A0A3Q0KQ17_SCHMA Loading...

Odd-skipped-related

AlphaFold DB , UniProt , Accession A0A3Q0KQ17, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 588 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.4	Very low	32.5	Very low	234 Å²	234	157.3 Å²	157.3	100%	1.153	80%	0.795	S	S	*	*				0	96.3	0	-66.4	166.1	175.3	0	0	105.9
2	L	31.4	Very low	32.1	Very low	162 Å²	162	155.9 Å²	155.9	85%	0.848	79%	0.792	S	S	*	*				68.8	88.5	82.3	-68.6	177.3	0	0	0	112.2
3	F	38.2	Very low	32.2	Very low	209 Å²	209	156.7 Å²	156.7	92%	0.917	80%	0.799	S	S	*	*				-162.7	139.9	109.6	-108.2	-75	0	0	0	111.1
4	Q	35	Very low	31.7	Very low	151 Å²	151	154.9 Å²	154.9	71%	0.706	80%	0.799	S	S	*	*			trans	-136.4	155.1	166.6	-91.6	-98.4	-32.6	0	0	105.2
5	P	34.3	Very low	31.3	Very low	123 Å²	123	154.2 Å²	154.2	80%	0.799	80%	0.796	S	S	*	*				-140.8	138.6	103.6	33.2	-18.4	0	0	0	114.9
6	T	30.7	Very low	31.2	Very low	102 Å²	102	155.6 Å²	155.6	63%	0.626	80%	0.797	S	S	*	*			trans	-44.1	151.4	158.2	49.8	0	0	0	0	114.8
7	F	33	Very low	31.1	Very low	211 Å²	211	152.8 Å²	152.8	93%	0.925	78%	0.784	S	S	*	*			trans	-138.9	138.9	134.1	-117.2	-82	0	0	0	112
8	N	30.7	Very low	30.8	Very low	131 Å²	131	153.9 Å²	153.9	70%	0.701	79%	0.792	S	S	*	*			trans	-77.5	169.4	177.7	-87.2	-18.1	0	0	0	111
9	N	29.6	Very low	30.6	Very low	115 Å²	115	152.7 Å²	152.7	62%	0.615	79%	0.785	S	S	*	*			cis	-157.3	166.9	16.1	-141.6	-13.5	0	0	0	114.7
10	Q	30.7	Very low	30.6	Very low	154 Å²	154	152.8 Å²	152.8	72%	0.72	78%	0.784	S	S	*	*			trans	72.9	133.4	147.3	-82.5	160.1	-9.4	0	0	122.7
11	N	31.2	Very low	30.3	Very low	138 Å²	138	153.8 Å²	153.8	74%	0.738	79%	0.791	S	S	*	*			trans	82.5	57.8	154.7	-60.1	-2.8	0	0	0	119.3
12	N	27.2	Very low	29.9	Very low	141 Å²	141	146.8 Å²	146.8	75%	0.754	77%	0.765	S	S	*	*				40.8	96.9	118	-54.9	4	0	0	0	118.1
13	N	33.1	Very low	29.7	Very low	166 Å²	166	145.3 Å²	145.3	89%	0.888	76%	0.763	S	S	*	*				-179.9	84	115.5	-88.5	-13.3	0	0	0	110.5
14	T	25.4	Very low	29.3	Very low	131 Å²	131	142.4 Å²	142.4	80%	0.804	76%	0.757	S	S	*	*			trans	-94.8	173.7	163.8	44.2	0	0	0	0	110.4
15	I	26.6	Very low	28.8	Very low	145 Å²	145	142.3 Å²	142.3	74%	0.744	76%	0.761	S	S	*	*			trans	78.4	83.7	174.1	-44.5	164.4	0	0	0	114.7
16	H	29.7	Very low	28.3	Very low	177 Å²	177	143.4 Å²	143.4	82%	0.819	75%	0.75	S	S	*	*				-154.9	95.3	122.8	-126.9	-30.5	0	0	0	112.5
17	D	29.3	Very low	28.3	Very low	107 Å²	107	146.1 Å²	146.1	57%	0.572	76%	0.761	S	S	*	*			trans	25.9	136.6	146.8	-45.4	-56.4	0	0	0	123.6	I19	D17-I19 HydrophobicContact CB-CD1 3.99Å; D17-I19 PolarHBondContact O-N 2.96Å
18	N	25.7	Very low	27.9	Very low	173 Å²	173	140.7 Å²	140.7	93%	0.925	75%	0.749	S	S	*	*			trans	-70.2	79.8	164.1	-67.1	-70.6	0	0	0	112.8
19	I	27	Very low	27.8	Very low	131 Å²	131	142.1 Å²	142.1	67%	0.672	75%	0.746	S	S	*	*			trans	-133.9	115.1	156.1	-66.8	91.8	0	0	0	109.6	D17	D17-I19 HydrophobicContact CB-CD1 3.99Å; D17-I19 PolarHBondContact O-N 2.96Å
20	M	30.2	Very low	27.7	Very low	154 Å²	154	141.7 Å²	141.7	76%	0.759	75%	0.751	S	S	*	*			trans	174.3	42.4	137.6	-92.8	-56	163.5	0	0	111.9	S22	M20-S22 PolarHBondContact O-N 3.07Å
21	N	24	Very low	27.6	Very low	174 Å²	174	145 Å²	145	93%	0.93	76%	0.763	S	S	*	*			trans	-86.4	46.7	179.2	-156.2	3.3	0	0	0	112.5
22	S	24.5	Very low	27.3	Very low	88 Å²	88	145 Å²	145	62%	0.615	76%	0.763	S	S	*	*			trans	-167.6	91.8	-176.1	53.3	0	0	0	0	114.8	M20	M20-S22 PolarHBondContact O-N 3.07Å
23	T	27.9	Very low	27.5	Very low	130 Å²	130	143.5 Å²	143.5	80%	0.798	76%	0.764	S	S	*	*	S	Bend	trans	-161.3	91.2	144.4	3.8	0	0	0	0	114.1
24	L	29	Very low	27.5	Very low	149 Å²	149	145 Å²	145	78%	0.78	77%	0.765	S	S	*	*			trans	51.4	72.3	145.2	-63.8	168.5	0	0	0	118.6	Y26	L24-Y26 HydrophobicContact CD2-CD2 4.44Å; L24-Y26 PolarHBondContact O-N 3.37Å; L24-Y26 VanDerWaalsContact O-N 3.17Å
25	N	24.9	Very low	27.5	Very low	148 Å²	148	145.8 Å²	145.8	79%	0.791	76%	0.763	S	S	*	*			trans	-53	113.2	148.1	173.8	7.3	0	0	0	109.9
26	Y	25.2	Very low	27.9	Very low	146 Å²	146	148.8 Å²	148.8	57%	0.573	77%	0.771	S	S	*	*			trans	-156.2	73.8	-178.5	-127.5	-84.7	0	0	0	113.8	L24 K436	L24-Y26 HydrophobicContact CD2-CD2 4.44Å; L24-Y26 PolarHBondContact O-N 3.37Å; L24-Y26 VanDerWaalsContact O-N 3.17Å; Y26-K436 VanDerWaalsContact OH-CE 3.28Å; Y26-K436 WeakPolarHBondContact OH-CE 3.41Å; Y26-K436 PolarHBondContact OH-NZ 3.37Å
27	N	28.6	Very low	27.9	Very low	159 Å²	159	145 Å²	145	85%	0.85	76%	0.764	S	S	*	*			trans	-166.8	52.6	154.7	-104.4	-11.6	0	0	0	113.7
28	S	25.7	Very low	27.9	Very low	98 Å²	98	148 Å²	148	69%	0.685	78%	0.779	S	S	*	*			trans	-97.8	120.6	158.3	48.5	0	0	0	0	109.4
29	Y	29.6	Very low	28.2	Very low	161 Å²	161	144.6 Å²	144.6	63%	0.631	77%	0.769	S	S	*	*			trans	-143.6	113.1	169.6	-105.6	-76.6	0	0	0	111.9	K436	Y29-K436 HydrophobicContact CE2-CD 4Å; Y29-K436 WeakPolarHBondContact OH-CD 3.42Å; Y29-K436 PolarHBondContact OH-NZ 3.23Å
30	C	26	Very low	28.5	Very low	106 Å²	106	144.9 Å²	144.9	72%	0.716	77%	0.772	S	S	*	*			trans	45.3	92.1	156.4	-60.1	0	0	0	0	118.9
31	F	28.8	Very low	28.7	Very low	224 Å²	224	144.8 Å²	144.8	98%	0.982	77%	0.77	S	S	*	*				-146.3	96	126.2	-110.3	-75.8	0	0	0	109
32	N	24.9	Very low	29.2	Very low	138 Å²	138	143.5 Å²	143.5	74%	0.738	76%	0.761	S	S	*	*			trans	-156.2	117.3	170	-162.6	0.4	0	0	0	109.2
33	S	30.7	Very low	29.6	Very low	109 Å²	109	143.8 Å²	143.8	76%	0.762	76%	0.763	S	S	*	*			trans	-150.9	143.3	177.7	-76.1	0	0	0	0	108.7
34	Q	33.3	Very low	29.8	Very low	196 Å²	196	144 Å²	144	92%	0.916	76%	0.764	S	S	*	*			trans	68	73	176.8	-55.8	-176.4	-1.9	0	0	115.7
35	I	26.8	Very low	30.1	Very low	149 Å²	149	141.8 Å²	141.8	76%	0.764	76%	0.759	S	S	*	*			trans	-80.8	131.8	143.7	-63.9	173.4	0	0	0	107.4
36	K	33.4	Very low	30.3	Very low	207 Å²	207	142.6 Å²	142.6	90%	0.9	76%	0.763	S	S	*	*			trans	-146.7	128.4	147.8	-153.6	170.4	-173.5	-179.7	0	110.1
37	S	30.7	Very low	30.6	Very low	97 Å²	97	141.4 Å²	141.4	68%	0.678	77%	0.77	S	S	*	*			trans	-88.4	143.5	-178.3	49.3	0	0	0	0	111.7
38	L	30	Very low	30.9	Very low	170 Å²	170	138 Å²	138	89%	0.89	76%	0.759	S	S	*	*				-157.5	134.4	120.9	-134	69.4	0	0	0	110.2
39	S	30.2	Very low	31.3	Very low	102 Å²	102	140 Å²	140	71%	0.713	76%	0.762	S	S	*	*			trans	-114.8	132.9	161.2	53.6	0	0	0	0	106.9
40	D	34.1	Very low	31.6	Very low	137 Å²	137	140.2 Å²	140.2	73%	0.733	77%	0.774	S	S	*	*			trans	-166.1	128.3	144.8	-105.7	-30.3	0	0	0	113.7
41	Q	35.4	Very low	31.9	Very low	153 Å²	153	139.9 Å²	139.9	72%	0.715	78%	0.779	S	S	*	*			trans	76	143.3	137.4	-69	175.8	51	0	0	124.3
42	I	33.1	Very low	32.3	Very low	146 Å²	146	133.1 Å²	133.1	75%	0.749	77%	0.765	S	S	*	*			trans	84.8	78.5	156.3	-60	145	0	0	0	119.5
43	S	33.2	Very low	32.7	Very low	94 Å²	94	134.5 Å²	134.5	66%	0.657	77%	0.771	S	S	*	*				56.8	99.3	110	-50.4	0	0	0	0	125.1
44	T	32.3	Very low	32.8	Very low	134 Å²	134	133.9 Å²	133.9	82%	0.822	77%	0.767	S	S	*	*				69.1	171.9	121.4	64.4	0	0	0	0	120
45	P	34.5	Very low	32.8	Very low	103 Å²	103	129.9 Å²	129.9	67%	0.669	76%	0.761	S	S	*	*				-142.3	-162.7	-104.3	34.5	-6.7	0	0	0	116.9
46	L	29.1	Very low	33	Very low	166 Å²	166	126.9 Å²	126.9	87%	0.869	76%	0.758	S	S	*	*			trans	75.7	156.1	167.6	-48.7	168.5	0	0	0	115.4
47	T	33.1	Very low	33.1	Very low	120 Å²	120	122.3 Å²	122.3	74%	0.736	75%	0.752	S	S	*	*			cis	-123.9	164.2	4.5	52	0	0	0	0	110.8
48	S	33.6	Very low	33.2	Very low	88 Å²	88	125.4 Å²	125.4	62%	0.615	76%	0.756	S	S	*	*				61.6	133.5	63.8	125.4	0	0	0	0	113.2
49	D	34.3	Very low	33.3	Very low	140 Å²	140	126.4 Å²	126.4	75%	0.749	75%	0.749	S	S	*	*			cis	-155.4	-166.5	8	-90.3	-43.7	0	0	0	113.7
50	D	35.2	Very low	33.4	Very low	166 Å²	166	127.5 Å²	127.5	89%	0.888	75%	0.752	S	S	*	*			trans	105.9	151.7	154.3	-71.2	-33.6	0	0	0	122.4
51	A	33.6	Very low	33.3	Very low	98 Å²	98	125.9 Å²	125.9	81%	0.81	75%	0.751	S	S	*	*			trans	-155.1	171.7	-163.6	0	0	0	0	0	112.8
52	A	35.8	Very low	33.3	Very low	83 Å²	83	124.6 Å²	124.6	69%	0.686	75%	0.754	S	S	*	*			trans	160.6	140.4	139.4	0	0	0	0	0	115.6
53	L	34.4	Very low	33.3	Very low	166 Å²	166	123 Å²	123	87%	0.869	75%	0.753	S	S	*	*			trans	57.8	156.4	142.6	-87.7	65.4	0	0	0	120.7
54	S	31.8	Very low	33.3	Very low	96 Å²	96	126.2 Å²	126.2	67%	0.671	76%	0.761	S	S	*	*			cis	-169.8	170.9	-25.6	-140.2	0	0	0	0	112.2
55	S	34.4	Very low	33.3	Very low	113 Å²	113	126.4 Å²	126.4	79%	0.79	76%	0.757	S	S	*	*			trans	69.9	157.1	151.8	76	0	0	0	0	120
56	A	31.3	Very low	33	Very low	85 Å²	85	129.1 Å²	129.1	70%	0.702	76%	0.758	S	S	*	*			cis	-172.6	173.3	-28.2	0	0	0	0	0	111.4
57	S	34.8	Very low	33.2	Very low	111 Å²	111	129 Å²	129	78%	0.776	75%	0.753	S	S	*	*			trans	76.6	159.7	160.2	78.5	0	0	0	0	119.8
58	Q	32.7	Very low	33.1	Very low	163 Å²	163	128.7 Å²	128.7	76%	0.762	75%	0.746	S	S	*	*				-167.5	-172.3	-57.5	-114.5	175.7	13.7	0	0	110.9
59	Y	33.3	Very low	32.9	Very low	191 Å²	191	130.7 Å²	130.7	75%	0.749	75%	0.75	S	S	*	*			trans	79.5	105.9	173.2	-56.3	-76.4	0	0	0	116.1
60	T	30.6	Very low	32.8	Very low	125 Å²	125	134 Å²	134	77%	0.767	75%	0.752	S	S	*	*				70.2	138.8	72.4	63.7	0	0	0	0	114.4
61	S	32.7	Very low	32.5	Very low	102 Å²	102	130.4 Å²	130.4	71%	0.713	74%	0.736	S	S	*	*			cis	-162.9	-176.1	-1.8	48.1	0	0	0	0	108.5
62	T	34.5	Very low	32.5	Very low	127 Å²	127	132.9 Å²	132.9	78%	0.779	74%	0.736	S	S	*	*			cis	-157.3	167.2	12.6	-11.1	0	0	0	0	109.2
63	P	35.1	Very low	32.1	Very low	113 Å²	113	134.3 Å²	134.3	73%	0.734	73%	0.732	S	S	*	*			trans	-115.5	-176.3	-167.3	44	-36.4	0	0	0	116
64	I	32.2	Very low	32	Very low	160 Å²	160	134.4 Å²	134.4	82%	0.821	73%	0.726	S	S	*	*			trans	165.9	134.3	150.6	-87.8	153.6	0	0	0	105.6
65	N	32.2	Very low	31.8	Very low	138 Å²	138	135 Å²	135	74%	0.738	73%	0.73	S	S	*	*			cis	-146	174.7	30.1	-139.2	-19.5	0	0	0	113.6
66	F	28.3	Very low	31.6	Very low	160 Å²	160	137.9 Å²	137.9	70%	0.702	74%	0.737	S	S	*	*			trans	-64.5	163.4	-177.2	-66.6	-103.9	0	0	0	114.4	L68	F66-L68 HydrophobicContact CD1-CD1 3.93Å; F66-L68 HydrophobicContact CD1-CG 4.36Å; F66-L68 HydrophobicContact CE1-CD1 4.44Å
67	H	34	Very low	31.3	Very low	165 Å²	165	143 Å²	143	76%	0.764	74%	0.738	S	S	*	*			cis	-134.7	140.9	24.5	-89.6	-107.4	0	0	0	111.3
68	L	30.7	Very low	31	Very low	112 Å²	112	143.1 Å²	143.1	59%	0.586	74%	0.736	S	S	*	*				47.9	115.6	83	-57.1	172.7	0	0	0	112.7	F66	F66-L68 HydrophobicContact CD1-CD1 3.93Å; F66-L68 HydrophobicContact CD1-CG 4.36Å; F66-L68 HydrophobicContact CE1-CD1 4.44Å
69	N	29.9	Very low	30.6	Very low	130 Å²	130	139.6 Å²	139.6	70%	0.695	73%	0.725	S	S	*	*			cis	-164.6	167.2	15.2	-94.1	-36.3	0	0	0	108.1
70	R	31	Very low	30.4	Very low	210 Å²	210	141.1 Å²	141.1	79%	0.792	73%	0.731	S	S	*	*			cis	-160.7	161.6	4.5	-130.9	-175	-178.8	171.2	-0.3	111.5
71	T	28.9	Very low	30	Very low	90 Å²	90	140 Å²	140	55%	0.552	73%	0.728	S	S	*	*			trans	6.9	138.3	143.9	57.5	0	0	0	0	120.3
72	N	33.3	Very low	29.8	Very low	150 Å²	150	140.6 Å²	140.6	80%	0.802	73%	0.733	S	S	*	*			cis	-147.6	178.4	21.8	-62.5	-68.2	0	0	0	111
73	D	29	Very low	29.5	Very low	114 Å²	114	138.9 Å²	138.9	61%	0.61	73%	0.726	S	S	*	*				-163.7	167.7	-64.9	-120.7	-22.4	0	0	0	110.3
74	F	30.5	Very low	29.2	Very low	168 Å²	168	139.7 Å²	139.7	74%	0.737	73%	0.729	S	S	*	*			trans	5.5	117.6	172.9	-58.8	-82.5	0	0	0	119.4
75	S	28	Very low	28.9	Very low	108 Å²	108	136.9 Å²	136.9	76%	0.755	72%	0.724	S	S	*	*				54.5	102.6	65.8	-61.7	0	0	0	0	114.8
76	N	29.8	Very low	28.8	Very low	174 Å²	174	135.5 Å²	135.5	93%	0.93	72%	0.722	S	S	*	*			trans	-149.3	132.9	154.9	-120.6	-28	0	0	0	111
77	R	25.3	Very low	28.9	Very low	193 Å²	193	135.7 Å²	135.7	73%	0.728	73%	0.731	S	S	*	*			trans	-140.5	125.1	-176.9	176.2	-164.9	-170.3	-122.3	12.1	109.3	T79	R77-T79 VanDerWaalsContact CZ-CG2 3.45Å; R77-T79 PolarHBondContact NH1-OG1 3.18Å; R77-T79 VanDerWaalsContact NH2-CG2 3.3Å
78	P	28.6	Very low	28.5	Very low	113 Å²	113	133.8 Å²	133.8	73%	0.734	72%	0.724	S	S	*	*			trans	-99.5	122.7	154.2	-0.9	21.2	0	0	0	109.5	Y80	P78-Y80 HydrophobicContact CB-CD2 4.48Å
79	T	24.4	Very low	28.4	Very low	89 Å²	89	135.2 Å²	135.2	55%	0.546	73%	0.733	S	S	.	*			trans	-85.4	128.7	150.6	11.8	0	0	0	0	107.8	R77	R77-T79 VanDerWaalsContact CZ-CG2 3.45Å; R77-T79 PolarHBondContact NH1-OG1 3.18Å; R77-T79 VanDerWaalsContact NH2-CG2 3.3Å
80	Y	29.4	Very low	28.6	Very low	223 Å²	223	136 Å²	136	88%	0.875	73%	0.73	S	S	*	*			trans	-122	135.7	150.1	-87.4	-84.2	0	0	0	108.7	P78	P78-Y80 HydrophobicContact CB-CD2 4.48Å
81	S	23	Very low	28.7	Very low	100 Å²	100	135 Å²	135	70%	0.699	73%	0.727	S	S	*	*			trans	-116.2	-179.7	171.9	53.6	0	0	0	0	108.1
82	S	28.6	Very low	28.7	Very low	116 Å²	116	137.2 Å²	137.2	81%	0.811	74%	0.736	S	S	*	*			trans	72.7	150.5	-172.7	84	0	0	0	0	113.5
83	S	27.3	Very low	28.7	Very low	90 Å²	90	137.3 Å²	137.3	63%	0.629	74%	0.735	S	S	*	*			cis	-173.1	150.6	-24.4	44.4	0	0	0	0	109.6
84	T	28.5	Very low	28.9	Very low	130 Å²	130	137.9 Å²	137.9	80%	0.798	74%	0.738	S	S	*	*			trans	60.7	154.1	158.6	48.8	0	0	0	0	117.1
85	S	26.1	Very low	29	Very low	102 Å²	102	137.3 Å²	137.3	71%	0.713	74%	0.738	S	S	*	*			cis	-153	169	-6.9	-112.4	0	0	0	0	109
86	P	30.4	Very low	29.1	Very low	109 Å²	109	138.4 Å²	138.4	71%	0.708	73%	0.734	S	S	*	*			trans	-76.5	166	-174.2	33.2	-37.3	0	0	0	113.2
87	N	30.7	Very low	29.2	Very low	164 Å²	164	136 Å²	136	88%	0.877	72%	0.72	S	S	*	*			trans	-140.3	149.8	162.6	-143.3	-22.1	0	0	0	111.3
88	I	25.8	Very low	29.5	Very low	124 Å²	124	134 Å²	134	64%	0.636	72%	0.724	S	S	*	*			trans	-138	164.4	-158.8	-67	174.6	0	0	0	109.9
89	N	28.1	Very low	29.6	Very low	142 Å²	142	137.7 Å²	137.7	76%	0.759	73%	0.728	S	S	*	*			trans	77.7	158.7	-179	-54	-47	0	0	0	113.7
90	K	33.3	Very low	30.1	Very low	146 Å²	146	138.7 Å²	138.7	64%	0.635	74%	0.737	S	S	*	*			cis	-155.9	155.8	17.9	-145.5	167.8	168.8	-156.9	0	107.2
91	Y	34.1	Very low	30.3	Very low	189 Å²	189	133.4 Å²	133.4	74%	0.741	73%	0.732	S	S	*	*			cis	-146	162	31	-81.2	-98.6	0	0	0	112.2
92	D	29.6	Very low	30.5	Very low	138 Å²	138	135.9 Å²	135.9	74%	0.738	74%	0.737	S	S	*	*			trans	-95.7	-159.5	179.2	-52.7	-83.8	0	0	0	114
93	I	33	Very low	30.5	Very low	151 Å²	151	137 Å²	137	77%	0.774	73%	0.734	S	S	*	*			trans	90.4	123.4	168.7	-54.7	166.8	0	0	0	115.7
94	D	32.1	Very low	30.4	Very low	126 Å²	126	137.3 Å²	137.3	67%	0.674	74%	0.736	S	S	*	*			cis	-159.2	159.5	-21.8	-103.7	-25.9	0	0	0	111.2
95	E	32.9	Very low	30.5	Very low	156 Å²	156	140.7 Å²	140.7	73%	0.729	74%	0.74	S	S	*	*			trans	16.6	147.5	131	-102	-165.5	141	0	0	120.6
96	I	31.1	Very low	30.4	Very low	131 Å²	131	144.3 Å²	144.3	67%	0.672	75%	0.745	S	S	*	*			cis	-164.6	165.2	46.4	-121.8	165.2	0	0	0	112
97	L	31.1	Very low	30.4	Very low	124 Å²	124	145 Å²	145	65%	0.649	75%	0.753	S	S	*	*			trans	-7	141.6	167.6	-69.1	72	0	0	0	119.6
98	N	32.1	Very low	30.1	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	75%	0.751	S	S	*	*				-169.7	168.2	63.2	-112.7	-40.6	0	0	0	116.2
99	K	31.1	Very low	30.4	Very low	191 Å²	191	142.1 Å²	142.1	83%	0.83	76%	0.756	S	S	*	*			trans	-141.8	-167.5	177.7	-105.8	-176	178.6	176.7	0	108
100	P	33.9	Very low	30.4	Very low	111 Å²	111	143.1 Å²	143.1	72%	0.721	76%	0.762	S	S	*	*				-133.2	173.1	-56.3	40.2	-25	0	0	0	113.7
101	S	33.4	Very low	30.4	Very low	111 Å²	111	143.9 Å²	143.9	78%	0.776	77%	0.773	S	S	*	*			trans	-165.8	130.5	150	53.2	0	0	0	0	110.3
102	L	26.4	Very low	30.1	Very low	152 Å²	152	139.4 Å²	139.4	80%	0.796	77%	0.769	S	S	*	*			cis	89.9	149.3	48.1	-100.2	162	0	0	0	115
103	N	30.1	Very low	30.1	Very low	141 Å²	141	140.5 Å²	140.5	75%	0.754	77%	0.772	S	S	*	*			trans	69.9	119.8	-170.9	-49.2	-13.9	0	0	0	113.2
104	S	24.3	Very low	30.1	Very low	95 Å²	95	140.2 Å²	140.2	66%	0.664	77%	0.77	S	S	*	*			cis	70.8	113.7	21.1	91	0	0	0	0	116.5
105	F	30	Very low	30	Very low	202 Å²	202	138.2 Å²	138.2	89%	0.886	77%	0.766	S	S	*	*			trans	-161.6	159.1	134.4	-110.8	-72.5	0	0	0	110.7
106	Q	25.8	Very low	30	Very low	178 Å²	178	137.8 Å²	137.8	83%	0.832	77%	0.767	S	S	*	*			trans	-107.5	149.2	178.2	-56.7	144.9	-96.8	0	0	110.2
107	S	29.7	Very low	29.9	Very low	124 Å²	124	138.9 Å²	138.9	87%	0.867	77%	0.773	S	S	*	*			trans	-175.4	150.3	133.6	52.5	0	0	0	0	111.9
108	S	24.6	Very low	30.1	Very low	118 Å²	118	136.9 Å²	136.9	83%	0.825	78%	0.775	S	S	*	*			trans	-100.3	144.2	173	52.4	0	0	0	0	111.8
109	S	32.4	Very low	30.1	Very low	108 Å²	108	135.8 Å²	135.8	76%	0.755	77%	0.773	S	S	*	*			trans	-162.1	129.8	155.5	50.4	0	0	0	0	109.8
110	D	26.9	Very low	30.3	Very low	164 Å²	164	132.6 Å²	132.6	88%	0.877	77%	0.77	S	S	*	*			trans	-69.8	145.2	163.2	-61.1	-69.4	0	0	0	109.4
111	D	33.4	Very low	30.3	Very low	162 Å²	162	133.2 Å²	133.2	87%	0.866	77%	0.772	S	S	*	*			trans	-150.5	146.6	162.9	-127.7	-31.9	0	0	0	111.9
112	S	28.2	Very low	30.3	Very low	95 Å²	95	134 Å²	134	66%	0.664	77%	0.772	S	S	*	*			trans	-107.3	159	-177.1	68	0	0	0	0	111
113	M	29.6	Very low	30.6	Very low	160 Å²	160	132.5 Å²	132.5	79%	0.788	77%	0.77	S	S	*	*			trans	169	151.2	141.6	-97	-59.2	177.3	0	0	114.6
114	I	32.8	Very low	30.9	Very low	146 Å²	146	131.3 Å²	131.3	75%	0.749	77%	0.768	S	S	*	*			trans	68.1	137.9	142.5	-72.4	165.5	0	0	0	119.3
115	S	30.6	Very low	31.4	Very low	84 Å²	84	131.6 Å²	131.6	59%	0.587	77%	0.765	S	S	*	*			cis	-172	-172.9	-16.6	64.5	0	0	0	0	111.7
116	I	32.3	Very low	31.7	Very low	147 Å²	147	130.1 Å²	130.1	75%	0.754	76%	0.761	S	S	*	*			trans	75.6	112.2	171.7	-53.8	150.7	0	0	0	114.4
117	I	30.2	Very low	32.1	Very low	153 Å²	153	127 Å²	127	79%	0.785	75%	0.754	S	S	*	*			cis	99.5	102.2	22.8	-57.4	170.5	0	0	0	115.2
118	A	33.9	Very low	32.1	Very low	83 Å²	83	126.6 Å²	126.6	69%	0.686	75%	0.747	S	S	*	*			trans	173.3	105.3	141.3	0	0	0	0	0	109
119	T	32.8	Very low	32.4	Very low	127 Å²	127	126.5 Å²	126.5	78%	0.779	74%	0.741	S	S	*	*				48.9	126	86.6	64	0	0	0	0	114.2
120	T	34.9	Very low	32.2	Very low	124 Å²	124	126.8 Å²	126.8	76%	0.761	74%	0.738	S	S	*	*			cis	-148.6	155.7	35	49	0	0	0	0	116.4
121	T	33.7	Very low	32.2	Very low	123 Å²	123	125.2 Å²	125.2	76%	0.755	74%	0.735	S	S	*	*			trans	-10.9	156	150.8	58.7	0	0	0	0	120.2
122	T	34.4	Very low	32.2	Very low	129 Å²	129	122.5 Å²	122.5	79%	0.791	73%	0.729	S	S	*	*			cis	-149	168.1	40.3	47.8	0	0	0	0	116.9
123	T	31.9	Very low	32.3	Very low	120 Å²	120	125 Å²	125	74%	0.736	74%	0.735	S	S	*	*			trans	-53.5	173.1	169.1	49.1	0	0	0	0	116.3
124	T	35.7	Very low	32.4	Very low	116 Å²	116	124.9 Å²	124.9	71%	0.712	74%	0.736	S	S	*	*			cis	-166.8	147.5	47.6	15.2	0	0	0	0	116.2
125	T	35.1	Very low	32.4	Very low	101 Å²	101	123.5 Å²	123.5	62%	0.62	73%	0.734	S	S	*	*			trans	55.3	118.3	141.8	63.3	0	0	0	0	122.3
126	H	36.1	Very low	32.6	Very low	171 Å²	171	126.2 Å²	126.2	79%	0.792	75%	0.746	S	S	*	*				81.3	148.4	93.6	-62.6	-37.7	0	0	0	115.3
127	T	34.2	Very low	32.5	Very low	112 Å²	112	124.8 Å²	124.8	69%	0.687	74%	0.74	S	S	*	*			cis	-165.3	154.3	2	9.6	0	0	0	0	112.5
128	T	30.4	Very low	32.5	Very low	116 Å²	116	125.1 Å²	125.1	71%	0.712	74%	0.738	S	S	*	*			trans	19.2	152.6	141	59.6	0	0	0	0	122.8
