# 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 D C C 93.17 5.04 19.24 24.85 110.22 -156.82 -94.97 108.30 99.69 0.30 0.00 99.62 0.11 0.03 0.00 0.00 0.00 0.23 0.01 1 I E E 48.49 17.27 11.97 28.68 118.56 -153.92 -105.21 128.41 39.03 60.86 0.12 38.20 0.56 0.22 0.02 0.07 0.00 60.12 0.80 2 V E E 71.80 6.90 19.01 27.06 119.18 -165.33 -112.04 129.77 13.24 86.67 0.10 12.05 0.98 0.20 0.03 0.07 0.00 86.10 0.57 3 M E E 52.50 17.77 13.74 31.06 120.69 -160.31 -108.14 131.87 9.61 90.33 0.06 8.83 0.63 0.13 0.02 0.04 0.00 89.86 0.48 4 T E E 66.03 7.63 20.08 28.58 126.10 -172.88 -122.41 142.44 16.11 83.78 0.11 14.42 1.29 0.22 0.03 0.08 0.00 82.85 1.10 5 Q E E 69.58 15.15 13.96 28.75 126.39 -160.72 -119.80 142.02 46.27 53.58 0.15 36.33 9.30 0.67 0.03 0.15 0.00 52.29 1.22 6 S C C 60.46 6.69 17.99 25.62 120.58 -131.70 -101.46 147.72 77.84 22.03 0.13 53.34 23.21 0.84 0.02 0.13 0.00 21.68 0.78 7 P C C 72.68 8.30 16.69 25.82 114.30 -45.89 -69.57 148.40 85.58 14.11 0.31 61.89 20.10 2.31 0.03 0.35 0.00 14.81 0.51 8 L C C 72.28 13.07 14.95 28.17 102.29 -151.48 -88.71 -1.22 61.67 37.96 0.38 44.48 14.96 2.00 0.05 0.41 0.00 37.13 0.99 9 S E E 61.32 8.18 19.10 28.30 129.97 32.12 -129.74 143.73 21.57 78.32 0.10 19.00 2.29 0.27 0.02 0.09 0.00 77.31 1.01 10 L E E 34.64 17.59 15.06 32.61 123.37 -171.21 -127.41 129.37 6.18 93.81 0.01 5.52 0.53 0.02 0.00 0.00 0.00 93.64 0.29 11 P E E 83.94 5.05 23.33 28.87 114.12 -120.68 -74.52 137.44 6.23 93.76 0.00 5.75 0.31 0.02 0.00 0.00 0.00 93.68 0.23 12 V E E 14.27 22.55 12.12 34.17 131.38 -176.88 -134.59 148.97 22.29 77.69 0.02 21.44 0.90 0.03 0.01 0.01 0.00 71.53 6.07 13 T C C 66.04 4.80 23.69 28.33 122.58 -135.32 -102.77 148.26 90.93 9.04 0.03 90.06 1.44 0.08 0.01 0.01 0.00 7.19 1.21 14 P C T 58.40 14.58 14.08 28.53 109.44 -88.09 -60.77 136.85 99.61 0.22 0.17 0.35 3.21 96.16 0.01 0.12 0.00 0.12 0.04 15 G C T 47.29 4.49 18.93 24.34 96.21 21.82 87.54 -5.98 99.78 0.11 0.11 0.52 3.47 95.83 0.01 0.09 0.00 0.07 0.01 16 E C S 92.96 6.27 18.65 26.09 121.93 112.42 -93.60 146.67 96.18 3.78 0.04 47.29 49.63 0.18 0.01 0.03 0.00 2.16 0.70 17 P C C 79.01 7.80 18.91 27.56 115.91 -104.66 -67.35 147.07 93.13 6.85 0.01 92.56 1.02 0.05 0.00 0.01 0.00 6.03 0.33 18 A E E 9.73 23.04 13.88 36.66 124.72 -157.20 -115.16 145.13 7.58 92.40 0.02 7.29 0.29 0.02 0.00 0.01 0.00 91.61 0.77 19 S E E 56.54 7.66 25.31 33.61 123.12 -149.17 -115.66 135.89 1.63 98.37 0.00 1.54 0.08 0.01 0.00 0.00 0.00 98.22 0.14 20 I E E 7.91 25.55 16.10 42.08 124.99 -170.71 -123.11 135.02 6.68 93.30 0.02 6.31 0.34 0.03 0.01 0.01 0.00 93.06 0.24 21 S E E 41.11 9.36 26.66 36.54 125.22 -165.64 -115.18 144.19 27.01 72.95 0.04 24.94 1.06 0.08 0.01 0.03 0.00 73.60 0.28 22 C E E 7.81 25.14 16.94 42.10 132.59 -172.67 -136.96 147.26 34.66 65.20 0.14 31.86 2.02 0.22 0.04 0.09 0.00 64.84 0.94 23 R E E 96.22 9.31 26.47 36.34 125.30 -165.86 -121.81 140.11 20.92 78.47 0.61 18.11 1.92 0.44 0.44 0.30 0.00 68.30 10.48 24 S C E 14.68 22.36 16.29 37.92 122.64 -156.61 -104.17 146.32 48.64 48.39 2.97 42.52 4.15 1.22 1.77 1.41 0.01 44.83 4.10 25 N C C 65.44 9.50 21.12 30.97 105.86 -139.32 -89.60 79.14 69.67 14.92 15.41 52.54 11.76 5.22 8.67 6.91 0.02 12.57 2.33 26 Q H G 93.25 9.93 17.18 27.31 98.19 85.75 -73.53 -23.57 46.18 4.61 49.21 21.10 11.58 14.06 24.19 24.70 0.12 2.98 1.25 27 S H G 57.64 7.16 17.92 25.76 97.93 66.83 -73.81 -24.75 44.79 4.89 50.32 22.92 8.67 13.33 23.88 26.61 0.07 3.25 1.26 28 L H G 56.68 14.10 14.66 28.64 96.41 60.54 -75.74 -21.18 42.14 6.78 51.08 22.25 9.31 11.30 24.78 26.05 0.13 4.42 1.76 29 Q C C 78.49 11.61 15.29 27.03 99.79 67.99 -79.29 -12.33 51.02 11.03 37.95 26.97 11.45 13.56 22.40 14.89 0.34 7.13 3.26 30 H C C 118.82 5.80 16.11 22.93 102.09 62.95 -88.83 16.81 66.33 9.66 24.01 36.40 13.77 16.79 14.00 9.63 0.10 6.32 2.99 31 S C C 54.98 9.29 13.55 23.71 109.39 101.89 -93.49 91.41 79.66 6.66 13.68 37.32 18.10 25.48 6.30 6.52 0.03 4.14 2.11 32 N C T 104.73 4.99 17.03 22.91 100.31 -117.45 -85.00 28.66 89.91 3.74 6.35 24.55 28.43 37.68 1.68 4.18 0.00 2.44 1.03 33 G C S 31.02 9.98 16.58 27.07 106.41 -77.07 90.57 3.41 88.28 9.78 1.93 23.40 40.05 25.07 0.22 1.76 0.00 8.56 0.95 34 Y C E 79.71 12.19 18.85 31.35 115.25 117.87 -97.45 130.16 54.52 44.93 0.56 40.70 11.58 2.32 0.10 0.52 0.00 43.20 1.58 35 V E E 24.74 19.30 18.86 37.76 118.20 -166.77 -109.00 130.07 22.61 77.31 0.08 19.21 2.55 0.27 0.02 0.06 0.00 77.38 0.52 36 H E E 37.06 14.84 24.89 39.81 129.54 145.86 -126.03 146.44 4.78 95.20 0.01 4.22 0.32 0.02 0.00 0.01 0.00 95.31 0.13 37 L E E 