#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2avi s SER 5 N -0.07 2.65 0.23 0.00 0.15 -1.26 -4.71 113.70 110.69 2avi s SER 5 Ca 0.29 -0.46 0.10 0.00 0.70 0.00 0.00 55.95 56.58 2avi s SER 5 Cb -0.17 -1.01 0.17 0.00 -1.71 0.00 0.00 66.02 63.29 2avi s SER 5 CO 0.15 0.15 1.50 -0.07 1.20 0.00 0.00 173.24 176.17 2avi h LEU 6 N 6.52 0.00 -9.02 3.45 4.07 -1.97 -3.44 115.31 114.92 2avi h LEU 6 Ca -0.27 0.00 -0.58 0.00 0.08 0.00 0.00 57.88 57.11 2avi h LEU 6 Cb 1.20 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.94 2avi h LEU 6 CO 0.47 0.73 1.41 -0.89 -1.08 0.00 0.00 178.44 179.08 2avi s THR 7 N -3.27 3.11 0.00 0.22 2.01 -1.26 -4.51 115.64 111.94 2avi s THR 7 Ca -0.00 0.12 0.00 0.00 0.31 0.00 0.00 61.69 62.11 2avi s THR 7 Cb 0.11 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.49 2avi s THR 7 CO 0.78 -0.08 0.00 0.61 -0.69 0.00 0.00 174.62 175.24 2avi n GLY 8 N 5.49 -0.13 3.79 4.40 0.00 -0.98 -5.00 105.19 112.76 2avi n GLY 8 Ca 0.27 -1.54 -0.38 0.00 0.00 0.00 0.00 46.02 44.37 2avi n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2avi s LYS 9 N -1.67 4.13 0.29 1.61 1.02 -1.26 -2.06 119.74 121.80 2avi s LYS 9 Ca 0.00 0.47 0.04 0.00 0.02 0.00 0.00 55.97 56.51 2avi s LYS 9 Cb 0.00 -3.31 -0.06 0.00 -0.52 0.00 0.00 37.83 33.94 2avi s LYS 9 CO 0.00 0.48 0.02 -1.58 -0.92 0.00 0.00 175.35 173.34 2avi s TRP 10 N -0.42 1.86 -0.05 3.18 0.52 0.02 -1.72 118.94 122.33 2avi s TRP 10 Ca 0.25 -0.89 -0.11 0.00 0.02 0.00 0.00 56.10 55.37 2avi s TRP 10 Cb -0.16 -1.15 0.02 0.00 -1.15 0.00 0.00 33.47 31.03 2avi s TRP 10 CO 0.13 0.06 0.26 -0.08 0.02 0.00 0.00 176.95 177.34 2avi s THR 11 N -3.26 0.04 0.47 2.01 -1.32 -0.26 -2.06 115.64 111.26 2avi s THR 11 Ca 0.33 -0.33 0.04 0.00 -1.21 0.00 0.00 61.69 60.52 2avi s THR 11 Cb 0.07 -0.49 -0.03 0.00 -1.51 0.00 0.00 72.50 70.53 2avi s THR 11 CO 0.13 -0.18 0.08 0.54 -2.21 0.00 0.00 174.62 172.98 2avi s ASN 12 N -0.75 4.17 0.61 8.08 2.20 -0.50 -0.21 114.94 128.54 2avi s ASN 12 Ca -0.08 -1.43 0.30 0.00 -0.94 0.00 0.00 52.86 50.71 2avi s ASN 12 Cb -0.04 0.09 1.67 0.00 -2.00 0.00 0.00 41.25 40.97 2avi s ASN 12 CO 0.02 -0.72 2.05 -2.24 -2.94 0.00 0.00 177.10 173.27 2avi h ASP 13 N 1.40 0.00 0.65 3.54 2.03 -1.85 -1.75 116.42 120.45 2avi h ASP 13 Ca -0.43 0.00 -0.27 0.00 -0.73 0.00 0.00 57.03 55.60 2avi h ASP 13 Cb 1.28 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 39.75 2avi h ASP 13 CO 0.73 0.00 -1.44 -0.07 -1.03 0.00 0.00 179.24 177.43 2avi h LEU 14 N 0.00 0.08 0.00 0.15 4.07 -1.95 -3.48 115.31 114.17 2avi h LEU 14 Ca 0.09 -0.12 0.00 0.00 0.08 0.00 0.00 57.88 57.93 2avi h LEU 14 Cb 0.62 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.34 2avi h LEU 14 CO -0.00 1.10 0.00 0.61 -1.08 0.00 0.00 178.44 179.07 2avi n GLY 15 N 1.52 1.04 3.78 0.83 0.00 -0.66 -4.88 105.19 106.82 2avi n GLY 15 Ca -0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 2avi n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2avi s SER 16 N -0.62 6.61 0.16 1.61 0.01 -1.26 -4.57 113.70 115.64 2avi s SER 16 Ca 0.00 2.09 0.07 0.00 1.31 0.00 0.00 55.95 59.42 2avi s SER 16 Cb 0.00 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.60 2avi s SER 16 CO 0.00 -0.60 -0.02 0.20 0.41 0.00 0.00 173.24 173.23 2avi s ASN 17 N -1.54 4.72 -0.09 2.44 0.01 -0.32 -1.41 114.94 118.75 2avi s ASN 17 Ca 0.60 -0.39 -0.14 0.00 -0.71 0.00 0.00 52.86 52.22 2avi s ASN 17 Cb -0.23 -0.99 0.03 0.00 0.41 0.00 0.00 41.25 40.47 2avi s ASN 17 CO 0.29 0.11 0.34 0.00 -1.51 0.00 0.00 177.10 176.32 2avi s MET 18 N -2.81 0.52 -0.16 -0.60 0.23 -0.88 -1.23 119.30 114.38 2avi s MET 18 Ca 0.26 0.22 -0.00 0.00 -1.03 0.00 0.00 55.69 55.14 2avi s MET 18 Cb -0.10 0.24 0.04 0.00 -1.53 0.00 0.00 34.83 33.49 2avi s MET 18 CO 0.18 -0.11 -0.06 0.99 -2.03 0.00 0.00 175.02 173.99 2avi s THR 19 N -0.42 1.17 0.01 3.16 2.01 -0.17 -0.80 115.64 120.60 2avi s THR 19 Ca -0.05 -0.63 -0.00 0.00 0.31 0.00 0.00 61.69 61.31 2avi s THR 19 Cb -0.04 