# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 M C C 79.06 9.96 20.98 30.87 115.24 -149.73 -92.57 130.90 99.75 0.24 0.00 99.76 0.05 0.01 0.00 0.00 0.00 0.17 0.00 1 V E E 19.13 20.58 14.84 35.09 122.87 -156.65 -113.21 136.01 17.53 82.46 0.01 17.94 0.19 0.01 0.00 0.00 0.00 81.46 0.39 2 T E E 39.41 9.53 23.52 33.99 121.73 -162.06 -115.20 133.53 3.60 96.40 0.00 3.17 0.22 0.01 0.00 0.00 0.00 96.55 0.05 3 I E E 14.33 23.21 17.10 40.30 119.56 -161.19 -111.18 128.68 0.75 99.25 0.00 0.67 0.02 0.00 0.00 0.00 0.00 99.29 0.01 4 R E E 79.70 9.72 25.23 35.23 123.36 -170.86 -119.66 134.47 0.48 99.52 0.00 0.43 0.01 0.00 0.00 0.00 0.00 99.55 0.00 5 L E E 24.45 21.65 17.44 38.55 120.53 -156.91 -106.76 132.79 0.72 99.28 0.00 0.65 0.02 0.00 0.00 0.00 0.00 99.33 0.01 6 A E E 29.84 10.69 22.09 33.58 130.98 -175.96 -128.87 149.26 0.72 99.27 0.00 0.65 0.03 0.00 0.00 0.00 0.00 99.31 0.01 7 R E E 107.77 12.67 16.95 29.61 116.00 -124.19 -88.11 133.22 1.95 98.05 0.01 1.78 0.08 0.01 0.00 0.00 0.00 98.08 0.06 8 H E E 78.12 9.12 16.06 26.37 131.48 171.19 -131.30 155.64 16.65 83.32 0.03 14.66 1.27 0.12 0.01 0.02 0.00 83.63 0.29 9 G E E 38.12 4.17 14.94 20.62 129.41 34.55 117.55 -172.62 45.58 54.34 0.08 32.34 12.47 0.85 0.01 0.09 0.00 53.50 0.74 10 A C C 64.99 4.53 12.22 18.42 123.70 -63.88 -113.21 156.95 67.65 32.02 0.33 53.27 13.22 1.45 0.08 0.33 0.00 28.08 3.57 11 K C S 161.59 1.82 11.34 14.32 101.26 -74.27 -64.17 -25.23 98.23 0.83 0.93 3.24 53.61 41.54 0.04 0.87 0.00 0.53 0.17 12 K C S 176.34 0.73 13.38 13.15 96.57 8.10 -63.45 -3.14 98.48 0.53 0.99 3.37 53.23 41.92 0.03 0.99 0.00 0.35 0.11 13 R C S 120.08 5.30 12.99 19.87 113.75 49.30 -124.30 98.96 69.51 30.15 0.34 21.91 46.17 2.31 0.03 0.35 0.00 27.67 1.55 14 P C C 42.87 11.90 13.81 27.11 114.89 -145.26 -70.88 142.07 55.91 44.06 0.04 51.83 1.64 0.16 0.00 0.03 0.00 46.04 0.29 15 F E E 43.76 12.56 18.97 32.80 130.88 -173.37 -128.43 149.45 3.92 96.07 0.00 3.35 0.28 0.01 0.00 0.00 0.00 96.26 0.10 16 Y E E 36.19 18.31 18.99 37.11 126.71 -156.59 -120.92 143.29 0.36 99.64 0.00 0.30 0.01 0.00 0.00 0.00 0.00 99.68 0.00 17 Q E E 34.35 14.98 24.22 39.17 131.14 -170.06 -129.13 146.98 0.14 99.86 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.88 0.00 18 V E E 8.74 22.50 21.58 44.11 118.19 -144.09 -106.14 129.16 0.07 99.93 0.00 0.06 0.00 0.00 0.00 0.00 0.00 99.93 0.00 19 V E E 12.45 18.17 25.04 43.14 126.78 -171.08 -121.93 142.49 0.08 99.92 0.00 0.07 