# 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 87.57 10.48 16.68 27.57 119.62 -169.95 -104.93 137.09 99.52 0.47 0.01 99.56 0.06 0.02 0.01 0.00 0.00 0.35 0.01 1 A E E 53.64 10.14 16.79 27.54 124.63 -160.95 -113.38 140.55 48.46 51.16 0.38 47.20 0.66 0.27 0.20 0.13 0.00 50.33 1.21 2 V E E 35.51 17.61 14.31 31.78 123.20 -161.43 -115.99 134.67 24.14 75.26 0.60 21.82 1.48 0.34 0.38 0.21 0.00 74.80 0.97 3 Q E E 85.79 8.20 22.61 31.38 119.84 -156.81 -110.08 131.68 18.01 81.39 0.60 16.40 1.16 0.32 0.37 0.21 0.00 80.95 0.59 4 L E E 23.52 22.67 14.85 37.03 119.89 -155.27 -106.18 133.74 21.99 77.11 0.90 20.13 1.21 0.38 0.51 0.32 0.00 76.88 0.56 5 V E E 64.01 9.01 24.07 33.42 124.45 -166.10 -121.64 134.67 23.31 75.61 1.08 20.60 1.93 0.63 0.61 0.46 0.00 74.74 1.04 6 E E E 66.73 18.10 16.15 33.03 116.22 -139.09 -91.22 130.74 37.61 60.33 2.06 30.80 4.67 1.97 0.78 1.25 0.00 59.34 1.20 7 S C C 52.26 10.37 19.86 30.28 103.87 -172.85 -96.77 1.43 67.37 29.79 2.84 38.61 16.24 13.02 0.46 2.52 0.00 27.89 1.25 8 G C S 37.65 10.14 19.34 29.23 113.41 -87.14 87.56 6.36 79.03 18.86 2.11 27.23 31.46 20.91 0.20 2.06 0.00 16.85 1.29 9 G C C 32.54 12.92 17.68 29.85 115.57 -22.85 103.89 1.84 80.06 18.67 1.27 41.93 27.86 10.42 0.13 1.38 0.00 16.92 1.35 10 G C E 29.53 11.14 19.23 30.30 116.86 -111.42 101.04 -152.13 58.23 41.43 0.34 38.19 18.41 2.54 0.05 0.37 0.00 39.33 1.10 11 L E E 80.88 11.08 21.45 32.21 119.60 -53.51 -99.05 135.65 22.39 77.48 0.13 17.95 4.43 0.41 0.03 0.11 0.00 75.61 1.44 12 V E E 22.78 20.64 14.69 34.85 126.19 -168.99 -120.53 137.25 8.25 91.70 0.05 7.54 0.61 0.03 0.04 0.02 0.00 80.38 11.36 13 Q C C 93.39 5.48 23.21 28.95 121.67 -138.21 -91.91 151.31 85.39 14.58 0.03 85.52 0.52 0.05 0.01 0.02 0.00 13.10 0.78 14 P C T 72.85 11.91 14.66 26.92 109.65 -87.69 -59.18 136.95 98.99 0.79 0.21 0.35 2.45 96.44 0.01 0.15 0.00 0.53 0.07 15 G C T 52.29 2.97 19.14 22.66 96.55 22.26 87.47 -5.36 99.35 0.50 0.15 0.48 2.98 96.01 0.00 0.12 0.00 0.38 0.03 16 G C C 24.08 9.13 15.95 26.50 128.05 118.25 -88.80 171.23 89.33 10.61 0.06 71.20 17.88 0.28 0.01 0.07 0.00 9.89 0.66 17 S E E 55.98 9.35 20.04 30.31 131.09 -122.67 -126.44 151.49 36.46 63.52 0.02 36.52 0.60 0.04 0.00 0.02 0.00 61.61 1.21 18 L E E 16.81 22.77 15.81 38.34 126.72 -157.55 -125.10 139.55 2.90 97.10 0.00 2.71 0.08 0.00 0.00 0.00 0.00 97.06 0.13 19 R E E 115.38 8.05 25.10 33.92 120.04 -153.05 -114.20 