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 71.13 2avi s THR 19 CO 0.02 0.17 0.11 -0.63 -0.69 0.00 0.00 174.62 173.60 2avi s ILE 20 N 1.61 4.88 0.11 1.82 1.01 -0.87 -1.49 121.20 128.27 2avi s ILE 20 Ca 0.01 -0.41 0.01 0.00 0.00 0.00 0.00 60.65 60.27 2avi s ILE 20 Cb -0.15 -3.27 0.01 0.00 0.01 0.00 0.00 42.46 39.07 2avi s ILE 20 CO -0.08 0.30 0.12 0.61 0.00 0.00 0.00 174.94 175.90 2avi n GLY 21 N 0.98 2.35 3.67 6.18 0.00 -0.40 -2.32 105.19 115.65 2avi n GLY 21 Ca -0.11 -2.17 -0.44 0.00 0.00 0.00 0.00 46.02 43.30 2avi n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2avi n ALA 22 N -2.84 1.57 -2.61 4.61 0.00 -1.26 -4.40 120.51 115.58 2avi n ALA 22 Ca -0.03 0.27 -0.41 0.00 0.00 0.00 0.00 53.44 53.27 2avi n ALA 22 Cb 0.12 -2.59 -0.06 0.00 0.00 0.00 0.00 19.45 16.92 2avi n ALA 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2avi s VAL 23 N 3.67 4.87 1.16 0.00 0.11 -1.26 -4.69 120.40 124.26 2avi s VAL 23 Ca 0.87 1.08 -0.19 0.00 -2.93 0.00 0.00 61.98 60.81 2avi s VAL 23 Cb -0.53 -4.06 0.30 0.00 -1.53 0.00 0.00 36.38 30.56 2avi s VAL 23 CO 0.43 -0.16 0.81 -0.46 -3.33 0.00 0.00 175.10 172.39 2avi n ASN 24 N 6.01 -3.06 -0.24 3.54 6.94 -0.16 -4.81 115.26 123.48 2avi n ASN 24 Ca 0.02 -0.87 0.03 0.00 -0.02 0.00 0.00 54.58 53.74 2avi n ASN 24 Cb 0.48 -0.84 0.16 0.00 -2.36 0.00 0.00 39.78 37.22 2avi n ASN 24 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 2avi h SER 25 N -3.01 0.26 0.00 0.53 4.64 -1.97 0.19 113.55 114.20 2avi h SER 25 Ca -0.34 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 2avi h SER 25 Cb 1.10 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2avi h SER 25 CO 0.21 0.12 0.00 0.54 -0.87 0.00 0.00 176.83 176.83 2avi n ARG 26 N -5.00 0.53 -1.01 4.77 1.74 -1.26 -4.83 116.66 111.61 2avi n ARG 26 Ca 0.12 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.20 2avi n ARG 26 Cb 0.36 -1.43 -0.00 0.00 -1.02 0.00 0.00 32.46 30.37 2avi n ARG 26 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2avi n GLY 27 N 0.06 0.47 3.89 -0.13 0.00 0.66 -4.86 105.19 105.28 2avi n GLY 27 Ca 0.11 -0.24 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 2avi n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2avi s GLU 28 N -0.55 3.68 0.27 1.61 2.02 -1.25 -0.97 118.70 123.51 2avi s GLU 28 Ca 0.00 0.05 -0.12 0.00 0.02 0.00 0.00 54.97 54.92 2avi s GLU 28 Cb 0.00 -2.73 -0.00 0.00 0.10 0.00 0.00 34.13 31.50 2avi s GLU 28 CO 0.00 0.35 0.50 -0.59 0.02 0.00 0.00 175.26 175.54 2avi s PHE 29 N -1.82 0.43 0.18 1.61 -0.12 -1.20 -0.99 117.98 116.07 2avi s PHE 29 Ca 0.44 -0.79 -0.06 0.00 -0.05 0.00 0.00 56.93 56.47 2avi s PHE 29 Cb -0.11 0.20 -0.02 0.00 -0.63 0.00 0.00 43.02 42.45 2avi s PHE 29 CO 0.25 -1.05 0.23 0.99 -0.05 0.00 0.00 175.22 175.59 2avi s THR 30 N -3.81 0.04 -0.12 -4.49 2.01 -1.26 -1.37 115.64 106.64 2avi s THR 30 Ca 0.23 -1.68 0.00 0.00 0.31 0.00 0.00 61.69 60.55 2avi s THR 30 Cb -0.01 -2.15 0.00 0.00 0.01 0.00 0.00 72.50 70.35 2avi s THR 30 CO 0.11 -0.19 0.00 0.61 -0.69 0.00 0.00 174.62 174.45 2avi n GLY 31 N -0.24 -0.98 3.17 4.40 0.00 -0.11 -1.28 105.19 110.15 2avi n GLY 31 Ca -0.03 -0.73 -0.17 0.00 0.00 0.00 0.00 46.02 45.08 2avi n GLY 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2avi s THR 32 N -3.00 1.06 -0.19 2.61 -4.23 -0.56 -1.49 115.64 109.84 2avi s THR 32 Ca 0.00 -1.34 0.00 0.00 -1.18 0.00 0.00 61.69 59.17 2avi s THR 32 Cb 0.00 -1.08 0.05 0.00 1.34 0.00 0.00 72.50 72.81 2avi s THR 32 CO 0.00 -0.28 -0.07 -0.47 -0.54 0.00 0.00 174.62 173.26 2avi s TYR 33 N -1.43 2.05 -0.51 3.99 6.14 -0.03 -1.00 117.35 126.56 2avi s TYR 33 Ca -0.01 -1.37 -0.09 0.00 0.64 0.00 0.00 57.07 56.23 2avi s TYR 33 Cb -0.09 -1.47 0.13 0.00 0.42 0.00 0.00 41.96 40.95 2avi s TYR 33 CO 0.02 -0.69 0.39 0.99 0.64 0.00 0.00 175.55 176.90 2avi s THR 34 N 1.51 4.31 0.64 4.34 2.01 -0.36 -2.17 115.64 125.93 2avi s THR 34 Ca -0.01 -1.93 -0.15 0.00 0.31 0.00 0.00 61.69 59.91 2avi s THR 34 Cb -0.16 -3.82 -0.01 0.00 0.01 0.00 0.00 72.50 68.52 