4.51 25.54 20.52 46.47 122.42 -156.54 -115.44 132.91 1.24 98.76 0.00 1.10 0.06 0.00 0.00 0.00 0.00 98.82 0.02 38 D E E 28.88 14.68 27.19 41.90 123.54 -166.68 -115.65 136.99 0.58 99.42 0.00 0.53 0.02 0.00 0.00 0.00 0.00 99.45 0.00 39 W E E 8.43 24.60 20.78 45.46 126.40 -165.78 -117.71 141.31 0.41 99.59 0.00 0.39 0.01 0.00 0.00 0.00 0.00 99.60 0.00 40 Y E E 29.51 15.24 25.06 40.55 132.52 -174.96 -132.45 150.25 0.24 99.76 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.77 0.01 41 R E E 37.51 17.56 20.89 38.29 120.30 -146.85 -108.94 132.80 1.19 98.81 0.00 0.99 0.06 0.00 0.00 0.00 0.00 98.91 0.03 42 Q E E 45.98 13.62 17.05 31.48 122.37 -163.28 -113.67 137.19 19.77 80.22 0.01 18.04 1.03 0.04 0.00 0.01 0.00 80.08 0.80 43 K C C 91.39 7.26 16.07 24.53 118.47 -133.62 -83.08 148.05 97.00 2.96 0.03 95.10 1.94 0.19 0.01 0.03 0.00 2.38 0.37 44 P C T 95.90 5.42 11.74 19.04 109.60 -86.30 -58.78 134.74 99.76 0.06 0.18 0.24 3.03 96.51 0.00 0.16 0.00 0.04 0.01 45 G C T 69.39 0.26 13.38 10.65 94.53 18.65 83.84 -2.97 99.78 0.05 0.17 0.35 2.91 96.52 0.00 0.18 0.00 0.03 0.01 46 Q C S 87.06 5.65 9.73 17.50 129.59 96.90 -113.84 160.48 94.73 5.05 0.22 41.65 52.38 0.76 0.05 0.17 0.00 1.63 3.37 47 S C C 81.90 1.66 17.20 18.43 117.05 -97.62 -70.25 150.38 97.76 2.22 0.02 87.47 10.31 0.16 0.00 0.02 0.00 1.74 0.30 48 P C C 49.99 17.14 11.26 27.65 114.90 -95.84 -65.12 144.36 94.30 5.69 0.01 91.54 2.51 0.11 0.00 0.02 0.00 5.65 0.17 49 H E E 85.51 8.60 20.57 29.92 123.98 -160.49 -120.53 137.51 9.36 90.62 0.02 8.33 0.80 0.05 0.01 0.01 0.00 90.28 0.52 50 L E E 64.28 15.05 18.41 33.19 110.62 -116.80 -75.20 125.76 0.65 99.35 0.00 0.61 0.02 0.00 0.00 0.00 0.00 99.36 0.02 51 L E E 22.60 18.19 20.51 38.78 101.62 175.77 -95.92 -36.06 1.97 98.03 0.00 1.37 0.47 0.01 0.00 0.00 0.00 98.14 0.01 52 I E E 13.69 20.23 21.56 41.74 137.48 3.39 -149.56 143.01 0.17 99.83 0.00 0.15 0.01 0.00 0.00 0.00 0.00 99.84 0.00 53 Y E E 62.85 16.92 23.30 39.13 124.11 -168.82 -125.53 130.52 0.40 99.59 0.00 0.36 0.01 0.00 0.00 0.00 0.00 99.61 0.01 54 L E E 22.52 19.20 21.26 39.87 121.17 -170.05 -115.81 131.32 12.14 87.72 0.14 9.60 1.83 0.31 0.04 0.07 0.00 87.87 0.26 55 G C E 17.14 14.64 21.75 35.97 134.14 102.33 147.13 167.32 50.89 48.21 0.90 28.83 18.51 4.73 0.16 0.72 