131.75 0.91 99.09 0.00 0.86 0.03 0.00 0.00 0.00 0.00 99.08 0.03 20 L E E 7.37 25.42 16.82 42.59 123.98 -169.95 -120.40 136.28 2.74 97.25 0.01 2.58 0.12 0.01 0.00 0.00 0.00 97.20 0.09 21 S E E 41.52 10.00 26.86 37.21 126.72 -166.86 -117.79 144.36 13.22 86.69 0.09 11.92 0.87 0.11 0.02 0.04 0.00 86.77 0.26 22 C E E 7.85 24.70 17.35 41.88 133.28 -164.04 -136.96 148.05 27.06 72.54 0.40 24.21 2.28 0.40 0.14 0.24 0.00 71.49 1.23 23 A E E 41.95 9.86 26.73 37.09 122.39 -159.67 -117.18 136.21 35.59 62.73 1.68 29.42 5.05 1.36 0.82 1.01 0.01 57.56 4.77 24 A C C 12.57 22.95 15.98 38.45 123.17 -164.30 -114.90 141.23 61.57 34.66 3.78 49.85 8.49 2.77 1.32 2.58 0.00 31.82 3.16 25 S C C 55.52 8.26 21.52 30.04 112.41 -154.81 -100.34 115.60 74.54 21.97 3.49 51.17 17.77 5.97 0.89 2.69 0.00 19.18 2.33 26 V C C 62.40 10.78 16.69 27.97 119.50 68.44 -114.85 149.31 75.42 18.89 5.69 36.60 28.15 12.47 1.28 4.19 0.01 14.61 2.68 27 S C C 62.32 7.93 17.08 25.75 113.28 -127.76 -92.50 129.07 76.97 18.13 4.89 50.69 16.86 10.01 1.21 3.74 0.01 14.42 3.06 28 I C C 74.05 12.06 14.27 26.65 110.16 -167.57 -95.75 105.06 76.99 17.36 5.66 41.92 21.32 15.21 1.47 4.13 0.02 12.42 3.51 29 S C C 54.11 9.14 15.39 25.30 111.64 152.47 -95.36 118.05 83.88 11.72 4.40 38.17 27.24 19.69 0.88 3.45 0.01 8.50 2.07 30 R C S 137.05 6.67 17.78 25.10 100.96 -133.15 -85.68 -10.64 84.88 11.59 3.54 28.48 39.01 18.08 0.56 2.90 0.00 9.34 1.62 31 I C C 72.75 10.16 18.53 29.13 113.70 45.58 -102.62 118.07 70.97 26.67 2.36 35.56 24.29 11.84 0.38 2.00 0.00 24.20 1.72 32 Y E E 34.12 20.12 17.13 36.62 123.75 80.06 -114.56 140.57 44.71 54.70 0.59 32.43 10.58 2.24 0.10 0.54 0.00 53.16 0.94 33 V E E 29.06 14.88 25.60 40.60 124.16 -161.51 -117.98 138.10 14.73 85.20 0.06 13.04 1.22 0.15 0.01 0.04 0.00 85.20 0.34 34 M E E 4.65 25.80 21.72 47.57 123.76 -162.43 -116.69 134.88 2.48 97.51 0.01 2.20 0.14 0.01 0.00 0.00 0.00 97.57 0.07 35 A E E 9.34 18.70 27.51 45.85 133.83 -176.81 -132.51 152.83 0.89 99.11 0.00 0.78 0.03 0.00 0.00 0.00 0.00 99.17 0.01 36 W E E 7.44 24.59 23.76 48.11 125.36 -145.97 -115.30 138.74 0.62 99.38 0.00 0.55 0.02 0.00 0.00 0.00 0.00 99.42 0.01 37 Y E E 18.60 19.36 25.02 43.84 133.85 -174.86 -133.47 150.65 0.37 99.63 0.00 0.33 0.01 0.00 0.00 0.00 0.00 99.65 0.01 38 R E E 40.82 17.72 23.01 40.03 124.94 -159.46 -118.35 138.46 0.78 99.22 0.00 0.67 0.04 0.00 0.00 0.00 0.00 99.27 0.02 39 Q E E 44.05 