2avi s THR 34 CO -0.08 -0.81 1.11 0.28 -0.69 0.00 0.00 174.62 174.43 2avi s THR 35 N 1.17 3.29 -0.10 -0.82 -1.32 -1.26 -1.17 115.64 115.42 2avi s THR 35 Ca 0.07 0.61 0.20 0.00 -1.21 0.00 0.00 61.69 61.37 2avi s THR 35 Cb -0.25 -3.14 -0.29 0.00 -1.51 0.00 0.00 72.50 67.31 2avi s THR 35 CO -0.01 -0.35 0.30 0.00 -2.21 0.00 0.00 174.62 172.34 2avi n ALA 36 N -2.29 2.25 -2.30 11.08 0.00 -1.26 -4.86 120.51 123.14 2avi n ALA 36 Ca 0.10 -0.84 -0.16 0.00 0.00 0.00 0.00 53.44 52.54 2avi n ALA 36 Cb 0.52 -0.50 -0.10 0.00 0.00 0.00 0.00 19.45 19.37 2avi n ALA 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2avi s VAL 37 N -3.06 0.98 0.03 0.00 0.11 -1.26 -4.99 120.40 112.21 2avi s VAL 37 Ca -0.09 -2.03 -0.16 0.00 -2.93 0.00 0.00 61.98 56.78 2avi s VAL 37 Cb 0.10 -2.21 0.03 0.00 -1.53 0.00 0.00 36.38 32.77 2avi s VAL 37 CO 0.85 -0.43 0.36 0.28 -3.33 0.00 0.00 175.10 172.83 2avi s THR 38 N -3.46 0.07 -0.29 5.04 -1.32 -1.26 -5.02 115.64 109.41 2avi s THR 38 Ca 0.26 -0.55 0.22 0.00 -1.21 0.00 0.00 61.69 60.41 2avi s THR 38 Cb 0.05 -0.90 0.10 0.00 -1.51 0.00 0.00 72.50 70.24 2avi s THR 38 CO 0.06 -0.30 1.22 0.00 -2.21 0.00 0.00 174.62 173.39 2avi h ALA 39 N 3.23 0.67 -3.05 11.08 0.00 -2.02 -3.45 119.26 125.72 2avi h ALA 39 Ca -0.31 -0.08 -0.60 0.00 0.00 0.00 0.00 54.91 53.91 2avi h ALA 39 Cb 1.20 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.91 2avi h ALA 39 CO 0.44 0.09 -0.38 -0.08 0.00 0.00 0.00 179.25 179.32 2avi s THR 40 N -3.27 5.34 -1.48 0.00 -1.32 -1.26 -4.97 115.64 108.68 2avi s THR 40 Ca 0.02 0.43 0.00 0.00 -1.21 0.00 0.00 61.69 60.93 2avi s THR 40 Cb 0.08 -3.56 0.00 0.00 -1.51 0.00 0.00 72.50 67.51 2avi s THR 40 CO 0.75 0.45 0.42 -0.24 -2.21 0.00 0.00 174.62 173.79 2avi n SER 41 N 3.21 0.30 -4.78 8.08 2.88 -1.26 -4.76 113.62 117.28 2avi n SER 41 Ca -0.14 -1.13 -0.30 0.00 -1.33 0.00 0.00 58.87 55.96 2avi n SER 41 Cb 0.52 -0.15 0.09 0.00 -0.75 0.00 0.00 64.21 63.93 2avi n SER 41 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 2avi s ASN 42 N -0.91 4.45 -0.24 -3.46 0.01 -1.26 -4.99 114.94 108.54 2avi s ASN 42 Ca 0.00 1.54 -0.26 0.00 -0.71 0.00 0.00 52.86 53.43 2avi s ASN 42 Cb 0.00 -2.28 0.00 0.00 0.41 0.00 0.00 41.25 39.38 2avi s ASN 42 CO 0.00 -2.03 0.91 -0.70 -1.51 0.00 0.00 177.10 173.78 2avi s GLU 43 N -5.02 4.20 0.27 -0.60 2.12 -1.26 -4.99 118.70 113.42 2avi s GLU 43 Ca 0.61 1.09 -0.30 0.00 0.36 0.00 0.00 54.97 56.72 2avi s GLU 43 Cb -0.16 -3.65 -0.13 0.00 0.26 0.00 0.00 34.13 30.46 2avi s GLU 43 CO 0.55 -0.58 1.44 -0.89 -0.54 0.00 0.00 175.26 175.25 2avi n ILE 44 N 5.31 1.10 -3.98 -3.70 5.41 -1.26 -4.80 119.36 117.44 2avi n ILE 44 Ca 0.08 -0.28 -0.12 0.00 1.00 0.00 0.00 62.75 63.43 2avi n ILE 44 Cb 0.47 -1.61 -0.13 0.00 -0.71 0.00 0.00 39.64 37.66 2avi n ILE 44 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2avi s LYS 45 N -0.62 0.23 0.18 0.38 3.01 -1.26 -5.07 119.74 116.59 2avi s LYS 45 Ca 0.65 -0.31 -0.32 0.00 -1.01 0.00 0.00 55.97 54.99 2avi s LYS 45 Cb -0.60 -0.08 -0.11 0.00 -1.01 0.00 0.00 37.83 36.03 2avi s LYS 45 CO 0.51 0.01 1.74 -2.00 0.51 0.00 0.00 175.35 176.12 2avi s GLU 46 N -0.64 4.13 0.23 1.68 2.12 -1.26 -4.73 118.70 120.22 2avi s GLU 46 Ca -0.06 2.59 0.09 0.00 0.36 0.00 0.00 54.97 57.96 2avi s GLU 46 Cb -0.05 -3.22 -0.04 0.00 0.26 0.00 0.00 34.13 31.08 2avi s GLU 46 CO -0.00 -0.77 -0.05 -1.12 -0.54 0.00 0.00 175.26 172.78 2avi s SER 47 N 1.59 4.38 0.70 -1.70 0.01 -0.92 -4.82 113.70 112.95 2avi s SER 47 Ca 0.76 -0.63 -0.11 0.00 1.31 0.00 0.00 55.95 57.28 2avi s SER 47 Cb -0.48 -0.77 0.01 0.00 0.21 0.00 0.00 66.02 64.99 2avi s SER 47 CO 0.33 0.05 1.07 -2.16 0.41 0.00 0.00 173.24 172.94 2avi s PRO 48 N -3.29 2.85 -0.02 12.44 0.04 -1.26 -0.85 135.00 144.91 2avi s PRO 48 Ca 0.29 1.03 0.00 0.00 0.04 0.00 0.00 61.00 62.35 2avi s PRO 48 Cb -0.07 -1.98 0.03 0.00 0.04 0.00 0.00 34.50 32.52 2avi s PRO 48 CO 0.18 -1.17 0.02 -1.17 0.04 0.00 0.00 177.00 174.89 2avi s LEU 49 N -5.50 1.19 -0.17 -3.56 