129	T	30.1	Very low	32.5	Very low	115 Å²	115	128.2 Å²	128.2	71%	0.706	75%	0.749	S	S	*	*			cis	-174.3	157	3.7	22.5	0	0	0	0	113.7
130	T	28.2	Very low	32.4	Very low	114 Å²	114	129.7 Å²	129.7	70%	0.699	75%	0.752	S	S	*	*			trans	51.8	123.1	144	59	0	0	0	0	125.4
131	T	26.9	Very low	32.3	Very low	132 Å²	132	129.1 Å²	129.1	81%	0.81	75%	0.751	S	S	*	*			trans	43.8	136.2	133.2	65	0	0	0	0	121.5
132	S	33.8	Very low	32.1	Very low	104 Å²	104	129.3 Å²	129.3	73%	0.727	76%	0.757	S	S	*	*				-178.4	138.5	64.1	57.2	0	0	0	0	116.5
133	N	30.2	Very low	31.7	Very low	149 Å²	149	129.6 Å²	129.6	80%	0.797	76%	0.759	S	S	*	*			trans	26	126	139.4	-65.7	3.8	0	0	0	124
134	I	33	Very low	31.5	Very low	157 Å²	157	130.3 Å²	130.3	81%	0.805	76%	0.763	S	S	*	*				147.3	110.3	124.6	-81.7	148	0	0	0	116.1
135	V	31.7	Very low	31.2	Very low	117 Å²	117	130.5 Å²	130.5	71%	0.709	77%	0.766	S	S	*	*			trans	33.8	125.3	136.8	-167.4	0	0	0	0	121.5
136	V	35.2	Very low	30.9	Very low	140 Å²	140	135.1 Å²	135.1	85%	0.848	78%	0.778	S	S	*	*				-166.6	147.6	111.9	149.2	0	0	0	0	111.7
137	N	31.1	Very low	30.5	Very low	118 Å²	118	133.2 Å²	133.2	63%	0.631	77%	0.772	S	S	*	*			trans	-42.5	161.6	-169	-73.3	21.4	0	0	0	124.4
138	E	29	Very low	30.1	Very low	159 Å²	159	135.5 Å²	135.5	74%	0.743	78%	0.78	S	S	*	*			trans	73.5	99.5	139.3	-77.5	160.4	-112.6	0	0	121.9
139	T	33.9	Very low	29.9	Very low	149 Å²	149	135.2 Å²	135.2	91%	0.914	78%	0.779	S	S	*	*				-168.7	155.3	104	18.8	0	0	0	0	112.9
140	N	29.9	Very low	29.8	Very low	158 Å²	158	135.1 Å²	135.1	85%	0.845	78%	0.783	S	S	*	*			trans	-90.7	171.8	177.3	-86.7	-37.6	0	0	0	111.7
141	P	32.7	Very low	29.8	Very low	112 Å²	112	136.6 Å²	136.6	73%	0.727	79%	0.787	S	S	*	*			cis	-136.5	160.4	-34.2	37.2	-21.9	0	0	0	113.3
142	S	29.6	Very low	29.6	Very low	126 Å²	126	137.9 Å²	137.9	88%	0.881	79%	0.788	S	S	*	*			trans	-172.5	147.4	149.2	31.7	0	0	0	0	112.6
143	T	26.1	Very low	29.4	Very low	135 Å²	135	140.6 Å²	140.6	83%	0.828	79%	0.787	S	S	*	*			trans	-107.5	126.8	-176	46.1	0	0	0	0	113.1
144	T	29.2	Very low	29.2	Very low	136 Å²	136	138.4 Å²	138.4	83%	0.834	78%	0.784	S	S	*	*			trans	-141.7	117.8	159	43	0	0	0	0	110.1
145	P	28.2	Very low	29	Very low	120 Å²	120	136.8 Å²	136.8	78%	0.779	78%	0.777	S	S	*	*			trans	-98.9	138	175	34.8	-29.9	0	0	0	111.9
146	F	29.5	Very low	28.6	Very low	197 Å²	197	140 Å²	140	86%	0.864	78%	0.784	S	S	*	*			trans	-106.8	109.4	169.2	-109.1	-86.4	0	0	0	111.2
147	I	28	Very low	28.2	Very low	131 Å²	131	139.8 Å²	139.8	67%	0.672	78%	0.778	S	S	*	*			trans	14.9	122.1	145.8	-50.5	173.9	0	0	0	117	T149	I147-T149 HydrophobicContact CG2-CG2 3.59Å
148	D	26.3	Very low	28.1	Very low	160 Å²	160	140.2 Å²	140.2	86%	0.856	79%	0.785	S	S	*	*			trans	-127.8	149.1	140.1	-157.1	-13.5	0	0	0	108.9
149	T	25.5	Very low	27.8	Very low	111 Å²	111	139.6 Å²	139.6	68%	0.681	79%	0.785	S	S	*	*			trans	-111.9	111.8	-157.3	48.3	0	0	0	0	115.2	I147	I147-T149 HydrophobicContact CG2-CG2 3.59Å
150	S	28	Very low	27.4	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	78%	0.779	S	S	*	*			trans	-143.7	112.1	158.4	54.2	0	0	0	0	111.8	N152	S150-N152 PolarHBondContact O-N 3.34Å
151	N	27.9	Very low	27.1	Very low	145 Å²	145	139.9 Å²	139.9	78%	0.775	77%	0.773	S	S	*	*			trans	-86.1	93.6	-172.2	-85.6	-47.5	0	0	0	112.8	F153	N151-F153 HydrophobicContact CB-CD2 4.28Å; N151-F153 HydrophobicContact CB-CE2 4.39Å; N151-F153 PolarHBondContact O-N 2.94Å
152	N	23.7	Very low	26.7	Very low	159 Å²	159	142.7 Å²	142.7	85%	0.85	78%	0.776	S	S	*	*			trans	-76.5	104.1	164.7	-109.7	-30.1	0	0	0	110.4	S150 S154	S150-N152 PolarHBondContact O-N 3.34Å; N152-S154 PolarHBondContact O-N 3.2Å
153	F	28.7	Very low	26.5	Very low	160 Å²	160	144 Å²	144	70%	0.702	77%	0.772	S	S	*	*			trans	-91.3	81.8	174.5	-98.4	-79.9	0	0	0	112.2	N151	N151-F153 HydrophobicContact CB-CD2 4.28Å; N151-F153 HydrophobicContact CB-CE2 4.39Å; N151-F153 PolarHBondContact O-N 2.94Å
154	S	25.1	Very low	26.3	Very low	103 Å²	103	143.5 Å²	143.5	72%	0.72	77%	0.769	S	S	*	*			trans	-69.4	136.2	157.6	-60.8	0	0	0	0	109.6	N152	N152-S154 PolarHBondContact O-N 3.2Å
155	N	28.9	Very low	26.2	Very low	124 Å²	124	145 Å²	145	66%	0.663	77%	0.771	S	S	*	*			trans	-150.3	93.6	168.8	-117.4	-13.8	0	0	0	110.2
156	E	24.9	Very low	26	Very low	184 Å²	184	149.6 Å²	149.6	86%	0.86	77%	0.773	S	S	*	*			trans	-80.8	135.6	163.9	-60.7	-175	120	0	0	108.9
157	N	25	Very low	25.7	Very low	136 Å²	136	146 Å²	146	73%	0.727	76%	0.763	S	S	*	*			trans	-168.1	83.8	164.7	-105.7	-45.1	0	0	0	111.3
158	V	29.4	Very low	25.9	Very low	127 Å²	127	148.7 Å²	148.7	77%	0.77	77%	0.772	S	S	*	*			trans	-140.6	110.2	158.3	-177.4	0	0	0	0	107.8	Y160	V158-Y160 HydrophobicContact CG1-CD2 3.96Å; V158-Y160 HydrophobicContact CG1-CE2 3.85Å
159	I	24.2	Very low	26	Very low	145 Å²	145	149 Å²	149	74%	0.744	77%	0.771	S	S	*	*			trans	-91.8	130.2	-178.4	-60.2	169.2	0	0	0	109.2
160	Y	24.6	Very low	26	Very low	203 Å²	203	149 Å²	149	80%	0.796	78%	0.775	S	S	*	*			trans	-138.5	148.9	160.4	-83.3	-73.9	0	0	0	109.6	V158	V158-Y160 HydrophobicContact CG1-CD2 3.96Å; V158-Y160 HydrophobicContact CG1-CE2 3.85Å
161	P	24.6	Very low	25.9	Very low	110 Å²	110	152.6 Å²	152.6	71%	0.714	78%	0.78	S	S	*	*			trans	-79.1	138.8	-155.3	29.2	-35.8	0	0	0	114.5
162	Q	23.3	Very low	26	Very low	171 Å²	171	151.5 Å²	151.5	80%	0.799	78%	0.778	S	S	*	*			trans	-77	123.2	161.1	-73	-78.3	-25.7	0	0	108.9
163	I	25.6	Very low	26.1	Very low	154 Å²	154	151.6 Å²	151.6	79%	0.79	78%	0.778	S	S	*	*			trans	-89.6	105.6	168	-65.1	174.1	0	0	0	107.5
164	T	22.7	Very low	26.2	Very low	125 Å²	125	149.3 Å²	149.3	77%	0.767	78%	0.781	S	S	*	*			trans	-81.5	121.1	173.5	49.5	0	0	0	0	110.5
165	L	25.8	Very low	26.4	Very low	168 Å²	168	149.9 Å²	149.9	88%	0.88	79%	0.786	S	S	*	*			trans	-119	127	157.4	-80.2	172.2	0	0	0	108.1
166	R	23.6	Very low	26.6	Very low	216 Å²	216	149.5 Å²	149.5	82%	0.815	79%	0.79	S	S	*	*			trans	-156.6	149.9	-177.8	174.1	162.4	-175	142.6	11.6	110.3
167	D	25	Very low	26.7	Very low	122 Å²	122	146.1 Å²	146.1	65%	0.652	79%	0.786	S	S	*	*			trans	70.8	102.7	171.9	-57.3	-27.6	0	0	0	117.5
168	E	31	Very low	26.9	Very low	186 Å²	186	145 Å²	145	87%	0.869	79%	0.789	S	S	*	*				-157.2	98.4	126.1	-104.7	175	-166.7	0	0	106.6
169	M	28.6	Very low	27.1	Very low	168 Å²	168	143.8 Å²	143.8	83%	0.828	79%	0.786	S	S	*	*				63.9	90.2	96.6	-64	-179.1	99.1	0	0	113.2
170	S	25.4	Very low	27.4	Very low	110 Å²	110	146.2 Å²	146.2	77%	0.769	79%	0.791	S	S	*	*				74.9	110.5	75	-65.8	0	0	0	0	115.9
171	Q	26.8	Very low	27.7	Very low	189 Å²	189	142.6 Å²	142.6	88%	0.883	79%	0.791	S	S	*	*				167.5	165	123.2	-92.1	-178	70.1	0	0	114.7
172	V	29.9	Very low	27.9	Very low	122 Å²	122	146 Å²	146	74%	0.739	80%	0.797	S	S	*	*			trans	62.3	105.4	169.9	-157.2	0	0	0	0	116.3
173	L	25.5	Very low	28.3	Very low	161 Å²	161	144.7 Å²	144.7	84%	0.843	80%	0.801	S	S	*	*			cis	79.2	139.8	48.5	-76.1	160.2	0	0	0	117.2
174	S	29.9	Very low	28.4	Very low	111 Å²	111	142 Å²	142	78%	0.776	80%	0.801	S	S	*	*			trans	84.9	99	161	-52.9	0	0	0	0	120.2
175	S	30.6	Very low	28.9	Very low	116 Å²	116	141 Å²	141	81%	0.811	80%	0.8	S	S	*	*			trans	-72.7	170.8	152.2	-40.6	0	0	0	0	111.1
176	P	33	Very low	29.1	Very low	116 Å²	116	138.7 Å²	138.7	75%	0.753	79%	0.792	S	S	*	*				-156.4	157.3	96.7	41	-22.8	0	0	0	118.9
177	S	27	Very low	29.5	Very low	113 Å²	113	134.5 Å²	134.5	79%	0.79	79%	0.791	S	S	*	*			trans	46.2	135.1	142.7	65	0	0	0	0	124.6
178	S	27.6	Very low	30	Very low	113 Å²	113	135.3 Å²	135.3	79%	0.79	80%	0.8	S	S	*	*			trans	-71.4	161.7	168.6	56.9	0	0	0	0	117
179	S	34.2	Very low	29.8	Very low	101 Å²	101	131.1 Å²	131.1	71%	0.706	80%	0.798	S	S	*	*			trans	-171.2	127.4	132.1	55.5	0	0	0	0	116.2
180	K	31.7	Very low	30	Very low	195 Å²	195	128.1 Å²	128.1	85%	0.848	80%	0.799	S	S	*	*			trans	61.3	161.8	145.8	-55.1	174.4	179.3	178.5	0	117.9
181	T	30.9	Very low	30.1	Very low	128 Å²	128	132.2 Å²	132.2	79%	0.785	80%	0.804	S	S	*	*			cis	-147.5	170.2	5.6	-23.7	0	0	0	0	110.7
182	E	27.3	Very low	30.4	Very low	181 Å²	181	130.5 Å²	130.5	85%	0.846	81%	0.806	S	S	*	*			trans	-74.7	165.9	173.5	-57.9	153.1	99.6	0	0	114.1
183	V	32.7	Very low	30.2	Very low	144 Å²	144	130.9 Å²	130.9	87%	0.873	81%	0.809	S	S	*	*				-166.6	148.5	128.7	138	0	0	0	0	109.1
184	A	27.3	Very low	30.3	Very low	96 Å²	96	129.1 Å²	129.1	79%	0.793	81%	0.81	S	S	*	*			trans	-131.6	144.5	-176.9	0	0	0	0	0	113.5
185	S	33.8	Very low	30.1	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	81%	0.809	S	S	*	*			trans	177.7	156.4	165	26.1	0	0	0	0	109
186	T	30.1	Very low	30.1	Very low	118 Å²	118	131.3 Å²	131.3	72%	0.724	81%	0.814	S	S	*	*			cis	-174	156.8	-38.7	16.6	0	0	0	0	106.5
187	T	32.1	Very low	29.7	Very low	128 Å²	128	133.6 Å²	133.6	79%	0.785	81%	0.814	S	S	*	*			trans	62.8	153.8	163.2	50.2	0	0	0	0	117.4
188	T	34.5	Very low	29.7	Very low	139 Å²	139	136.8 Å²	136.8	85%	0.853	82%	0.821	S	S	*	*			cis	-142.7	165.8	4.4	-18.1	0	0	0	0	110.5
189	A	27	Very low	29.6	Very low	98 Å²	98	137.1 Å²	137.1	81%	0.81	82%	0.819	S	S	*	*			trans	-108.7	158.5	-175.3	0	0	0	0	0	114.2
190	A	32.4	Very low	29.4	Very low	105 Å²	105	142.5 Å²	142.5	87%	0.868	83%	0.829	S	S	*	*			trans	-138.6	137.3	161.4	0	0	0	0	0	109.9
191	K	27.2	Very low	29.2	Very low	197 Å²	197	137.1 Å²	137.1	86%	0.857	82%	0.822	S	S	*	*			trans	-116.5	143.2	176.7	-84.5	-178.3	174	178.1	0	110.1
192	T	32.8	Very low	28.9	Very low	152 Å²	152	138 Å²	138	93%	0.933	82%	0.82	S	S	*	*			trans	-146.1	119.7	153.9	4.5	0	0	0	0	109.4
193	T	26.2	Very low	28.9	Very low	130 Å²	130	136.4 Å²	136.4	80%	0.798	82%	0.817	S	S	*	*			trans	-111.7	142.9	-179.8	44.4	0	0	0	0	110.5
194	S	28.8	Very low	28.7	Very low	124 Å²	124	137.4 Å²	137.4	87%	0.867	81%	0.812	S	S	*	*			trans	-143.8	158	160	-163.5	0	0	0	0	110.2
195	T	25.3	Very low	28.7	Very low	125 Å²	125	140.1 Å²	140.1	77%	0.767	81%	0.813	S	S	*	*			trans	-130.4	139.8	-152.9	48.4	0	0	0	0	113.8
196	V	29.9	Very low	28.4	Very low	149 Å²	149	140 Å²	140	90%	0.903	81%	0.813	S	S	*	*			trans	-141.7	146	157.3	-176.4	0	0	0	0	109.1
197	H	25.6	Very low	28.1	Very low	164 Å²	164	141.4 Å²	141.4	76%	0.759	81%	0.814	S	S	*	*			trans	-65.4	149	-175.3	-83.9	-122.9	0	0	0	115
198	L	26.6	Very low	27.9	Very low	180 Å²	180	142 Å²	142	94%	0.942	81%	0.811	S	S	*	*			trans	-133.6	138	145.6	-128.1	91.7	0	0	0	109.6
199	T	24.2	Very low	27.4	Very low	120 Å²	120	143.7 Å²	143.7	74%	0.736	81%	0.81	S	S	*	*			trans	-128.6	110.1	-178.2	36.5	0	0	0	0	111.6
200	K	30	Very low	27.4	Very low	213 Å²	213	143.8 Å²	143.8	93%	0.926	80%	0.796	S	S	*	*			trans	-156.7	124.8	151.7	-127.7	170.1	-176.2	176.8	0	115.3
201	A	27.4	Very low	27	Very low	83 Å²	83	147.4 Å²	147.4	69%	0.686	80%	0.801	S	S	*	*			trans	0.2	122.4	163.1	0	0	0	0	0	120.7
202	I	25.5	Very low	27	Very low	146 Å²	146	141.1 Å²	141.1	75%	0.749	78%	0.782	S	S	*	*				47.7	106.4	125.2	-51.7	163.7	0	0	0	116.8	Q204	I202-Q204 HydrophobicContact CG2-CG 4.36Å
203	N	28.3	Very low	26.7	Very low	147 Å²	147	140.7 Å²	140.7	79%	0.786	77%	0.767	S	S	*	*			trans	-131.9	89.7	147.6	-170.7	2.6	0	0	0	108.9
204	Q	27.9	Very low	26.8	Very low	165 Å²	165	142.6 Å²	142.6	77%	0.771	77%	0.773	S	S	*	*			trans	-85.8	108.2	172.7	-73.9	174.7	-56.1	0	0	109	I202	I202-Q204 HydrophobicContact CG2-CG 4.36Å
205	N	27.5	Very low	26.8	Very low	153 Å²	153	144.5 Å²	144.5	82%	0.818	77%	0.773	S	S	*	*			trans	-150.5	70.1	161.7	-93	-50.7	0	0	0	109.1
206	S	27	Very low	26.9	Very low	105 Å²	105	142.1 Å²	142.1	73%	0.734	76%	0.758	S	S	*	*			trans	-79.9	119.8	172	50.9	0	0	0	0	110.4
207	I	24	Very low	26.7	Very low	147 Å²	147	140.9 Å²	140.9	75%	0.754	75%	0.747	S	S	*	*			trans	20.8	104.9	146.1	-50.8	169	0	0	0	115.2	E209	I207-E209 HydrophobicContact CG2-CG 4.33Å
208	I	27	Very low	27	Very low	141 Å²	141	138.6 Å²	138.6	72%	0.723	75%	0.749	S	S	*	*			trans	-129	109.9	144.6	-58.1	-178.2	0	0	0	106.6	N210	I208-N210 WeakPolarHBondContact CG2-ND2 3.27Å
209	E	24.9	Very low	27.5	Very low	174 Å²	174	133.6 Å²	133.6	81%	0.813	73%	0.729	S	S	*	*			trans	-67.6	130.6	168	-62.8	169.1	149.2	0	0	108.1	I207	I207-E209 HydrophobicContact CG2-CG 4.33Å
210	N	26.4	Very low	27.9	Very low	99 Å²	99	132.3 Å²	132.3	53%	0.529	72%	0.718	S	S	.	*			trans	-147.1	62.3	-177.5	-102.3	-33.7	0	0	0	111.8	I208 S212	I208-N210 WeakPolarHBondContact CG2-ND2 3.27Å; N210-S212 WeakPolarHBondContact CA-OG 3.31Å; N210-S212 WeakPolarHBondContact CB-OG 3.41Å; N210-S212 PolarHBondContact O-N 2.85Å; N210-S212 PolarHBondContact O-OG 3.14Å; N210-S212 PolarHBondContact OD1-OG 3.36Å
211	D	25.6	Very low	28.1	Very low	181 Å²	181	126.8 Å²	126.8	97%	0.968	70%	0.697	S	S	*	*			trans	-69.4	62.4	158.9	-75.8	-45.4	0	0	0	109.8
212	S	25.9	Very low	28.6	Very low	65 Å²	65	127 Å²	127	46%	0.455	69%	0.694	S	S	.	*			trans	-146	3.6	-160.4	58.5	0	0	0	0	116.1	N210	N210-S212 WeakPolarHBondContact CA-OG 3.31Å; N210-S212 WeakPolarHBondContact CB-OG 3.41Å; N210-S212 PolarHBondContact O-N 2.85Å; N210-S212 PolarHBondContact O-OG 3.14Å; N210-S212 PolarHBondContact OD1-OG 3.36Å
213	F	27.5	Very low	29.1	Very low	144 Å²	144	126.1 Å²	126.1	63%	0.632	69%	0.69	S	S	*	*			trans	-122.1	22.2	-175.3	-76.3	-67	0	0	0	116.7	N215 V216	F213-N215 PolarHBondContact O-N 3.42Å; F213-V216 HydrophobicContact CB-CG2 4.44Å; F213-V216 HydrophobicContact CD1-CG2 3.56Å; F213-V216 HydrophobicContact CE1-CG2 4.31Å; F213-V216 HydrophobicContact CG-CG2 4.43Å
214	N	28	Very low	29.4	Very low	170 Å²	170	127.5 Å²	127.5	91%	0.909	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	46.4	166.7	-75.3	-25.1	0	0	0	112.9
215	N	27.7	Very low	29.8	Very low	163 Å²	163	126.6 Å²	126.6	87%	0.872	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-170.4	42.8	171.7	-111.4	-19.2	0	0	0	114.8	F213	F213-N215 PolarHBondContact O-N 3.42Å
216	V	27.3	Very low	30.3	Very low	76 Å²	76	124.7 Å²	124.7	46%	0.461	67%	0.668	S	S	.	*			trans	-97.2	127.4	173	-172.4	0	0	0	0	110.3	F213 D220	F213-V216 HydrophobicContact CB-CG2 4.44Å; F213-V216 HydrophobicContact CD1-CG2 3.56Å; F213-V216 HydrophobicContact CE1-CG2 4.31Å; F213-V216 HydrophobicContact CG-CG2 4.43Å; V216-D220 HydrophobicContact CG1-CB 4.23Å
217	N	27.5	Very low	30.9	Very low	123 Å²	123	123.5 Å²	123.5	66%	0.658	66%	0.658	S	S	*	*			trans	-72.1	153.4	179.9	-78.1	-47.8	0	0	0	112.5	S219 D220	N217-S219 PolarHBondContact O-N 3.4Å; N217-D220 PolarHBondContact O-N 2.9Å
218	S	31.6	Very low	31.5	Very low	115 Å²	115	124.1 Å²	124.1	80%	0.804	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-10.7	-172.1	-160.2	0	0	0	0	115.7
219	S	37.4	Very low	32.1	Very low	76 Å²	76	121 Å²	121	53%	0.531	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72	-37.5	178.6	45.4	0	0	0	0	114.2	N217 S222	N217-S219 PolarHBondContact O-N 3.4Å; S219-S222 PolarHBondContact O-OG 3.03Å
220	D	32.5	Very low	32.8	Very low	93 Å²	93	117.2 Å²	117.2	50%	0.497	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.1	-13.6	-156.5	-57.7	-7.3	0	0	0	113	V216 N217 S222	V216-D220 HydrophobicContact CG1-CB 4.23Å; N217-D220 PolarHBondContact O-N 2.9Å; D220-S222 PolarHBondContact O-N 2.93Å
221	I	33.7	Very low	33.5	Very low	96 Å²	96	117.5 Å²	117.5	49%	0.492	62%	0.623	S	S	.	*	H	α-helix	trans	-62.8	-24.9	-177.7	-58.6	174.6	0	0	0	111.8	L223	I221-L223 PolarHBondContact O-N 3.2Å
222	S	37.1	Very low	34.2	Very low	87 Å²	87	112.3 Å²	112.3	61%	0.608	60%	0.595	S	S	*	*	H	α-helix	trans	-64.6	-30.5	-175.2	59.2	0	0	0	0	114.8	S219 D220	S219-S222 PolarHBondContact O-OG 3.03Å; D220-S222 PolarHBondContact O-N 2.93Å
223	L	36.3	Very low	34.7	Very low	128 Å²	128	115.7 Å²	115.7	67%	0.67	60%	0.602	S	S	*	*	H	α-helix	trans	-91.2	-24.2	-173	-67.2	174.2	0	0	0	114	I221 W225 L226	I221-L223 PolarHBondContact O-N 3.2Å; L223-W225 PolarHBondContact O-N 2.97Å; L223-L226 HydrophobicContact CD2-CD1 4.43Å
224	F	35.2	Very low	35.3	Very low	177 Å²	177	112.2 Å²	112.2	78%	0.776	59%	0.59	S	S	*	*	H	α-helix	trans	-69.9	-26.2	-173.4	-107.9	-89.8	0	0	0	114.7
225	W	35.4	Very low	35.7	Very low	145 Å²	145	110.7 Å²	110.7	55%	0.549	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.8	-17.3	-172.1	-73.9	95.4	0	0	0	115	L223 Y228 L229	L223-W225 PolarHBondContact O-N 2.97Å; W225-Y228 PolarHBondContact O-N 2.93Å; W225-Y228 VanDerWaalsContact O-N 3.15Å; W225-L229 HydrophobicContact CB-CD1 4.35Å; W225-L229 WeakPolarHBondContact O-CG 3.29Å; W225-L229 PolarHBondContact O-N 3.08Å
226	L	37.4	Very low	36	Very low	113 Å²	113	110.6 Å²	110.6	59%	0.592	57%	0.567	S	S	*	*	H	α-helix	trans	-56.9	-46.2	-175.8	-82	155.3	0	0	0	113.8	L223 Y228 N230	L223-L226 HydrophobicContact CD2-CD1 4.43Å; L226-Y228 PolarHBondContact O-N 2.92Å; L226-N230 PolarHBondContact O-N 3.1Å
227	P	40.2	Very low	36.4	Very low	81 Å²	81	110.4 Å²	110.4	53%	0.526	57%	0.569	S	S	.	*	H	α-helix	trans	-66.1	-36.7	175.9	-20.7	33.8	0	0	0	113.1	N230 N231	P227-N230 PolarHBondContact O-N 3.32Å; P227-N231 PolarHBondContact O-N 3.06Å
228	Y	36.9	Very low	36.9	Very low	159 Å²	159	109.4 Å²	109.4	62%	0.624	57%	0.572	S	S	*	*	H	α-helix	trans	-68.5	-43.3	-178.9	-115.9	-82.6	0	0	0	111.9	W225 L226 N230 N231 I232	W225-Y228 PolarHBondContact O-N 2.93Å; W225-Y228 VanDerWaalsContact O-N 3.15Å; L226-Y228 PolarHBondContact O-N 2.92Å; Y228-N230 VanDerWaalsContact C-N 3.33Å; Y228-N230 PolarHBondContact O-N 3.29Å; Y228-N231 PolarHBondContact O-N 3.33Å; Y228-I232 WeakPolarHBondContact O-CG1 3.45Å; Y228-I232 PolarHBondContact O-N 2.76Å
229	L	39.7	Very low	37.3	Very low	77 Å²	77	108.2 Å²	108.2	40%	0.403	56%	0.563	S	S	.	*	H	α-helix	trans	-63.1	-39	174.6	-70.4	170.4	0	0	0	111.7	W225 I232 F233 L262	W225-L229 HydrophobicContact CB-CD1 4.35Å; W225-L229 WeakPolarHBondContact O-CG 3.29Å; W225-L229 PolarHBondContact O-N 3.08Å; L229-I232 PolarHBondContact O-N 3.3Å; L229-F233 WeakPolarHBondContact O-CB 3.5Å; L229-F233 PolarHBondContact O-N 2.94Å; L229-L262 HydrophobicContact CD2-CD1 3.95Å
230	N	40	Very low	37.2	Very low	93 Å²	93	110.1 Å²	110.1	50%	0.497	57%	0.567	S	S	.	*	H	α-helix	trans	-64.7	-41.6	176.1	-163.5	30.7	0	0	0	112	L226 P227 Y228 F233 N234	L226-N230 PolarHBondContact O-N 3.1Å; P227-N230 PolarHBondContact O-N 3.32Å; Y228-N230 VanDerWaalsContact C-N 3.33Å; Y228-N230 PolarHBondContact O-N 3.29Å; N230-F233 PolarHBondContact O-N 3.38Å; N230-N234 WeakPolarHBondContact O-CB 3.25Å; N230-N234 VanDerWaalsContact O-CG 3.27Å; N230-N234 PolarHBondContact O-N 3.49Å; N230-N234 PolarHBondContact O-ND2 2.82Å
231	N	40.3	Very low	37.3	Very low	105 Å²	105	112.7 Å²	112.7	56%	0.561	58%	0.58	S	S	*	*	H	α-helix	trans	-64.5	-39.9	174.5	-81	-16.9	0	0	0	112.9	P227 Y228 N234 M235	P227-N231 PolarHBondContact O-N 3.06Å; Y228-N231 PolarHBondContact O-N 3.33Å; N231-N234 PolarHBondContact O-N 3.14Å; N231-M235 PolarHBondContact O-N 3.35Å