14.43 18.70 33.63 115.86 -139.57 -96.65 129.79 9.74 90.25 0.01 9.10 0.42 0.02 0.00 0.00 0.00 89.89 0.57 40 A C C 25.26 11.64 14.97 28.13 119.31 -130.92 -78.71 155.66 97.46 2.51 0.03 96.50 0.97 0.22 0.01 0.02 0.00 1.99 0.29 41 P C T 90.00 6.12 13.13 20.89 109.60 -76.46 -58.94 135.54 99.58 0.09 0.33 0.24 3.10 96.25 0.01 0.34 0.00 0.05 0.02 42 G C T 68.68 0.33 13.55 11.28 95.74 17.04 83.41 -2.51 99.56 0.06 0.37 0.32 2.90 96.33 0.01 0.40 0.00 0.04 0.01 43 K C S 106.87 5.24 9.84 17.20 129.17 91.81 -119.30 160.73 96.14 3.19 0.68 38.32 55.72 2.37 0.10 0.59 0.00 1.39 1.51 44 Q C C 132.48 1.64 16.96 18.24 116.47 -96.17 -74.31 152.27 94.33 5.60 0.07 78.69 15.48 0.38 0.01 0.07 0.00 4.73 0.63 45 R C C 92.72 15.69 12.46 27.59 114.06 -93.33 -69.53 138.99 54.47 45.50 0.03 51.59 1.57 0.10 0.00 0.03 0.00 46.33 0.37 46 E E E 59.26 12.02 19.97 32.66 125.79 -167.17 -123.48 137.57 3.99 96.00 0.01 3.60 0.20 0.01 0.00 0.00 0.00 96.07 0.12 47 V E E 47.59 15.55 21.53 36.71 110.84 -116.31 -73.60 127.66 0.71 99.29 0.00 0.67 0.01 0.00 0.00 0.00 0.00 99.30 0.01 48 V E E 5.91 22.89 21.70 45.01 102.23 174.87 -100.38 -30.90 3.95 96.05 0.00 2.42 1.07 0.01 0.00 0.00 0.00 96.48 0.01 49 A E E 2.22 23.25 23.08 46.76 142.18 -1.72 -154.76 155.02 0.55 99.45 0.00 0.42 0.05 0.00 0.00 0.00 0.00 99.53 0.00 50 V E E 21.89 16.67 26.18 42.63 129.01 -158.88 -132.25 139.60 0.30 99.70 0.00 0.28 0.01 0.00 0.00 0.00 0.00 99.71 0.00 51 I E E 9.48 21.89 19.30 41.59 118.65 -157.88 -113.37 126.34 0.65 99.35 0.00 0.59 0.02 0.00 0.00 0.00 0.00 99.31 0.08 52 R E E 70.95 9.51 21.62 31.60 126.72 -157.41 -97.21 163.48 30.53 69.39 0.08 28.13 1.32 0.21 0.01 0.06 0.00 69.63 0.64 53 Y C T 113.99 13.47 14.24 27.65 91.92 -102.29 -63.37 -24.49 92.76 5.83 1.41 2.12 7.13 83.82 0.06 1.37 0.00 5.09 0.41 54 D C T 110.74 1.64 18.34 19.16 93.59 58.17 -86.74 0.32 98.27 0.45 1.28 1.14 6.70 90.34 0.05 1.39 0.00 0.30 0.08 55 G C S 35.50 10.24 13.92 24.71 98.77 -100.33 89.27 4.94 96.28 1.64 2.08 14.47 69.52 12.21 0.16 2.06 0.00 1.08 0.50 56 T C C 71.04 4.38 19.73 24.97 117.94 135.24 -82.23 143.34 81.73 18.20 0.06 78.73 2.49 0.26 0.01 0.05 0.00 17.87 0.60 57 T E E 40.94 20.26 12.39 31.50 126.81 -159.38 -122.35 140.63 7.54 92.45 0.01 7.24 0.32 0.02 0.00 0.01 0.00 91.70 0.70 58 N E E 73.42 6.96 23.97 31.67 130.42 -173.03 -132.30 146.00 3.58 96.41 0.01 3.21 0.28 0.02 0.00 0.01 0.00 96.02 0.46 59 Y E E 69.38 19.67 14.93 