0.20 -0.55 -2.36 118.68 107.92 2avi s LEU 49 Ca 0.59 0.02 -0.03 0.00 0.69 0.00 0.00 54.13 55.40 2avi s LEU 49 Cb -0.15 -0.09 0.06 0.00 -0.43 0.00 0.00 46.19 45.57 2avi s LEU 49 CO 0.53 -0.11 0.05 -1.00 -0.29 0.00 0.00 176.35 175.54 2avi s HIS 50 N 0.95 0.66 0.00 5.38 3.76 -1.01 -0.93 115.29 124.09 2avi s HIS 50 Ca -0.08 -0.56 0.00 0.00 -0.15 0.00 0.00 55.06 54.27 2avi s HIS 50 Cb -0.12 -0.87 0.00 0.00 1.11 0.00 0.00 32.58 32.71 2avi s HIS 50 CO -0.02 -0.53 0.00 0.41 -0.85 0.00 0.00 174.74 173.74 2avi n GLY 51 N 5.15 5.91 3.62 -2.22 0.00 -0.47 -2.49 105.19 114.68 2avi n GLY 51 Ca -0.08 -1.62 -0.11 0.00 0.00 0.00 0.00 46.02 44.21 2avi n GLY 51 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2avi s THR 52 N 0.78 0.00 0.06 2.61 -1.32 0.34 -3.24 115.64 114.87 2avi s THR 52 Ca 0.00 0.00 0.07 0.00 -1.21 0.00 0.00 61.69 60.55 2avi s THR 52 Cb 0.00 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.96 2avi s THR 52 CO 0.00 0.00 -0.15 -1.83 -2.21 0.00 0.00 174.62 170.43 2avi s GLU 53 N 0.10 2.09 0.13 7.08 -1.05 -0.14 -1.50 118.70 125.41 2avi s GLU 53 Ca 0.01 -0.99 -0.30 0.00 -0.15 0.00 0.00 54.97 53.54 2avi s GLU 53 Cb -0.04 -2.23 -0.07 0.00 -0.44 0.00 0.00 34.13 31.35 2avi s GLU 53 CO -0.02 0.53 1.11 1.21 0.95 0.00 0.00 175.26 179.04 2avi s ASN 54 N -1.67 7.24 -0.04 0.83 3.84 0.25 -4.61 114.94 120.78 2avi s ASN 54 Ca 0.17 2.02 0.06 0.00 0.21 0.00 0.00 52.86 55.31 2avi s ASN 54 Cb -0.11 -2.59 0.09 0.00 -0.55 0.00 0.00 41.25 38.09 2avi s ASN 54 CO 0.08 -0.28 0.94 0.35 -2.79 0.00 0.00 177.10 175.39 2avi n THR 55 N 2.93 0.81 -0.30 -5.21 -2.24 -1.26 -4.55 114.28 104.45 2avi n THR 55 Ca 0.05 -0.93 -0.05 0.00 -2.27 0.00 0.00 64.05 60.85 2avi n THR 55 Cb 0.47 0.39 -0.01 0.00 -2.10 0.00 0.00 70.33 69.08 2avi n THR 55 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 2avi h ILE 56 N 2.30 0.06 -0.97 2.28 1.08 -2.00 0.13 117.51 120.39 2avi h ILE 56 Ca 0.00 0.00 -0.59 0.00 -0.39 0.00 0.00 64.86 63.88 2avi h ILE 56 Cb 0.97 0.06 -0.39 0.00 -3.07 0.00 0.00 36.82 34.38 2avi h ILE 56 CO 0.00 0.00 -0.36 0.59 -0.69 0.00 0.00 178.15 177.69 2avi n ASN 57 N -5.42 5.60 -3.49 1.72 3.02 -1.26 -4.94 115.26 110.49 2avi n ASN 57 Ca 0.06 -3.76 -0.14 0.00 -0.03 0.00 0.00 54.58 50.70 2avi n ASN 57 Cb 0.36 -0.52 -0.02 0.00 -0.61 0.00 0.00 39.78 38.99 2avi n ASN 57 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2avi n LYS 58 N -0.71 -0.87 -1.46 3.52 5.02 0.46 -4.80 118.16 119.31 2avi n LYS 58 Ca 0.48 -0.12 -0.36 0.00 -2.02 0.00 0.00 58.31 56.28 2avi n LYS 58 Cb 0.83 -0.87 0.08 0.00 -0.02 0.00 0.00 35.03 35.04 2avi n LYS 58 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2avi n ARG 59 N -2.41 0.66 0.01 1.97 5.12 -1.26 -4.97 116.66 115.77 2avi n ARG 59 Ca -0.09 0.28 -0.08 0.00 -1.93 0.00 0.00 57.85 56.03 2avi n ARG 59 Cb 0.24 -2.23 -0.13 0.00 -1.16 0.00 0.00 32.46 29.18 2avi n ARG 59 CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 2avi h THR 60 N 0.00 1.15 -3.10 0.55 1.35 -1.94 -3.40 112.91 107.53 2avi h THR 60 Ca -0.48 -2.96 -0.62 0.00 -0.55 0.00 0.00 66.41 61.80 2avi h THR 60 Cb 1.34 2.57 -0.42 0.00 -1.73 0.00 0.00 68.15 69.92 2avi h THR 60 CO 0.48 0.66 -0.61 -1.10 -0.25 0.00 0.00 175.52 174.70 2avi s GLN 61 N -2.64 2.27 0.56 4.72 -0.21 -1.26 0.13 119.66 123.23 2avi s GLN 61 Ca -0.03 -3.12 -0.16 0.00 0.02 0.00 0.00 55.36 52.08 2avi s GLN 61 Cb 0.09 -3.27 -0.05 0.00 1.00 0.00 0.00 33.01 30.77 2avi s GLN 61 CO 0.82 -1.26 1.02 -1.25 -2.12 0.00 0.00 175.29 172.51 2avi s PRO 62 N -1.12 3.60 0.07 2.91 0.04 -1.24 -4.63 135.00 134.63 2avi s PRO 62 Ca 0.24 1.05 -0.18 0.00 0.04 0.00 0.00 61.00 62.15 2avi s PRO 62 Cb -0.08 -2.08 -0.07 0.00 0.04 0.00 0.00 34.50 32.31 2avi s PRO 62 CO -0.13 -0.56 0.54 0.99 0.04 0.00 0.00 177.00 177.87 2avi s THR 63 N -2.61 4.80 0.33 1.26 2.01 -1.26 -1.47 115.64 118.69 2avi s THR 63 Ca 0.61 1.11 -0.00 0.00 0.31 0.00 0.00 61.69 63.71 2avi s THR 63 Cb -0.13 -3.85 -0.01 0.00 0.01 0.00 0.00 72.50 68.53 2avi s THR 63 