 2ntm s PHE 189 CO -0.01 0.21 0.06 1.21 -1.46 0.00 0.00 175.22 175.22 2ntm s ASN 190 N -1.60 2.49 -0.15 6.13 3.84 0.12 -1.57 114.94 124.20 2ntm s ASN 190 Ca 0.11 -0.64 0.13 0.00 0.21 0.00 0.00 52.86 52.68 2ntm s ASN 190 Cb -0.10 -0.41 0.65 0.00 -0.55 0.00 0.00 41.25 40.84 2ntm s ASN 190 CO 0.04 -0.31 1.52 -0.90 -2.79 0.00 0.00 177.10 174.65 2ntm n ASP 191 N 5.16 4.53 0.00 -4.21 5.68 -1.26 -1.00 116.55 125.46 2ntm n ASP 191 Ca -0.08 -2.58 0.00 0.00 -0.50 0.00 0.00 54.79 51.63 2ntm n ASP 191 Cb 0.48 -0.60 0.00 0.00 -1.14 0.00 0.00 41.12 39.87 2ntm n ASP 191 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ntm n GLY 192 N 0.76 0.43 0.01 6.12 0.00 -1.26 -4.91 105.19 106.34 2ntm n GLY 192 Ca 0.22 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.32 2ntm n GLY 192 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ntm n GLU 193 N -1.60 1.88 0.00 1.61 -0.58 -1.26 -5.09 120.64 115.59 2ntm n GLU 193 Ca 0.00 -0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.72 2ntm n GLU 193 Cb 0.00 -1.23 0.00 0.00 -0.57 0.00 0.00 31.44 29.64 2ntm n GLU 193 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ntm n GLY 194 N 1.36 2.92 3.67 0.62 0.00 -1.26 -5.07 105.19 107.43 2ntm n GLY 194 Ca 0.03 -1.88 -0.41 0.00 0.00 0.00 0.00 46.02 43.76 2ntm n GLY 194 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2ntm s TRP 195 N -1.96 3.43 0.03 1.61 0.52 -1.26 -4.24 118.94 117.07 2ntm s TRP 195 Ca 0.00 1.25 0.06 0.00 0.02 0.00 0.00 56.10 57.43 2ntm s TRP 195 Cb 0.00 -3.00 -0.03 0.00 -1.15 0.00 0.00 33.47 29.29 2ntm s TRP 195 CO 0.00 -0.22 -0.13 -0.80 0.02 0.00 0.00 176.95 175.83 2ntm s ASN 196 N 1.14 4.19 0.26 2.95 0.01 -0.61 -4.96 114.94 117.92 2ntm s ASN 196 Ca 0.38 -0.31 0.09 0.00 -0.71 0.00 0.00 52.86 52.31 2ntm s ASN 196 Cb -0.17 -0.82 -0.04 0.00 0.41 0.00 0.00 41.25 40.63 2ntm s ASN 196 CO 0.13 0.26 0.04 -0.76 -1.51 0.00 0.00 177.10 175.25 2ntm s LEU 197 N -1.53 3.32 -0.09 0.60 1.43 -1.26 -1.51 118.68 119.63 2ntm s LEU 197 Ca 0.16 -0.56 -0.30 0.00 -1.03 0.00 0.00 54.13 52.40 2ntm s LEU 197 Cb -0.11 -1.85 0.11 0.00 0.03 0.00 0.00 46.19 44.37 2ntm s LEU 197 CO 0.07 -0.00 0.89 0.00 0.23 0.00 0.00 176.35 177.54 2ntm s ALA 198 N -2.27 -1.86 0.33 4.21 0.00 -0.96 -4.84 121.76 116.38 2ntm s ALA 198 Ca 0.32 1.38 0.06 0.00 0.00 0.00 0.00 51.96 53.72 2ntm s ALA 198 Cb -0.07 -0.28 -0.07 0.00 0.00 0.00 0.00 23.12 22.71 2ntm s ALA 198 CO 0.21 -0.41 -0.01 0.95 0.00 0.00 0.00 175.76 176.49 2ntm s THR 199 N -1.61 1.68 -0.20 0.00 -4.23 -1.26 -1.89 115.64 108.13 2ntm s THR 199 Ca -0.02 -2.07 -0.12 0.00 -1.18 0.00 0.00 61.69 58.30 2ntm s THR 199 Cb -0.00 -2.71 0.06 0.00 1.34 0.00 0.00 72.50 71.18 2ntm s THR 199 CO 0.01 -0.13 0.49 -0.13 -0.54 0.00 0.00 174.62 174.32 2ntm s ARG 200 N -3.75 0.49 0.36 3.99 1.81 -0.68 -4.93 118.95 116.23 2ntm s ARG 200 Ca 0.33 0.88 0.07 0.00 -1.72 0.00 0.00 55.73 55.30 2ntm s ARG 200 Cb 0.07 0.05 -0.02 0.00 -0.45 0.00 0.00 34.95 34.59 2ntm s ARG 200 CO 0.15 -0.15 0.33 -1.21 -0.68 0.00 0.00 175.30 173.75 2ntm s GLU 201 N 1.32 2.71 0.00 3.54 0.41 -1.26 -1.98 118.70 123.44 2ntm s GLU 201 Ca -0.09 -1.33 0.13 0.00 -0.41 0.00 0.00 54.97 53.28 2ntm s GLU 201 Cb -0.07 -2.49 0.80 0.00 -1.78 0.00 0.00 34.13 30.60 2ntm s GLU 201 CO -0.13 0.01 1.23 -1.33 -0.49 0.00 0.00 175.26 174.55