33.39 126.61 -158.64 -121.34 142.49 24.92 75.05 0.03 23.85 0.91 0.05 0.01 0.02 0.00 73.99 1.17 60 P C C 24.88 14.71 13.81 29.61 115.06 -108.01 -66.37 149.58 94.70 5.03 0.28 92.79 1.76 0.35 0.07 0.16 0.00 4.47 0.40 61 D H G 119.53 1.73 17.56 19.63 91.79 -112.57 -59.77 -31.31 36.21 0.35 63.44 1.95 4.33 28.48 2.88 62.02 0.00 0.21 0.12 62 S H G 64.24 6.05 17.17 24.52 90.52 63.38 -69.69 -18.03 34.81 0.17 65.03 0.71 2.51 30.80 2.26 63.56 0.00 0.10 0.06 63 V H G 8.63 22.54 10.60 33.14 97.77 46.24 -100.61 -3.23 35.68 0.53 63.79 1.78 3.93 29.05 3.04 61.66 0.01 0.32 0.22 64 K C T 120.77 7.31 14.90 24.61 110.87 121.57 -60.42 131.66 93.35 1.86 4.78 2.38 4.00 87.62 1.36 2.52 0.00 0.86 1.25 65 G C T 61.99 1.24 18.71 18.97 93.61 13.85 80.96 -2.23 96.03 0.28 3.68 0.71 3.68 92.39 0.39 2.56 0.00 0.17 0.11 66 R C T 85.39 12.45 17.13 29.80 100.55 79.39 -99.86 -19.87 95.09 1.34 3.56 8.57 22.06 64.54 0.42 3.09 0.00 1.07 0.27 67 F E E 9.12 24.08 12.64 37.02 135.71 34.73 -137.23 153.20 20.08 79.88 0.04 15.51 4.95 0.17 0.01 0.03 0.00 77.62 1.71 68 T E E 63.60 6.22 26.49 33.34 124.45 -153.05 -118.70 139.91 2.36 97.64 0.00 2.24 0.06 0.00 0.00 0.00 0.00 97.63 0.06 69 I E E 22.54 24.16 14.47 38.29 123.49 -160.70 -119.81 131.74 1.16 98.84 0.00 1.13 0.02 0.00 0.00 0.00 0.00 98.84 0.01 70 S E E 47.00 6.83 25.50 32.70 131.14 -174.83 -132.66 150.10 1.32 98.67 0.00 1.20 0.04 0.00 0.00 0.00 0.00 98.75 0.01 71 R E E 87.49 17.81 14.16 31.04 123.44 -153.50 -119.39 134.37 2.58 97.41 0.01 2.23 0.19 0.01 0.00 0.00 0.00 97.44 0.12 72 D E E 52.95 7.78 16.01 25.55 108.97 -156.21 -107.67 107.05 17.90 82.04 0.06 17.05 0.70 0.09 0.02 0.04 0.00 81.24 0.86 73 N C T 102.13 6.28 13.10 21.36 93.88 -168.28 -68.55 -27.92 91.82 0.45 7.72 1.15 5.94 83.56 0.17 8.76 0.00 0.30 0.13 74 A C T 89.57 1.12 15.15 15.60 92.83 55.88 -68.64 -35.73 91.70 0.59 7.71 0.72 5.18 84.94 0.17 8.44 0.00 0.35 0.19 75 K C T 110.85 4.67 15.59 21.09 97.71 30.65 -97.03 -4.79 93.86 0.16 5.98 1.19 6.62 84.80 0.14 7.09 0.00 0.09 0.06 76 N C T 62.33 12.03 15.83 28.91 95.04 -127.19 56.92 42.92 99.56 0.20 0.23 5.99 5.57 88.06 0.03 0.17 0.00 0.15 0.03 77 T E E 25.93 12.56 20.88 34.65 133.65 127.55 -130.31 153.75 8.75 91.24 0.01 7.71 0.69 0.04 0.00 0.00 0.00 90.67 0.89 78 V E E 6.49 23.57 18.87 42.83 123.41 -155.97 -120.64 133.88 1.19 98.81 0.00 1.11 0.03 0.00 0.00 0.00 0.00 98.80 0.05 79 Y E E 53.53 12.75 26.75 39.98 120.53 -159.94 -112.49 130.54 1.95 98.05 0.00 1.74 0.05 0.00 0.00 0.00 0.00 98.20 0.01 80 L E E 3.19 26.09 19.81 46.63 119.94 -162.12 -112.12 130.08 0.53 99.47 0.00 0.50 0.01 0.00 0.00 0.00 0.00 99.49 0.00 81 Q E E 54.78 11.57 27.34 39.33 119.96 -162.72 -112.35 129.03 0.39 99.61 0.00 0.38 0.00 0.00 0.00 0.00 0.00 99.58 0.03 82 M E E 8.58 24.52 17.21 41.97 119.97 -167.61 -112.01 128.54 19.31 80.69 0.00 19.80 0.16 0.01 0.00 0.00 0.00 78.86 1.17 83 N C C 64.30 8.42 22.93 31.54 119.46 -155.37 -95.39 154.28 97.21 2.74 0.06 50.32 41.86 4.77 0.00 0.10 0.00 2.73 0.21 84 S C S 61.97 5.91 24.32 30.28 99.02 8.49 56.39 60.85 99.29 0.67 0.05 15.31 78.02 5.98 0.00 0.07 0.00 0.47 0.15 85 L C C 16.57 24.20 11.44 35.31 114.42 -157.31 -75.19 135.70 99.32 0.66 0.02 96.73 2.57 0.03 0.01 0.00 0.00 0.20 0.47 86 K C C 92.93 4.99 24.76 29.85 130.26 -170.22 -123.44 156.12 99.90 0.09 0.01 99.00 0.89 0.01 0.00 0.00 0.00 0.02 0.06 87 P H G 63.41 14.19 16.26 30.39 91.08 -103.61 -58.83 -32.87 5.87 0.04 94.09 0.45 0.44 3.67 0.29 95.13 0.00 0.03 0.00 88 E H G 109.18 6.26 22.15 29.41 89.91 62.75 -70.88 -15.55 4.84 0.06 95.10 0.28 0.37 3.23 0.27 95.80 0.00 0.05 0.00 89 D H G 12.25 21.45 18.39 40.17 94.39 63.42 -87.95 -0.02 5.94 0.12 93.94 1.32 0.76 2.12 0.41 95.30 0.00 0.10 0.00 90 T C C 22.20 18.92 22.47 41.30 117.08 105.25 -84.53 137.73 76.17 23.19 0.63 72.21 3.85 0.33 0.11 0.49 0.00 22.19 0.83 91 A E E 6.42 22.05 24.85 45.70 143.29 161.21 -151.21 166.58 4.28 95.69 0.02 4.02 0.31 0.02 0.01 0.01 0.00 95.12 0.51 92 V E E 17.18 20.03 27.00 46.36 119.52 -113.31 -102.93 133.47 1.29 98.70 0.01 1.24 0.05 0.00 0.00 0.00 0.00 98.67 0.04 93 Y E E 5.89 25.42 24.30 49.37 123.14 -163.71 -114.97 135.44 0.93 99.06 0.01 0.85 0.05 0.01 0.00 0.00 0.00 99.05 0.03 94 Y E E 19.60 20.61 27.73 47.30 127.73 -171.03 -124.17 142.67 2.92 97.01 0.07 2.62 0.19 0.04 0.02 0.03 0.00 96.93 0.16 95 C E E 4.66 24.11 23.22 47.06 123.96 -161.18 -119.49 137.19 22.69 76.68 0.63 19.65 2.42 0.57 0.23 0.32 0.00 75.84 0.98 96 N C E 31.47 14.96 24.83 39.83 107.70 -158.20 -100.48 89.70 53.29 44.95 1.76 41.70 9.58 2.71 0.56 1.21 0.01 42.05 2.18 97 A C C 21.84 18.30 17.61 35.18 112.28 164.20 -91.71 129.01 71.72 21.43 6.86 33.00 27.61 13.42 2.18 4.40 0.07 16.46 2.86 98 N C C 92.92 6.32 20.42 27.12 102.40 -119.70 -89.24 19.86 81.15 10.92 7.93 38.30 27.34 16.83 2.41 5.20 0.04 7.18 2.70 99 V C S 59.96 12.28 14.02 26.56 113.03 