CO 0.36 0.51 0.40 0.72 -0.69 0.00 0.00 174.62 175.93 2avi s PHE 64 N -1.16 1.22 -0.29 4.92 -0.12 -0.86 -0.58 117.98 121.12 2avi s PHE 64 Ca 0.29 -1.37 -0.22 0.00 -0.05 0.00 0.00 56.93 55.58 2avi s PHE 64 Cb -0.18 -0.27 0.14 0.00 -0.63 0.00 0.00 43.02 42.08 2avi s PHE 64 CO 0.18 -1.03 1.07 0.20 -0.05 0.00 0.00 175.22 175.59 2avi s GLY 65 N -3.26 -0.01 0.05 1.99 0.00 -0.56 -2.29 107.32 103.24 2avi s GLY 65 Ca 0.33 2.98 -0.03 0.00 0.00 0.00 0.00 44.72 48.01 2avi s GLY 65 CO 0.21 2.14 0.02 -0.11 0.00 0.00 0.00 173.10 175.37 2avi s PHE 66 N 0.62 0.39 -0.09 1.90 -0.71 -0.86 -0.51 117.98 118.71 2avi s PHE 66 Ca -0.01 -0.85 0.02 0.00 -1.04 0.00 0.00 56.93 55.05 2avi s PHE 66 Cb -0.04 -0.28 -0.02 0.00 -1.21 0.00 0.00 43.02 41.46 2avi s PHE 66 CO -0.11 -0.38 -0.13 0.99 -1.34 0.00 0.00 175.22 174.26 2avi s THR 67 N -3.41 3.17 -0.23 -4.49 2.01 -1.04 -1.90 115.64 109.75 2avi s THR 67 Ca 0.02 -0.66 -0.05 0.00 0.31 0.00 0.00 61.69 61.31 2avi s THR 67 Cb 0.04 -2.29 -0.01 0.00 0.01 0.00 0.00 72.50 70.25 2avi s THR 67 CO -0.08 0.56 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.72 2avi s VAL 68 N -0.28 3.69 -0.58 3.82 1.01 0.05 -2.40 120.40 125.70 2avi s VAL 68 Ca 0.02 -0.42 -0.23 0.00 0.00 0.00 0.00 61.98 61.36 2avi s VAL 68 Cb -0.13 -2.71 0.06 0.00 0.00 0.00 0.00 36.38 33.59 2avi s VAL 68 CO 0.03 0.37 0.89 0.21 0.00 0.00 0.00 175.10 176.59 2avi s ASN 69 N 1.52 6.26 -0.27 3.32 3.04 -1.00 -2.48 114.94 125.33 2avi s ASN 69 Ca 0.06 -0.70 -0.29 0.00 0.04 0.00 0.00 52.86 51.97 2avi s ASN 69 Cb -0.15 -2.40 -0.01 0.00 -1.54 0.00 0.00 41.25 37.16 2avi s ASN 69 CO -0.01 -1.24 1.38 0.26 -3.04 0.00 0.00 177.10 174.45 2avi s TRP 70 N 3.72 2.55 0.15 0.43 0.52 -1.20 -4.06 118.94 121.04 2avi s TRP 70 Ca 0.24 0.79 0.15 0.00 0.02 0.00 0.00 56.10 57.30 2avi s TRP 70 Cb -0.16 -3.90 0.42 0.00 -1.15 0.00 0.00 33.47 28.69 2avi s TRP 70 CO 0.14 -2.03 1.62 0.87 0.02 0.00 0.00 176.95 177.57 2avi h LYS 71 N 9.56 0.00 -0.33 4.98 6.56 -1.87 -3.28 116.57 132.18 2avi h LYS 71 Ca -0.28 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.31 2avi h LYS 71 Cb 1.11 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.77 2avi h LYS 71 CO 1.02 0.52 0.00 1.97 -2.06 0.00 0.00 179.45 180.90 2avi n PHE 72 N -3.54 0.42 -4.05 -1.35 -1.74 -1.26 -4.97 117.46 100.97 2avi n PHE 72 Ca -0.00 -0.21 -0.10 0.00 -0.56 0.00 0.00 57.45 56.58 2avi n PHE 72 Cb 0.61 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.55 2avi n PHE 72 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 2avi s SER 73 N -1.54 -0.01 0.00 5.98 1.04 -1.24 -4.72 113.70 113.20 2avi s SER 73 Ca 0.37 -1.06 0.18 0.00 0.48 0.00 0.00 55.95 55.92 2avi s SER 73 Cb 0.22 0.53 0.51 0.00 0.10 0.00 0.00 66.02 67.38 2avi s SER 73 CO 0.31 -1.06 1.41 -0.62 0.98 0.00 0.00 173.24 174.26 2avi n GLU 74 N -0.36 2.09 -3.02 4.02 1.02 -1.26 -4.65 120.64 118.49 2avi n GLU 74 Ca -0.01 -1.68 -0.22 0.00 -0.02 0.00 0.00 57.16 55.24 2avi n GLU 74 Cb 0.63 -1.41 0.01 0.00 -0.02 0.00 0.00 31.44 30.66 2avi n GLU 74 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2avi s SER 75 N -1.22 5.77 0.13 1.62 1.04 -1.26 -4.55 113.70 115.22 2avi s SER 75 Ca 0.34 0.14 0.07 0.00 0.48 0.00 0.00 55.95 56.97 2avi s SER 75 Cb 0.18 -1.35 -0.04 0.00 0.10 0.00 0.00 66.02 64.91 2avi s SER 75 CO 0.25 -0.72 -0.15 -0.89 0.98 0.00 0.00 173.24 172.70 2avi s THR 76 N -2.51 1.47 -0.01 2.02 2.01 -0.98 -3.27 115.64 114.37 2avi s THR 76 Ca 0.49 -1.77 0.00 0.00 0.31 0.00 0.00 61.69 60.72 2avi s THR 76 Cb -0.10 -1.62 0.01 0.00 0.01 0.00 0.00 72.50 70.80 2avi s THR 76 CO 0.37 -0.39 0.01 -0.89 -0.69 0.00 0.00 174.62 173.03 2avi s THR 77 N -2.11 0.02 -0.01 -0.82 2.01 -1.04 -1.75 115.64 111.95 2avi s THR 77 Ca 0.11 0.07 0.07 0.00 0.31 0.00 0.00 61.69 62.25 2avi s THR 77 Cb -0.05 -0.08 -0.02 0.00 0.01 0.00 0.00 72.50 72.36 2avi s THR 77 CO 0.04 0.05 -0.24 0.68 -0.69 0.00 0.00 174.62 174.46 2avi s VAL 78 N 0.46 1.87 0.00 3.82 -7.23 -0.85 -0.77 120.40 117.70 2avi s VAL 78 