232	I	40.5	Very low	37.1	Very low	73 Å²	73	113.6 Å²	113.6	37%	0.374	59%	0.586	S	S	.	*	H	α-helix	trans	-63.2	-43.6	174	-68.5	166.4	0	0	0	110.5	Y228 L229 N234 M235 Y236	Y228-I232 WeakPolarHBondContact O-CG1 3.45Å; Y228-I232 PolarHBondContact O-N 2.76Å; L229-I232 PolarHBondContact O-N 3.3Å; I232-N234 VanDerWaalsContact C-N 3.35Å; I232-N234 PolarHBondContact O-N 3.43Å; I232-M235 PolarHBondContact O-N 2.92Å; I232-Y236 HydrophobicContact CG2-CD2 4.01Å; I232-Y236 HydrophobicContact CG2-CE2 4.05Å; I232-Y236 WeakPolarHBondContact O-CD2 3.11Å; I232-Y236 PolarHBondContact O-N 3.31Å
233	F	37	Very low	36.9	Very low	136 Å²	136	115.1 Å²	115.1	60%	0.596	59%	0.594	S	S	*	*	H	α-helix	trans	-58.9	-46.1	176.1	-165.6	-95.2	0	0	0	111.4	L229 N230 M235 Y236 S237	L229-F233 WeakPolarHBondContact O-CB 3.5Å; L229-F233 PolarHBondContact O-N 2.94Å; N230-F233 PolarHBondContact O-N 3.38Å; F233-M235 PolarHBondContact O-N 3.4Å; F233-Y236 PolarHBondContact O-N 3.28Å; F233-S237 PolarHBondContact O-N 2.81Å; F233-S237 PolarHBondContact O-OG 3.49Å
234	N	38.8	Very low	37	Very low	71 Å²	71	113.7 Å²	113.7	38%	0.38	60%	0.595	S	S	.	*	H	α-helix	trans	-65.8	-34.9	178.2	-70.5	-30.2	0	0	0	113.6	N230 N231 I232 S237 S238	N230-N234 WeakPolarHBondContact O-CB 3.25Å; N230-N234 VanDerWaalsContact O-CG 3.27Å; N230-N234 PolarHBondContact O-N 3.49Å; N230-N234 PolarHBondContact O-ND2 2.82Å; N231-N234 PolarHBondContact O-N 3.14Å; I232-N234 VanDerWaalsContact C-N 3.35Å; I232-N234 PolarHBondContact O-N 3.43Å; N234-S237 WeakPolarHBondContact CA-OG 3.19Å; N234-S237 PolarHBondContact O-OG 3.48Å; N234-S238 VanDerWaalsContact O-CB 3.29Å; N234-S238 WeakPolarHBondContact O-CB 3.33Å; N234-S238 PolarHBondContact O-N 3.38Å; N234-S238 VanDerWaalsContact O-N 3.1Å; N234-S238 PolarHBondContact O-OG 2.88Å
235	M	37.2	Very low	37	Very low	138 Å²	138	112.6 Å²	112.6	68%	0.68	59%	0.592	S	S	*	*	H	α-helix	trans	-63.3	-44.6	173.8	-80.6	-171.4	70	0	0	112.1	N231 I232 F233 S239	N231-M235 PolarHBondContact O-N 3.35Å; I232-M235 PolarHBondContact O-N 2.92Å; F233-M235 PolarHBondContact O-N 3.4Å; M235-S239 PolarHBondContact O-OG 3.25Å
236	Y	34.5	Very low	36.8	Very low	161 Å²	161	111.9 Å²	111.9	63%	0.631	60%	0.596	S	S	*	*	H	α-helix	trans	-74.9	-34.1	-178.9	-79.2	-73.6	0	0	0	113	I232 F233	I232-Y236 HydrophobicContact CG2-CD2 4.01Å; I232-Y236 HydrophobicContact CG2-CE2 4.05Å; I232-Y236 WeakPolarHBondContact O-CD2 3.11Å; I232-Y236 PolarHBondContact O-N 3.31Å; F233-Y236 PolarHBondContact O-N 3.28Å
237	S	35.3	Very low	36.8	Very low	72 Å²	72	113 Å²	113	50%	0.503	61%	0.608	S	S	.	*	H	α-helix	trans	-71.1	-31.9	175.3	63.7	0	0	0	0	113.2	F233 N234 S239	F233-S237 PolarHBondContact O-N 2.81Å; F233-S237 PolarHBondContact O-OG 3.49Å; N234-S237 WeakPolarHBondContact CA-OG 3.19Å; N234-S237 PolarHBondContact O-OG 3.48Å; S237-S239 PolarHBondContact O-N 3.18Å
238	S	38.2	Very low	36.6	Very low	101 Å²	101	118.2 Å²	118.2	71%	0.706	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-10.5	179.8	-56.7	0	0	0	0	114.2	N234	N234-S238 VanDerWaalsContact O-CB 3.29Å; N234-S238 WeakPolarHBondContact O-CB 3.33Å; N234-S238 PolarHBondContact O-N 3.38Å; N234-S238 VanDerWaalsContact O-N 3.1Å; N234-S238 PolarHBondContact O-OG 2.88Å
239	S	40.3	Very low	36.5	Very low	90 Å²	90	118.1 Å²	118.1	63%	0.629	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	-0.6	-166.4	-57.5	0	0	0	0	114.7	M235 S237	M235-S239 PolarHBondContact O-OG 3.25Å; S237-S239 PolarHBondContact O-N 3.18Å
240	L	35	Very low	36.4	Very low	117 Å²	117	119.2 Å²	119.2	61%	0.613	63%	0.634	S	S	*	*	S	Bend	trans	-135.9	90.4	-169.6	-76	171.7	0	0	0	114.3
241	L	34.6	Very low	36.4	Very low	146 Å²	146	121.9 Å²	121.9	76%	0.764	64%	0.644	S	S	*	*	S	Bend	trans	67	166.1	163	-65.8	88.6	0	0	0	117
242	N	28.9	Very low	36.6	Very low	115 Å²	115	121.6 Å²	121.6	62%	0.615	65%	0.646	S	S	*	*			trans	-68	137.9	-170.7	-75.3	-44.5	0	0	0	112.7	S244 Q245	N242-S244 PolarHBondContact O-N 2.84Å; N242-Q245 PolarHBondContact O-N 2.98Å
243	P	33.3	Very low	37.1	Very low	119 Å²	119	121.5 Å²	121.5	77%	0.773	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-64.9	-12.9	-178.5	26.4	-35.2	0	0	0	114.3	Q245	P243-Q245 VanDerWaalsContact C-N 3.29Å; P243-Q245 PolarHBondContact O-N 3.3Å
244	S	37.6	Very low	37.6	Very low	99 Å²	99	119.3 Å²	119.3	69%	0.692	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-75.7	-5.6	178.4	51.7	0	0	0	0	115.3	N242	N242-S244 PolarHBondContact O-N 2.84Å
245	Q	36.8	Very low	38.3	Very low	153 Å²	153	117.7 Å²	117.7	72%	0.715	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-112.3	1.3	-178.6	-67.4	-171.9	-19.4	0	0	114.7	N242 P243	N242-Q245 PolarHBondContact O-N 2.98Å; P243-Q245 VanDerWaalsContact C-N 3.29Å; P243-Q245 PolarHBondContact O-N 3.3Å
246	M	31.2	Very low	39	Very low	131 Å²	131	118.3 Å²	118.3	65%	0.645	64%	0.638	S	S	*	*			trans	-97.8	14.2	-164	-140.4	178.4	77	0	0	115.9	Q248	M246-Q248 VanDerWaalsContact C-N 3.33Å; M246-Q248 PolarHBondContact O-N 2.99Å
247	T	36	Very low	40	Very low	137 Å²	137	120.1 Å²	120.1	84%	0.84	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	0.5	-168.6	43.6	0	0	0	0	116.5
248	Q	37.4	Very low	41.5	Very low	189 Å²	189	120.4 Å²	120.4	88%	0.883	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.2	8.4	-174.4	-146.5	171.1	6.9	0	0	115.9	M246	M246-Q248 VanDerWaalsContact C-N 3.33Å; M246-Q248 PolarHBondContact O-N 2.99Å
249	F	33.4	Very low	42.5	Very low	157 Å²	157	122.6 Å²	122.6	69%	0.689	63%	0.631	S	S	*	*	S	Bend	trans	-94.1	134.9	178.2	-113.9	-94.7	0	0	0	112.7	Q251	F249-Q251 PolarHBondContact O-N 2.71Å
250	N	38.4	Very low	43.4	Very low	100 Å²	100	124.3 Å²	124.3	54%	0.535	62%	0.624	S	S	.	*			trans	-76.2	91.6	-164.5	-147.4	-15.9	0	0	0	112	T252 T253	N250-T252 PolarHBondContact O-N 3.16Å; N250-T252 VanDerWaalsContact O-N 3.1Å; N250-T252 PolarHBondContact OD1-OG1 3.35Å; N250-T253 HydrophobicContact CB-CG2 4.2Å; N250-T253 PolarHBondContact O-N 2.96Å; N250-T253 PolarHBondContact O-OG1 3.38Å
251	Q	40.8	Very low	44.7	Very low	150 Å²	150	121.8 Å²	121.8	70%	0.701	62%	0.616	S	S	*	*	H	α-helix	trans	-49.7	-37.9	-174.8	-65.5	177.5	-9.9	0	0	113.2	F249 T253 I254 G255	F249-Q251 PolarHBondContact O-N 2.71Å; Q251-T253 VanDerWaalsContact C-N 3.31Å; Q251-T253 PolarHBondContact O-N 3.43Å; Q251-I254 PolarHBondContact O-N 2.89Å; Q251-G255 PolarHBondContact O-N 2.85Å
252	T	44.2	Very low	45.6	Very low	98 Å²	98	117.9 Å²	117.9	60%	0.601	60%	0.595	S	S	*	*	H	α-helix	trans	-52.6	-43	174.8	55.6	0	0	0	0	113.2	N250 G255 W256	N250-T252 PolarHBondContact O-N 3.16Å; N250-T252 VanDerWaalsContact O-N 3.1Å; N250-T252 PolarHBondContact OD1-OG1 3.35Å; T252-G255 PolarHBondContact O-N 2.78Å; T252-W256 WeakPolarHBondContact O-CB 3.05Å; T252-W256 PolarHBondContact O-N 3.23Å
253	T	50.9	Low	47	Very low	72 Å²	72	115.3 Å²	115.3	44%	0.442	58%	0.581	S	S	.	*	H	α-helix	trans	-73.9	-31.4	-176.1	63	0	0	0	0	113	N250 Q251 R257	N250-T253 HydrophobicContact CB-CG2 4.2Å; N250-T253 PolarHBondContact O-N 2.96Å; N250-T253 PolarHBondContact O-OG1 3.38Å; Q251-T253 VanDerWaalsContact C-N 3.31Å; Q251-T253 PolarHBondContact O-N 3.43Å; T253-R257 VanDerWaalsContact O-CG 3.32Å; T253-R257 WeakPolarHBondContact O-CG 3.22Å; T253-R257 PolarHBondContact O-N 3.07Å; T253-R257 VanDerWaalsContact O-N 3.16Å
254	I	47.9	Very low	47.8	Very low	90 Å²	90	116.7 Å²	116.7	46%	0.462	57%	0.571	S	S	.	*	H	α-helix	trans	-71.5	-47.6	174.2	-64.3	173.7	0	0	0	109.1	Q251 W256 R257 I258	Q251-I254 PolarHBondContact O-N 2.89Å; I254-W256 VanDerWaalsContact C-N 3.35Å; I254-W256 PolarHBondContact O-N 3Å; I254-R257 PolarHBondContact O-N 3.12Å; I254-I258 HydrophobicContact CG2-CD1 3.77Å; I254-I258 HydrophobicContact CG2-CG1 4.47Å; I254-I258 WeakPolarHBondContact O-CG1 3.15Å; I254-I258 PolarHBondContact O-N 3.44Å
255	G	52.3	Low	48.3	Very low	37 Å²	37	116.4 Å²	116.4	38%	0.381	56%	0.562	S	S	.	*	H	α-helix	trans	-52.8	-49.1	173.4	0	0	0	0	0	112.4	Q251 T252 R257 I258 W259	Q251-G255 PolarHBondContact O-N 2.85Å; T252-G255 PolarHBondContact O-N 2.78Å; G255-R257 PolarHBondContact O-N 2.85Å; G255-I258 PolarHBondContact O-N 3.26Å; G255-W259 VanDerWaalsContact O-CB 3.25Å; G255-W259 WeakPolarHBondContact O-CB 3.36Å; G255-W259 PolarHBondContact O-N 2.92Å
256	W	52.5	Low	48.6	Very low	151 Å²	151	114.2 Å²	114.2	57%	0.572	56%	0.555	S	S	*	*	H	α-helix	trans	-67	-34.1	-179.4	-157.4	79.4	0	0	0	113.7	T252 I254 R260	T252-W256 WeakPolarHBondContact O-CB 3.05Å; T252-W256 PolarHBondContact O-N 3.23Å; I254-W256 VanDerWaalsContact C-N 3.35Å; I254-W256 PolarHBondContact O-N 3Å; W256-R260 WeakPolarHBondContact O-CB 3.48Å; W256-R260 PolarHBondContact O-N 2.77Å
257	R	54.3	Low	49.1	Very low	199 Å²	199	114.6 Å²	114.6	75%	0.751	56%	0.557	S	S	*	*	H	α-helix	trans	-69.9	-41	174.9	-73.2	179.6	76.2	159.1	4	112.2	T253 I254 G255 S261	T253-R257 VanDerWaalsContact O-CG 3.32Å; T253-R257 WeakPolarHBondContact O-CG 3.22Å; T253-R257 PolarHBondContact O-N 3.07Å; T253-R257 VanDerWaalsContact O-N 3.16Å; I254-R257 PolarHBondContact O-N 3.12Å; G255-R257 PolarHBondContact O-N 2.85Å; R257-S261 PolarHBondContact O-N 3.02Å; R257-S261 VanDerWaalsContact O-N 3.14Å
258	I	67	Low	49.5	Very low	77 Å²	77	114.3 Å²	114.3	40%	0.395	55%	0.549	S	S	.	.	H	α-helix	trans	-66.4	-49.1	175.1	-66.1	171.5	0	0	0	109.9	I254 G255 R260 S261 L262	I254-I258 HydrophobicContact CG2-CD1 3.77Å; I254-I258 HydrophobicContact CG2-CG1 4.47Å; I254-I258 WeakPolarHBondContact O-CG1 3.15Å; I254-I258 PolarHBondContact O-N 3.44Å; G255-I258 PolarHBondContact O-N 3.26Å; I258-R260 PolarHBondContact O-N 2.83Å; I258-S261 CarbonylContact O-C 3.55Å; I258-S261 WeakPolarHBondContact O-CA 3.46Å; I258-S261 WeakPolarHBondContact O-CB 2.94Å; I258-S261 PolarHBondContact O-N 2.98Å; I258-L262 HydrophobicContact CG2-CD1 3.96Å; I258-L262 HydrophobicContact CG2-CG 4.42Å; I258-L262 PolarHBondContact O-N 2.79Å
259	W	60.1	Low	49.6	Very low	148 Å²	148	111.4 Å²	111.4	56%	0.561	54%	0.54	S	S	*	.	H	α-helix	trans	-58.9	-43.7	178.2	-168.2	85.2	0	0	0	111.9	G255 S261 L262 L263	G255-W259 VanDerWaalsContact O-CB 3.25Å; G255-W259 WeakPolarHBondContact O-CB 3.36Å; G255-W259 PolarHBondContact O-N 2.92Å; W259-S261 VanDerWaalsContact C-N 3.26Å; W259-S261 PolarHBondContact O-N 3.29Å; W259-L262 PolarHBondContact O-N 2.84Å; W259-L263 HydrophobicContact CH2-CD1 4.08Å; W259-L263 HydrophobicContact CH2-CD2 3.92Å; W259-L263 HydrophobicContact CZ2-CD1 4.07Å; W259-L263 HydrophobicContact CZ3-CD2 3.85Å; W259-L263 WeakPolarHBondContact O-CB 3.33Å; W259-L263 PolarHBondContact O-N 2.99Å
260	R	58.5	Low	49.6	Very low	126 Å²	126	112.3 Å²	112.3	48%	0.475	55%	0.546	S	S	.	.	H	α-helix	trans	-66.1	-25	174.9	-168.7	171.7	-172.6	-179.2	3.7	113.4	W256 I258 R264	W256-R260 WeakPolarHBondContact O-CB 3.48Å; W256-R260 PolarHBondContact O-N 2.77Å; I258-R260 PolarHBondContact O-N 2.83Å; R260-R264 WeakPolarHBondContact O-CG 3.41Å; R260-R264 PolarHBondContact O-N 3.43Å
261	S	63.2	Low	49.3	Very low	64 Å²	64	114 Å²	114	45%	0.448	56%	0.555	S	S	.	*	H	α-helix	trans	-80.9	-38.9	173.4	-156.6	0	0	0	0	112.2	R257 I258 W259 R264 N265	R257-S261 PolarHBondContact O-N 3.02Å; R257-S261 VanDerWaalsContact O-N 3.14Å; I258-S261 CarbonylContact O-C 3.55Å; I258-S261 WeakPolarHBondContact O-CA 3.46Å; I258-S261 WeakPolarHBondContact O-CB 2.94Å; I258-S261 PolarHBondContact O-N 2.98Å; W259-S261 VanDerWaalsContact C-N 3.26Å; W259-S261 PolarHBondContact O-N 3.29Å; S261-R264 PolarHBondContact O-N 3.43Å; S261-N265 PolarHBondContact O-N 3.17Å; S261-N265 VanDerWaalsContact O-N 3.07Å
262	L	53.6	Low	49	Very low	63 Å²	63	113.7 Å²	113.7	33%	0.33	56%	0.558	S	S	.	*	H	α-helix	trans	-62.3	-47.1	171.7	-74.4	168.3	0	0	0	111	L229 I258 W259 R264 N265 L266	L229-L262 HydrophobicContact CD2-CD1 3.95Å; I258-L262 HydrophobicContact CG2-CD1 3.96Å; I258-L262 HydrophobicContact CG2-CG 4.42Å; I258-L262 PolarHBondContact O-N 2.79Å; W259-L262 PolarHBondContact O-N 2.84Å; L262-R264 VanDerWaalsContact C-N 3.31Å; L262-R264 PolarHBondContact O-N 2.73Å; L262-N265 PolarHBondContact O-N 3.06Å; L262-L266 WeakPolarHBondContact O-CG 3.31Å; L262-L266 PolarHBondContact O-N 3.21Å
263	L	58	Low	48.3	Very low	61 Å²	61	117.7 Å²	117.7	32%	0.319	57%	0.57	S	S	.	*	H	α-helix	trans	-61.2	-39.3	178.2	-158.6	80.1	0	0	0	111.6	W259 M267	W259-L263 HydrophobicContact CH2-CD1 4.08Å; W259-L263 HydrophobicContact CH2-CD2 3.92Å; W259-L263 HydrophobicContact CZ2-CD1 4.07Å; W259-L263 HydrophobicContact CZ3-CD2 3.85Å; W259-L263 WeakPolarHBondContact O-CB 3.33Å; W259-L263 PolarHBondContact O-N 2.99Å; L263-M267 HydrophobicContact CG-CG 4.42Å; L263-M267 VanDerWaalsContact O-CB 3.22Å; L263-M267 WeakPolarHBondContact O-CB 3.37Å; L263-M267 WeakPolarHBondContact O-CG 3.42Å; L263-M267 PolarHBondContact O-N 3.16Å
264	R	49.1	Very low	47.3	Very low	148 Å²	148	123.2 Å²	123.2	56%	0.558	59%	0.588	S	S	*	*	H	α-helix	trans	-62	-41.6	171.7	-80.2	-179.4	-170.3	-90.8	10.2	112.5	R260 S261 L262 L268	R260-R264 WeakPolarHBondContact O-CG 3.41Å; R260-R264 PolarHBondContact O-N 3.43Å; S261-R264 PolarHBondContact O-N 3.43Å; L262-R264 VanDerWaalsContact C-N 3.31Å; L262-R264 PolarHBondContact O-N 2.73Å; R264-L268 WeakPolarHBondContact O-CB 3.41Å; R264-L268 WeakPolarHBondContact O-CD1 3.47Å; R264-L268 WeakPolarHBondContact O-CG 3.48Å; R264-L268 PolarHBondContact O-N 2.97Å
265	N	48.5	Very low	46.6	Very low	93 Å²	93	124.8 Å²	124.8	50%	0.497	60%	0.604	S	S	.	*	H	α-helix	trans	-72	-36.1	-179.4	-71.2	-8.5	0	0	0	112.2	S261 L262 L268 N269	S261-N265 PolarHBondContact O-N 3.17Å; S261-N265 VanDerWaalsContact O-N 3.07Å; L262-N265 PolarHBondContact O-N 3.06Å; N265-L268 PolarHBondContact O-N 3.42Å; N265-N269 PolarHBondContact O-N 3.34Å
266	L	44.5	Very low	45.4	Very low	108 Å²	108	132.4 Å²	132.4	57%	0.565	63%	0.627	S	S	*	*	H	α-helix	trans	-64.1	-50.3	172.7	-70.2	165.1	0	0	0	110.7	L262 L268 N269	L262-L266 WeakPolarHBondContact O-CG 3.31Å; L262-L266 PolarHBondContact O-N 3.21Å; L266-L268 PolarHBondContact O-N 3.24Å; L266-N269 PolarHBondContact O-N 3Å; L266-N269 VanDerWaalsContact O-N 3.15Å
267	M	40.4	Very low	44.3	Very low	139 Å²	139	131.8 Å²	131.8	69%	0.685	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	1.5	176.9	-64.9	-84.6	179.6	0	0	114.7	L263	L263-M267 HydrophobicContact CG-CG 4.42Å; L263-M267 VanDerWaalsContact O-CB 3.22Å; L263-M267 WeakPolarHBondContact O-CB 3.37Å; L263-M267 WeakPolarHBondContact O-CG 3.42Å; L263-M267 PolarHBondContact O-N 3.16Å
268	L	44.7	Very low	43.1	Very low	131 Å²	131	131.4 Å²	131.4	69%	0.686	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	-1.3	176.5	-75.3	172.2	0	0	0	113.3	R264 N265 L266	R264-L268 WeakPolarHBondContact O-CB 3.41Å; R264-L268 WeakPolarHBondContact O-CD1 3.47Å; R264-L268 WeakPolarHBondContact O-CG 3.48Å; R264-L268 PolarHBondContact O-N 2.97Å; N265-L268 PolarHBondContact O-N 3.42Å; L266-L268 PolarHBondContact O-N 3.24Å
269	N	38.6	Very low	41.2	Very low	128 Å²	128	133.3 Å²	133.3	68%	0.684	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-12.7	179.9	-85.9	4.9	0	0	0	114	N265 L266 N271	N265-N269 PolarHBondContact O-N 3.34Å; L266-N269 PolarHBondContact O-N 3Å; L266-N269 VanDerWaalsContact O-N 3.15Å; N269-N271 PolarHBondContact O-N 3.14Å
270	E	34.8	Very low	39.7	Very low	175 Å²	175	132.2 Å²	132.2	82%	0.818	67%	0.666	S	S	*	*			trans	-76.6	106.4	168	-70	-172.8	143.8	0	0	109.4
271	N	31.9	Very low	38.2	Very low	136 Å²	136	131.2 Å²	131.2	73%	0.727	68%	0.678	S	S	*	*			trans	-77	161.4	171.4	-64.5	-74.5	0	0	0	110.5	N269	N269-N271 PolarHBondContact O-N 3.14Å
272	D	33.5	Very low	36.5	Very low	143 Å²	143	136 Å²	136	77%	0.765	70%	0.697	S	S	*	*	S	Bend	trans	67.5	95.9	166.8	-58.4	-41.7	0	0	0	119.2	K274	D272-K274 PolarHBondContact O-N 2.85Å
273	H	30.3	Very low	35.2	Very low	182 Å²	182	142.8 Å²	142.8	84%	0.843	72%	0.724	S	S	*	*				53.1	67.6	126.8	-72.8	-76.4	0	0	0	119.2
274	K	29.8	Very low	33.8	Very low	189 Å²	189	144.5 Å²	144.5	82%	0.822	74%	0.741	S	S	*	*			trans	-161.1	141.2	136.3	-109.9	155.8	-173.1	176.7	0	112.5	D272	D272-K274 PolarHBondContact O-N 2.85Å
275	P	32.9	Very low	32.8	Very low	123 Å²	123	144.2 Å²	144.2	80%	0.799	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-69.6	132.1	159.3	31.1	-31.4	0	0	0	108.7
276	F	27.5	Very low	31.9	Very low	196 Å²	196	144.9 Å²	144.9	86%	0.86	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-84.6	125.3	171.1	-125.4	-86.1	0	0	0	108.8
277	D	28.7	Very low	31.1	Very low	138 Å²	138	147.7 Å²	147.7	74%	0.738	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-70.8	129.4	177	-107.6	-43.9	0	0	0	110.8	T279	D277-T279 VanDerWaalsContact C-N 3.27Å; D277-T279 PolarHBondContact O-N 3.29Å
278	H	29	Very low	30.6	Very low	192 Å²	192	149.8 Å²	149.8	89%	0.889	77%	0.773	S	S	*	*	S	Bend	trans	-82.4	55.9	-172.9	-83.6	-60.8	0	0	0	113.2
279	T	27.8	Very low	29.9	Very low	116 Å²	116	150.8 Å²	150.8	71%	0.712	78%	0.779	S	S	*	*			trans	-131.8	8.6	-172.5	50.4	0	0	0	0	117.9	D277	D277-T279 VanDerWaalsContact C-N 3.27Å; D277-T279 PolarHBondContact O-N 3.29Å
280	T	29.3	Very low	29.4	Very low	126 Å²	126	149.4 Å²	149.4	77%	0.773	78%	0.779	S	S	*	*	S	Bend	trans	-145	130.4	169.1	29.4	0	0	0	0	116.4
281	S	25.3	Very low	29.1	Very low	104 Å²	104	147.3 Å²	147.3	73%	0.727	78%	0.779	S	S	*	*			trans	35.3	93.8	146.9	62.7	0	0	0	0	120.9
282	I	28.8	Very low	29.1	Very low	164 Å²	164	146.9 Å²	146.9	84%	0.841	78%	0.783	S	S	*	*			trans	-131.2	89	135.9	-56.2	-177.7	0	0	0	108.1
283	F	25.6	Very low	29	Very low	206 Å²	206	145.9 Å²	145.9	90%	0.904	78%	0.782	S	S	*	*			trans	-128.6	64.6	-175.3	-130.6	-65.7	0	0	0	110.4
284	S	29.8	Very low	28.8	Very low	97 Å²	97	143.4 Å²	143.4	68%	0.678	78%	0.782	S	S	*	*			trans	-158.4	79.9	-175.3	57.1	0	0	0	0	114.3
285	L	27	Very low	28.8	Very low	142 Å²	142	141.7 Å²	141.7	74%	0.743	78%	0.78	S	S	*	*			trans	49.8	168.5	135.5	-95.3	83.5	0	0	0	121	F287	L285-F287 HydrophobicContact CD2-CD2 4.46Å; L285-F287 HydrophobicContact CG-CD2 4.44Å
286	P	30.3	Very low	28.6	Very low	108 Å²	108	142.2 Å²	142.2	70%	0.701	78%	0.781	S	S	*	*			cis	-118.1	157.6	14	29.8	-9.9	0	0	0	117.6
287	F	26.3	Very low	28.4	Very low	166 Å²	166	140.2 Å²	140.2	73%	0.728	78%	0.779	S	S	*	*			trans	-62	146.3	165.1	-83.6	-128.3	0	0	0	111.7	L285	L285-F287 HydrophobicContact CD2-CD2 4.46Å; L285-F287 HydrophobicContact CG-CD2 4.44Å
288	F	30.7	Very low	28.3	Very low	183 Å²	183	139.5 Å²	139.5	80%	0.803	78%	0.782	S	S	*	*			trans	-141.8	120.9	148.3	-94.6	-84.9	0	0	0	110.3
289	L	30.2	Very low	28.1	Very low	153 Å²	153	137.6 Å²	137.6	80%	0.801	78%	0.777	S	S	*	*			trans	46.2	101.4	155.2	-55.5	170	0	0	0	116.7
290	S	27.1	Very low	28	Very low	99 Å²	99	139.2 Å²	139.2	69%	0.692	78%	0.781	S	S	*	*			cis	74	55	40.5	-44.1	0	0	0	0	117.1
291	T	30.3	Very low	27.9	Very low	131 Å²	131	140 Å²	140	80%	0.804	78%	0.78	S	S	*	*			trans	-154.1	128.2	145.8	43.4	0	0	0	0	111.3
292	P	29.9	Very low	27.9	Very low	126 Å²	126	143.3 Å²	143.3	82%	0.818	79%	0.787	S	S	*	*			trans	-101.9	125.5	172.1	34.9	-27.9	0	0	0	112.6
293	T	31.6	Very low	27.7	Very low	122 Å²	122	142.2 Å²	142.2	75%	0.748	78%	0.783	S	S	*	*			trans	-134.3	115.6	165.8	45.8	0	0	0	0	110.4
294	P	27.6	Very low	27.8	Very low	130 Å²	130	141.1 Å²	141.1	84%	0.844	78%	0.78	S	S	*	*			trans	-84.8	125.7	177.8	32	-31.5	0	0	0	110.8