79.76 -96.66 120.35 71.20 4.51 24.29 22.07 25.40 25.38 7.08 15.54 0.06 2.34 2.13 100 E C T 133.21 4.22 17.85 22.97 99.11 -92.31 -75.44 -11.73 72.00 2.62 25.38 17.38 22.84 33.07 6.78 17.15 0.04 1.31 1.42 101 T C T 59.48 10.82 16.82 27.96 104.92 49.51 -96.87 21.65 63.56 11.61 24.83 20.99 18.24 26.64 6.65 16.48 0.26 6.50 4.25 102 W C T 73.76 16.65 16.49 32.37 106.86 82.92 -89.43 54.38 70.14 16.41 13.44 21.13 14.94 35.12 4.83 8.09 0.22 9.77 5.90 103 G C T 21.35 13.69 20.18 33.50 116.32 -107.14 85.49 -152.45 79.25 13.80 6.95 27.37 19.61 33.69 1.46 5.13 0.03 9.56 3.16 104 Q C C 75.10 12.28 22.72 34.47 106.23 -18.15 -84.25 89.74 81.93 14.79 3.28 55.16 16.66 9.87 0.71 2.75 0.00 12.07 2.77 105 G C C 11.95 19.48 18.87 37.10 126.76 -150.14 92.08 169.39 67.60 31.77 0.63 48.27 15.02 4.04 0.11 0.59 0.00 30.45 1.53 106 T E E 30.38 16.59 23.11 39.25 124.44 -93.62 -111.37 142.59 21.90 77.99 0.10 19.44 2.14 0.22 0.03 0.07 0.00 77.13 0.97 107 Q E E 61.07 16.17 22.48 37.61 120.27 -138.80 -100.50 134.02 5.22 94.75 0.03 4.81 0.32 0.03 0.01 0.01 0.00 94.60 0.23 108 V E E 22.58 19.23 20.08 38.93 125.45 -169.17 -122.07 138.17 3.81 96.18 0.02 3.68 0.12 0.01 0.00 0.00 0.00 96.09 0.09 109 T E E 43.28 14.12 22.74 36.57 123.14 -160.01 -114.29 136.55 4.39 95.57 0.04 4.08 0.25 0.04 0.01 0.01 0.00 95.43 0.17 110 V E E 26.29 18.23 19.02 36.89 124.33 -168.64 -119.10 137.48 12.09 87.74 0.17 11.00 0.91 0.18 0.07 0.08 0.00 87.13 0.62 111 S E E 37.96 12.15 19.75 32.18 125.77 -161.84 -115.04 146.93 39.47 59.72 0.81 32.89 5.09 1.30 0.24 0.55 0.00 58.70 1.23 112 S C C 39.59 13.61 14.57 28.37 113.60 -151.35 -102.04 131.51 71.25 25.29 3.46 51.05 13.94 5.94 0.74 2.78 0.00 23.91 1.63 113 H C C 120.73 5.56 15.51 22.08 106.66 -140.48 -89.13 67.98 82.55 9.41 8.04 43.56 24.11 15.39 1.39 6.73 0.00 7.39 1.43 114 H C C 111.50 6.76 12.40 20.43 108.47 77.78 -89.87 95.96 84.45 5.59 9.95 50.32 18.52 15.48 1.73 8.68 0.00 3.85 1.42 115 H C C 112.16 6.75 10.57 18.69 107.73 77.63 -90.18 84.31 84.81 3.96 11.23 53.73 17.60 13.22 1.89 9.81 0.00 2.57 1.19 116 H C C 125.56 4.46 9.92 16.14 109.31 66.81 -91.24 104.24 87.49 3.16 9.36 55.00 17.94 14.23 1.57 8.22 0.00 2.04 1.00 117 H C C 135.24 3.41 9.18 14.41 108.24 71.88 -89.72 89.50 92.15 2.29 5.57 78.86 4.22 9.48 1.25 3.85 0.00 1.46 0.87 118 H C C 137.07 3.66 11.19 16.55 108.32 -143.86 -88.99 91.04 99.70 0.08 0.22 99.24 0.25 0.32 0.05 0.09 0.00 0.04 0.02