Ca -0.04 -1.06 0.07 0.00 -1.81 0.00 0.00 61.98 59.14 2avi s VAL 78 Cb -0.06 -1.57 -0.02 0.00 0.56 0.00 0.00 36.38 35.30 2avi s VAL 78 CO -0.01 0.49 -0.22 -0.36 -0.31 0.00 0.00 175.10 174.68 2avi s PHE 79 N -0.60 1.98 0.05 2.82 0.40 -0.80 -1.79 117.98 120.05 2avi s PHE 79 Ca 0.09 -0.38 0.05 0.00 -0.60 0.00 0.00 56.93 56.10 2avi s PHE 79 Cb -0.09 -1.24 -0.02 0.00 0.51 0.00 0.00 43.02 42.17 2avi s PHE 79 CO -0.00 0.01 -0.15 0.99 0.70 0.00 0.00 175.22 176.77 2avi s THR 80 N -0.61 1.15 0.00 0.64 2.01 0.16 -2.04 115.64 116.95 2avi s THR 80 Ca 0.09 -1.12 0.00 0.00 0.31 0.00 0.00 61.69 60.97 2avi s THR 80 Cb -0.09 -1.06 0.00 0.00 0.01 0.00 0.00 72.50 71.36 2avi s THR 80 CO 0.00 -0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.48 2avi n GLY 81 N 1.67 1.89 3.16 4.40 0.00 -0.97 -0.94 105.19 114.41 2avi n GLY 81 Ca -0.19 -0.66 -0.13 0.00 0.00 0.00 0.00 46.02 45.05 2avi n GLY 81 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2avi s GLN 82 N 1.06 0.42 -0.50 1.61 0.74 -0.63 -2.02 119.66 120.33 2avi s GLN 82 Ca 0.00 0.08 -0.21 0.00 0.05 0.00 0.00 55.36 55.28 2avi s GLN 82 Cb 0.00 0.19 0.04 0.00 1.10 0.00 0.00 33.01 34.35 2avi s GLN 82 CO 0.00 -0.09 0.73 0.00 -0.55 0.00 0.00 175.29 175.39 2avi s PHE 84 N 3.10 3.19 -0.53 0.00 0.08 -0.01 -3.73 117.98 120.08 2avi s PHE 84 Ca 0.22 -0.07 0.01 0.00 0.12 0.00 0.00 56.93 57.21 2avi s PHE 84 Cb -0.16 -1.46 0.14 0.00 -0.57 0.00 0.00 43.02 40.97 2avi s PHE 84 CO 0.16 0.51 0.30 0.42 -0.10 0.00 0.00 175.22 176.50 2avi s ILE 85 N -2.05 2.96 0.62 0.64 -1.09 -1.26 -1.57 121.20 119.45 2avi s ILE 85 Ca 0.33 -3.05 -0.18 0.00 -2.23 0.00 0.00 60.65 55.52 2avi s ILE 85 Cb -0.08 -3.01 -0.06 0.00 -1.58 0.00 0.00 42.46 37.72 2avi s ILE 85 CO 0.26 -0.80 0.69 -0.67 -1.23 0.00 0.00 174.94 173.18 2avi n ASP 86 N 3.41 -0.43 0.21 3.58 -0.08 0.85 -4.81 116.55 119.27 2avi n ASP 86 Ca 0.05 0.72 0.07 0.00 -1.51 0.00 0.00 54.79 54.13 2avi n ASP 86 Cb 0.35 -1.26 0.37 0.00 2.34 0.00 0.00 41.12 42.92 2avi n ASP 86 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 2avi h ARG 87 N 0.15 0.00 -0.62 -0.67 3.08 -1.98 0.71 114.38 115.05 2avi h ARG 87 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.58 2avi h ARG 87 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.43 2avi h ARG 87 CO 0.47 0.00 0.00 0.27 -1.07 0.00 0.00 179.97 179.64 2avi n ASN 88 N -2.20 3.72 0.00 7.04 0.23 -1.26 -4.92 115.26 117.88 2avi n ASN 88 Ca -0.01 -2.32 0.00 0.00 -0.53 0.00 0.00 54.58 51.72 2avi n ASN 88 Cb 0.44 -0.50 0.00 0.00 -2.08 0.00 0.00 39.78 37.65 2avi n ASN 88 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2avi n GLY 89 N 0.97 0.96 3.57 4.83 0.00 0.25 -5.03 105.19 110.73 2avi n GLY 89 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 2avi n GLY 89 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2avi s LYS 90 N -0.02 2.09 0.11 1.61 -2.85 -1.22 -4.81 119.74 114.64 2avi s LYS 90 Ca 0.00 -1.14 -0.31 0.00 -1.00 0.00 0.00 55.97 53.52 2avi s LYS 90 Cb 0.00 -2.23 -0.08 0.00 -2.06 0.00 0.00 37.83 33.46 2avi s LYS 90 CO 0.00 0.47 1.37 -1.21 0.10 0.00 0.00 175.35 176.09 2avi s GLU 91 N -2.50 4.33 -0.02 1.78 2.02 -1.26 -0.11 118.70 122.94 2avi s GLU 91 Ca 0.23 2.04 -0.04 0.00 0.02 0.00 0.00 54.97 57.23 2avi s GLU 91 Cb -0.10 -3.27 0.00 0.00 0.10 0.00 0.00 34.13 30.86 2avi s GLU 91 CO 0.14 -0.43 0.08 0.54 0.02 0.00 0.00 175.26 175.62 2avi s VAL 92 N 1.16 0.03 -0.23 2.63 0.11 -0.61 -3.91 120.40 119.58 2avi s VAL 92 Ca 0.64 -0.27 -0.01 0.00 -2.93 0.00 0.00 61.98 59.40 2avi s VAL 92 Cb -0.36 -0.21 0.02 0.00 -1.53 0.00 0.00 36.38 34.30 2avi s VAL 92 CO 0.30 -0.15 -0.09 -0.76 -3.33 0.00 0.00 175.10 171.07 2avi s LEU 93 N -0.46 2.93 -0.32 2.54 1.43 -0.27 -0.83 118.68 123.71 2avi s LEU 93 Ca -0.05 -0.75 -0.14 0.00 -1.03 0.00 0.00 54.13 52.16 2avi s LEU 93 Cb -0.03 -1.64 -0.03 0.00 0.03 0.00 0.00 46.19 44.52 2avi s LEU 93 CO 0.00 -0.08 0.30 -0.54 0.23 0.00 0.00 176.35 176.26 2avi s LYS 94 N 1.34 3.69 0.15 1.70 -0.14 -1.09 -1.10 