295	I	29.4	Very low	27.5	Very low	153 Å²	153	146.7 Å²	146.7	79%	0.785	79%	0.792	S	S	*	*			trans	-128.6	126.4	169.4	-61	-179.2	0	0	0	108.9
296	T	27.9	Very low	27.4	Very low	134 Å²	134	147.4 Å²	147.4	82%	0.822	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-78.2	137.3	-176.3	46.8	0	0	0	0	112.7
297	L	23	Very low	27.1	Very low	154 Å²	154	147.3 Å²	147.3	81%	0.806	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-82.4	142.9	173.3	-67.1	85.5	0	0	0	112
298	P	28.2	Very low	27.2	Very low	123 Å²	123	145.7 Å²	145.7	80%	0.799	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-83.5	133.3	145.4	7.3	11.4	0	0	0	109.9
299	I	24.7	Very low	27	Very low	153 Å²	153	141.1 Å²	141.1	79%	0.785	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-84.5	130.3	173.6	-63.3	163.7	0	0	0	109.1
300	N	26.1	Very low	26.9	Very low	149 Å²	149	139.8 Å²	139.8	80%	0.797	77%	0.773	S	S	*	*			trans	-174.8	163.4	142.2	-97.9	-34.1	0	0	0	113.5
301	N	25.6	Very low	26.8	Very low	142 Å²	142	138.7 Å²	138.7	76%	0.759	76%	0.764	S	S	*	*			trans	60.8	72	170.8	-69.5	-8.1	0	0	0	118.5
302	M	25.6	Very low	26.7	Very low	175 Å²	175	135.9 Å²	135.9	86%	0.862	75%	0.745	S	S	*	*			trans	-106.2	72.3	156	-83.8	-72.5	173.2	0	0	110.7
303	N	25	Very low	26.5	Very low	141 Å²	141	140 Å²	140	75%	0.754	74%	0.744	S	S	*	*			trans	-136.3	49.4	-173.9	-98.6	-17.6	0	0	0	113.1
304	H	26.5	Very low	26.4	Very low	182 Å²	182	140.8 Å²	140.8	84%	0.843	74%	0.744	S	S	*	*			trans	-165.6	80.6	162.4	-97.2	-57.4	0	0	0	113
305	F	25.4	Very low	26.9	Very low	214 Å²	214	140.2 Å²	140.2	94%	0.939	73%	0.729	S	S	*	*			trans	-150	83.3	157.1	-90.7	-66.1	0	0	0	110.7
306	N	23.2	Very low	26.9	Very low	158 Å²	158	140 Å²	140	85%	0.845	73%	0.729	S	S	*	*			trans	-97.4	168.8	162.6	-98.6	-36.3	0	0	0	109.9
307	S	24.5	Very low	27	Very low	105 Å²	105	141.3 Å²	141.3	73%	0.734	73%	0.729	S	S	*	*			trans	65.1	58.7	172.2	75	0	0	0	0	119
308	V	28.1	Very low	27.2	Very low	132 Å²	132	138.1 Å²	138.1	80%	0.8	71%	0.713	S	S	*	*			trans	-128.4	116.8	134.1	-177	0	0	0	0	108.3	L310	V308-L310 HydrophobicContact CG1-CD1 4.26Å; V308-L310 PolarHBondContact O-N 3.27Å
309	Y	26.9	Very low	27.1	Very low	88 Å²	88	140.2 Å²	140.2	35%	0.345	72%	0.717	S	S	.	*			trans	-87	108.7	-178.1	-87.6	-107.1	0	0	0	111.7	R503 H514 N518	Y309-R503 VanDerWaalsContact CZ-NH1 3.3Å; Y309-H514 AromaticContact CE1-ND1 3.96Å; Y309-H514 AromaticContact CZ-ND1 3.93Å; Y309-H514 PolarHBondContact OH-CE1 2.96Å; Y309-H514 PolarHBondContact OH-ND1 2.72Å; Y309-N518 PolarHBondContact OH-ND2 3.21Å; Y309-N518 VanDerWaalsContact OH-ND2 3.09Å; Y309-N518 PolarHBondContact OH-OD1 2.87Å
310	L	27.4	Very low	27.2	Very low	124 Å²	124	138.4 Å²	138.4	65%	0.649	72%	0.718	S	S	*	*			trans	-104.2	123.4	150	-72.5	92.3	0	0	0	108.7	V308	V308-L310 HydrophobicContact CG1-CD1 4.26Å; V308-L310 PolarHBondContact O-N 3.27Å
311	C	25.1	Very low	27.3	Very low	76 Å²	76	135.2 Å²	135.2	51%	0.514	71%	0.707	S	S	.	*	S	Bend	trans	-74.9	139	167.9	-65.5	0	0	0	0	109.6
312	N	28	Very low	27.4	Very low	73 Å²	73	132.5 Å²	132.5	39%	0.39	71%	0.712	S	S	.	*			trans	63.6	81.8	173.8	-61.9	18	0	0	0	116
313	W	27.7	Very low	27.6	Very low	212 Å²	212	129.5 Å²	129.5	80%	0.803	71%	0.709	S	S	*	*			trans	-96.4	-7	153.3	-95.7	62.3	0	0	0	113.4	H315	W313-H315 PolarHBondContact O-N 2.98Å
314	D	29.6	Very low	27.8	Very low	139 Å²	139	130.8 Å²	130.8	74%	0.743	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	20.6	-175.4	-59.1	-45.4	0	0	0	115.3
315	H	36.9	Very low	28	Very low	117 Å²	117	130 Å²	130	54%	0.542	71%	0.713	S	S	.	*	T	Hydrogen-bonded Turn	trans	-129.3	15.7	-173.7	-66.3	-13	0	0	0	114	W313	W313-H315 PolarHBondContact O-N 2.98Å
316	L	28.7	Very low	28.1	Very low	150 Å²	150	127 Å²	127	79%	0.785	71%	0.706	S	S	*	*			trans	-134.2	40.7	-178.1	-79.3	174	0	0	0	114.3
317	I	30.1	Very low	28.4	Very low	161 Å²	161	126.6 Å²	126.6	83%	0.826	71%	0.709	S	S	*	*			trans	-132.6	81.7	163.6	-51	180	0	0	0	109.5
318	D	27.5	Very low	28.6	Very low	86 Å²	86	125.4 Å²	125.4	46%	0.46	71%	0.706	S	S	.	*			trans	-136.7	57.2	166.7	-112.7	-6	0	0	0	107	T461 R478	D318-T461 WeakPolarHBondContact OD2-CG2 3.36Å; D318-R478 IonicContact OD2-NH1 2.96Å; D318-R478 PolarHBondContact OD2-NH1 3.3Å
319	L	27	Very low	28.4	Very low	167 Å²	167	124.2 Å²	124.2	87%	0.874	70%	0.703	S	S	*	*			trans	-132.6	79.5	-178.8	-84.1	167.4	0	0	0	108.7
320	S	26	Very low	28.4	Very low	115 Å²	115	128.2 Å²	128.2	80%	0.804	73%	0.729	S	S	*	*			trans	-150.5	46.5	-177.6	58.4	0	0	0	0	113.4
321	S	28.3	Very low	28.2	Very low	82 Å²	82	131 Å²	131	57%	0.573	74%	0.738	S	S	*	*			trans	-157.6	52.4	174.1	57.3	0	0	0	0	112
322	G	28.8	Very low	28.3	Very low	85 Å²	85	134.1 Å²	134.1	88%	0.876	76%	0.755	S	S	*	*			trans	-97.4	104.4	160.8	0	0	0	0	0	108.2
323	S	28.3	Very low	28.1	Very low	113 Å²	113	137.3 Å²	137.3	79%	0.79	78%	0.778	S	S	*	*			trans	-115.7	95.4	-178.6	58.1	0	0	0	0	110.3
324	D	31.1	Very low	28	Very low	167 Å²	167	133.2 Å²	133.2	89%	0.893	78%	0.778	S	S	*	*			trans	-118.4	144.7	165.7	-84.2	-60.2	0	0	0	110.1
325	Q	30.7	Very low	27.9	Very low	167 Å²	167	134.7 Å²	134.7	78%	0.78	79%	0.785	S	S	*	*			trans	-92.5	169.7	-176.4	-64	-173.2	-4.8	0	0	111.5
326	N	26.4	Very low	27.4	Very low	149 Å²	149	135.8 Å²	135.8	80%	0.797	80%	0.795	S	S	*	*			trans	72.1	99.2	170	-46	-54.3	0	0	0	116
327	V	30.1	Very low	27.3	Very low	150 Å²	150	136.9 Å²	136.9	91%	0.909	80%	0.801	S	S	*	*				-154.7	149.2	110.4	140.6	0	0	0	0	107.8
328	A	27.9	Very low	27.1	Very low	80 Å²	80	133.5 Å²	133.5	66%	0.661	80%	0.797	S	S	*	*			trans	-83.7	159.3	-169	0	0	0	0	0	114.3
329	S	23.8	Very low	27.2	Very low	107 Å²	107	138.7 Å²	138.7	75%	0.748	82%	0.821	S	S	*	*			trans	48.5	115.8	149.1	60.4	0	0	0	0	119.8
330	I	27.9	Very low	27.3	Very low	172 Å²	172	139.5 Å²	139.5	88%	0.882	82%	0.817	S	S	*	*				-159.7	146.6	113.6	-98.2	150.3	0	0	0	108.7
331	Q	22.7	Very low	27.5	Very low	183 Å²	183	142.4 Å²	142.4	86%	0.855	82%	0.823	S	S	*	*			trans	-85.4	146.1	-175	-60.7	159.8	-80	0	0	112.1
332	T	27.6	Very low	27.3	Very low	142 Å²	142	144.6 Å²	144.6	87%	0.871	83%	0.828	S	S	*	*			trans	-163.1	129.7	130.5	26.8	0	0	0	0	109.9
333	T	22.7	Very low	27.3	Very low	140 Å²	140	146.1 Å²	146.1	86%	0.859	83%	0.825	S	S	*	*			trans	-121.9	139.2	167	49.6	0	0	0	0	109.5
334	P	25.2	Very low	27.4	Very low	126 Å²	126	145 Å²	145	82%	0.818	82%	0.818	S	S	*	*				-146.4	171.7	122.6	34.2	-18	0	0	0	112
335	L	27.8	Very low	27.1	Very low	169 Å²	169	143.9 Å²	143.9	89%	0.885	81%	0.812	S	S	*	*			cis	-155.8	151.4	-30.2	176.5	64.3	0	0	0	105.6
336	N	26	Very low	27	Very low	141 Å²	141	142 Å²	142	75%	0.754	82%	0.815	S	S	*	*			trans	-87.4	142.7	-175.1	-154.4	-10.2	0	0	0	111.8
337	L	28.1	Very low	26.9	Very low	172 Å²	172	142.1 Å²	142.1	90%	0.901	82%	0.816	S	S	*	*			trans	-151.7	134.5	155.7	-150.4	72.3	0	0	0	111.5
338	A	25.5	Very low	26.8	Very low	90 Å²	90	141 Å²	141	74%	0.744	80%	0.804	S	S	*	*			trans	-131.6	151.6	176.3	0	0	0	0	0	109.4
339	M	30.1	Very low	26.7	Very low	196 Å²	196	143 Å²	143	97%	0.966	81%	0.807	S	S	*	*			trans	-108.4	134.8	170.8	-83.8	-175.1	146.8	0	0	110.8
340	K	29.4	Very low	26.8	Very low	183 Å²	183	143.9 Å²	143.9	80%	0.796	81%	0.809	S	S	*	*			trans	-147.2	118.8	174.2	-174.9	-175.8	-178.5	-172.2	0	106.9
341	L	29	Very low	26.8	Very low	176 Å²	176	140.5 Å²	140.5	92%	0.921	80%	0.8	S	S	*	*			trans	-97.5	143.4	171.1	-72.4	171.2	0	0	0	109.4
342	N	24.8	Very low	27	Very low	129 Å²	129	137.2 Å²	137.2	69%	0.69	79%	0.793	S	S	*	*			trans	-102.9	-172.2	-178.2	-76.2	-22.2	0	0	0	110.5
343	S	28.7	Very low	27.2	Very low	116 Å²	116	136.5 Å²	136.5	81%	0.811	79%	0.788	S	S	*	*			trans	93	138.9	157.6	-49.6	0	0	0	0	117.5
344	S	29.3	Very low	27.7	Very low	90 Å²	90	134 Å²	134	63%	0.629	78%	0.777	S	S	*	*			cis	-163.2	165.6	-23.9	60.8	0	0	0	0	111.4
345	D	26.6	Very low	27.9	Very low	144 Å²	144	134.9 Å²	134.9	77%	0.77	77%	0.773	S	S	*	*			trans	67.7	166.6	153.2	-49.2	-43.4	0	0	0	121.6
346	C	27	Very low	27.9	Very low	126 Å²	126	132.6 Å²	132.6	85%	0.851	77%	0.766	S	S	*	*			trans	70.6	79.2	-175.4	-57.7	0	0	0	0	115.4
347	N	25.7	Very low	28.2	Very low	152 Å²	152	131.9 Å²	131.9	81%	0.813	77%	0.767	S	S	*	*			cis	84	145.6	36	-149.3	5.7	0	0	0	115.2
348	I	26.9	Very low	28.3	Very low	128 Å²	128	130.6 Å²	130.6	66%	0.656	76%	0.761	S	S	*	*			trans	82.7	98.4	163.4	-65.2	163.5	0	0	0	120.2
349	T	25.6	Very low	28.6	Very low	120 Å²	120	132.4 Å²	132.4	74%	0.736	76%	0.763	S	S	*	*			trans	63.8	158.3	141.3	67.3	0	0	0	0	119.7
350	T	26.1	Very low	28.7	Very low	127 Å²	127	129.4 Å²	129.4	78%	0.779	76%	0.756	S	S	*	*			cis	-166.9	171.3	-5.5	13.2	0	0	0	0	107.8
351	S	28.6	Very low	28.6	Very low	100 Å²	100	127.3 Å²	127.3	70%	0.699	76%	0.759	S	S	*	*			cis	-155.3	-167.4	-2.5	-149.7	0	0	0	0	112
352	T	26.6	Very low	28.8	Very low	114 Å²	114	124.8 Å²	124.8	70%	0.699	76%	0.756	S	S	*	*			trans	-48.4	158.2	157.3	56.1	0	0	0	0	114.4
353	T	31.8	Very low	29.1	Very low	127 Å²	127	124.3 Å²	124.3	78%	0.779	76%	0.762	S	S	*	*				-169.1	171.2	53.5	34.5	0	0	0	0	110.5
354	S	32.2	Very low	29.4	Very low	87 Å²	87	127 Å²	127	61%	0.608	77%	0.766	S	S	*	*			cis	-176.2	148.8	-24	58	0	0	0	0	111.9
355	I	30.2	Very low	29.4	Very low	146 Å²	146	128 Å²	128	75%	0.749	77%	0.773	S	S	*	*			trans	66.5	110.4	136.2	-68.4	170	0	0	0	120.8
356	T	28.2	Very low	29.8	Very low	121 Å²	121	126.2 Å²	126.2	74%	0.742	77%	0.772	S	S	*	*			trans	37	152.8	131.2	74.8	0	0	0	0	121.8
357	T	32.5	Very low	29.9	Very low	125 Å²	125	125.5 Å²	125.5	77%	0.767	77%	0.768	S	S	*	*				-150.2	160.4	54	49.1	0	0	0	0	116.8
358	N	28.8	Very low	30.3	Very low	145 Å²	145	122.5 Å²	122.5	78%	0.775	76%	0.764	S	S	*	*			trans	-92	-165.7	173.8	-69.8	-25.6	0	0	0	112.1
359	T	32.1	Very low	30.4	Very low	129 Å²	129	122.1 Å²	122.1	79%	0.791	77%	0.768	S	S	*	*			trans	86.7	139.1	162.3	75.5	0	0	0	0	116.4
360	T	32.4	Very low	30.6	Very low	133 Å²	133	122.5 Å²	122.5	82%	0.816	77%	0.771	S	S	*	*			cis	-152.7	160.9	-15.4	5.2	0	0	0	0	110.9
361	T	27.9	Very low	30.9	Very low	139 Å²	139	122.1 Å²	122.1	85%	0.853	77%	0.768	S	S	*	*			trans	-79.8	138.1	172.4	48.4	0	0	0	0	113.2
362	S	33.7	Very low	30.8	Very low	122 Å²	122	123.3 Å²	123.3	85%	0.853	77%	0.772	S	S	*	*			trans	-155.1	129.6	150.6	52.1	0	0	0	0	111.1
363	S	30.1	Very low	31.1	Very low	119 Å²	119	123.5 Å²	123.5	83%	0.832	78%	0.777	S	S	*	*			trans	-103.7	136.5	-179.2	53.4	0	0	0	0	111.2
364	I	35	Very low	31	Very low	173 Å²	173	123.3 Å²	123.3	89%	0.887	78%	0.776	S	S	*	*			trans	-131.4	139.2	164.5	-60.6	-177.6	0	0	0	108.9
365	S	29.7	Very low	31	Very low	110 Å²	110	127.4 Å²	127.4	77%	0.769	79%	0.789	S	S	*	*			trans	-115.8	135.2	-173.3	54.5	0	0	0	0	112.3
366	S	35.1	Very low	30.9	Very low	108 Å²	108	128.5 Å²	128.5	76%	0.755	79%	0.791	S	S	*	*			trans	-169.6	109.5	154.7	53	0	0	0	0	114
367	S	29.7	Very low	31	Very low	111 Å²	111	127.7 Å²	127.7	78%	0.776	80%	0.797	S	S	*	*			trans	29.6	146.9	133.6	60.2	0	0	0	0	124
368	A	32.7	Very low	30.9	Very low	88 Å²	88	126.6 Å²	126.6	73%	0.727	79%	0.792	S	S	*	*			trans	79.4	146.6	149.9	0	0	0	0	0	117.6
369	T	30.1	Very low	31.1	Very low	121 Å²	121	127.2 Å²	127.2	74%	0.742	79%	0.794	S	S	*	*			cis	-163.6	164.4	-12.8	15.1	0	0	0	0	109.4
370	T	28.8	Very low	31.1	Very low	128 Å²	128	127.4 Å²	127.4	79%	0.785	79%	0.79	S	S	*	*			trans	64.8	156.2	161	41.1	0	0	0	0	117.1
371	T	32.2	Very low	30.8	Very low	119 Å²	119	131 Å²	131	73%	0.73	79%	0.79	S	S	*	*			cis	-146.8	161.7	11.4	-15.5	0	0	0	0	112.6
372	T	27.6	Very low	31	Very low	125 Å²	125	132.1 Å²	132.1	77%	0.767	79%	0.79	S	S	*	*			trans	-21.7	153.9	158.4	54.9	0	0	0	0	118
373	S	32.7	Very low	30.9	Very low	117 Å²	117	130.9 Å²	130.9	82%	0.818	78%	0.779	S	S	*	*				-163	173.1	53.8	56.4	0	0	0	0	116.2
374	T	28.6	Very low	30.9	Very low	124 Å²	124	133.4 Å²	133.4	76%	0.761	78%	0.783	S	S	*	*			trans	-116.9	156	-175.3	46.2	0	0	0	0	113.1
375	I	33.8	Very low	30.4	Very low	172 Å²	172	128.5 Å²	128.5	88%	0.882	78%	0.775	S	S	*	*			trans	-136.5	135.7	156.6	-62.1	-175.2	0	0	0	109.1
376	H	26.6	Very low	30.3	Very low	169 Å²	169	131.1 Å²	131.1	78%	0.782	78%	0.78	S	S	*	*			trans	-101.7	153.8	179.2	-91.9	-76.3	0	0	0	112.4
377	A	30.6	Very low	29.8	Very low	105 Å²	105	133.2 Å²	133.2	87%	0.868	78%	0.777	S	S	*	*			trans	-159.2	96.2	151	0	0	0	0	0	113.1
378	P	30.8	Very low	29.7	Very low	101 Å²	101	136.2 Å²	136.2	66%	0.656	78%	0.777	S	S	*	*			trans	-105.6	151.8	163.2	36.9	-29.5	0	0	0	111.9
379	I	33.1	Very low	29.6	Very low	159 Å²	159	136.1 Å²	136.1	82%	0.815	77%	0.767	S	S	*	*			trans	-165.6	130.9	158.4	-108.5	149.7	0	0	0	114.1
380	N	32.2	Very low	29.7	Very low	132 Å²	132	135.9 Å²	135.9	71%	0.706	76%	0.761	S	S	*	*			trans	52	116.6	152.9	-56.9	-10.3	0	0	0	125.1
381	Y	26.8	Very low	29.8	Very low	209 Å²	209	133.4 Å²	133.4	82%	0.82	75%	0.746	S	S	*	*				16.6	138.9	125.1	-60.2	-83.4	0	0	0	119.5
382	L	31.5	Very low	29.9	Very low	162 Å²	162	133.5 Å²	133.5	85%	0.848	74%	0.738	S	S	*	*				-159.1	154.2	64.4	-162.2	61.7	0	0	0	111.6
383	P	32.2	Very low	30.2	Very low	96 Å²	96	134.8 Å²	134.8	62%	0.623	73%	0.733	S	S	*	*			trans	-99	157.8	-167.3	37.7	-36.2	0	0	0	115.6
384	N	29	Very low	30.3	Very low	172 Å²	172	132.8 Å²	132.8	92%	0.92	72%	0.716	S	S	*	*			trans	-164.6	145.4	130.8	-96	-33	0	0	0	109.9
385	G	25	Very low	30.5	Very low	71 Å²	71	131.5 Å²	131.5	73%	0.732	70%	0.704	S	S	*	*			trans	-90.1	159.8	-159.9	0	0	0	0	0	116.4
386	L	26.7	Very low	30.6	Very low	164 Å²	164	128.3 Å²	128.3	86%	0.859	69%	0.689	S	S	*	*			trans	-168.5	95.3	131	-101.8	165.3	0	0	0	112.6
387	H	25.4	Very low	31.2	Very low	152 Å²	152	124.1 Å²	124.1	70%	0.704	68%	0.675	S	S	*	*			trans	44.2	87.9	136.7	-152.4	-88.9	0	0	0	120.4	T389	H387-T389 PolarHBondContact CE1-OG1 2.84Å; H387-T389 VanDerWaalsContact CE1-OG1 3.27Å
388	F	27.2	Very low	31.4	Very low	174 Å²	174	123.6 Å²	123.6	76%	0.763	66%	0.655	S	S	*	*			trans	-117.5	79.8	167	-103.2	-91.5	0	0	0	112.6	T391	F388-T391 HydrophobicContact CD1-CG2 4.32Å
389	T	31	Very low	31.8	Very low	86 Å²	86	121.2 Å²	121.2	53%	0.528	64%	0.64	S	S	.	*			trans	-93.1	-1.6	-178.9	51.1	0	0	0	0	114.9	H387	H387-T389 PolarHBondContact CE1-OG1 2.84Å; H387-T389 VanDerWaalsContact CE1-OG1 3.27Å
390	N	31.8	Very low	32.2	Very low	116 Å²	116	120.6 Å²	120.6	62%	0.62	63%	0.629	S	S	*	*	S	Bend	trans	-89.5	-29.7	-175.1	-81.1	-21.5	0	0	0	114.9	Q392 K393 V394	N390-Q392 PolarHBondContact O-N 3.05Å; N390-K393 PolarHBondContact O-N 3.07Å; N390-V394 PolarHBondContact O-N 3.44Å
391	T	30.6	Very low	32.7	Very low	76 Å²	76	119.1 Å²	119.1	47%	0.466	62%	0.62	S	S	.	*	H	α-helix	trans	-63.2	-41.2	-175.5	44.9	0	0	0	0	112.8	F388 K393 V394 L395	F388-T391 HydrophobicContact CD1-CG2 4.32Å; T391-K393 VanDerWaalsContact C-N 3.28Å; T391-K393 PolarHBondContact O-N 3.38Å; T391-V394 PolarHBondContact O-N 2.96Å; T391-L395 PolarHBondContact O-N 3.24Å
392	Q	34.4	Very low	33.6	Very low	121 Å²	121	114 Å²	114	57%	0.565	61%	0.606	S	S	*	*	H	α-helix	trans	-66.9	-28	178.9	-150	68.4	31.4	0	0	113.1	N390 N396	N390-Q392 PolarHBondContact O-N 3.05Å; Q392-N396 WeakPolarHBondContact O-CB 3.49Å; Q392-N396 VanDerWaalsContact O-CG 3.28Å; Q392-N396 PolarHBondContact O-N 3.18Å; Q392-N396 PolarHBondContact O-ND2 3.02Å
393	K	34.4	Very low	34.4	Very low	153 Å²	153	113 Å²	113	67%	0.665	60%	0.595	S	S	*	*	H	α-helix	trans	-69.1	-45.2	173.2	-93.4	-175.7	174.1	178.9	0	111.4	N390 T391 N396 T397	N390-K393 PolarHBondContact O-N 3.07Å; T391-K393 VanDerWaalsContact C-N 3.28Å; T391-K393 PolarHBondContact O-N 3.38Å; K393-N396 PolarHBondContact O-N 3.33Å; K393-T397 PolarHBondContact O-N 3.48Å; K393-T397 PolarHBondContact O-OG1 3.37Å; K393-T397 VanDerWaalsContact O-OG1 3.11Å
394	V	35	Very low	35	Very low	74 Å²	74	111 Å²	111	45%	0.448	58%	0.582	S	S	.	*	H	α-helix	trans	-58.1	-52.4	179.4	175.8	0	0	0	0	110.8	N390 T391 N396 T397 E398	N390-V394 PolarHBondContact O-N 3.44Å; T391-V394 PolarHBondContact O-N 2.96Å; V394-N396 VanDerWaalsContact C-N 3.29Å; V394-N396 PolarHBondContact O-N 2.86Å; V394-T397 WeakPolarHBondContact CA-OG1 3.37Å; V394-T397 PolarHBondContact O-N 3.4Å; V394-T397 VanDerWaalsContact O-N 3.09Å; V394-T397 PolarHBondContact O-OG1 3.02Å; V394-E398 HydrophobicContact CG1-CG 4.36Å; V394-E398 WeakPolarHBondContact O-CG 3.14Å; V394-E398 PolarHBondContact O-N 2.94Å
395	L	32.4	Very low	35.5	Very low	97 Å²	97	106.1 Å²	106.1	51%	0.508	56%	0.562	S	S	.	*	H	α-helix	trans	-58.3	-38.6	178.6	-69.6	168.9	0	0	0	112.9	T391 S399	T391-L395 PolarHBondContact O-N 3.24Å; L395-S399 WeakPolarHBondContact O-CB 3.04Å; L395-S399 PolarHBondContact O-N 3.15Å
396	N	35	Very low	36.7	Very low	106 Å²	106	106.7 Å²	106.7	57%	0.567	55%	0.548	S	S	*	.	H	α-helix	trans	-70.4	-38.4	176.7	-75.6	-12.1	0	0	0	112.3	Q392 K393 V394 Y400	Q392-N396 WeakPolarHBondContact O-CB 3.49Å; Q392-N396 VanDerWaalsContact O-CG 3.28Å; Q392-N396 PolarHBondContact O-N 3.18Å; Q392-N396 PolarHBondContact O-ND2 3.02Å; K393-N396 PolarHBondContact O-N 3.33Å; V394-N396 VanDerWaalsContact C-N 3.29Å; V394-N396 PolarHBondContact O-N 2.86Å; N396-Y400 PolarHBondContact O-N 3.02Å; N396-Y400 VanDerWaalsContact O-N 3.1Å
397	T	41.1	Very low	37.9	Very low	80 Å²	80	105 Å²	105	49%	0.491	53%	0.533	S	S	.	.	H	α-helix	trans	-67.3	-41	173.8	45	0	0	0	0	112.3	K393 V394 Y400 I401	K393-T397 PolarHBondContact O-N 3.48Å; K393-T397 PolarHBondContact O-OG1 3.37Å; K393-T397 VanDerWaalsContact O-OG1 3.11Å; V394-T397 WeakPolarHBondContact CA-OG1 3.37Å; V394-T397 PolarHBondContact O-N 3.4Å; V394-T397 VanDerWaalsContact O-N 3.09Å; V394-T397 PolarHBondContact O-OG1 3.02Å; T397-Y400 PolarHBondContact O-N 3.15Å; T397-I401 VanDerWaalsContact O-CG1 3.27Å; T397-I401 WeakPolarHBondContact O-CG1 3.36Å; T397-I401 PolarHBondContact O-N 3.26Å
398	E	32.9	Very low	38.7	Very low	95 Å²	95	100.4 Å²	100.4	44%	0.444	52%	0.521	S	S	.	.	H	α-helix	trans	-63.3	-42.3	175.4	-71.3	173.3	165	0	0	111.2	V394 Y400 I401 I402	V394-E398 HydrophobicContact CG1-CG 4.36Å; V394-E398 WeakPolarHBondContact O-CG 3.14Å; V394-E398 PolarHBondContact O-N 2.94Å; E398-Y400 VanDerWaalsContact C-N 3.33Å; E398-Y400 PolarHBondContact O-N 3.43Å; E398-I401 PolarHBondContact O-N 3.38Å; E398-I402 WeakPolarHBondContact O-CB 3.41Å; E398-I402 VanDerWaalsContact O-CG1 3.25Å; E398-I402 WeakPolarHBondContact O-CG1 3.4Å; E398-I402 PolarHBondContact O-N 2.96Å
399	S	40.3	Very low	39.3	Very low	51 Å²	51	99.3 Å²	99.3	36%	0.357	51%	0.513	S	S	.	.	H	α-helix	trans	-59.8	-40.1	174	-165.3	0	0	0	0	112.7	L395 K403	L395-S399 WeakPolarHBondContact O-CB 3.04Å; L395-S399 PolarHBondContact O-N 3.15Å; S399-K403 WeakPolarHBondContact O-CB 3.32Å; S399-K403 VanDerWaalsContact O-CG 3.3Å; S399-K403 WeakPolarHBondContact O-CG 3.38Å; S399-K403 PolarHBondContact O-N 2.87Å