0.00 0.00 0.00 0.00 0.00 99.93 0.00 20 V E E 12.73 20.20 23.82 43.85 119.32 -152.37 -108.61 129.91 0.32 99.68 0.00 0.28 0.01 0.00 0.00 0.00 0.00 99.71 0.01 21 A E E 10.04 16.87 20.06 37.65 134.26 172.13 -134.92 156.77 3.43 96.56 0.01 3.14 0.13 0.01 0.00 0.00 0.00 96.58 0.15 22 D E E 37.58 9.98 19.06 30.41 113.54 -103.97 -72.68 143.68 27.87 71.87 0.26 25.11 2.51 0.30 0.08 0.16 0.00 70.92 0.92 23 S C T 58.21 10.09 14.75 25.80 92.41 -122.98 -64.44 -27.72 74.30 1.13 24.57 3.28 17.59 54.27 3.03 20.51 0.04 0.72 0.56 24 R C T 176.92 1.16 16.93 17.04 94.39 58.71 -77.15 -21.05 72.76 0.73 26.51 3.15 17.34 52.63 3.42 22.55 0.03 0.40 0.48 25 N C C 62.24 7.87 11.97 21.40 108.96 40.27 -118.36 75.88 67.77 6.26 25.97 28.98 25.13 14.58 5.15 19.93 0.03 3.00 3.20 26 A C T 49.73 12.26 10.67 23.34 94.30 159.14 -63.43 -30.46 63.12 2.65 34.23 24.70 8.53 30.35 6.17 27.52 0.02 1.44 1.27 27 R C T 162.12 3.02 15.49 19.46 93.62 55.71 -69.86 -27.68 65.14 0.74 34.12 3.60 7.66 52.65 4.04 31.13 0.02 0.43 0.48 28 N C T 107.46 2.79 16.98 19.91 98.54 33.61 -97.39 0.41 66.55 0.68 32.76 3.24 8.60 54.17 3.88 29.28 0.01 0.40 0.42 29 G C C 23.60 15.17 12.29 26.95 100.32 -118.67 76.32 14.12 90.02 3.09 6.88 45.05 27.86 17.11 1.10 6.00 0.00 1.87 1.01 30 R C C 120.50 5.32 20.78 26.82 115.48 148.59 -84.60 133.86 85.82 13.31 0.87 72.54 10.94 1.98 0.23 0.73 0.00 11.51 2.07 31 F E E 74.54 16.48 14.44 30.35 113.00 -124.24 -78.11 128.08 29.75 70.11 0.15 28.39 1.09 0.14 0.05 0.10 0.00 67.05 3.18 32 I E E 66.72 11.17 18.68 30.41 101.18 175.84 -94.75 -33.48 24.21 75.64 0.16 12.24 11.55 0.37 0.01 0.09 0.00 75.59 0.15 33 E E E 74.93 8.52 22.07 31.10 139.39 -3.52 -152.12 150.51 1.65 98.29 0.06 1.36 0.21 0.02 0.01 0.03 0.00 98.35 0.02 34 R E E 112.51 13.03 19.11 31.75 112.21 -127.62 -86.95 122.60 0.72 99.25 0.03 0.79 0.02 0.00 0.01 0.01 0.00 99.13 0.03 35 V E E 19.23 18.81 18.47 37.55 101.16 175.71 -100.96 -25.36 2.42 97.57 0.01 2.04 0.28 0.02 0.00 0.01 0.00 97.62 0.03 36 G E E 8.30 13.24 22.31 36.59 145.69 -42.10 164.83 175.57 2.22 97.77 0.01 1.71 0.34 0.04 0.00 0.01 0.00 97.87 0.03 37 F E E 63.26 14.14 21.97 36.22 133.11 -100.09 -137.07 150.02 3.02 96.96 0.02 2.78 0.19 0.02 0.00 0.01 0.00 96.81 0.19 38 F E E 40.29 17.44 18.43 36.01 119.46 -139.82 -107.48 131.84 14.66 85.28 0.06 12.75 1.69 0.13 0.03 0.04 0.00 83.15 2.21 39 N C C 40.19 10.95 18.38 30.77 111.96 -163.87 -117.84 104.94 85.95 13.74 0.31 81.63 3.60 0.35 0.13 0.16 0.00 