119.74 124.29 2avi s LYS 94 Ca 0.02 -0.39 0.07 0.00 -1.36 0.00 0.00 55.97 54.32 2avi s LYS 94 Cb -0.16 -3.75 -0.04 0.00 -1.68 0.00 0.00 37.83 32.20 2avi s LYS 94 CO -0.06 -0.40 -0.16 0.95 -0.76 0.00 0.00 175.35 174.92 2avi s THR 95 N 1.90 1.62 -0.01 2.17 -4.23 -0.41 -1.61 115.64 115.06 2avi s THR 95 Ca 0.10 -1.89 0.03 0.00 -1.18 0.00 0.00 61.69 58.75 2avi s THR 95 Cb -0.17 -1.76 -0.00 0.00 1.34 0.00 0.00 72.50 71.91 2avi s THR 95 CO 0.11 -0.40 -0.09 -0.04 -0.54 0.00 0.00 174.62 173.66 2avi s MET 96 N -2.88 0.83 0.29 3.99 -1.94 -0.11 -2.64 119.30 116.84 2avi s MET 96 Ca 0.14 -0.33 0.05 0.00 -1.71 0.00 0.00 55.69 53.84 2avi s MET 96 Cb -0.05 -0.79 -0.06 0.00 2.01 0.00 0.00 34.83 35.94 2avi s MET 96 CO 0.05 0.18 -0.00 1.67 -0.01 0.00 0.00 175.02 176.91 2avi s TRP 97 N -0.10 1.90 -0.07 -0.03 1.48 0.49 -0.67 118.94 121.94 2avi s TRP 97 Ca 0.02 -0.84 -0.00 0.00 -1.06 0.00 0.00 56.10 54.22 2avi s TRP 97 Cb -0.05 -1.16 0.03 0.00 -1.16 0.00 0.00 33.47 31.12 2avi s TRP 97 CO -0.00 0.12 -0.03 -0.51 -4.06 0.00 0.00 176.95 172.47 2avi s LEU 98 N -3.44 0.92 -0.31 -4.66 1.43 -0.74 -1.34 118.68 110.55 2avi s LEU 98 Ca 0.32 -0.15 -0.05 0.00 -1.03 0.00 0.00 54.13 53.22 2avi s LEU 98 Cb 0.06 -0.54 0.03 0.00 0.03 0.00 0.00 46.19 45.77 2avi s LEU 98 CO 0.13 -0.14 0.06 -0.22 0.23 0.00 0.00 176.35 176.41 2avi s LEU 99 N 1.62 3.96 -0.14 1.79 2.96 0.41 -2.02 118.68 127.26 2avi s LEU 99 Ca 0.00 -0.98 -0.17 0.00 -0.22 0.00 0.00 54.13 52.77 2avi s LEU 99 Cb -0.13 -1.82 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 2avi s LEU 99 CO -0.04 -0.25 0.43 -0.60 -1.32 0.00 0.00 176.35 174.57 2avi s ARG 100 N 1.40 4.31 0.27 1.98 6.06 -0.72 -0.55 118.95 131.71 2avi s ARG 100 Ca -0.01 0.34 0.06 0.00 -2.50 0.00 0.00 55.73 53.63 2avi s ARG 100 Cb -0.18 -3.44 -0.02 0.00 0.06 0.00 0.00 34.95 31.36 2avi s ARG 100 CO 0.01 0.16 0.37 -1.12 -2.50 0.00 0.00 175.30 172.22 2avi s SER 101 N 0.62 6.05 -0.42 -2.12 0.01 0.18 -2.33 113.70 115.70 2avi s SER 101 Ca 0.23 -0.08 -0.14 0.00 1.31 0.00 0.00 55.95 57.27 2avi s SER 101 Cb -0.15 -1.57 0.03 0.00 0.21 0.00 0.00 66.02 64.55 2avi s SER 101 CO 0.08 -0.19 0.31 -0.94 0.41 0.00 0.00 173.24 172.92 2avi s SER 102 N -4.02 6.06 0.38 2.44 1.04 -1.26 -4.86 113.70 113.48 2avi s SER 102 Ca 0.37 -1.03 0.01 0.00 0.48 0.00 0.00 55.95 55.79 2avi s SER 102 Cb -0.09 -2.14 -0.02 0.00 0.10 0.00 0.00 66.02 63.87 2avi s SER 102 CO 0.29 -0.49 0.58 0.68 0.98 0.00 0.00 173.24 175.28 2avi s VAL 103 N 1.65 4.57 -0.04 5.02 -7.23 -1.26 -5.07 120.40 118.04 2avi s VAL 103 Ca 0.04 -0.55 -0.02 0.00 -1.81 0.00 0.00 61.98 59.65 2avi s VAL 103 Cb -0.20 -3.66 -0.01 0.00 0.56 0.00 0.00 36.38 33.07 2avi s VAL 103 CO 0.09 -0.42 -0.04 0.78 -0.31 0.00 0.00 175.10 175.20 2avi h ASN 104 N 0.64 0.00 -3.12 4.85 2.35 -1.97 -3.47 115.58 114.86 2avi h ASN 104 Ca -0.48 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 54.68 2avi h ASN 104 Cb 1.24 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.56 2avi h ASN 104 CO 0.59 0.21 -0.15 -0.62 -1.65 0.00 0.00 177.43 175.81 2avi s ASP 105 N -4.06 6.87 0.57 5.81 -1.08 -1.26 -4.95 116.67 118.56 2avi s ASP 105 Ca -0.03 1.05 0.24 0.00 -0.52 0.00 0.00 52.55 53.29 2avi s ASP 105 Cb 0.00 -2.28 1.31 0.00 -1.46 0.00 0.00 42.92 40.49 2avi s ASP 105 CO 0.04 0.27 1.71 -0.29 0.52 0.00 0.00 175.17 177.42 2avi h ILE 106 N 3.48 0.00 0.00 4.11 2.10 -2.03 -1.14 117.51 124.02 2avi h ILE 106 Ca -0.51 0.00 -0.01 0.00 1.08 0.00 0.00 64.86 65.43 2avi h ILE 106 Cb 1.21 0.53 -0.00 0.00 -1.09 0.00 0.00 36.82 37.47 2avi h ILE 106 CO 0.63 0.00 -0.05 1.23 -1.08 0.00 0.00 178.15 178.88 2avi h GLY 107 N 0.00 0.00 1.34 8.18 0.00 -2.00 -2.33 103.07 108.27 2avi h GLY 107 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2avi h GLY 107 CO 0.00 0.00 -0.29 1.22 0.00 0.00 0.00 176.54 177.47 2avi n ASP 108 N -3.16 0.33 -0.25 0.19 8.00 -0.43 -4.28 116.55 116.95 2avi n ASP 108 Ca 0.01 -0.01 0.28 0.00 0.71 0.00 0.00 54.79 55.77 2avi n ASP 108 Cb 0.34 -0.05 