400	Y	40.7	Very low	40.1	Very low	145 Å²	145	100.3 Å²	100.3	57%	0.569	51%	0.512	S	S	*	.	H	α-helix	trans	-69.5	-41.5	176.4	-175	-91	0	0	0	112.5	N396 T397 E398 K403 S404	N396-Y400 PolarHBondContact O-N 3.02Å; N396-Y400 VanDerWaalsContact O-N 3.1Å; T397-Y400 PolarHBondContact O-N 3.15Å; E398-Y400 VanDerWaalsContact C-N 3.33Å; E398-Y400 PolarHBondContact O-N 3.43Å; Y400-K403 PolarHBondContact O-N 2.89Å; Y400-S404 WeakPolarHBondContact O-CB 3.43Å; Y400-S404 PolarHBondContact O-N 2.9Å; Y400-S404 PolarHBondContact O-OG 3.21Å
401	I	43	Very low	40.8	Very low	101 Å²	101	100 Å²	100	52%	0.518	51%	0.508	S	S	.	.	H	α-helix	trans	-62.4	-47.4	175.3	-69.5	163.4	0	0	0	110.2	T397 E398 S404 S405	T397-I401 VanDerWaalsContact O-CG1 3.27Å; T397-I401 WeakPolarHBondContact O-CG1 3.36Å; T397-I401 PolarHBondContact O-N 3.26Å; E398-I401 PolarHBondContact O-N 3.38Å; I401-S404 PolarHBondContact O-N 2.94Å; I401-S405 WeakPolarHBondContact O-CB 3.46Å; I401-S405 PolarHBondContact O-N 3.1Å; I401-S405 PolarHBondContact O-OG 3.46Å; I401-S405 VanDerWaalsContact O-OG 3.07Å
402	I	46.5	Very low	41.5	Very low	102 Å²	102	99.5 Å²	99.5	52%	0.523	51%	0.505	S	S	.	.	H	α-helix	trans	-61.7	-46.4	178.7	-70	165.1	0	0	0	110.9	E398 S404 S405 I406	E398-I402 WeakPolarHBondContact O-CB 3.41Å; E398-I402 VanDerWaalsContact O-CG1 3.25Å; E398-I402 WeakPolarHBondContact O-CG1 3.4Å; E398-I402 PolarHBondContact O-N 2.96Å; I402-S404 VanDerWaalsContact C-N 3.32Å; I402-S404 PolarHBondContact O-N 2.78Å; I402-S405 PolarHBondContact O-N 2.98Å; I402-I406 HydrophobicContact CG2-CD1 3.72Å; I402-I406 HydrophobicContact CG2-CG1 4.39Å; I402-I406 WeakPolarHBondContact O-CB 3.47Å; I402-I406 VanDerWaalsContact O-CG1 3.3Å; I402-I406 WeakPolarHBondContact O-CG1 3.36Å; I402-I406 PolarHBondContact O-N 3.07Å
403	K	47.2	Very low	41.9	Very low	142 Å²	142	96 Å²	96	62%	0.617	49%	0.49	S	S	*	.	H	α-helix	trans	-62.3	-37.7	176.4	-75.4	173.2	-180	174	0	112.7	S399 Y400 K407	S399-K403 WeakPolarHBondContact O-CB 3.32Å; S399-K403 VanDerWaalsContact O-CG 3.3Å; S399-K403 WeakPolarHBondContact O-CG 3.38Å; S399-K403 PolarHBondContact O-N 2.87Å; Y400-K403 PolarHBondContact O-N 2.89Å; K403-K407 WeakPolarHBondContact O-CB 3.46Å; K403-K407 PolarHBondContact O-N 2.98Å
404	S	45.4	Very low	42.4	Very low	52 Å²	52	94.8 Å²	94.8	36%	0.364	49%	0.487	S	S	.	.	H	α-helix	trans	-68.4	-40.8	176.3	-59.3	0	0	0	0	111.9	Y400 I401 I402 A408	Y400-S404 WeakPolarHBondContact O-CB 3.43Å; Y400-S404 PolarHBondContact O-N 2.9Å; Y400-S404 PolarHBondContact O-OG 3.21Å; I401-S404 PolarHBondContact O-N 2.94Å; I402-S404 VanDerWaalsContact C-N 3.32Å; I402-S404 PolarHBondContact O-N 2.78Å; S404-A408 WeakPolarHBondContact O-CB 3.4Å; S404-A408 PolarHBondContact O-N 3.31Å
405	S	40.5	Very low	42.5	Very low	71 Å²	71	94.5 Å²	94.5	50%	0.497	48%	0.483	S	S	.	.	H	α-helix	trans	-65.8	-42.1	174.8	-66.6	0	0	0	0	112.5	I401 I402 A408 Y409	I401-S405 WeakPolarHBondContact O-CB 3.46Å; I401-S405 PolarHBondContact O-N 3.1Å; I401-S405 PolarHBondContact O-OG 3.46Å; I401-S405 VanDerWaalsContact O-OG 3.07Å; I402-S405 PolarHBondContact O-N 2.98Å; S405-A408 PolarHBondContact O-N 2.82Å; S405-Y409 WeakPolarHBondContact O-CB 3.15Å; S405-Y409 PolarHBondContact O-N 2.98Å
406	I	48.3	Very low	43	Very low	83 Å²	83	95.1 Å²	95.1	43%	0.426	48%	0.481	S	S	.	.	H	α-helix	trans	-61.3	-50.4	174.7	-70.9	167	0	0	0	109.9	I402 A408 Y409 E410	I402-I406 HydrophobicContact CG2-CD1 3.72Å; I402-I406 HydrophobicContact CG2-CG1 4.39Å; I402-I406 WeakPolarHBondContact O-CB 3.47Å; I402-I406 VanDerWaalsContact O-CG1 3.3Å; I402-I406 WeakPolarHBondContact O-CG1 3.36Å; I402-I406 PolarHBondContact O-N 3.07Å; I406-A408 VanDerWaalsContact C-N 3.3Å; I406-A408 PolarHBondContact O-N 3.03Å; I406-Y409 CarbonylContact O-C 3.54Å; I406-Y409 WeakPolarHBondContact O-CA 3.33Å; I406-Y409 WeakPolarHBondContact O-CB 3.43Å; I406-Y409 PolarHBondContact O-N 3.4Å; I406-E410 HydrophobicContact CG2-CG 4.21Å; I406-E410 WeakPolarHBondContact CG2-OE1 3.34Å; I406-E410 WeakPolarHBondContact O-CG 3.33Å; I406-E410 PolarHBondContact O-N 3.06Å
407	K	52.4	Low	43.2	Very low	129 Å²	129	95.7 Å²	95.7	56%	0.561	48%	0.484	S	S	*	.	H	α-helix	trans	-61.4	-36.9	178.9	-169.4	168.2	-175.6	173	0	112.9	K403 E410 M411	K403-K407 WeakPolarHBondContact O-CB 3.46Å; K403-K407 PolarHBondContact O-N 2.98Å; K407-E410 WeakPolarHBondContact CA-OE2 3.38Å; K407-M411 WeakPolarHBondContact O-CB 3.43Å; K407-M411 VanDerWaalsContact O-CG 3.27Å; K407-M411 WeakPolarHBondContact O-CG 3.34Å; K407-M411 PolarHBondContact O-N 3.39Å
408	A	43	Very low	43.1	Very low	54 Å²	54	98.5 Å²	98.5	45%	0.446	50%	0.495	S	S	.	.	H	α-helix	trans	-64.7	-42.6	171.4	0	0	0	0	0	111.8	S404 S405 I406 M411 T412	S404-A408 WeakPolarHBondContact O-CB 3.4Å; S404-A408 PolarHBondContact O-N 3.31Å; S405-A408 PolarHBondContact O-N 2.82Å; I406-A408 VanDerWaalsContact C-N 3.3Å; I406-A408 PolarHBondContact O-N 3.03Å; A408-M411 PolarHBondContact O-N 3.29Å; A408-T412 WeakPolarHBondContact O-CG2 3.28Å; A408-T412 PolarHBondContact O-N 3Å
409	Y	39.3	Very low	43.1	Very low	151 Å²	151	102.9 Å²	102.9	59%	0.592	51%	0.513	S	S	*	.	H	α-helix	trans	-65.3	-45.4	179	-161.7	-107.6	0	0	0	112.1	S405 I406 T412 N413	S405-Y409 WeakPolarHBondContact O-CB 3.15Å; S405-Y409 PolarHBondContact O-N 2.98Å; I406-Y409 CarbonylContact O-C 3.54Å; I406-Y409 WeakPolarHBondContact O-CA 3.33Å; I406-Y409 WeakPolarHBondContact O-CB 3.43Å; I406-Y409 PolarHBondContact O-N 3.4Å; Y409-T412 CarbonylContact O-C 3.54Å; Y409-T412 PolarHBondContact O-N 3.25Å; Y409-T412 VanDerWaalsContact O-N 3.1Å; Y409-T412 PolarHBondContact O-OG1 3.05Å; Y409-N413 VanDerWaalsContact CD1-ND2 3.33Å; Y409-N413 WeakPolarHBondContact CD1-ND2 3.31Å; Y409-N413 WeakPolarHBondContact CE1-ND2 3.4Å; Y409-N413 PolarHBondContact O-N 2.93Å
410	E	48.8	Very low	42.6	Very low	108 Å²	108	105.6 Å²	105.6	51%	0.505	53%	0.528	S	S	.	.	H	α-helix	trans	-53.5	-54.8	171.9	-71.9	168.1	162.8	0	0	110.8	I406 K407 T412 N413 E414	I406-E410 HydrophobicContact CG2-CG 4.21Å; I406-E410 WeakPolarHBondContact CG2-OE1 3.34Å; I406-E410 WeakPolarHBondContact O-CG 3.33Å; I406-E410 PolarHBondContact O-N 3.06Å; K407-E410 WeakPolarHBondContact CA-OE2 3.38Å; E410-T412 PolarHBondContact O-N 3.32Å; E410-N413 PolarHBondContact O-N 3.43Å; E410-E414 PolarHBondContact O-N 2.92Å
411	M	44.8	Very low	42.1	Very low	108 Å²	108	110.2 Å²	110.2	53%	0.532	54%	0.544	S	S	.	.	H	α-helix	trans	-58.5	-33.7	176.4	-71.2	-178.7	81.7	0	0	112.5	K407 A408 N415	K407-M411 WeakPolarHBondContact O-CB 3.43Å; K407-M411 VanDerWaalsContact O-CG 3.27Å; K407-M411 WeakPolarHBondContact O-CG 3.34Å; K407-M411 PolarHBondContact O-N 3.39Å; A408-M411 PolarHBondContact O-N 3.29Å; M411-N415 WeakPolarHBondContact O-CB 3.11Å; M411-N415 PolarHBondContact O-N 3.12Å; M411-N415 PolarHBondContact O-ND2 3.03Å
412	T	45.4	Very low	41.8	Very low	67 Å²	67	110.8 Å²	110.8	41%	0.411	56%	0.557	S	S	.	*	H	α-helix	trans	-74	-24.8	172.7	67.2	0	0	0	0	114.2	A408 Y409 E410 K416	A408-T412 WeakPolarHBondContact O-CG2 3.28Å; A408-T412 PolarHBondContact O-N 3Å; Y409-T412 CarbonylContact O-C 3.54Å; Y409-T412 PolarHBondContact O-N 3.25Å; Y409-T412 VanDerWaalsContact O-N 3.1Å; Y409-T412 PolarHBondContact O-OG1 3.05Å; E410-T412 PolarHBondContact O-N 3.32Å; T412-K416 VanDerWaalsContact O-CG 3.31Å; T412-K416 WeakPolarHBondContact O-CG 3.27Å; T412-K416 PolarHBondContact O-N 3.29Å
413	N	42.9	Very low	41.4	Very low	46 Å²	46	116 Å²	116	25%	0.246	58%	0.575	C	S	.	*	H	α-helix	trans	-89.7	-35	-178.2	-73.8	-14.8	0	0	0	112.8	Y409 E410 N415 K416 N417	Y409-N413 VanDerWaalsContact CD1-ND2 3.33Å; Y409-N413 WeakPolarHBondContact CD1-ND2 3.31Å; Y409-N413 WeakPolarHBondContact CE1-ND2 3.4Å; Y409-N413 PolarHBondContact O-N 2.93Å; E410-N413 PolarHBondContact O-N 3.43Å; N413-N415 PolarHBondContact O-N 3.3Å; N413-K416 CarbonylContact O-C 3.58Å; N413-K416 WeakPolarHBondContact O-CA 3.33Å; N413-K416 PolarHBondContact O-N 3.32Å; N413-K416 PolarHBondContact OD1-NZ 3.35Å; N413-N417 PolarHBondContact O-N 2.99Å
414	E	45.1	Very low	41.1	Very low	128 Å²	128	115.5 Å²	115.5	60%	0.598	59%	0.585	S	S	*	*	H	α-helix	trans	-53.7	-44.7	163.2	-67.5	176.6	152.1	0	0	110.1	E410 K416 N417 I418	E410-E414 PolarHBondContact O-N 2.92Å; E414-K416 PolarHBondContact O-N 3.1Å; E414-K416 VanDerWaalsContact O-N 3.16Å; E414-N417 PolarHBondContact O-N 2.68Å; E414-I418 PolarHBondContact O-N 3.19Å
415	N	38.6	Very low	40.7	Very low	68 Å²	68	122 Å²	122	36%	0.364	61%	0.609	S	S	.	*	H	α-helix	trans	-69	-4.9	175.8	-86.4	-83.6	0	0	0	115.3	M411 N413 K437	M411-N415 WeakPolarHBondContact O-CB 3.11Å; M411-N415 PolarHBondContact O-N 3.12Å; M411-N415 PolarHBondContact O-ND2 3.03Å; N413-N415 PolarHBondContact O-N 3.3Å; N415-K437 WeakPolarHBondContact OD1-CE 3.45Å; N415-K437 PolarHBondContact OD1-NZ 3.31Å
416	K	42.4	Very low	40.7	Very low	111 Å²	111	123.4 Å²	123.4	48%	0.483	62%	0.617	S	S	.	*	H	α-helix	trans	-107.1	-30.7	169.8	-70	166.8	-161.5	158.6	0	112.6	T412 N413 E414 I418 F419	T412-K416 VanDerWaalsContact O-CG 3.31Å; T412-K416 WeakPolarHBondContact O-CG 3.27Å; T412-K416 PolarHBondContact O-N 3.29Å; N413-K416 CarbonylContact O-C 3.58Å; N413-K416 WeakPolarHBondContact O-CA 3.33Å; N413-K416 PolarHBondContact O-N 3.32Å; N413-K416 PolarHBondContact OD1-NZ 3.35Å; E414-K416 PolarHBondContact O-N 3.1Å; E414-K416 VanDerWaalsContact O-N 3.16Å; K416-I418 VanDerWaalsContact C-N 3.25Å; K416-I418 PolarHBondContact O-N 3.22Å; K416-F419 WeakPolarHBondContact O-CA 3.46Å; K416-F419 WeakPolarHBondContact O-CB 3.45Å; K416-F419 PolarHBondContact O-N 3.33Å
417	N	38.3	Very low	40	Very low	118 Å²	118	125.1 Å²	125.1	63%	0.631	63%	0.631	S	S	*	*	H	α-helix	trans	-70.6	-19.8	179.1	-82.3	-7.7	0	0	0	113.3	N413 E414 F419	N413-N417 PolarHBondContact O-N 2.99Å; E414-N417 PolarHBondContact O-N 2.68Å; N417-F419 PolarHBondContact O-N 3.22Å; N417-F419 VanDerWaalsContact O-N 3.14Å
418	I	39.1	Very low	39.3	Very low	139 Å²	139	125.8 Å²	125.8	71%	0.713	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.5	-16.4	163.2	-63.4	168	0	0	0	111.8	E414 K416	E414-I418 PolarHBondContact O-N 3.19Å; K416-I418 VanDerWaalsContact C-N 3.25Å; K416-I418 PolarHBondContact O-N 3.22Å
419	F	32.3	Very low	38.9	Very low	186 Å²	186	129.4 Å²	129.4	82%	0.816	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	26.5	-174.1	-129.2	-89.2	0	0	0	114.3	K416 N417	K416-F419 WeakPolarHBondContact O-CA 3.46Å; K416-F419 WeakPolarHBondContact O-CB 3.45Å; K416-F419 PolarHBondContact O-N 3.33Å; N417-F419 PolarHBondContact O-N 3.22Å; N417-F419 VanDerWaalsContact O-N 3.14Å
420	T	30.1	Very low	38.8	Very low	109 Å²	109	128.9 Å²	128.9	67%	0.669	67%	0.67	S	S	*	*	S	Bend	trans	-134.8	144.1	169.8	61.9	0	0	0	0	113.5
421	R	31.5	Very low	38.3	Very low	242 Å²	242	131 Å²	131	91%	0.913	68%	0.684	S	S	*	*	S	Bend	trans	73.2	66.6	163	-150.3	-174.8	91.1	166	6.8	120
422	S	35.5	Very low	38.1	Very low	112 Å²	112	129.3 Å²	129.3	78%	0.783	68%	0.683	S	S	*	*				-157	142.5	123.1	54.8	0	0	0	0	111.7
423	K	38.5	Very low	37.9	Very low	211 Å²	211	135.3 Å²	135.3	92%	0.917	71%	0.708	S	S	*	*			trans	-114.7	91.8	175.8	-81.4	-173.4	174.7	-176.8	0	109.8
424	T	41	Very low	38.1	Very low	133 Å²	133	140.1 Å²	140.1	82%	0.816	73%	0.734	S	S	*	*			trans	-158.4	112.1	161.6	38.6	0	0	0	0	109.2
425	E	36.5	Very low	38.4	Very low	188 Å²	188	140.4 Å²	140.4	88%	0.879	74%	0.738	S	S	*	*			trans	-83.1	-178.8	168.4	-95.4	-167.2	159.3	0	0	110.9
426	P	40.8	Very low	39.1	Very low	101 Å²	101	142.1 Å²	142.1	66%	0.656	74%	0.742	S	S	*	*			cis	-135	-164.2	7.6	23.9	2.9	0	0	0	115.3
427	T	34.6	Very low	39.9	Very low	119 Å²	119	142 Å²	142	73%	0.73	74%	0.742	S	S	*	*			trans	91.7	69.7	154.7	69.4	0	0	0	0	121.2
428	L	36.1	Very low	41.1	Very low	142 Å²	142	138.6 Å²	138.6	74%	0.743	73%	0.728	S	S	*	*			trans	-149.5	40.2	151.6	-153.2	93.8	0	0	0	114.2	T430	L428-T430 VanDerWaalsContact C-N 3.29Å; L428-T430 PolarHBondContact O-N 3.49Å
429	T	35.2	Very low	43.2	Very low	131 Å²	131	136.7 Å²	136.7	80%	0.804	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	5.3	-158.3	-14.4	0	0	0	0	116.9
430	T	37	Very low	45.8	Very low	140 Å²	140	131.9 Å²	131.9	86%	0.859	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	-0.5	-174.6	-11.9	0	0	0	0	115.5	L428	L428-T430 VanDerWaalsContact C-N 3.29Å; L428-T430 PolarHBondContact O-N 3.49Å
431	L	38.7	Very low	48.6	Very low	152 Å²	152	133.7 Å²	133.7	80%	0.796	69%	0.693	S	S	*	*	S	Bend	trans	-111.5	-1.8	174.6	-118.4	72.3	0	0	0	113.8	M433	L431-M433 PolarHBondContact O-N 3.32Å
432	S	40.4	Very low	51.5	Low	73 Å²	73	122.4 Å²	122.4	51%	0.51	65%	0.651	S	S	.	*			trans	-94.6	56.9	-164.5	-159.7	0	0	0	0	114.4	I435	S432-I435 WeakPolarHBondContact OG-CD1 3.35Å
433	M	41.2	Very low	54	Low	192 Å²	192	121.3 Å²	121.3	95%	0.946	64%	0.644	S	S	*	*	S	Bend	trans	-122.6	9.2	174.1	-74.1	-161	174.4	0	0	115.3	L431	L431-M433 PolarHBondContact O-N 3.32Å
434	N	46.7	Very low	56.4	Low	147 Å²	147	116.7 Å²	116.7	79%	0.786	63%	0.625	S	S	*	*			trans	-129.1	12.1	176.3	-132.8	-22.9	0	0	0	114.6	K436	N434-K436 PolarHBondContact O-N 2.95Å
435	I	51.6	Low	58.7	Low	135 Å²	135	113.3 Å²	113.3	69%	0.692	61%	0.606	S	S	*	*			trans	-82.5	42.3	-179.2	-37	-175.5	0	0	0	111.7	S432 K437	S432-I435 WeakPolarHBondContact OG-CD1 3.35Å; I435-K437 PolarHBondContact O-N 3.46Å
436	K	53.2	Low	61.1	Low	103 Å²	103	106.5 Å²	106.5	45%	0.448	59%	0.587	S	S	.	*	S	Bend	trans	-79.3	60.4	167.8	-160.9	172.6	-160.6	165.5	0	110.6	Y26 Y29 N434 S438	Y26-K436 VanDerWaalsContact OH-CE 3.28Å; Y26-K436 WeakPolarHBondContact OH-CE 3.41Å; Y26-K436 PolarHBondContact OH-NZ 3.37Å; Y29-K436 HydrophobicContact CE2-CD 4Å; Y29-K436 WeakPolarHBondContact OH-CD 3.42Å; Y29-K436 PolarHBondContact OH-NZ 3.23Å; N434-K436 PolarHBondContact O-N 2.95Å; K436-S438 PolarHBondContact O-N 2.94Å
437	K	60.6	Low	63.4	Low	108 Å²	108	109 Å²	109	47%	0.47	58%	0.583	S	S	.	*			trans	32.3	68.4	179.5	-159.2	174.6	-179	168	0	114.2	N415 I435 I439	N415-K437 WeakPolarHBondContact OD1-CE 3.45Å; N415-K437 PolarHBondContact OD1-NZ 3.31Å; I435-K437 PolarHBondContact O-N 3.46Å; K437-I439 HydrophobicContact CD-CD1 4.31Å; K437-I439 HydrophobicContact CD-CG1 4.3Å; K437-I439 HydrophobicContact CG-CD1 4.37Å; K437-I439 HydrophobicContact CG-CG1 3.85Å; K437-I439 PolarHBondContact O-N 2.94Å
438	S	63.4	Low	66	Low	48 Å²	48	105.2 Å²	105.2	34%	0.336	57%	0.567	S	S	.	*			trans	-69.2	91.6	167	162.8	0	0	0	0	110.5	K436 G448 F449	K436-S438 PolarHBondContact O-N 2.94Å; S438-G448 WeakPolarHBondContact OG-CA 3.43Å; S438-F449 PolarHBondContact OG-N 2.93Å
439	I	81.7	Confident	68.7	Low	98 Å²	98	100 Å²	100	50%	0.503	54%	0.539	S	S	.	.			trans	-73.9	-37.7	179	-55.1	178.1	0	0	0	111.3	K437 K441	K437-I439 HydrophobicContact CD-CD1 4.31Å; K437-I439 HydrophobicContact CD-CG1 4.3Å; K437-I439 HydrophobicContact CG-CD1 4.37Å; K437-I439 HydrophobicContact CG-CG1 3.85Å; K437-I439 PolarHBondContact O-N 2.94Å; I439-K441 PolarHBondContact O-N 2.89Å
440	Y	87.6	Confident	71.3	Confident	85 Å²	85	97.8 Å²	97.8	33%	0.333	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	92	-167.1	-54.4	-76	0	0	0	111	F449 K451 A452	Y440-F449 PolarHBondContact N-O 2.86Å; Y440-F449 VanDerWaalsContact N-O 3.12Å; Y440-F449 WeakPolarHBondContact O-CB 3.42Å; Y440-F449 PolarHBondContact O-N 2.89Å; Y440-K451 VanDerWaalsContact CD2-C 3.43Å; Y440-A452 HydrophobicContact CD1-CB 3.75Å; Y440-A452 HydrophobicContact CD2-CB 4.37Å; Y440-A452 VanDerWaalsContact CD2-N 3.25Å; Y440-A452 HydrophobicContact CE1-CB 3.7Å; Y440-A452 HydrophobicContact CE2-CB 4.31Å; Y440-A452 HydrophobicContact CG-CB 4.09Å
441	K	88.6	Confident	73.8	Confident	148 Å²	148	97.6 Å²	97.6	64%	0.643	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	139.4	172.2	-60.1	-179.1	-175.9	178.6	0	110.5	I439 R447 R455	I439-K441 PolarHBondContact O-N 2.89Å; K441-R447 CarbonylContact C-O 3.6Å; K441-R447 WeakPolarHBondContact CA-O 3.48Å; K441-R455 WeakPolarHBondContact O-CD 3.41Å
442	C	92.4	Very high	76.2	Confident	4 Å²	4	92.1 Å²	92.1	3%	0.027	49%	0.493	C	S	.	.			trans	-72	138.5	171.5	176.5	0	0	0	0	111.1	G446 R447 F449 R455 E459	C442-G446 VanDerWaalsContact O-CA 3.29Å; C442-G446 WeakPolarHBondContact O-CA 3.49Å; C442-G446 PolarHBondContact O-N 3.2Å; C442-R447 PolarHBondContact N-O 3.4Å; C442-F449 HydrophobicContact CB-CE2 4.25Å; C442-R455 HydrophobicContact CB-CG 4.29Å; C442-E459 HydrophobicContact CB-CG 4.46Å
443	S	88.9	Confident	78.5	Confident	90 Å²	90	96.1 Å²	96.1	63%	0.629	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-44.8	176.7	47.1	0	0	0	0	113.8
444	H	87.7	Confident	80.9	Confident	114 Å²	114	90 Å²	90	53%	0.528	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-31.6	-168.2	-60.7	-81.8	0	0	0	114.4	H462	H444-H462 HydrophobicContact CB-CB 3.95Å; H444-H462 AromaticContact CD2-CG 3.96Å; H444-H462 AromaticContact CG-CG 3.82Å
445	C	90.7	Very high	83.1	Confident	61 Å²	61	86.3 Å²	86.3	41%	0.412	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	3.7	-172.6	67.8	0	0	0	0	114.4	R447 H458	C445-R447 PolarHBondContact O-N 2.69Å; C445-R447 WeakPolarHBondContact SG-CB 3.44Å; C445-H458 PolarHBondContact SG-NE2 2.87Å
446	G	87.1	Confident	85	Confident	46 Å²	46	82.5 Å²	82.5	47%	0.474	43%	0.427	S	S	.	.			trans	66.4	-6	-177.7	0	0	0	0	0	115.8	C442 G448	C442-G446 VanDerWaalsContact O-CA 3.29Å; C442-G446 WeakPolarHBondContact O-CA 3.49Å; C442-G446 PolarHBondContact O-N 3.2Å; G446-G448 PolarHBondContact O-N 2.87Å
447	R	88.5	Confident	86.7	Confident	154 Å²	154	78.8 Å²	78.8	58%	0.581	41%	0.412	S	S	*	.			trans	-56.9	132.2	-174.8	-173.4	174	-176.4	171.6	4.6	111.3	K441 C442 C445 F449	K441-R447 CarbonylContact C-O 3.6Å; K441-R447 WeakPolarHBondContact CA-O 3.48Å; C442-R447 PolarHBondContact N-O 3.4Å; C445-R447 PolarHBondContact O-N 2.69Å; C445-R447 WeakPolarHBondContact SG-CB 3.44Å; R447-F449 HydrophobicContact CB-CE2 4.01Å; R447-F449 HydrophobicContact CB-CZ 4.4Å; R447-F449 HydrophobicContact CG-CE2 3.89Å; R447-F449 HydrophobicContact CG-CZ 3.9Å; R447-F449 VanDerWaalsContact O-CD2 3.31Å; R447-F449 WeakPolarHBondContact O-CD2 3.48Å; R447-F449 VanDerWaalsContact O-CE2 3.27Å; R447-F449 WeakPolarHBondContact O-CE2 3.41Å
448	G	89.4	Confident	88.1	Confident	38 Å²	38	74.7 Å²	74.7	39%	0.392	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	138.6	-174.3	0	0	0	0	0	114.9	S438 G446	S438-G448 WeakPolarHBondContact OG-CA 3.43Å; G446-G448 PolarHBondContact O-N 2.87Å