0.00 46.24 0.80 56 F C C 79.90 13.07 18.97 31.86 116.81 -101.06 -106.43 137.07 70.76 25.10 4.14 37.30 23.82 11.46 1.10 2.87 0.02 20.96 2.46 57 N C C 86.00 9.05 18.34 27.72 106.74 -135.96 -96.05 78.60 77.16 15.47 7.37 40.86 22.44 15.26 2.39 4.76 0.03 10.83 3.42 58 R C C 107.43 10.75 14.89 26.06 113.55 139.53 -97.18 126.83 76.18 12.96 10.86 47.91 16.06 12.60 3.59 7.17 0.02 8.44 4.20 59 A C C 60.07 9.07 14.37 24.15 107.81 -122.68 -80.58 112.68 77.15 9.01 13.84 38.73 17.07 22.37 3.09 10.18 0.02 5.34 3.20 60 S C T 74.94 5.49 15.10 21.77 107.70 -99.46 -84.15 96.87 83.03 5.06 11.92 19.21 20.74 43.75 2.15 9.17 0.02 3.06 1.89 61 G C T 49.19 5.09 16.78 22.86 103.23 -45.97 85.52 0.95 87.82 6.66 5.52 24.92 28.14 35.45 0.75 4.78 0.00 4.28 1.68 62 V C C 43.83 15.34 11.85 27.36 116.07 114.48 -99.15 128.38 84.53 14.72 0.74 58.58 24.56 1.82 0.27 0.53 0.00 7.88 6.36 63 P C C 62.02 8.93 16.74 26.75 109.99 -118.38 -67.35 149.16 85.89 10.09 4.01 61.37 12.72 11.40 0.93 3.43 0.00 7.79 2.34 64 D C C 88.29 9.36 17.20 26.96 100.33 -111.34 -79.60 3.79 85.53 8.62 5.86 40.04 25.16 20.99 0.83 5.26 0.01 6.46 1.24 65 R C C 101.23 10.77 19.67 30.50 111.43 82.07 -104.48 80.32 68.62 25.45 5.93 34.47 23.00 12.44 1.07 4.60 0.01 22.96 1.45 66 F E E 31.03 22.42 14.24 35.83 123.35 113.58 -112.13 138.67 24.07 74.84 1.09 19.42 4.30 1.07 0.52 0.64 0.00 71.74 2.31 67 S E E 53.83 7.90 23.82 32.76 133.26 -171.71 -135.52 153.92 12.09 87.65 0.27 10.56 1.23 0.29 0.14 0.12 0.00 86.12 1.54 68 G E E 23.54 17.81 16.48 33.12 139.93 166.47 -157.49 168.27 16.48 83.34 0.18 13.76 2.36 0.54 0.06 0.12 0.00 82.17 0.99 69 G E E 35.96 7.67 21.14 30.10 137.61 -155.31 -153.27 169.08 27.17 72.61 0.22 22.29 4.23 0.83 0.06 0.18 0.00 71.40 1.02 70 G E E 31.48 10.34 16.83 27.98 137.57 146.79 149.54 175.98 45.22 54.43 0.35 31.11 12.91 2.58 0.06 0.37 0.00 51.04 1.92 71 S C E 73.42 4.48 20.93 26.08 112.27 -103.81 -109.09 71.34 59.41 39.02 1.58 26.97 23.20 11.80 0.22 1.66 0.01 31.78 4.36 72 G C S 30.87 11.83 18.59 30.06 107.65 -56.53 70.16 -119.13 96.54 1.97 1.48 4.40 48.37 43.93 0.05 1.56 0.00 1.38 0.32 73 T C S 57.98 13.70 17.57 31.01 99.43 -10.39 -100.55 -4.46 95.73 3.01 1.26 4.78 50.42 40.79 0.05 1.26 0.00 2.33 0.37 74 D E E 63.33 8.53 22.63 32.19 118.84 84.83 -107.49 129.59 