0.66 0.00 -0.02 0.00 0.00 41.12 42.06 2avi n ASP 108 CO 0.00 0.00 0.00 -0.78 -0.39 0.00 0.00 177.20 176.03 2avi h ASP 109 N 0.06 0.14 0.00 -2.24 3.58 -1.56 -2.62 116.42 113.79 2avi h ASP 109 Ca 0.00 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.47 2avi h ASP 109 Cb 0.49 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.54 2avi h ASP 109 CO 0.00 0.04 0.25 4.11 -2.88 0.00 0.00 179.24 180.76 2avi h TRP 110 N 0.13 0.00 -0.07 0.28 5.08 -1.82 -1.10 115.95 118.45 2avi h TRP 110 Ca 0.50 0.00 -0.09 0.00 1.08 0.00 0.00 58.89 60.38 2avi h TRP 110 Cb 1.73 0.00 -0.13 0.00 -3.00 0.00 0.00 29.16 27.75 2avi h TRP 110 CO -0.00 0.00 -0.67 0.36 -1.28 0.00 0.00 178.44 176.85 2avi n LYS 111 N -2.54 1.38 -0.51 0.12 -0.00 -0.99 -4.73 118.16 110.89 2avi n LYS 111 Ca -0.02 -3.08 0.10 0.00 -0.00 0.00 0.00 58.31 55.32 2avi n LYS 111 Cb 0.29 -1.29 0.33 0.00 -0.00 0.00 0.00 35.03 34.36 2avi n LYS 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2avi n ALA 112 N -0.70 2.82 -3.74 0.58 0.00 -0.42 -4.89 120.51 114.15 2avi n ALA 112 Ca 0.18 -1.51 -0.22 0.00 0.00 0.00 0.00 53.44 51.88 2avi n ALA 112 Cb 0.82 -0.94 -0.17 0.00 0.00 0.00 0.00 19.45 19.16 2avi n ALA 112 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2avi s THR 113 N -1.58 0.45 0.08 0.00 2.01 -1.26 0.48 115.64 115.82 2avi s THR 113 Ca 0.49 0.03 0.01 0.00 0.31 0.00 0.00 61.69 62.53 2avi s THR 113 Cb 0.30 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 72.20 2avi s THR 113 CO 0.26 0.26 0.17 -0.13 -0.69 0.00 0.00 174.62 174.48 2avi s ARG 114 N 1.66 3.23 -0.05 4.92 0.52 0.29 -4.92 118.95 124.59 2avi s ARG 114 Ca 0.01 -0.55 0.03 0.00 -0.52 0.00 0.00 55.73 54.69 2avi s ARG 114 Cb -0.13 -2.91 0.01 0.00 0.52 0.00 0.00 34.95 32.43 2avi s ARG 114 CO -0.04 0.58 -0.14 0.54 0.02 0.00 0.00 175.30 176.27 2avi s VAL 115 N -1.49 1.19 0.24 3.52 0.11 -1.26 -0.45 120.40 122.26 2avi s VAL 115 Ca 0.33 -0.55 -0.07 0.00 -2.93 0.00 0.00 61.98 58.76 2avi s VAL 115 Cb -0.12 -1.06 0.03 0.00 -1.53 0.00 0.00 36.38 33.69 2avi s VAL 115 CO 0.26 0.36 0.43 0.61 -3.33 0.00 0.00 175.10 173.43 2avi n GLY 116 N 3.50 1.72 3.59 6.54 0.00 -0.45 -4.99 105.19 115.09 2avi n GLY 116 Ca -0.20 -1.27 -0.25 0.00 0.00 0.00 0.00 46.02 44.29 2avi n GLY 116 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2avi s ILE 117 N -2.52 2.52 -0.30 -0.61 2.07 -1.26 -0.38 121.20 120.72 2avi s ILE 117 Ca 0.12 -2.08 -0.16 0.00 -1.41 0.00 0.00 60.65 57.12 2avi s ILE 117 Cb -0.02 -2.71 0.17 0.00 0.13 0.00 0.00 42.46 40.03 2avi s ILE 117 CO 0.09 -0.22 1.08 0.20 -1.91 0.00 0.00 174.94 174.18 2avi s ASN 118 N -3.66 -0.41 -0.34 4.50 0.02 -1.08 -4.90 114.94 109.07 2avi s ASN 118 Ca 0.33 0.57 -0.10 0.00 -1.02 0.00 0.00 52.86 52.65 2avi s ASN 118 Cb 0.00 1.44 0.01 0.00 0.02 0.00 0.00 41.25 42.73 2avi s ASN 118 CO 0.18 -0.08 0.16 -0.63 0.02 0.00 0.00 177.10 176.75 2avi s ILE 119 N 2.23 4.43 -0.16 0.60 1.01 -1.26 -1.29 121.20 126.76 2avi s ILE 119 Ca -0.02 -0.71 -0.15 0.00 0.00 0.00 0.00 60.65 59.77 2avi s ILE 119 Cb -0.04 -3.38 -0.05 0.00 0.01 0.00 0.00 42.46 39.00 2avi s ILE 119 CO -0.17 -0.08 0.32 -0.36 0.00 0.00 0.00 174.94 174.65 2avi s PHE 120 N 1.55 3.45 0.25 3.97 0.40 -0.26 -2.65 117.98 124.70 2avi s PHE 120 Ca 0.03 0.63 0.11 0.00 -0.60 0.00 0.00 56.93 57.09 2avi s PHE 120 Cb -0.18 -2.39 -0.05 0.00 0.51 0.00 0.00 43.02 40.91 2avi s PHE 120 CO 0.06 0.20 -0.14 -0.08 0.70 0.00 0.00 175.22 175.95 2avi s THR 121 N 0.60 2.79 0.04 0.64 -1.32 0.71 -1.11 115.64 117.98 2avi s THR 121 Ca 0.18 -2.13 -0.30 0.00 -1.21 0.00 0.00 61.69 58.22 2avi s THR 121 Cb -0.13 -2.44 -0.09 0.00 -1.51 0.00 0.00 72.50 68.33 2avi s THR 121 CO 0.05 -0.31 1.90 -0.13 -2.21 0.00 0.00 174.62 173.92 2avi s ARG 122 N -3.33 4.15 0.00 7.08 1.81 -1.25 -1.10 118.95 126.30 2avi s ARG 122 Ca 0.28 2.55 0.26 0.00 -1.72 0.00 0.00 55.73 57.10 2avi s ARG 122 Cb -0.06 -4.06 1.57 0.00 -0.45 0.00 0.00 34.95 31.95 2avi s ARG 122 CO 0.15 -0.92 1.92 -0.11 -0.68 0.00 0.00 175.30 175.67