449	F	91.5	Very high	89.4	Confident	32 Å²	32	74 Å²	74	14%	0.14	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	146	176.9	-60.4	-90.8	0	0	0	112.1	S438 Y440 C442 R447 N454 R455 H458	S438-F449 PolarHBondContact OG-N 2.93Å; Y440-F449 PolarHBondContact N-O 2.86Å; Y440-F449 VanDerWaalsContact N-O 3.12Å; Y440-F449 WeakPolarHBondContact O-CB 3.42Å; Y440-F449 PolarHBondContact O-N 2.89Å; C442-F449 HydrophobicContact CB-CE2 4.25Å; R447-F449 HydrophobicContact CB-CE2 4.01Å; R447-F449 HydrophobicContact CB-CZ 4.4Å; R447-F449 HydrophobicContact CG-CE2 3.89Å; R447-F449 HydrophobicContact CG-CZ 3.9Å; R447-F449 VanDerWaalsContact O-CD2 3.31Å; R447-F449 WeakPolarHBondContact O-CD2 3.48Å; R447-F449 VanDerWaalsContact O-CE2 3.27Å; R447-F449 WeakPolarHBondContact O-CE2 3.41Å; F449-N454 HydrophobicContact CB-CB 4.33Å; F449-N454 HydrophobicContact CD1-CB 3.9Å; F449-N454 HydrophobicContact CG-CB 4.41Å; F449-R455 HydrophobicContact CB-CB 4.11Å; F449-R455 HydrophobicContact CD2-CB 3.85Å; F449-R455 HydrophobicContact CD2-CG 4.06Å; F449-R455 HydrophobicContact CG-CB 4.12Å; F449-H458 HydrophobicContact CE1-CB 4.04Å; F449-H458 HydrophobicContact CE2-CB 3.98Å; F449-H458 AromaticContact CE2-CD2 3.41Å; F449-H458 VanDerWaalsContact CE2-CD2 3.41Å; F449-H458 WeakPolarHBondContact CE2-CD2 3.29Å; F449-H458 AromaticContact CE2-CG 3.9Å; F449-H458 HydrophobicContact CZ-CB 3.48Å; F449-H458 VanDerWaalsContact CZ-CB 3.48Å; F449-H458 AromaticContact CZ-CD2 3.31Å; F449-H458 WeakPolarHBondContact CZ-CD2 3.46Å; F449-H458 AromaticContact CZ-CG 3.4Å; F449-H458 VanDerWaalsContact CZ-CG 3.4Å
450	S	89.6	Confident	89.9	Confident	86 Å²	86	72 Å²	72	60%	0.601	37%	0.372	S	S	*	.	S	Bend	trans	-80.7	-11.6	177.5	54.2	0	0	0	0	114.4
451	K	89.4	Confident	90	Very high	135 Å²	135	69.2 Å²	69.2	59%	0.587	36%	0.363	S	S	*	.	S	Bend	trans	-139.9	137.1	178.6	-63.2	-173.3	179	-174.8	0	110.6	Y440 Y453 N454 R455	Y440-K451 VanDerWaalsContact CD2-C 3.43Å; K451-Y453 VanDerWaalsContact C-N 3.3Å; K451-Y453 PolarHBondContact O-N 2.85Å; K451-N454 WeakPolarHBondContact O-CB 3.35Å; K451-N454 PolarHBondContact O-N 3.27Å; K451-R455 PolarHBondContact O-N 3.26Å
452	A	89.6	Confident	90.1	Very high	37 Å²	37	64.4 Å²	64.4	31%	0.306	34%	0.343	S	S	.	.	H	α-helix	trans	-56	-42.7	179.1	0	0	0	0	0	112.8	Y440 N454 R455 T456	Y440-A452 HydrophobicContact CD1-CB 3.75Å; Y440-A452 HydrophobicContact CD2-CB 4.37Å; Y440-A452 VanDerWaalsContact CD2-N 3.25Å; Y440-A452 HydrophobicContact CE1-CB 3.7Å; Y440-A452 HydrophobicContact CE2-CB 4.31Å; Y440-A452 HydrophobicContact CG-CB 4.09Å; A452-N454 VanDerWaalsContact C-N 3.28Å; A452-N454 PolarHBondContact O-N 2.95Å; A452-R455 WeakPolarHBondContact O-CB 3.45Å; A452-R455 PolarHBondContact O-N 3.41Å; A452-R455 VanDerWaalsContact O-N 3.12Å; A452-T456 PolarHBondContact O-N 3.5Å
453	Y	90.2	Very high	89.9	Confident	158 Å²	158	67.4 Å²	67.4	62%	0.62	36%	0.362	S	S	*	.	H	α-helix	trans	-54.8	-40.4	175.3	177.2	-105.1	0	0	0	113.2	K451 T456 I457	K451-Y453 VanDerWaalsContact C-N 3.3Å; K451-Y453 PolarHBondContact O-N 2.85Å; Y453-T456 PolarHBondContact O-N 3.35Å; Y453-I457 HydrophobicContact CD1-CD1 3.89Å; Y453-I457 HydrophobicContact CD2-CD1 4.38Å; Y453-I457 HydrophobicContact CE1-CD1 3.36Å; Y453-I457 HydrophobicContact CE2-CD1 3.91Å; Y453-I457 HydrophobicContact CG-CD1 4.38Å; Y453-I457 WeakPolarHBondContact O-CB 3.36Å; Y453-I457 PolarHBondContact O-N 2.68Å
454	N	90.6	Very high	89.7	Confident	64 Å²	64	66.8 Å²	66.8	34%	0.342	35%	0.351	S	S	.	.	H	α-helix	trans	-70.7	-38.7	178.6	-65.6	9.1	0	0	0	111.4	F449 K451 A452 H458	F449-N454 HydrophobicContact CB-CB 4.33Å; F449-N454 HydrophobicContact CD1-CB 3.9Å; F449-N454 HydrophobicContact CG-CB 4.41Å; K451-N454 WeakPolarHBondContact O-CB 3.35Å; K451-N454 PolarHBondContact O-N 3.27Å; A452-N454 VanDerWaalsContact C-N 3.28Å; A452-N454 PolarHBondContact O-N 2.95Å; N454-H458 WeakPolarHBondContact O-CB 3.43Å; N454-H458 PolarHBondContact O-N 3.4Å
455	R	92.6	Very high	89.7	Confident	69 Å²	69	65.9 Å²	65.9	26%	0.26	35%	0.347	S	S	.	.	H	α-helix	trans	-60.4	-47.4	172.7	-175	-147.6	61.5	-157.8	-8.8	110.6	K441 C442 F449 K451 A452 H458 E459	K441-R455 WeakPolarHBondContact O-CD 3.41Å; C442-R455 HydrophobicContact CB-CG 4.29Å; F449-R455 HydrophobicContact CB-CB 4.11Å; F449-R455 HydrophobicContact CD2-CB 3.85Å; F449-R455 HydrophobicContact CD2-CG 4.06Å; F449-R455 HydrophobicContact CG-CB 4.12Å; K451-R455 PolarHBondContact O-N 3.26Å; A452-R455 WeakPolarHBondContact O-CB 3.45Å; A452-R455 PolarHBondContact O-N 3.41Å; A452-R455 VanDerWaalsContact O-N 3.12Å; R455-H458 CarbonylContact O-C 3.38Å; R455-H458 WeakPolarHBondContact O-CA 3.34Å; R455-H458 WeakPolarHBondContact O-CB 3.41Å; R455-H458 PolarHBondContact O-N 3.02Å; R455-E459 WeakPolarHBondContact CD-OE1 3.3Å; R455-E459 HydrophobicContact CG-CG 4.43Å; R455-E459 WeakPolarHBondContact CG-OE1 3.32Å; R455-E459 IonicContact CZ-OE1 3.56Å; R455-E459 IonicContact CZ-OE2 3.5Å; R455-E459 VanDerWaalsContact NE-CD 3.29Å; R455-E459 IonicContact NE-OE1 2.68Å; R455-E459 PolarHBondContact NE-OE1 3.32Å; R455-E459 IonicContact NE-OE2 3.56Å; R455-E459 PolarHBondContact NE-OE2 3.38Å; R455-E459 IonicContact NH2-OE2 3.51Å; R455-E459 WeakPolarHBondContact O-CG 3.5Å; R455-E459 PolarHBondContact O-N 3.47Å
456	T	90.7	Very high	89.7	Confident	54 Å²	54	68.5 Å²	68.5	33%	0.331	35%	0.348	S	S	.	.	H	α-helix	trans	-75.1	-25.2	-177.3	-65.7	0	0	0	0	114.4	A452 Y453 H458 E459	A452-T456 PolarHBondContact O-N 3.5Å; Y453-T456 PolarHBondContact O-N 3.35Å; T456-H458 VanDerWaalsContact C-N 3.33Å; T456-E459 WeakPolarHBondContact CA-OE2 3.41Å; T456-E459 PolarHBondContact N-OE2 2.77Å; T456-E459 PolarHBondContact OG1-OE2 3.23Å
457	I	89.6	Confident	89.8	Confident	26 Å²	26	68.7 Å²	68.7	13%	0.133	34%	0.341	C	S	.	.	H	α-helix	trans	-65.2	-37.9	162	-80.6	170.8	0	0	0	111.7	Y453 R479	Y453-I457 HydrophobicContact CD1-CD1 3.89Å; Y453-I457 HydrophobicContact CD2-CD1 4.38Å; Y453-I457 HydrophobicContact CE1-CD1 3.36Å; Y453-I457 HydrophobicContact CE2-CD1 3.91Å; Y453-I457 HydrophobicContact CG-CD1 4.38Å; Y453-I457 WeakPolarHBondContact O-CB 3.36Å; Y453-I457 PolarHBondContact O-N 2.68Å; I457-R479 HydrophobicContact CD1-CG 3.83Å; I457-R479 HydrophobicContact CG1-CG 4.06Å; I457-R479 HydrophobicContact CG2-CG 3.96Å
458	H	90.5	Very high	89.9	Confident	21 Å²	21	63.1 Å²	63.1	10%	0.097	32%	0.321	C	S	.	.	H	α-helix	trans	-73.9	-30.4	176.5	179.4	53.7	0	0	0	113	C445 F449 N454 R455 T456 R460 T461 H462	C445-H458 PolarHBondContact SG-NE2 2.87Å; F449-H458 HydrophobicContact CE1-CB 4.04Å; F449-H458 HydrophobicContact CE2-CB 3.98Å; F449-H458 AromaticContact CE2-CD2 3.41Å; F449-H458 VanDerWaalsContact CE2-CD2 3.41Å; F449-H458 WeakPolarHBondContact CE2-CD2 3.29Å; F449-H458 AromaticContact CE2-CG 3.9Å; F449-H458 HydrophobicContact CZ-CB 3.48Å; F449-H458 VanDerWaalsContact CZ-CB 3.48Å; F449-H458 AromaticContact CZ-CD2 3.31Å; F449-H458 WeakPolarHBondContact CZ-CD2 3.46Å; F449-H458 AromaticContact CZ-CG 3.4Å; F449-H458 VanDerWaalsContact CZ-CG 3.4Å; N454-H458 WeakPolarHBondContact O-CB 3.43Å; N454-H458 PolarHBondContact O-N 3.4Å; R455-H458 CarbonylContact O-C 3.38Å; R455-H458 WeakPolarHBondContact O-CA 3.34Å; R455-H458 WeakPolarHBondContact O-CB 3.41Å; R455-H458 PolarHBondContact O-N 3.02Å; T456-H458 VanDerWaalsContact C-N 3.33Å; H458-R460 PolarHBondContact O-N 2.9Å; H458-T461 PolarHBondContact CE1-OG1 3.11Å; H458-T461 VanDerWaalsContact CE1-OG1 3.23Å; H458-T461 PolarHBondContact ND1-OG1 2.95Å; H458-T461 WeakPolarHBondContact O-CA 3.37Å; H458-T461 WeakPolarHBondContact O-CB 3.3Å; H458-T461 PolarHBondContact O-N 2.78Å; H458-T461 PolarHBondContact O-OG1 3.22Å; H458-H462 AromaticContact CD2-NE2 3.77Å; H458-H462 AromaticContact CE1-NE2 3.3Å; H458-H462 PolarHBondContact CE1-NE2 2.84Å; H458-H462 VanDerWaalsContact CE1-NE2 3.3Å; H458-H462 AromaticContact NE2-NE2 3.08Å; H458-H462 PolarHBondContact NE2-NE2 3.39Å; H458-H462 PolarHBondContact O-CD2 3.07Å; H458-H462 VanDerWaalsContact O-CD2 3.32Å
459	E	90.6	Very high	89.9	Confident	33 Å²	33	62.5 Å²	62.5	15%	0.154	32%	0.315	C	S	.	.	H	α-helix	trans	-61.4	-33.5	175.4	-74.3	157.2	160.8	0	0	110.9	C442 R455 T456 T461 H462 T463	C442-E459 HydrophobicContact CB-CG 4.46Å; R455-E459 WeakPolarHBondContact CD-OE1 3.3Å; R455-E459 HydrophobicContact CG-CG 4.43Å; R455-E459 WeakPolarHBondContact CG-OE1 3.32Å; R455-E459 IonicContact CZ-OE1 3.56Å; R455-E459 IonicContact CZ-OE2 3.5Å; R455-E459 VanDerWaalsContact NE-CD 3.29Å; R455-E459 IonicContact NE-OE1 2.68Å; R455-E459 PolarHBondContact NE-OE1 3.32Å; R455-E459 IonicContact NE-OE2 3.56Å; R455-E459 PolarHBondContact NE-OE2 3.38Å; R455-E459 IonicContact NH2-OE2 3.51Å; R455-E459 WeakPolarHBondContact O-CG 3.5Å; R455-E459 PolarHBondContact O-N 3.47Å; T456-E459 WeakPolarHBondContact CA-OE2 3.41Å; T456-E459 PolarHBondContact N-OE2 2.77Å; T456-E459 PolarHBondContact OG1-OE2 3.23Å; E459-T461 PolarHBondContact O-N 2.73Å; E459-H462 PolarHBondContact O-N 2.96Å; E459-T463 PolarHBondContact O-N 3.29Å; E459-T463 VanDerWaalsContact O-N 3.14Å
460	R	91.1	Very high	89.9	Confident	58 Å²	58	61.8 Å²	61.8	22%	0.219	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-7.1	168.5	-61.4	-172.5	179	136.4	7.7	115.6	H458 H462 D464 E465 R478	H458-R460 PolarHBondContact O-N 2.9Å; R460-H462 VanDerWaalsContact C-N 3.33Å; R460-D464 WeakPolarHBondContact O-CA 3.41Å; R460-D464 PolarHBondContact O-N 2.81Å; R460-E465 HydrophobicContact CB-CB 4.17Å; R460-E465 HydrophobicContact CG-CB 3.9Å; R460-E465 IonicContact NE-OE2 2.9Å; R460-R478 HydrophobicContact CB-CB 4.43Å; R460-R478 HydrophobicContact CB-CG 4.43Å; R460-R478 PolarHBondContact NH1-O 3.02Å; R460-R478 WeakPolarHBondContact O-CD 3.22Å; R460-R478 PolarHBondContact O-NE 3.33Å
461	T	90.2	Very high	89.8	Confident	25 Å²	25	63.2 Å²	63.2	15%	0.153	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-10.9	168.3	78.7	0	0	0	0	112.5	D318 H458 E459	D318-T461 WeakPolarHBondContact OD2-CG2 3.36Å; H458-T461 PolarHBondContact CE1-OG1 3.11Å; H458-T461 VanDerWaalsContact CE1-OG1 3.23Å; H458-T461 PolarHBondContact ND1-OG1 2.95Å; H458-T461 WeakPolarHBondContact O-CA 3.37Å; H458-T461 WeakPolarHBondContact O-CB 3.3Å; H458-T461 PolarHBondContact O-N 2.78Å; H458-T461 PolarHBondContact O-OG1 3.22Å; E459-T461 PolarHBondContact O-N 2.73Å
462	H	90.2	Very high	89.7	Confident	48 Å²	48	61.3 Å²	61.3	22%	0.222	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-40.1	175.6	-57.5	-83	0	0	0	111.9	H444 H458 E459 R460 D464	H444-H462 HydrophobicContact CB-CB 3.95Å; H444-H462 AromaticContact CD2-CG 3.96Å; H444-H462 AromaticContact CG-CG 3.82Å; H458-H462 AromaticContact CD2-NE2 3.77Å; H458-H462 AromaticContact CE1-NE2 3.3Å; H458-H462 PolarHBondContact CE1-NE2 2.84Å; H458-H462 VanDerWaalsContact CE1-NE2 3.3Å; H458-H462 AromaticContact NE2-NE2 3.08Å; H458-H462 PolarHBondContact NE2-NE2 3.39Å; H458-H462 PolarHBondContact O-CD2 3.07Å; H458-H462 VanDerWaalsContact O-CD2 3.32Å; E459-H462 PolarHBondContact O-N 2.96Å; R460-H462 VanDerWaalsContact C-N 3.33Å; H462-D464 PolarHBondContact O-N 3.17Å
463	T	88.5	Confident	89.7	Confident	67 Å²	67	61.5 Å²	61.5	41%	0.411	31%	0.313	S	S	.	.	S	Bend	trans	-79.5	-5.6	174.3	65	0	0	0	0	113.7	E459 E465	E459-T463 PolarHBondContact O-N 3.29Å; E459-T463 VanDerWaalsContact O-N 3.14Å; T463-E465 PolarHBondContact O-N 3.24Å; T463-E465 VanDerWaalsContact OG1-CD 3.32Å; T463-E465 WeakPolarHBondContact OG1-CG 3.46Å; T463-E465 PolarHBondContact OG1-OE1 3.1Å
464	D	85.4	Confident	89.6	Confident	77 Å²	77	60 Å²	60	41%	0.412	33%	0.325	S	S	.	.			trans	49.3	17.4	-171	-132.6	-27.3	0	0	0	116.3	R460 H462 R466 R478	R460-D464 WeakPolarHBondContact O-CA 3.41Å; R460-D464 PolarHBondContact O-N 2.81Å; H462-D464 PolarHBondContact O-N 3.17Å; D464-R466 VanDerWaalsContact CG-NH2 3.3Å; D464-R466 WeakPolarHBondContact O-CG 3.3Å; D464-R466 PolarHBondContact O-N 3.49Å; D464-R466 IonicContact OD1-CZ 3.4Å; D464-R466 VanDerWaalsContact OD1-CZ 3.25Å; D464-R466 IonicContact OD1-NE 3.65Å; D464-R466 PolarHBondContact OD1-NE 2.91Å; D464-R466 IonicContact OD1-NH2 3.88Å; D464-R466 PolarHBondContact OD1-NH2 2.96Å; D464-R466 IonicContact OD2-NH2 3.66Å; D464-R466 PolarHBondContact OD2-NH2 3Å; D464-R478 IonicContact OD1-CZ 2.83Å; D464-R478 IonicContact OD1-NE 3.02Å; D464-R478 IonicContact OD1-NH2 3.57Å; D464-R478 PolarHBondContact OD1-NH2 3.39Å; D464-R478 IonicContact OD2-NH2 2.92Å
465	E	86.9	Confident	89.6	Confident	95 Å²	95	64.8 Å²	64.8	44%	0.444	34%	0.339	S	S	.	.			trans	-55.2	123.8	176.2	-87.1	169.7	-122.1	0	0	112.5	R460 T463 P467 R478	R460-E465 HydrophobicContact CB-CB 4.17Å; R460-E465 HydrophobicContact CG-CB 3.9Å; R460-E465 IonicContact NE-OE2 2.9Å; T463-E465 PolarHBondContact O-N 3.24Å; T463-E465 VanDerWaalsContact OG1-CD 3.32Å; T463-E465 WeakPolarHBondContact OG1-CG 3.46Å; T463-E465 PolarHBondContact OG1-OE1 3.1Å; E465-P467 WeakPolarHBondContact O-CD 3.26Å; E465-R478 WeakPolarHBondContact O-CG 3.4Å
466	R	90.3	Very high	89.5	Confident	115 Å²	115	68.4 Å²	68.4	43%	0.434	35%	0.352	S	S	.	.			trans	-123.9	77.2	176.3	-66.2	162.3	-160.6	-161.4	8.1	109.8	D464 F468 R476 F477 R478	D464-R466 VanDerWaalsContact CG-NH2 3.3Å; D464-R466 WeakPolarHBondContact O-CG 3.3Å; D464-R466 PolarHBondContact O-N 3.49Å; D464-R466 IonicContact OD1-CZ 3.4Å; D464-R466 VanDerWaalsContact OD1-CZ 3.25Å; D464-R466 IonicContact OD1-NE 3.65Å; D464-R466 PolarHBondContact OD1-NE 2.91Å; D464-R466 IonicContact OD1-NH2 3.88Å; D464-R466 PolarHBondContact OD1-NH2 2.96Å; D464-R466 IonicContact OD2-NH2 3.66Å; D464-R466 PolarHBondContact OD2-NH2 3Å; R466-F468 VanDerWaalsContact C-N 3.31Å; R466-F468 PolarHBondContact O-N 3.27Å; R466-R476 HydrophobicContact CB-CB 3.51Å; R466-R476 WeakPolarHBondContact O-CB 3.41Å; R466-R476 PolarHBondContact O-NE 3.4Å; R466-F477 CarbonylContact C-O 3.21Å; R466-F477 WeakPolarHBondContact CA-O 3.37Å; R466-R478 HydrophobicContact CG-CG 4.05Å
467	P	90.4	Very high	89.5	Confident	50 Å²	50	68 Å²	68	33%	0.325	35%	0.346	S	S	.	.			trans	-60.4	-40.6	-173.5	-24.5	34.7	0	0	0	112.7	E465 G469 R476	E465-P467 WeakPolarHBondContact O-CD 3.26Å; P467-G469 PolarHBondContact O-N 3.19Å; P467-R476 PolarHBondContact O-NH2 3.24Å
468	F	91	Very high	89.5	Confident	38 Å²	38	68.7 Å²	68.7	17%	0.167	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	92.8	-168.7	-53.5	-75.8	0	0	0	111.1	R466 R476 F477 K480 L483	R466-F468 VanDerWaalsContact C-N 3.31Å; R466-F468 PolarHBondContact O-N 3.27Å; F468-R476 CarbonylContact O-C 3.58Å; F468-R476 WeakPolarHBondContact O-CA 3.25Å; F468-F477 HydrophobicContact CB-CB 4.45Å; F468-F477 WeakPolarHBondContact CD2-O 3.27Å; F468-F477 PolarHBondContact N-O 2.88Å; F468-F477 PolarHBondContact O-N 2.95Å; F468-K480 HydrophobicContact CD1-CB 3.93Å; F468-K480 HydrophobicContact CD1-CG 4.28Å; F468-K480 HydrophobicContact CE1-CB 3.79Å; F468-K480 HydrophobicContact CE1-CG 4.3Å; F468-K480 HydrophobicContact CE2-CB 4.43Å; F468-K480 HydrophobicContact CG-CB 4.33Å; F468-K480 HydrophobicContact CZ-CB 4.05Å; F468-L483 HydrophobicContact CB-CB 4.09Å; F468-L483 HydrophobicContact CB-CD2 3.88Å
469	G	88.5	Confident	89.5	Confident	25 Å²	25	71.6 Å²	71.6	26%	0.258	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	161.3	171	0	0	0	0	0	112.8	P467 L483	P467-G469 PolarHBondContact O-N 3.19Å; G469-L483 VanDerWaalsContact O-CD1 3.23Å; G469-L483 WeakPolarHBondContact O-CD1 3.45Å; G469-L483 WeakPolarHBondContact O-CD2 3.42Å
470	C	91.3	Very high	89.5	Confident	17 Å²	17	75.8 Å²	75.8	12%	0.115	38%	0.375	C	S	.	.			trans	-104.1	135	171.4	-178	0	0	0	0	110.7	V472 C473 R475 L483 H490	C470-V472 PolarHBondContact O-N 3.33Å; C470-C473 WeakPolarHBondContact CB-O 3.39Å; C470-C473 PolarHBondContact O-N 2.88Å; C470-R475 PolarHBondContact N-O 3.39Å; C470-L483 HydrophobicContact CB-CD1 3.65Å; C470-H490 PolarHBondContact SG-NE2 3.07Å; C470-H490 VanDerWaalsContact SG-NE2 3.36Å
471	D	88.8	Confident	89.3	Confident	116 Å²	116	75 Å²	75	62%	0.62	38%	0.375	S	S	*	.	S	Bend	trans	-74.3	-15.3	-174.5	-39.9	-66.4	0	0	0	113	I548	D471-I548 WeakPolarHBondContact OD2-CD1 3.09Å
472	V	87.4	Confident	89.3	Confident	95 Å²	95	76.9 Å²	76.9	58%	0.576	38%	0.382	S	S	*	.	S	Bend	trans	-100.3	-19.5	-178.2	-175.8	0	0	0	0	112.4	C470 H490	C470-V472 PolarHBondContact O-N 3.33Å; V472-H490 HydrophobicContact CG1-CB 4.12Å
473	C	88.9	Confident	89.3	Confident	41 Å²	41	75 Å²	75	28%	0.277	37%	0.374	S	S	.	.	S	Bend	trans	-158.8	153.2	175.5	75.6	0	0	0	0	111.9	C470 R475 H486 H490	C470-C473 WeakPolarHBondContact CB-O 3.39Å; C470-C473 PolarHBondContact O-N 2.88Å; C473-R475 PolarHBondContact O-N 3.36Å; C473-H486 PolarHBondContact SG-NE2 3.06Å; C473-H486 VanDerWaalsContact SG-NE2 3.39Å; C473-H490 VanDerWaalsContact SG-CE1 3.52Å
474	S	88.8	Confident	89.3	Confident	126 Å²	126	77.9 Å²	77.9	88%	0.881	38%	0.377	S	S	*	.	S	Bend	trans	-62.2	9.1	-173.8	-37.6	0	0	0	0	116.6
475	R	88.7	Confident	89.3	Confident	165 Å²	165	75.6 Å²	75.6	62%	0.623	36%	0.364	S	S	*	.			trans	-72.2	130.3	176.4	-68.9	-176.1	173.9	-167.4	-1.2	110.9	C470 C473 F477	C470-R475 PolarHBondContact N-O 3.39Å; C473-R475 PolarHBondContact O-N 3.36Å; R475-F477 HydrophobicContact CB-CE2 3.88Å; R475-F477 HydrophobicContact CB-CZ 3.99Å
476	R	91.5	Very high	89.4	Confident	145 Å²	145	71.7 Å²	71.7	55%	0.547	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	146.6	177.1	-51.3	-173.2	69.2	128.9	7.2	111.4	R466 P467 F468	R466-R476 HydrophobicContact CB-CB 3.51Å; R466-R476 WeakPolarHBondContact O-CB 3.41Å; R466-R476 PolarHBondContact O-NE 3.4Å; P467-R476 PolarHBondContact O-NH2 3.24Å; F468-R476 CarbonylContact O-C 3.58Å; F468-R476 WeakPolarHBondContact O-CA 3.25Å
477	F	90.2	Very high	89.2	Confident	44 Å²	44	67.8 Å²	67.8	19%	0.193	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	147.7	-172.1	-59.3	-91.5	0	0	0	112.2	R466 F468 R475 R479 H482 L483 H486	R466-F477 CarbonylContact C-O 3.21Å; R466-F477 WeakPolarHBondContact CA-O 3.37Å; F468-F477 HydrophobicContact CB-CB 4.45Å; F468-F477 WeakPolarHBondContact CD2-O 3.27Å; F468-F477 PolarHBondContact N-O 2.88Å; F468-F477 PolarHBondContact O-N 2.95Å; R475-F477 HydrophobicContact CB-CE2 3.88Å; R475-F477 HydrophobicContact CB-CZ 3.99Å; F477-R479 PolarHBondContact O-N 3.1Å; F477-H482 HydrophobicContact CB-CB 4.33Å; F477-H482 HydrophobicContact CD1-CB 3.98Å; F477-H482 HydrophobicContact CG-CB 4.41Å; F477-L483 HydrophobicContact CD2-CB 4.09Å; F477-L483 HydrophobicContact CD2-CD1 4.08Å; F477-L483 HydrophobicContact CE2-CD1 4.28Å; F477-L483 HydrophobicContact CG-CB 4.45Å; F477-H486 HydrophobicContact CE1-CB 4.07Å; F477-H486 HydrophobicContact CE2-CB 4.06Å; F477-H486 AromaticContact CE2-CD2 3.26Å; F477-H486 WeakPolarHBondContact CE2-CD2 3.39Å; F477-H486 AromaticContact CE2-CG 3.79Å; F477-H486 HydrophobicContact CZ-CB 3.58Å; F477-H486 AromaticContact CZ-CD2 3.3Å; F477-H486 WeakPolarHBondContact CZ-CD2 3.27Å; F477-H486 AromaticContact CZ-CG 3.36Å
478	R	90.6	Very high	89	Confident	42 Å²	42	68.8 Å²	68.8	16%	0.158	33%	0.334	C	S	.	.	S	Bend	trans	-70.2	-17.2	175.6	-59.7	-179.5	176.7	153.4	-4.4	113	D318 R460 D464 E465 R466	D318-R478 IonicContact OD2-NH1 2.96Å; D318-R478 PolarHBondContact OD2-NH1 3.3Å; R460-R478 HydrophobicContact CB-CB 4.43Å; R460-R478 HydrophobicContact CB-CG 4.43Å; R460-R478 PolarHBondContact NH1-O 3.02Å; R460-R478 WeakPolarHBondContact O-CD 3.22Å; R460-R478 PolarHBondContact O-NE 3.33Å; D464-R478 IonicContact OD1-CZ 2.83Å; D464-R478 IonicContact OD1-NE 3.02Å; D464-R478 IonicContact OD1-NH2 3.57Å; D464-R478 PolarHBondContact OD1-NH2 3.39Å; D464-R478 IonicContact OD2-NH2 2.92Å; E465-R478 WeakPolarHBondContact O-CG 3.4Å; R466-R478 HydrophobicContact CG-CG 4.05Å