43.72 55.83 0.44 28.05 14.63 2.46 0.08 0.49 0.00 50.26 4.03 75 F E E 8.83 24.70 16.11 41.08 128.83 -174.44 -128.34 143.26 30.36 69.62 0.02 28.13 1.14 0.10 0.00 0.02 0.00 69.83 0.78 76 T E E 34.05 10.74 27.30 39.05 124.94 -164.08 -122.54 137.30 12.01 87.98 0.00 10.91 0.39 0.02 0.00 0.00 0.00 88.53 0.15 77 L E E 3.18 26.23 18.97 46.06 119.71 -162.10 -111.86 128.95 1.10 98.90 0.00 1.16 0.02 0.00 0.00 0.00 0.00 98.79 0.03 78 K E E 76.81 9.51 27.44 37.47 118.49 -162.37 -113.95 126.38 0.34 99.66 0.00 0.40 0.00 0.00 0.00 0.00 0.00 99.57 0.03 79 I E E 6.96 24.58 16.28 41.46 117.30 -168.41 -113.86 122.79 5.10 94.90 0.00 5.43 0.04 0.00 0.00 0.00 0.00 93.50 1.03 80 S C S 45.15 7.27 23.30 30.78 127.85 -173.67 -110.74 155.97 93.20 6.77 0.03 42.46 47.62 2.10 0.00 0.05 0.00 7.59 0.19 81 R C S 145.76 3.56 23.92 27.51 95.88 10.52 58.00 56.74 98.69 1.30 0.01 7.00 89.61 2.15 0.00 0.01 0.00 1.14 0.09 82 V C C 11.44 24.72 10.28 34.72 114.93 -156.67 -76.53 134.76 99.17 0.83 0.01 98.61 0.79 0.01 0.00 0.00 0.00 0.36 0.22 83 E C C 82.87 4.49 25.00 29.12 132.59 -173.33 -125.37 162.65 98.33 1.64 0.03 98.61 0.22 0.01 0.01 0.01 0.00 0.26 0.89 84 A H G 52.02 14.10 15.23 29.22 91.13 -101.35 -58.95 -32.55 2.45 0.02 97.53 0.14 0.17 1.55 0.23 97.89 0.00 0.01 0.00 85 E H G 128.45 3.33 21.97 25.89 89.98 62.87 -70.45 -16.90 2.14 0.02 97.84 0.08 0.13 1.44 0.16 98.18 0.00 0.02 0.00 86 D H G 11.98 21.50 16.62 38.52 93.02 62.97 -86.23 -5.04 3.03 0.03 96.94 0.33 0.27 1.45 0.20 97.72 0.00 0.03 0.00 87 V C C 33.54 17.68 19.67 37.46 115.50 110.13 -72.67 138.30 97.19 2.79 0.02 95.44 1.92 0.05 0.00 0.02 0.00 2.47 0.10 88 G E E 10.59 11.42 24.38 37.68 142.19 83.13 153.93 -169.02 2.90 97.10 0.00 2.51 0.30 0.01 0.00 0.00 0.00 96.99 0.19 89 V E E 31.80 15.62 25.22 40.88 119.90 -44.29 -107.16 133.59 0.27 99.73 0.00 0.26 0.00 0.00 0.00 0.00 0.00 99.74 0.00 90 Y E E 6.66 25.10 21.70 46.81 122.54 -165.01 -115.02 137.34 0.16 99.84 0.00 0.14 0.00 0.00 0.00 0.00 0.00 99.85 0.00 91 Y E E 22.20 19.22 27.63 46.04 129.44 -170.88 -125.03 144.61 0.28 99.72 0.00 0.25 0.01 0.00 0.00 0.00 0.00 99.74 0.00 92 C E E 2.45 25.42 23.99 49.27 124.50 -160.65 -118.54 138.85 1.00 99.00 0.00 0.87 0.03 0.00 0.00 0.00 0.00 99.09 0.01 93 M E E 19.61 18.56 26.32 44.19 127.79 -169.84 -123.06 143.17 0.98 99.02 0.00 0.89 0.03 0.00 0.00 0.00 0.00 99.04 0.04 94 Q E E 27.23 18.88 21.68 39.93 125.51 -163.61 -117.62 139.66 5.65 94.33 0.02 4.85 0.49 0.04 0.00 0.01 0.00 94.31 0.29 95 G E E 14.01 14.08 18.65 33.29 123.40 -156.63 -114.54 149.67 42.68 57.21 0.11 37.46 3.62 0.44 0.02 0.10 0.00 57.34 1.01 96 L C S 82.20 9.95 15.98 26.47 102.59 -150.77 -86.64 -19.97 87.57 11.55 0.88 15.05 48.71 23.90 0.08 0.90 0.00 10.33 1.03 97 Q C S 125.21 2.82 16.97 20.21 105.10 23.16 -97.78 -24.33 97.35 1.82 0.83 7.99 60.13 29.33 0.05 0.82 0.00 1.30 0.36 98 T C S 78.95 4.66 14.37 20.45 120.06 8.91 -123.16 130.55 94.86 4.45 0.69 16.33 68.96 9.67 0.06 0.71 0.00 3.54 0.72 99 P C C 79.53 5.70 17.52 23.99 114.26 -85.86 -67.65 148.73 84.45 15.11 0.44 50.56 26.60 6.30 0.05 0.49 0.00 15.33 0.67 100 F C E 67.25 17.45 13.69 30.38 115.14 -113.79 -82.24 134.87 51.25 48.58 0.17 44.38 3.98 0.74 0.02 0.15 0.00 50.22 0.50 101 T E E 52.86 10.35 22.42 33.11 129.06 -173.30 -128.80 143.33 6.67 93.30 0.03 5.98 0.47 0.07 0.01 0.02 0.00 91.53 1.93 102 F E E 51.66 20.14 16.85 35.97 118.99 -144.53 -101.14 134.71 9.18 90.79 0.03 8.30 0.61 0.06 0.01 0.02 0.00 88.25 2.75 103 G C C 15.20 13.75 18.51 32.69 125.42 -133.85 -82.34 172.72 67.79 32.17 0.04 56.59 8.58 0.44 0.01 0.05 0.00 33.86 0.49 104 P C C 89.41 4.94 23.16 28.41 109.59 -69.97 -69.10 144.24 81.04 18.91 0.06 64.95 13.25 0.73 0.00 0.06 0.00 20.70 0.30 105 G C C 17.04 19.70 15.65 33.85 129.11 -131.24 -92.92 173.31 63.94 36.02 0.04 58.24 3.20 0.20 0.00 0.04 0.00 37.93 0.40 106 T E E 32.04 15.10 20.14 35.58 126.89 -113.12 -121.30 143.12 4.90 95.09 0.00 4.62 0.16 0.01 0.00 0.00 0.00 95.05 0.17 107 T E E 66.60 10.39 22.90 33.36 119.64 -138.06 -98.50 133.41 0.62 99.38 0.00 0.58 0.02 0.00 0.00 0.00 0.00 99.37 0.02 108 V E E 12.04 22.52 14.62 37.16 121.62 -164.58 -116.00 132.93 0.91 99.09 0.00 0.89 0.02 0.00 0.00 0.00 0.00 99.07 0.02 109 D E E 76.89 5.61 23.31 29.37 117.13 -154.86 -104.59 127.96 2.72 97.27 0.01 2.68 0.08 0.01 0.00 0.00 0.00 97.08 0.15 110 L E E 30.20 20.51 10.84 30.38 114.08 -154.85 -96.19 126.30 29.23 70.72 0.05 29.61 0.25 0.05 0.02 0.02 0.00 69.02 1.03 111 K C C 136.33 3.45 19.44 23.64 112.52 -149.34 -89.84 128.80 99.65 0.35 0.00 99.66 0.05 0.02 0.00 0.00 0.00 0.26 0.01