13.46 0.66 40 P C T 54.65 10.52 15.13 27.16 94.65 -166.99 -66.76 -23.53 73.91 4.01 22.09 22.74 17.19 34.96 7.78 13.43 0.03 2.70 1.16 41 I C T 102.62 4.69 15.26 20.76 98.93 54.96 -84.62 -16.25 70.88 2.80 26.33 15.96 20.34 35.34 9.74 15.41 0.09 1.39 1.74 42 A C C 57.22 7.41 10.88 19.64 103.78 80.11 -78.09 19.70 68.80 2.13 29.07 26.72 21.10 22.10 9.66 18.03 0.02 0.95 1.42 43 S C T 72.77 4.12 12.14 17.60 103.94 63.89 -86.03 25.72 76.41 1.05 22.54 27.37 19.77 30.10 9.02 12.47 0.01 0.44 0.82 44 E C T 132.53 3.81 11.44 16.85 100.49 35.51 -77.16 9.43 77.78 1.13 21.08 27.56 22.07 29.06 7.94 12.02 0.01 0.46 0.88 45 K C C 127.92 4.34 11.71 17.64 106.39 90.58 -87.31 51.08 70.23 1.71 28.06 34.93 17.54 18.21 9.08 18.35 0.01 0.76 1.12 46 E C C 119.53 5.83 12.45 19.61 103.02 58.92 -77.43 -5.43 64.91 2.07 33.03 25.33 17.32 23.70 8.93 22.61 0.02 1.03 1.07 47 E C C 118.66 5.46 14.59 21.37 105.13 64.84 -85.68 36.93 65.65 3.89 30.46 32.39 13.57 21.28 7.05 22.11 0.02 2.40 1.20 48 G C C 28.89 10.15 16.21 27.00 108.94 38.55 81.09 -4.22 77.46 10.33 12.21 46.71 20.84 10.70 2.97 9.01 0.01 8.09 1.67 49 T E E 33.98 17.68 14.15 31.31 121.47 66.29 -109.59 135.59 43.71 53.84 2.44 36.88 4.98 1.72 1.18 1.41 0.00 50.83 3.00 50 R E E 125.68 6.84 21.99 30.12 124.02 -168.75 -120.87 136.39 18.10 81.46 0.45 15.76 1.50 0.27 0.35 0.19 0.00 75.05 6.88 51 L E E 29.10 21.65 12.71 33.59 119.17 -143.00 -96.80 134.45 31.53 68.29 0.18 30.25 1.07 0.10 0.14 0.07 0.00 62.71 5.67 52 D C C 67.79 6.24 20.46 27.57 105.61 -131.86 -86.94 105.64 83.67 16.13 0.20 83.94 0.59 0.06 0.13 0.03 0.00 14.65 0.59 53 L H H 68.13 13.96 13.49 27.81 93.73 -170.09 -64.90 -35.44 1.64 0.01 98.36 0.55 0.16 0.68 98.27 0.33 0.00 0.00 0.00 54 D H H 109.58 1.22 20.10 19.78 91.42 55.28 -63.41 -40.27 0.42 0.00 99.58 0.05 0.03 0.27 99.36 0.29 0.00 0.00 0.00 55 R H H 90.18 8.46 18.33 27.65 92.12 49.08 -66.03 -40.48 0.16 0.00 99.83 0.02 0.01 0.10 99.60 0.26 0.00 0.00 0.00 56 I H H 8.93 22.60 13.31 35.87 91.64 51.17 -63.55 -42.95 0.09 0.00 99.91 0.01 0.00 0.05 99.88 0.06 0.00 0.00 0.00 57 A H H 50.07 6.51 19.82 27.06 91.34 51.53 -62.62 -41.53 0.15 0.00 99.85 0.01 0.00 0.09 99.85 0.04 0.00 0.00 0.00 58 H H H 109.43 2.15 21.34 22.19 91.99 49.92 -64.51 -42.08 0.31 0.00 99.69 0.02 0.01 0.23 99.66 0.08 0.00 0.00 0.00 59 W H H 38.41 14.77 15.69 31.23 92.12 49.14 -64.93 -42.53 0.72 0.00 99.27 0.07 0.04 0.51 99.14 0.23 0.00 0.00 0.00 60 V H H 41.81 15.60 14.03 29.51 