479	R	90.4	Very high	88.7	Confident	81 Å²	81	70.3 Å²	70.3	31%	0.306	35%	0.347	S	S	.	.	S	Bend	trans	-141.1	147.9	-175	-66.3	162.8	53.6	164.4	-0.8	113.4	I457 F477 D481 H482 L483	I457-R479 HydrophobicContact CD1-CG 3.83Å; I457-R479 HydrophobicContact CG1-CG 4.06Å; I457-R479 HydrophobicContact CG2-CG 3.96Å; F477-R479 PolarHBondContact O-N 3.1Å; R479-D481 VanDerWaalsContact CB-OD1 3.22Å; R479-D481 WeakPolarHBondContact CB-OD1 3.45Å; R479-D481 IonicContact CZ-OD1 2.73Å; R479-D481 IonicContact CZ-OD2 3.62Å; R479-D481 IonicContact NE-OD1 3.25Å; R479-D481 PolarHBondContact NE-OD1 3.5Å; R479-D481 IonicContact NE-OD2 2.72Å; R479-D481 IonicContact NH2-OD1 3.27Å; R479-D481 PolarHBondContact NH2-OD1 3.3Å; R479-D481 IonicContact NH2-OD2 3.54Å; R479-D481 PolarHBondContact NH2-OD2 2.93Å; R479-H482 WeakPolarHBondContact CD-NE2 3.23Å; R479-H482 VanDerWaalsContact CZ-CE1 3.45Å; R479-H482 PolarHBondContact NE-NE2 3.19Å; R479-H482 PolarHBondContact O-N 3.36Å; R479-L483 PolarHBondContact O-N 2.88Å
480	K	90.6	Very high	88.6	Confident	121 Å²	121	72.6 Å²	72.6	53%	0.526	35%	0.35	S	S	.	.	H	α-helix	trans	-69.2	-33.9	-179.7	-170.2	175.2	-178.5	176.9	0	114	F468 L483 R484	F468-K480 HydrophobicContact CD1-CB 3.93Å; F468-K480 HydrophobicContact CD1-CG 4.28Å; F468-K480 HydrophobicContact CE1-CB 3.79Å; F468-K480 HydrophobicContact CE1-CG 4.3Å; F468-K480 HydrophobicContact CE2-CB 4.43Å; F468-K480 HydrophobicContact CG-CB 4.33Å; F468-K480 HydrophobicContact CZ-CB 4.05Å; K480-L483 PolarHBondContact O-N 3.44Å; K480-R484 PolarHBondContact O-N 3.32Å
481	D	86.9	Confident	88.1	Confident	42 Å²	42	74.7 Å²	74.7	23%	0.225	36%	0.36	C	S	.	.	H	α-helix	trans	-69.8	-35.4	177.6	64.3	-48.2	0	0	0	111.9	R479 R484 D485	R479-D481 VanDerWaalsContact CB-OD1 3.22Å; R479-D481 WeakPolarHBondContact CB-OD1 3.45Å; R479-D481 IonicContact CZ-OD1 2.73Å; R479-D481 IonicContact CZ-OD2 3.62Å; R479-D481 IonicContact NE-OD1 3.25Å; R479-D481 PolarHBondContact NE-OD1 3.5Å; R479-D481 IonicContact NE-OD2 2.72Å; R479-D481 IonicContact NH2-OD1 3.27Å; R479-D481 PolarHBondContact NH2-OD1 3.3Å; R479-D481 IonicContact NH2-OD2 3.54Å; R479-D481 PolarHBondContact NH2-OD2 2.93Å; D481-R484 PolarHBondContact O-N 2.63Å; D481-D485 WeakPolarHBondContact O-CB 3.44Å; D481-D485 PolarHBondContact O-N 3.28Å
482	H	89.1	Confident	87.4	Confident	64 Å²	64	76.1 Å²	76.1	30%	0.296	37%	0.374	S	S	.	.	H	α-helix	trans	-67.4	-34.5	172.3	-61.8	-16.2	0	0	0	112.9	F477 R479 H486	F477-H482 HydrophobicContact CB-CB 4.33Å; F477-H482 HydrophobicContact CD1-CB 3.98Å; F477-H482 HydrophobicContact CG-CB 4.41Å; R479-H482 WeakPolarHBondContact CD-NE2 3.23Å; R479-H482 VanDerWaalsContact CZ-CE1 3.45Å; R479-H482 PolarHBondContact NE-NE2 3.19Å; R479-H482 PolarHBondContact O-N 3.36Å; H482-H486 VanDerWaalsContact O-CB 3.27Å; H482-H486 WeakPolarHBondContact O-CB 3.17Å; H482-H486 PolarHBondContact O-N 3.43Å
483	L	90.8	Very high	86.8	Confident	10 Å²	10	75.5 Å²	75.5	5%	0.052	37%	0.373	C	S	.	.	H	α-helix	trans	-62.7	-47.8	170.2	169.7	62.1	0	0	0	111.6	F468 G469 C470 F477 R479 K480 H486 S487 I551	F468-L483 HydrophobicContact CB-CB 4.09Å; F468-L483 HydrophobicContact CB-CD2 3.88Å; G469-L483 VanDerWaalsContact O-CD1 3.23Å; G469-L483 WeakPolarHBondContact O-CD1 3.45Å; G469-L483 WeakPolarHBondContact O-CD2 3.42Å; C470-L483 HydrophobicContact CB-CD1 3.65Å; F477-L483 HydrophobicContact CD2-CB 4.09Å; F477-L483 HydrophobicContact CD2-CD1 4.08Å; F477-L483 HydrophobicContact CE2-CD1 4.28Å; F477-L483 HydrophobicContact CG-CB 4.45Å; R479-L483 PolarHBondContact O-N 2.88Å; K480-L483 PolarHBondContact O-N 3.44Å; L483-H486 CarbonylContact O-C 3.43Å; L483-H486 WeakPolarHBondContact O-CB 3.38Å; L483-H486 PolarHBondContact O-N 2.92Å; L483-S487 PolarHBondContact O-N 3.05Å; L483-I551 HydrophobicContact CD2-CD1 3.82Å
484	R	89.2	Confident	86.5	Confident	127 Å²	127	78.2 Å²	78.2	48%	0.479	38%	0.38	S	S	.	.	H	α-helix	trans	-61	-45.8	177.1	-179.2	-157.8	62.7	-153.1	-7.1	111.6	K480 D481 H486 S487 Y488	K480-R484 PolarHBondContact O-N 3.32Å; D481-R484 PolarHBondContact O-N 2.63Å; R484-H486 PolarHBondContact O-N 3.47Å; R484-S487 PolarHBondContact O-N 3.12Å; R484-S487 VanDerWaalsContact O-N 3.11Å; R484-S487 PolarHBondContact O-OG 3.42Å; R484-Y488 HydrophobicContact CG-CE2 3.97Å; R484-Y488 WeakPolarHBondContact O-CD2 3.26Å; R484-Y488 PolarHBondContact O-N 2.98Å
485	D	85.4	Confident	86.4	Confident	28 Å²	28	75 Å²	75	15%	0.15	36%	0.357	C	S	.	.	H	α-helix	trans	-68	-22.6	-179.8	-66.3	6.5	0	0	0	111.6	D481 Q507	D481-D485 WeakPolarHBondContact O-CB 3.44Å; D481-D485 PolarHBondContact O-N 3.28Å; D485-Q507 HydrophobicContact CB-CG 4.01Å
486	H	88.1	Confident	86.3	Confident	14 Å²	14	70.8 Å²	70.8	7%	0.065	34%	0.343	C	S	.	.	H	α-helix	trans	-79.7	-33.7	168.5	169.5	53.7	0	0	0	113.9	C473 F477 H482 L483 R484 Y488 T489 H490	C473-H486 PolarHBondContact SG-NE2 3.06Å; C473-H486 VanDerWaalsContact SG-NE2 3.39Å; F477-H486 HydrophobicContact CE1-CB 4.07Å; F477-H486 HydrophobicContact CE2-CB 4.06Å; F477-H486 AromaticContact CE2-CD2 3.26Å; F477-H486 WeakPolarHBondContact CE2-CD2 3.39Å; F477-H486 AromaticContact CE2-CG 3.79Å; F477-H486 HydrophobicContact CZ-CB 3.58Å; F477-H486 AromaticContact CZ-CD2 3.3Å; F477-H486 WeakPolarHBondContact CZ-CD2 3.27Å; F477-H486 AromaticContact CZ-CG 3.36Å; H482-H486 VanDerWaalsContact O-CB 3.27Å; H482-H486 WeakPolarHBondContact O-CB 3.17Å; H482-H486 PolarHBondContact O-N 3.43Å; L483-H486 CarbonylContact O-C 3.43Å; L483-H486 WeakPolarHBondContact O-CB 3.38Å; L483-H486 PolarHBondContact O-N 2.92Å; R484-H486 PolarHBondContact O-N 3.47Å; H486-Y488 PolarHBondContact O-N 2.99Å; H486-T489 PolarHBondContact CE1-OG1 3.41Å; H486-T489 PolarHBondContact ND1-OG1 3.26Å; H486-T489 WeakPolarHBondContact O-CA 3.32Å; H486-T489 VanDerWaalsContact O-CB 3.31Å; H486-T489 WeakPolarHBondContact O-CB 3.37Å; H486-T489 PolarHBondContact O-N 3.33Å; H486-T489 PolarHBondContact O-OG1 3.46Å; H486-H490 AromaticContact CE1-CE1 3.68Å; H486-H490 AromaticContact CE1-NE2 3.24Å; H486-H490 PolarHBondContact CE1-NE2 2.72Å; H486-H490 AromaticContact NE2-CE1 3.87Å; H486-H490 AromaticContact NE2-NE2 3.1Å; H486-H490 PolarHBondContact NE2-NE2 3.38Å; H486-H490 VanDerWaalsContact NE2-NE2 3.1Å
487	S	86.6	Confident	86.1	Confident	32 Å²	32	67.3 Å²	67.3	22%	0.224	34%	0.341	C	S	.	.	H	α-helix	trans	-64.6	-29.1	178.1	67.3	0	0	0	0	112.1	L483 R484 T489 H490 L491	L483-S487 PolarHBondContact O-N 3.05Å; R484-S487 PolarHBondContact O-N 3.12Å; R484-S487 VanDerWaalsContact O-N 3.11Å; R484-S487 PolarHBondContact O-OG 3.42Å; S487-T489 PolarHBondContact O-N 2.91Å; S487-H490 PolarHBondContact O-N 2.89Å; S487-H490 VanDerWaalsContact O-N 3.08Å; S487-L491 PolarHBondContact O-N 3.09Å
488	Y	86.6	Confident	86.1	Confident	71 Å²	71	65.2 Å²	65.2	28%	0.278	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-1.3	166	-57.8	-49.9	0	0	0	115.3	R484 H486 L491 P495 C506	R484-Y488 HydrophobicContact CG-CE2 3.97Å; R484-Y488 WeakPolarHBondContact O-CD2 3.26Å; R484-Y488 PolarHBondContact O-N 2.98Å; H486-Y488 PolarHBondContact O-N 2.99Å; Y488-L491 HydrophobicContact CD1-CD1 3.79Å; Y488-L491 HydrophobicContact CE1-CD1 4.36Å; Y488-P495 HydrophobicContact CD1-CG 3.97Å; Y488-P495 HydrophobicContact CD2-CG 3.96Å; Y488-P495 HydrophobicContact CE1-CG 4.22Å; Y488-P495 HydrophobicContact CE2-CG 4.21Å; Y488-P495 HydrophobicContact CG-CG 3.88Å; Y488-C506 PolarHBondContact O-SG 3.29Å
489	T	85.3	Confident	86	Confident	71 Å²	71	67.1 Å²	67.1	44%	0.436	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-19.1	170	68.5	0	0	0	0	113.4	H486 S487 C506	H486-T489 PolarHBondContact CE1-OG1 3.41Å; H486-T489 PolarHBondContact ND1-OG1 3.26Å; H486-T489 WeakPolarHBondContact O-CA 3.32Å; H486-T489 VanDerWaalsContact O-CB 3.31Å; H486-T489 WeakPolarHBondContact O-CB 3.37Å; H486-T489 PolarHBondContact O-N 3.33Å; H486-T489 PolarHBondContact O-OG1 3.46Å; S487-T489 PolarHBondContact O-N 2.91Å; T489-C506 HydrophobicContact CG2-CB 4.31Å
490	H	86.1	Confident	85.8	Confident	72 Å²	72	67.6 Å²	67.6	33%	0.333	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-27.5	171.7	-58.2	-58.5	0	0	0	112.2	C470 V472 C473 H486 S487	C470-H490 PolarHBondContact SG-NE2 3.07Å; C470-H490 VanDerWaalsContact SG-NE2 3.36Å; V472-H490 HydrophobicContact CG1-CB 4.12Å; C473-H490 VanDerWaalsContact SG-CE1 3.52Å; H486-H490 AromaticContact CE1-CE1 3.68Å; H486-H490 AromaticContact CE1-NE2 3.24Å; H486-H490 PolarHBondContact CE1-NE2 2.72Å; H486-H490 AromaticContact NE2-CE1 3.87Å; H486-H490 AromaticContact NE2-NE2 3.1Å; H486-H490 PolarHBondContact NE2-NE2 3.38Å; H486-H490 VanDerWaalsContact NE2-NE2 3.1Å; S487-H490 PolarHBondContact O-N 2.89Å; S487-H490 VanDerWaalsContact O-N 3.08Å
491	L	81	Confident	85.7	Confident	61 Å²	61	64.5 Å²	64.5	32%	0.319	35%	0.352	S	S	.	.	S	Bend	trans	-70.7	131.8	173.2	-75.9	156.9	0	0	0	111.3	S487 Y488 S493	S487-L491 PolarHBondContact O-N 3.09Å; Y488-L491 HydrophobicContact CD1-CD1 3.79Å; Y488-L491 HydrophobicContact CE1-CD1 4.36Å; L491-S493 VanDerWaalsContact C-N 3.33Å; L491-S493 WeakPolarHBondContact CB-O 3.49Å
492	T	73.3	Confident	85.7	Confident	147 Å²	147	69.8 Å²	69.8	90%	0.902	38%	0.375	S	S	*	.	S	Bend	trans	-66.5	-36.5	173.3	52.7	0	0	0	0	111.5
493	S	74.6	Confident	85.5	Confident	81 Å²	81	71.3 Å²	71.3	57%	0.566	38%	0.378	S	S	*	.	S	Bend	trans	-81.8	125.1	170.4	52.5	0	0	0	0	111	L491	L491-S493 VanDerWaalsContact C-N 3.33Å; L491-S493 WeakPolarHBondContact CB-O 3.49Å
494	K	83.8	Confident	85.3	Confident	99 Å²	99	72.1 Å²	72.1	43%	0.43	39%	0.389	S	S	.	.			trans	-106.6	128.8	178.8	-70.5	178.6	-179.5	173.3	0	109.9	F496 G504	K494-F496 VanDerWaalsContact C-N 3.28Å; K494-F496 PolarHBondContact O-N 3.32Å; K494-G504 WeakPolarHBondContact CD-O 3.36Å
495	P	84.8	Confident	85.1	Confident	59 Å²	59	66.4 Å²	66.4	38%	0.383	37%	0.367	S	S	.	.	S	Bend	trans	-67.8	-20.6	-166.2	23.5	-33.6	0	0	0	115.2	Y488	Y488-P495 HydrophobicContact CD1-CG 3.97Å; Y488-P495 HydrophobicContact CD2-CG 3.96Å; Y488-P495 HydrophobicContact CE1-CG 4.22Å; Y488-P495 HydrophobicContact CE2-CG 4.21Å; Y488-P495 HydrophobicContact CG-CG 3.88Å
496	F	87.2	Confident	85.1	Confident	76 Å²	76	66 Å²	66	33%	0.333	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	111.5	-179.2	-53.2	-77	0	0	0	110.3	K494 G504 F505 S508 L511	K494-F496 VanDerWaalsContact C-N 3.28Å; K494-F496 PolarHBondContact O-N 3.32Å; F496-G504 CarbonylContact O-C 3.59Å; F496-G504 WeakPolarHBondContact O-CA 3.42Å; F496-F505 HydrophobicContact CB-CB 4.34Å; F496-F505 PolarHBondContact N-O 3.16Å; F496-F505 PolarHBondContact O-N 3.28Å; F496-S508 VanDerWaalsContact CD2-N 3.31Å; F496-L511 HydrophobicContact CB-CB 4.21Å; F496-L511 HydrophobicContact CB-CD2 3.87Å
497	S	87.1	Confident	84.9	Confident	72 Å²	72	67.1 Å²	67.1	50%	0.503	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	148.9	178.1	61.3	0	0	0	0	112.5	S499 R503 L511	S497-S499 PolarHBondContact O-N 2.87Å; S497-R503 CarbonylContact C-O 3.59Å; S497-R503 WeakPolarHBondContact CA-O 3.41Å; S497-L511 VanDerWaalsContact O-CD2 3.32Å; S497-L511 WeakPolarHBondContact O-CD2 3.44Å
498	C	89.9	Confident	85	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	38%	0.383	C	S	.	.			trans	-77	124.1	174.8	-171.3	0	0	0	0	111.3	I500 H502 R503 F505 L511 H514 H519	C498-I500 PolarHBondContact O-N 2.75Å; C498-I500 VanDerWaalsContact O-N 3.1Å; C498-H502 WeakPolarHBondContact O-CA 3.47Å; C498-H502 PolarHBondContact O-N 3.37Å; C498-R503 PolarHBondContact N-O 3.09Å; C498-F505 HydrophobicContact CB-CE2 4.38Å; C498-L511 VanDerWaalsContact CA-CD1 3.5Å; C498-L511 HydrophobicContact CB-CD1 3.71Å; C498-H514 PolarHBondContact SG-NE2 3.27Å; C498-H519 VanDerWaalsContact SG-CD2 3.54Å
499	S	89	Confident	85	Confident	81 Å²	81	73.6 Å²	73.6	57%	0.566	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-9.1	176.2	53.7	0	0	0	0	114.7	S497 K515	S497-S499 PolarHBondContact O-N 2.87Å; S499-K515 WeakPolarHBondContact OG-CE 3.42Å; S499-K515 PolarHBondContact OG-NZ 3.36Å
500	I	85.9	Confident	85.1	Confident	91 Å²	91	71.2 Å²	71.2	47%	0.467	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-35.3	-174.7	-58.2	171.3	0	0	0	112.2	C498 H519	C498-I500 PolarHBondContact O-N 2.75Å; C498-I500 VanDerWaalsContact O-N 3.1Å; I500-H519 HydrophobicContact CD1-CB 3.63Å
501	C	89.1	Confident	85.4	Confident	56 Å²	56	68.8 Å²	68.8	38%	0.378	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	8.4	179.5	70.3	0	0	0	0	114.5	R503 H514 H519	C501-R503 PolarHBondContact O-N 3.11Å; C501-H514 VanDerWaalsContact SG-CE1 3.52Å; C501-H514 PolarHBondContact SG-NE2 3.45Å; C501-H519 PolarHBondContact SG-NE2 2.88Å; C501-H519 VanDerWaalsContact SG-NE2 3.36Å
502	H	86.1	Confident	85.7	Confident	153 Å²	153	71.5 Å²	71.5	71%	0.708	39%	0.388	S	S	*	.			trans	57.5	3.5	178.2	-52.1	-61.7	0	0	0	116.9	C498 G504	C498-H502 WeakPolarHBondContact O-CA 3.47Å; C498-H502 PolarHBondContact O-N 3.37Å; H502-G504 PolarHBondContact O-N 2.95Å
503	R	85.8	Confident	86.4	Confident	96 Å²	96	68.2 Å²	68.2	36%	0.362	37%	0.365	S	S	.	.			trans	-59.6	130.3	176.5	-171.3	170.8	-173.6	163.6	3	111.8	Y309 S497 C498 C501 F505	Y309-R503 VanDerWaalsContact CZ-NH1 3.3Å; S497-R503 CarbonylContact C-O 3.59Å; S497-R503 WeakPolarHBondContact CA-O 3.41Å; C498-R503 PolarHBondContact N-O 3.09Å; C501-R503 PolarHBondContact O-N 3.11Å; R503-F505 HydrophobicContact CB-CE2 3.98Å; R503-F505 HydrophobicContact CB-CZ 4.25Å; R503-F505 HydrophobicContact CG-CE2 3.94Å; R503-F505 HydrophobicContact CG-CZ 3.84Å; R503-F505 VanDerWaalsContact O-CD2 3.29Å; R503-F505 WeakPolarHBondContact O-CD2 3.31Å; R503-F505 WeakPolarHBondContact O-CE2 3.46Å
504	G	86.2	Confident	87.1	Confident	27 Å²	27	64.7 Å²	64.7	28%	0.278	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	143.3	179.9	0	0	0	0	0	114.5	K494 F496 H502	K494-G504 WeakPolarHBondContact CD-O 3.36Å; F496-G504 CarbonylContact O-C 3.59Å; F496-G504 WeakPolarHBondContact O-CA 3.42Å; H502-G504 PolarHBondContact O-N 2.95Å
505	F	85.8	Confident	87.4	Confident	7 Å²	7	63.3 Å²	63.3	3%	0.031	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	144.7	-176.5	-60.9	-88.6	0	0	0	111.4	F496 C498 R503 L511 H514	F496-F505 HydrophobicContact CB-CB 4.34Å; F496-F505 PolarHBondContact N-O 3.16Å; F496-F505 PolarHBondContact O-N 3.28Å; C498-F505 HydrophobicContact CB-CE2 4.38Å; R503-F505 HydrophobicContact CB-CE2 3.98Å; R503-F505 HydrophobicContact CB-CZ 4.25Å; R503-F505 HydrophobicContact CG-CE2 3.94Å; R503-F505 HydrophobicContact CG-CZ 3.84Å; R503-F505 VanDerWaalsContact O-CD2 3.29Å; R503-F505 WeakPolarHBondContact O-CD2 3.31Å; R503-F505 WeakPolarHBondContact O-CE2 3.46Å; F505-L511 HydrophobicContact CB-CB 4.2Å; F505-L511 HydrophobicContact CD2-CB 3.82Å; F505-L511 HydrophobicContact CD2-CD1 3.89Å; F505-L511 HydrophobicContact CD2-CG 4.44Å; F505-L511 HydrophobicContact CE2-CB 4.5Å; F505-L511 HydrophobicContact CE2-CD1 3.97Å; F505-L511 HydrophobicContact CG-CB 4.09Å; F505-H514 HydrophobicContact CE1-CB 3.85Å; F505-H514 HydrophobicContact CE2-CB 4.18Å; F505-H514 AromaticContact CE2-CD2 3.5Å; F505-H514 VanDerWaalsContact CE2-CD2 3.5Å; F505-H514 WeakPolarHBondContact CE2-CD2 3.2Å; F505-H514 AromaticContact CE2-CG 3.88Å; F505-H514 HydrophobicContact CZ-CB 3.47Å; F505-H514 VanDerWaalsContact CZ-CB 3.47Å; F505-H514 AromaticContact CZ-CD2 3.44Å; F505-H514 VanDerWaalsContact CZ-CD2 3.44Å; F505-H514 WeakPolarHBondContact CZ-CD2 3.29Å; F505-H514 AromaticContact CZ-CG 3.31Å; F505-H514 AromaticContact CZ-ND1 3.97Å
506	C	84.6	Confident	87.6	Confident	20 Å²	20	70.5 Å²	70.5	14%	0.135	35%	0.353	C	S	.	.	S	Bend	trans	-82.7	-16.6	-177.9	-51	0	0	0	0	113	Y488 T489	Y488-C506 PolarHBondContact O-SG 3.29Å; T489-C506 HydrophobicContact CG2-CB 4.31Å
507	Q	84.9	Confident	87.6	Confident	37 Å²	37	70.9 Å²	70.9	17%	0.173	37%	0.365	C	S	.	.	S	Bend	trans	-134.8	141.5	179.6	-61.7	174.6	6	0	0	110.3	D485 R509 S510 L511	D485-Q507 HydrophobicContact CB-CG 4.01Å; Q507-R509 VanDerWaalsContact C-N 3.32Å; Q507-R509 PolarHBondContact O-N 3.27Å; Q507-S510 WeakPolarHBondContact O-CB 3.34Å; Q507-S510 PolarHBondContact O-N 3.2Å; Q507-S510 VanDerWaalsContact O-N 3.16Å; Q507-L511 PolarHBondContact O-N 3.25Å
508	S	87.3	Confident	87.3	Confident	67 Å²	67	70.6 Å²	70.6	47%	0.469	36%	0.358	S	S	.	.	H	α-helix	trans	-59	-40.5	178	-175.2	0	0	0	0	112.6	F496 S510 L511 E512	F496-S508 VanDerWaalsContact CD2-N 3.31Å; S508-S510 VanDerWaalsContact C-N 3.3Å; S508-S510 PolarHBondContact O-N 3.11Å; S508-L511 WeakPolarHBondContact O-CA 3.47Å; S508-L511 WeakPolarHBondContact O-CB 3.48Å; S508-L511 PolarHBondContact O-N 3.3Å; S508-L511 VanDerWaalsContact O-N 3.07Å; S508-E512 PolarHBondContact O-N 3.35Å
509	R	87.2	Confident	87.1	Confident	172 Å²	172	72.7 Å²	72.7	65%	0.649	37%	0.367	S	S	*	.	H	α-helix	trans	-63.1	-32.3	177.4	-179	162.8	-71.8	157.3	0.6	113.4	Q507 L511 E512 N513	Q507-R509 VanDerWaalsContact C-N 3.32Å; Q507-R509 PolarHBondContact O-N 3.27Å; R509-L511 VanDerWaalsContact C-N 3.34Å; R509-E512 PolarHBondContact O-N 3.22Å; R509-N513 VanDerWaalsContact O-CB 3.32Å; R509-N513 WeakPolarHBondContact O-CB 3.5Å; R509-N513 PolarHBondContact O-N 2.62Å
510	S	88.4	Confident	86.2	Confident	22 Å²	22	73.7 Å²	73.7	15%	0.154	37%	0.372	C	S	.	.	H	α-helix	trans	-67.1	-37.9	174	-49.4	0	0	0	0	111.4	Q507 S508 H514	Q507-S510 WeakPolarHBondContact O-CB 3.34Å; Q507-S510 PolarHBondContact O-N 3.2Å; Q507-S510 VanDerWaalsContact O-N 3.16Å; S508-S510 VanDerWaalsContact C-N 3.3Å; S508-S510 PolarHBondContact O-N 3.11Å; S510-H514 VanDerWaalsContact O-CB 3.26Å; S510-H514 WeakPolarHBondContact O-CB 3.32Å; S510-H514 PolarHBondContact O-N 3.07Å
511	L	90.4	Very high	85.1	Confident	21 Å²	21	74.7 Å²	74.7	11%	0.11	38%	0.377	C	S	.	.	H	α-helix	trans	-66.6	-45.4	173.3	167.7	61.2	0	0	0	111.7	F496 S497 C498 F505 Q507 S508 R509 H514 K515	F496-L511 HydrophobicContact CB-CB 4.21Å; F496-L511 HydrophobicContact CB-CD2 3.87Å; S497-L511 VanDerWaalsContact O-CD2 3.32Å; S497-L511 WeakPolarHBondContact O-CD2 3.44Å; C498-L511 VanDerWaalsContact CA-CD1 3.5Å; C498-L511 HydrophobicContact CB-CD1 3.71Å; F505-L511 HydrophobicContact CB-CB 4.2Å; F505-L511 HydrophobicContact CD2-CB 3.82Å; F505-L511 HydrophobicContact CD2-CD1 3.89Å; F505-L511 HydrophobicContact CD2-CG 4.44Å; F505-L511 HydrophobicContact CE2-CB 4.5Å; F505-L511 HydrophobicContact CE2-CD1 3.97Å; F505-L511 HydrophobicContact CG-CB 4.09Å; Q507-L511 PolarHBondContact O-N 3.25Å; S508-L511 WeakPolarHBondContact O-CA 3.47Å; S508-L511 WeakPolarHBondContact O-CB 3.48Å; S508-L511 PolarHBondContact O-N 3.3Å; S508-L511 VanDerWaalsContact O-N 3.07Å; R509-L511 VanDerWaalsContact C-N 3.34Å; L511-H514 PolarHBondContact O-N 2.81Å; L511-K515 HydrophobicContact CD1-CD 4.41Å; L511-K515 HydrophobicContact CD1-CG 4.17Å; L511-K515 PolarHBondContact O-N 2.98Å
512	E	89.1	Confident	83.3	Confident	117 Å²	117	81.1 Å²	81.1	55%	0.547	40%	0.399	S	S	.	.	H	α-helix	trans	-58.4	-51.4	176.4	-175.8	-175.1	-167.5	0	0	111.5	S508 R509 H514 K515 R516	S508-E512 PolarHBondContact O-N 3.35Å; R509-E512 PolarHBondContact O-N 3.22Å; E512-H514 VanDerWaalsContact C-N 3.33Å; E512-H514 PolarHBondContact O-N 3.43Å; E512-K515 PolarHBondContact O-N 3.08Å; E512-R516 PolarHBondContact O-N 3.11Å
513	N	88	Confident	81.2	Confident	78 Å²	78	80.4 Å²	80.4	42%	0.417	40%	0.4	S	S	.	.	H	α-helix	trans	-60	-42	176.4	-78.2	-10	0	0	0	111.8	R509 R516 S517	R509-N513 VanDerWaalsContact O-CB 3.32Å; R509-N513 WeakPolarHBondContact O-CB 3.5Å; R509-N513 PolarHBondContact O-N 2.62Å; N513-R516 PolarHBondContact O-N 3.4Å; N513-S517 WeakPolarHBondContact O-CB 3.5Å; N513-S517 PolarHBondContact O-N 3.41Å; N513-S517 PolarHBondContact O-OG 3.06Å
514	H	89.1	Confident	78.8	Confident	7 Å²	7	82.5 Å²	82.5	3%	0.032	42%	0.418	C	S	.	.	H	α-helix	trans	-61.2	-48.9	175.1	156.8	67.8	0	0	0	111.8	Y309 C498 C501 F505 S510 L511 E512 R516 S517 N518 H519	Y309-H514 AromaticContact CE1-ND1 3.96Å; Y309-H514 AromaticContact CZ-ND1 3.93Å; Y309-H514 PolarHBondContact OH-CE1 2.96Å; Y309-H514 PolarHBondContact OH-ND1 2.72Å; C498-H514 PolarHBondContact SG-NE2 3.27Å; C501-H514 VanDerWaalsContact SG-CE1 3.52Å; C501-H514 PolarHBondContact SG-NE2 3.45Å; F505-H514 HydrophobicContact CE1-CB 3.85Å; F505-H514 HydrophobicContact CE2-CB 4.18Å; F505-H514 AromaticContact CE2-CD2 3.5Å; F505-H514 VanDerWaalsContact CE2-CD2 3.5Å; F505-H514 WeakPolarHBondContact CE2-CD2 3.2Å; F505-H514 AromaticContact CE2-CG 3.88Å; F505-H514 HydrophobicContact CZ-CB 3.47Å; F505-H514 VanDerWaalsContact CZ-CB 3.47Å; F505-H514 AromaticContact CZ-CD2 3.44Å; F505-H514 VanDerWaalsContact CZ-CD2 3.44Å; F505-H514 WeakPolarHBondContact CZ-CD2 3.29Å; F505-H514 AromaticContact CZ-CG 3.31Å; F505-H514 AromaticContact CZ-ND1 3.97Å; S510-H514 VanDerWaalsContact O-CB 3.26Å; S510-H514 WeakPolarHBondContact O-CB 3.32Å; S510-H514 PolarHBondContact O-N 3.07Å; L511-H514 PolarHBondContact O-N 2.81Å; E512-H514 VanDerWaalsContact C-N 3.33Å; E512-H514 PolarHBondContact O-N 3.43Å; H514-R516 PolarHBondContact O-N 3.25Å; H514-S517 PolarHBondContact O-N 3.17Å; H514-S517 PolarHBondContact O-OG 2.86Å; H514-N518 WeakPolarHBondContact O-CB 3.43Å; H514-N518 PolarHBondContact O-N 3.38Å; H514-N518 PolarHBondContact O-ND2 3.29Å; H514-N518 VanDerWaalsContact O-ND2 3.12Å; H514-H519 AromaticContact CE1-CD2 3.95Å; H514-H519 AromaticContact CE1-NE2 3.53Å; H514-H519 AromaticContact NE2-CD2 3.63Å; H514-H519 AromaticContact NE2-NE2 3.38Å; H514-H519 PolarHBondContact NE2-NE2 2.74Å
515	K	89.5	Confident	76.4	Confident	70 Å²	70	90.5 Å²	90.5	30%	0.304	45%	0.449	S	S	.	.	H	α-helix	trans	-54.5	-53.5	174.7	-78.3	-174.7	171.1	-169.9	0	110.1	S499 L511 E512 S517 N518 H519	S499-K515 WeakPolarHBondContact OG-CE 3.42Å; S499-K515 PolarHBondContact OG-NZ 3.36Å; L511-K515 HydrophobicContact CD1-CD 4.41Å; L511-K515 HydrophobicContact CD1-CG 4.17Å; L511-K515 PolarHBondContact O-N 2.98Å; E512-K515 PolarHBondContact O-N 3.08Å; K515-S517 VanDerWaalsContact C-N 3.26Å; K515-S517 PolarHBondContact O-N 2.85Å; K515-N518 PolarHBondContact O-N 3.36Å; K515-H519 CarbonylContact O-C 3.55Å; K515-H519 WeakPolarHBondContact O-CA 3.46Å; K515-H519 PolarHBondContact O-N 3.41Å; K515-H519 VanDerWaalsContact O-O 3.05Å
516	R	88.9	Confident	74.1	Confident	211 Å²	211	94.3 Å²	94.3	80%	0.796	48%	0.476	S	S	*	.	H	α-helix	trans	-59.5	-31.8	-177.6	-159.3	-179.8	86.3	138.3	3.8	114	E512 N513 H514	E512-R516 PolarHBondContact O-N 3.11Å; N513-R516 PolarHBondContact O-N 3.4Å; H514-R516 PolarHBondContact O-N 3.25Å
517	S	87.6	Confident	71.5	Confident	83 Å²	83	101.9 Å²	101.9	58%	0.58	52%	0.515	S	S	*	.	H	α-helix	trans	-97.5	-20.6	-175.3	52	0	0	0	0	115.2	N513 H514 K515	N513-S517 WeakPolarHBondContact O-CB 3.5Å; N513-S517 PolarHBondContact O-N 3.41Å; N513-S517 PolarHBondContact O-OG 3.06Å; H514-S517 PolarHBondContact O-N 3.17Å; H514-S517 PolarHBondContact O-OG 2.86Å; K515-S517 VanDerWaalsContact C-N 3.26Å; K515-S517 PolarHBondContact O-N 2.85Å
518	N	80.5	Confident	69.1	Low	67 Å²	67	105.6 Å²	105.6	36%	0.358	54%	0.54	S	S	.	.	H	α-helix	trans	-123.7	-17.2	-173.9	-62.6	-100.2	0	0	0	113.7	Y309 H514 K515 P520	Y309-N518 PolarHBondContact OH-ND2 3.21Å; Y309-N518 VanDerWaalsContact OH-ND2 3.09Å; Y309-N518 PolarHBondContact OH-OD1 2.87Å; H514-N518 WeakPolarHBondContact O-CB 3.43Å; H514-N518 PolarHBondContact O-N 3.38Å; H514-N518 PolarHBondContact O-ND2 3.29Å; H514-N518 VanDerWaalsContact O-ND2 3.12Å; K515-N518 PolarHBondContact O-N 3.36Å; N518-P520 VanDerWaalsContact C-CD 3.42Å
519	H	85.3	Confident	66.5	Low	43 Å²	43	112 Å²	112	20%	0.199	56%	0.56	C	S	.	*	S	Bend	trans	-128.5	67.5	175.3	-55.7	-46.6	0	0	0	108.4	C498 I500 C501 H514 K515 I521	C498-H519 VanDerWaalsContact SG-CD2 3.54Å; I500-H519 HydrophobicContact CD1-CB 3.63Å; C501-H519 PolarHBondContact SG-NE2 2.88Å; C501-H519 VanDerWaalsContact SG-NE2 3.36Å; H514-H519 AromaticContact CE1-CD2 3.95Å; H514-H519 AromaticContact CE1-NE2 3.53Å; H514-H519 AromaticContact NE2-CD2 3.63Å; H514-H519 AromaticContact NE2-NE2 3.38Å; H514-H519 PolarHBondContact NE2-NE2 2.74Å; K515-H519 CarbonylContact O-C 3.55Å; K515-H519 WeakPolarHBondContact O-CA 3.46Å; K515-H519 PolarHBondContact O-N 3.41Å; K515-H519 VanDerWaalsContact O-O 3.05Å; H519-I521 PolarHBondContact O-N 3.2Å
520	P	70	Confident	63.8	Low	103 Å²	103	109.7 Å²	109.7	67%	0.669	56%	0.56	S	S	*	*			trans	-65.3	95.1	179.5	28.2	-34.9	0	0	0	110	N518 K522	N518-P520 VanDerWaalsContact C-CD 3.42Å; P520-K522 PolarHBondContact O-N 3.07Å
521	I	62.5	Low	61	Low	111 Å²	111	115.5 Å²	115.5	57%	0.569	59%	0.589	S	S	*	*			trans	-63.9	120.3	174.7	-56.3	177.7	0	0	0	107.5	H519 N523	H519-I521 PolarHBondContact O-N 3.2Å; I521-N523 WeakPolarHBondContact CG2-OD1 3.33Å; I521-N523 PolarHBondContact O-N 3.18Å; I521-N523 PolarHBondContact O-OD1 3.27Å
522	K	52.1	Low	58	Low	192 Å²	192	121.1 Å²	121.1	84%	0.835	62%	0.619	S	S	*	*			trans	-73.3	103	166.9	-69.1	-176.2	178.8	-178.4	0	107	P520 N524	P520-K522 PolarHBondContact O-N 3.07Å; K522-N524 PolarHBondContact O-N 2.78Å
523	N	41.4	Very low	55.1	Low	137 Å²	137	122.1 Å²	122.1	73%	0.733	63%	0.629	S	S	*	*			trans	-72.1	71.4	-175.3	-73.5	-1.7	0	0	0	112.8	I521	I521-N523 WeakPolarHBondContact CG2-OD1 3.33Å; I521-N523 PolarHBondContact O-N 3.18Å; I521-N523 PolarHBondContact O-OD1 3.27Å
524	N	35.1	Very low	52.4	Low	140 Å²	140	127 Å²	127	75%	0.749	64%	0.642	S	S	*	*	S	Bend	trans	-115	143.7	155.2	-71	-17.7	0	0	0	107.2	K522	K522-N524 PolarHBondContact O-N 2.78Å
525	E	36.7	Very low	49.5	Very low	196 Å²	196	132.1 Å²	132.1	92%	0.916	68%	0.679	S	S	*	*	S	Bend	trans	60	61.6	173.5	-57.1	-177.2	168.9	0	0	116.2
526	S	37.7	Very low	46.9	Very low	86 Å²	86	133.3 Å²	133.3	60%	0.601	69%	0.692	S	S	*	*			trans	-148.9	13.7	161.1	-39.4	0	0	0	0	115.7	T528	S526-T528 PolarHBondContact O-N 2.81Å
527	N	30.5	Very low	44.1	Very low	179 Å²	179	132.5 Å²	132.5	96%	0.957	69%	0.694	S	S	*	*			trans	-77.4	45.8	174.9	-87.7	-11.6	0	0	0	112.4
528	T	33.8	Very low	41.3	Very low	115 Å²	115	135.2 Å²	135.2	71%	0.706	70%	0.702	S	S	*	*	S	Bend	trans	-144	106.8	-179.3	50.6	0	0	0	0	110.6	S526	S526-T528 PolarHBondContact O-N 2.81Å
529	K	32.8	Very low	38.8	Very low	203 Å²	203	138 Å²	138	88%	0.883	72%	0.721	S	S	*	*			trans	56.8	72	165.2	-57.8	-177.7	179.5	-179.5	0	116.9
530	L	31.3	Very low	36.1	Very low	123 Å²	123	145.1 Å²	145.1	64%	0.644	75%	0.748	S	S	*	*			trans	-132.9	33.7	151.2	-89.6	179.6	0	0	0	113.1	Y534	L530-Y534 HydrophobicContact CD1-CE2 3.98Å; L530-Y534 HydrophobicContact CD2-CD2 4.14Å; L530-Y534 HydrophobicContact CD2-CE2 3.54Å; L530-Y534 HydrophobicContact CG-CE2 4.38Å
531	N	28.5	Very low	34	Very low	144 Å²	144	146 Å²	146	77%	0.77	75%	0.751	S	S	*	*	S	Bend	trans	-77.3	153.6	138.7	-79.1	-10.1	0	0	0	107.5
532	D	27.4	Very low	32.5	Very low	138 Å²	138	146.5 Å²	146.5	74%	0.738	76%	0.76	S	S	*	*	S	Bend	trans	69.2	138.5	-174.3	-45	-37.6	0	0	0	114.4
533	N	27.8	Very low	31.5	Very low	139 Å²	139	141.3 Å²	141.3	74%	0.743	75%	0.752	S	S	*	*			trans	68.6	46.6	171.3	-57.5	-33.8	0	0	0	120.2
534	Y	31.7	Very low	31	Very low	180 Å²	180	141.5 Å²	141.5	71%	0.706	75%	0.754	S	S	*	*			trans	-116.4	19.9	142.9	-77	-59.3	0	0	0	115.1	L530 T536	L530-Y534 HydrophobicContact CD1-CE2 3.98Å; L530-Y534 HydrophobicContact CD2-CD2 4.14Å; L530-Y534 HydrophobicContact CD2-CE2 3.54Å; L530-Y534 HydrophobicContact CG-CE2 4.38Å; Y534-T536 HydrophobicContact CD1-CG2 3.94Å; Y534-T536 HydrophobicContact CE1-CG2 4.42Å; Y534-T536 PolarHBondContact O-N 2.88Å
535	S	29	Very low	30.8	Very low	115 Å²	115	139.5 Å²	139.5	80%	0.804	74%	0.742	S	S	*	*			trans	-70.9	61.6	146.8	-65.6	0	0	0	0	109.9	K537	S535-K537 PolarHBondContact O-N 2.99Å
536	T	34.1	Very low	30.7	Very low	94 Å²	94	136.3 Å²	136.3	58%	0.577	73%	0.729	S	S	*	*			trans	-70.4	81.9	171.8	46.2	0	0	0	0	109	Y534 L538	Y534-T536 HydrophobicContact CD1-CG2 3.94Å; Y534-T536 HydrophobicContact CE1-CG2 4.42Å; Y534-T536 PolarHBondContact O-N 2.88Å; T536-L538 PolarHBondContact O-N 3.1Å
537	K	29.8	Very low	30.3	Very low	195 Å²	195	137 Å²	137	85%	0.848	73%	0.732	S	S	*	*			trans	-63.4	60.8	170.7	-172.8	-174.2	179.6	-176.5	0	109.6	S535 T539	S535-K537 PolarHBondContact O-N 2.99Å; K537-T539 PolarHBondContact O-N 3.04Å
538	L	29.6	Very low	30.5	Very low	140 Å²	140	132 Å²	132	73%	0.733	70%	0.704	S	S	*	*			trans	-59.9	120.6	174.2	-85.9	164	0	0	0	107.7	T536 Y540	T536-L538 PolarHBondContact O-N 3.1Å; L538-Y540 PolarHBondContact O-N 2.82Å
539	T	28.7	Very low	30.3	Very low	124 Å²	124	133 Å²	133	76%	0.761	71%	0.706	S	S	*	*			trans	-63.2	129.7	-168.6	38.3	0	0	0	0	110.9	K537 T541	K537-T539 PolarHBondContact O-N 3.04Å; T539-T541 PolarHBondContact O-N 3.5Å
540	Y	26.7	Very low	30.1	Very low	194 Å²	194	129.3 Å²	129.3	76%	0.761	70%	0.696	S	S	*	*			trans	-61.8	106.4	174.1	-67.7	-89.5	0	0	0	110	L538 T542 I545	L538-Y540 PolarHBondContact O-N 2.82Å; Y540-T542 PolarHBondContact O-N 2.94Å; Y540-I545 HydrophobicContact CD1-CD1 3.82Å
541	T	27.9	Very low	30.1	Very low	120 Å²	120	126.6 Å²	126.6	74%	0.736	68%	0.681	S	S	*	*			trans	-73.5	100.5	157.3	39.3	0	0	0	0	107.6	T539 A543	T539-T541 PolarHBondContact O-N 3.5Å; T541-A543 PolarHBondContact O-N 2.87Å
542	T	30.9	Very low	30.3	Very low	123 Å²	123	126.6 Å²	126.6	76%	0.755	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-67.4	7	-170.4	44	0	0	0	0	115.3	Y540	Y540-T542 PolarHBondContact O-N 2.94Å
543	A	31	Very low	30.3	Very low	82 Å²	82	125.6 Å²	125.6	68%	0.678	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-77.8	-22.3	-167.8	0	0	0	0	0	115.8	T541	T541-A543 PolarHBondContact O-N 2.87Å
544	N	30	Very low	30.6	Very low	142 Å²	142	125.1 Å²	125.1	76%	0.759	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-136.5	29	-170.7	-76.7	-48.8	0	0	0	113.8
545	I	31.5	Very low	30.3	Very low	97 Å²	97	123.7 Å²	123.7	50%	0.497	68%	0.682	S	S	.	*			trans	-111.3	110.4	-179.4	-57.8	176.4	0	0	0	109.4	Y540 P547	Y540-I545 HydrophobicContact CD1-CD1 3.82Å; I545-P547 WeakPolarHBondContact O-CD 3.45Å
546	I	33.9	Very low	30.5	Very low	129 Å²	129	125.5 Å²	125.5	66%	0.662	68%	0.683	S	S	*	*			trans	-66.6	119	163.8	-60.8	174.8	0	0	0	107.4	I548	I546-I548 PolarHBondContact O-N 3.12Å; I546-I548 VanDerWaalsContact O-N 3.07Å
547	P	29.4	Very low	30.2	Very low	100 Å²	100	128.2 Å²	128.2	65%	0.649	69%	0.694	S	S	*	*			trans	-80.4	93.7	-176.6	31.6	-33	0	0	0	110.3	I545 N549	I545-P547 WeakPolarHBondContact O-CD 3.45Å; P547-N549 PolarHBondContact O-N 2.77Å
548	I	34.9	Very low	30.3	Very low	74 Å²	74	125 Å²	125	38%	0.379	69%	0.69	S	S	.	*			trans	-74.7	64.8	176.9	-45.5	177.2	0	0	0	110.9	D471 I546 I551	D471-I548 WeakPolarHBondContact OD2-CD1 3.09Å; I546-I548 PolarHBondContact O-N 3.12Å; I546-I548 VanDerWaalsContact O-N 3.07Å; I548-I551 HydrophobicContact CG2-CD1 4.04Å; I548-I551 HydrophobicContact CG2-CG1 3.87Å
549	N	29.2	Very low	30.3	Very low	138 Å²	138	123.7 Å²	123.7	74%	0.738	69%	0.688	S	S	*	*			trans	-76.2	144.8	163.1	-75.3	-16.8	0	0	0	109.2	P547	P547-N549 PolarHBondContact O-N 2.77Å
550	N	29	Very low	30.3	Very low	125 Å²	125	124.4 Å²	124.4	67%	0.668	69%	0.688	S	S	*	*			trans	49.7	65.9	169.4	-61	6.9	0	0	0	116.8	H552	N550-H552 PolarHBondContact O-N 2.78Å
551	I	30.8	Very low	30.5	Very low	66 Å²	66	122.7 Å²	122.7	34%	0.338	69%	0.692	S	S	.	*			trans	-64.2	92.2	149.7	-57.3	176.8	0	0	0	107.2	L483 I548	L483-I551 HydrophobicContact CD2-CD1 3.82Å; I548-I551 HydrophobicContact CG2-CD1 4.04Å; I548-I551 HydrophobicContact CG2-CG1 3.87Å
552	H	32.1	Very low	30.5	Very low	143 Å²	143	122.9 Å²	122.9	66%	0.662	69%	0.693	S	S	*	*			trans	-63.4	132.6	170.8	-96.6	-92.6	0	0	0	109.8	N550 T554	N550-H552 PolarHBondContact O-N 2.78Å; H552-T554 PolarHBondContact O-N 3.21Å; H552-T554 VanDerWaalsContact O-N 3.11Å
553	T	29.3	Very low	30.5	Very low	118 Å²	118	124 Å²	124	72%	0.724	70%	0.699	S	S	*	*			trans	-73.2	98	166.5	45.4	0	0	0	0	109.1	N555	T553-N555 PolarHBondContact O-N 3.43Å
554	T	32.2	Very low	30.3	Very low	128 Å²	128	128.1 Å²	128.1	79%	0.785	70%	0.704	S	S	*	*			trans	-74.5	65.8	175.3	43.1	0	0	0	0	112	H552 N556	H552-T554 PolarHBondContact O-N 3.21Å; H552-T554 VanDerWaalsContact O-N 3.11Å; T554-N556 PolarHBondContact O-N 3.01Å
555	N	26.7	Very low	30.4	Very low	150 Å²	150	129.3 Å²	129.3	80%	0.802	71%	0.709	S	S	*	*			trans	-68.4	104.3	153.7	-81.9	5.9	0	0	0	107.4	T553	T553-N555 PolarHBondContact O-N 3.43Å
556	N	32	Very low	30.2	Very low	154 Å²	154	131.1 Å²	131.1	82%	0.824	72%	0.72	S	S	*	*			trans	-148.4	112.6	162.4	-96.8	-22.4	0	0	0	109.7	T554	T554-N556 PolarHBondContact O-N 3.01Å
557	N	28.5	Very low	29.8	Very low	151 Å²	151	129.9 Å²	129.9	81%	0.807	72%	0.723	S	S	*	*			trans	-76.2	-177.6	157.8	-70.7	-28.3	0	0	0	109.1
558	T	31.8	Very low	29.6	Very low	127 Å²	127	129.9 Å²	129.9	78%	0.779	73%	0.725	S	S	*	*			trans	62.9	87.9	168.3	43.3	0	0	0	0	117.5
559	T	29	Very low	29.3	Very low	112 Å²	112	133 Å²	133	69%	0.687	74%	0.741	S	S	*	*				51.5	126.5	119.7	55.7	0	0	0	0	121.4
560	N	29	Very low	29.2	Very low	140 Å²	140	133.2 Å²	133.2	75%	0.749	74%	0.742	S	S	*	*			trans	65.6	115.2	144.2	-52	-1.7	0	0	0	116
561	N	31.4	Very low	29	Very low	158 Å²	158	133.3 Å²	133.3	85%	0.845	75%	0.747	S	S	*	*				-157.7	171.3	54.7	-92	-39.4	0	0	0	114
562	T	27	Very low	28.9	Very low	124 Å²	124	138.7 Å²	138.7	76%	0.761	77%	0.769	S	S	*	*			trans	-75.9	143.7	179.2	51.2	0	0	0	0	115.2
563	T	31.6	Very low	28.7	Very low	145 Å²	145	137.7 Å²	137.7	89%	0.89	78%	0.775	S	S	*	*				-158.3	143.9	125.3	26.6	0	0	0	0	110.9
564	H	26.6	Very low	28.6	Very low	169 Å²	169	138.3 Å²	138.3	78%	0.782	78%	0.779	S	S	*	*			trans	-81.3	138.5	174.6	-74.2	-98.8	0	0	0	111.9
565	I	32.4	Very low	28.3	Very low	167 Å²	167	140 Å²	140	86%	0.856	78%	0.783	S	S	*	*			trans	-139.9	106.7	136.3	-61	-173.1	0	0	0	108.3
566	N	26.7	Very low	28.4	Very low	135 Å²	135	139 Å²	139	72%	0.722	79%	0.787	S	S	*	*			trans	-75.3	153.9	156.1	-59.6	-19.7	0	0	0	106.7
567	S	25.2	Very low	28	Very low	104 Å²	104	139.4 Å²	139.4	73%	0.727	79%	0.788	S	S	*	*			cis	-174.2	168.1	32.7	48.7	0	0	0	0	108.8
568	S	27	Very low	28.1	Very low	100 Å²	100	137.2 Å²	137.2	70%	0.699	78%	0.78	S	S	*	*				163.8	130.5	125.6	-79.4	0	0	0	0	114.1
569	I	27	Very low	27.8	Very low	139 Å²	139	138.1 Å²	138.1	71%	0.713	79%	0.786	S	S	*	*			trans	53.2	105	143.9	-50.9	165.6	0	0	0	117.6
570	N	27	Very low	27.7	Very low	142 Å²	142	139.8 Å²	139.8	76%	0.759	79%	0.788	S	S	*	*			trans	-153.4	66.8	143.1	-109	-32.2	0	0	0	110.6	F572	N570-F572 PolarHBondContact O-N 2.92Å
571	T	26.3	Very low	27.6	Very low	127 Å²	127	138.2 Å²	138.2	78%	0.779	78%	0.783	S	S	*	*			trans	-80.8	103.3	173.6	47.3	0	0	0	0	110.4
572	F	27.3	Very low	27.6	Very low	180 Å²	180	139.8 Å²	139.8	79%	0.789	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-96	123	168	-81.4	-81.1	0	0	0	110.5	N570	N570-F572 PolarHBondContact O-N 2.92Å
573	P	29	Very low	27.5	Very low	122 Å²	122	144 Å²	144	79%	0.792	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-75.1	147.3	-179.7	30.7	-34.6	0	0	0	112
574	T	26.2	Very low	27.4	Very low	131 Å²	131	144 Å²	144	80%	0.804	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-84.2	151.6	172.3	46.5	0	0	0	0	111.5
575	N	25.6	Very low	27.8	Very low	162 Å²	162	144 Å²	144	87%	0.866	79%	0.788	S	S	*	*			trans	56.6	120.9	175.9	-77	-9.1	0	0	0	118.2
576	C	29.4	Very low	27.5	Very low	131 Å²	131	146 Å²	146	89%	0.885	79%	0.791	S	S	*	*			trans	-156.9	130.9	134	-135.9	0	0	0	0	110.8
577	D	24.3	Very low	27.6	Very low	161 Å²	161	144 Å²	144	86%	0.861	79%	0.793	S	S	*	*			trans	-70.8	126.9	173.5	-76.7	-70.3	0	0	0	111.2
578	V	29.9	Very low	28	Very low	106 Å²	106	152.1 Å²	152.1	64%	0.642	82%	0.819	S	S	*	*			trans	-142.3	102.5	156.3	-168	0	0	0	0	111.4	M580	V578-M580 HydrophobicContact CG1-CB 3.7Å; V578-M580 HydrophobicContact CG1-CG 3.48Å; V578-M580 VanDerWaalsContact CG1-CG 3.48Å; V578-M580 HydrophobicContact CG1-SD 3.76Å; V578-M580 PolarHBondContact O-N 3.18Å; V578-M580 VanDerWaalsContact O-N 3.12Å
579	T	25.1	Very low	28	Very low	146 Å²	146	154.8 Å²	154.8	90%	0.896	83%	0.825	S	S	*	*			trans	-77.5	82.2	163.2	51.2	0	0	0	0	110.4
580	M	27.2	Very low	28.1	Very low	146 Å²	146	155.6 Å²	155.6	72%	0.719	83%	0.831	S	S	*	*			trans	-127.3	123.8	176.7	-81.9	-173.6	77.2	0	0	115.7	V578	V578-M580 HydrophobicContact CG1-CB 3.7Å; V578-M580 HydrophobicContact CG1-CG 3.48Å; V578-M580 VanDerWaalsContact CG1-CG 3.48Å; V578-M580 HydrophobicContact CG1-SD 3.76Å; V578-M580 PolarHBondContact O-N 3.18Å; V578-M580 VanDerWaalsContact O-N 3.12Å
581	V	28	Very low	28.1	Very low	107 Å²	107	156.3 Å²	156.3	65%	0.648	84%	0.835	S	S	*	*			trans	51.1	90.1	137.6	-165.8	0	0	0	0	117.6
582	M	30.3	Very low	28.2	Very low	191 Å²	191	158.1 Å²	158.1	94%	0.941	84%	0.838	S	S	*	*			trans	-123.5	65.7	136.2	-89.4	-68.3	-167.2	0	0	109.1
583	R	26.3	Very low	28.3	Very low	213 Å²	213	156.7 Å²	156.7	80%	0.804	84%	0.841	S	S	*	*			trans	-107.5	150.5	156.7	-78.4	-172.1	174.6	115	-2.7	107.1
584	N	28.7	Very low	28.3	Very low	146 Å²	146	159 Å²	159	78%	0.781	85%	0.845	S	S	*	*			trans	70.3	133	-159.8	-41.8	-18.3	0	0	0	109
585	I	34.2	Very low	28.4	Very low	169 Å²	169	161 Å²	161	87%	0.867	85%	0.847	S	S	*	*			cis	-114.4	132.4	25.1	-63.6	152.3	0	0	0	111.6
586	K	27.2	Very low	28.6	Very low	209 Å²	209	160.9 Å²	160.9	91%	0.909	85%	0.846	S	S	*	*			trans	-159.3	68.9	162.7	-168.8	-168.7	175.7	-179.3	0	110.5
587	A	28.9	Very low	28.6	Very low	92 Å²	92	163.4 Å²	163.4	76%	0.76	84%	0.843	S	S	*	*			trans	-168.8	72.6	170.4	0	0	0	0	0	111.4
588	E	32.6	Very low	28.9	Very low	275 Å²	275	163.6 Å²	163.6	100%	1.285	84%	0.841	S	S	*	*			trans	-164.6	0	146	-109.3	171.9	-165.8	0	0	108

Retrieved 588 of 588 residues in 248.7 ms (Link to these results)

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