92.09 49.43 -64.85 -39.72 1.77 0.01 98.22 0.13 0.09 1.44 97.76 0.56 0.00 0.00 0.00 61 G H H 57.48 1.77 17.00 18.90 90.89 56.79 -67.27 -22.95 12.94 0.03 87.03 0.37 0.49 12.37 85.99 0.75 0.02 0.01 0.01 62 Q C T 120.29 2.88 15.02 18.74 94.28 55.51 -87.41 0.17 82.32 0.03 17.65 0.30 1.38 80.14 17.45 0.68 0.00 0.01 0.03 63 G C T 53.30 2.32 17.90 20.18 99.85 -95.33 92.56 7.13 93.36 0.03 6.61 1.49 1.74 89.68 6.89 0.18 0.00 0.01 0.01 64 A C C 23.34 18.40 9.23 26.90 117.63 152.95 -73.26 146.00 98.12 1.72 0.16 96.28 1.73 0.33 0.06 0.05 0.00 1.23 0.32 65 T C C 97.97 2.45 22.87 25.22 117.35 -135.58 -100.91 134.15 78.46 21.41 0.13 76.98 2.17 0.29 0.06 0.07 0.00 17.17 3.26 66 I C C 48.56 20.92 11.28 30.65 119.71 -141.23 -95.03 137.12 72.92 27.00 0.08 72.72 1.60 0.06 0.05 0.03 0.00 18.55 6.99 67 S C C 37.56 8.14 15.52 25.25 120.41 -122.94 -75.58 163.47 96.81 3.11 0.09 96.98 0.52 0.03 0.06 0.01 0.00 1.94 0.47 68 D H H 121.19 1.40 16.68 18.11 91.10 -106.72 -60.20 -35.22 1.08 0.00 98.92 0.14 0.14 0.60 98.96 0.16 0.00 0.00 0.00 69 R H H 128.71 4.42 18.36 23.60 91.80 53.56 -64.53 -40.82 0.44 0.00 99.56 0.04 0.03 0.28 99.51 0.14 0.00 0.00 0.00 70 V H H 11.12 21.09 14.37 35.34 91.86 48.13 -65.19 -42.23 0.13 0.00 99.87 0.02 0.01 0.07 99.82 0.09 0.00 0.00 0.00 71 A H H 31.49 10.46 17.84 29.57 91.30 52.29 -62.27 -42.09 0.06 0.00 99.94 0.01 0.00 0.03 99.94 0.02 0.00 0.00 0.00 72 A H H 56.36 2.25 22.35 23.18 91.28 50.49 -63.82 -41.86 0.15 0.00 99.85 0.01 0.00 0.09 99.87 0.02 0.00 0.00 0.00 73 L H H 31.87 12.39 18.60 32.09 92.03 50.19 -64.53 -42.54 0.24 0.00 99.76 0.02 0.01 0.16 99.78 0.04 0.00 0.00 0.00 74 I H H 16.95 19.12 15.71 34.99 91.73 49.81 -64.04 -42.07 0.61 0.00 99.39 0.09 0.04 0.37 99.39 0.11 0.00 0.00 0.00 75 K H H 116.23 3.49 19.55 23.44 91.76 50.75 -63.82 -40.44 2.50 0.01 97.49 0.40 0.18 1.67 97.40 0.34 0.00 0.00 0.00 76 E H H 108.95 2.65 18.10 20.67 92.29 50.11 -66.37 -38.52 7.28 0.02 92.70 1.08 0.64 5.08 92.43 0.75 0.00 0.01 0.01 77 V H H 42.53 12.66 12.37 25.76 93.75 51.57 -70.03 -32.59 18.22 0.12 81.66 4.21 2.43 10.96 80.91 1.37 0.01 0.04 0.06 78 N H H 92.33 6.83 12.98 21.01 95.91 58.59 -73.79 -20.54 44.50 0.82 54.67 15.47 6.03 23.29 52.27 2.17 0.02 0.34 0.40 79 K C C 150.36 1.87 12.03 14.85 99.96 66.17 -80.31 -8.60 68.45 1.02 30.53 44.03 1.55 20.29 31.36 1.76 0.00 0.44 0.57 80 A C C 71.08 5.16 11.27 17.93 103.67 95.99 -79.75 35.31 99.94 0.03 0.03 99.86 0.05 0.05 0.02 0.00 0.00 0.01 0.00