A0A060VN75_ONCMY Loading...

Angiopoietin-like 2b

AlphaFold DB , UniProt , Accession A0A060VN75, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110535965, Length 524 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	32.4	Very low	34.6	Very low	235 Å²	235	154.8 Å²	154.8	100%	1.158	83%	0.833	S	S	*	*				0	127.9	0	-71.3	-177	-82	0	0	108.9
2	E	32	Very low	34.6	Very low	192 Å²	192	152.8 Å²	152.8	90%	0.897	83%	0.83	S	S	*	*			cis	-162.1	163.2	-42.1	-119.3	-173.2	177.1	0	0	108.7
3	L	36	Very low	34.3	Very low	144 Å²	144	157.7 Å²	157.7	75%	0.754	83%	0.831	S	S	*	*			trans	-96	163.1	-179.3	-92.8	171.4	0	0	0	110.2	A5	L3-A5 HydrophobicContact CB-CB 4.44Å; L3-A5 HydrophobicContact CD2-CB 4.14Å
4	P	52.7	Low	33.9	Very low	116 Å²	116	152.1 Å²	152.1	75%	0.753	83%	0.83	S	S	*	*				-138	158.2	68.7	28.6	-6.6	0	0	0	115
5	A	37.2	Very low	33.7	Very low	79 Å²	79	154 Å²	154	65%	0.653	83%	0.834	S	S	*	*			cis	78.1	58.2	18.7	0	0	0	0	0	117.8	L3	L3-A5 HydrophobicContact CB-CB 4.44Å; L3-A5 HydrophobicContact CD2-CB 4.14Å
6	V	32.9	Very low	33.4	Very low	136 Å²	136	152.7 Å²	152.7	82%	0.824	83%	0.832	S	S	*	*			trans	-153.6	149.1	149.4	-118.4	0	0	0	0	107.4
7	V	32.7	Very low	33.3	Very low	134 Å²	134	151 Å²	151	81%	0.812	83%	0.834	S	S	*	*			cis	-131.4	137.5	3.3	179.5	0	0	0	0	109.1
8	L	31.3	Very low	33	Very low	160 Å²	160	147.3 Å²	147.3	84%	0.838	84%	0.836	S	S	*	*			trans	-159.9	141.2	165.1	-136.7	152.4	0	0	0	109.5
9	L	29.6	Very low	32.8	Very low	153 Å²	153	144.5 Å²	144.5	80%	0.801	83%	0.833	S	S	*	*			trans	89.6	91.7	-178.6	-62.3	158.3	0	0	0	117.8
10	F	30.8	Very low	32.6	Very low	208 Å²	208	147.2 Å²	147.2	91%	0.912	84%	0.838	S	S	*	*			trans	-178.3	127.2	147.2	-87.4	-57.8	0	0	0	105.2
11	L	33.6	Very low	32.5	Very low	146 Å²	146	149 Å²	149	76%	0.764	84%	0.839	S	S	*	*			cis	-139	121.9	6.5	-80.7	151.7	0	0	0	110.9
12	V	33.9	Very low	32.9	Very low	130 Å²	130	142.9 Å²	142.9	79%	0.788	82%	0.817	S	S	*	*			trans	-105.1	156.6	140.2	174.2	0	0	0	0	105.3
13	Y	30.9	Very low	32.8	Very low	217 Å²	217	142.9 Å²	142.9	85%	0.851	82%	0.817	S	S	*	*			trans	87.4	103.8	-167.9	-68	-89.2	0	0	0	115.2
14	G	28.4	Very low	32.4	Very low	79 Å²	79	139.1 Å²	139.1	81%	0.814	81%	0.814	S	S	*	*			trans	-153.8	55	173.1	0	0	0	0	0	110.8
15	M	30.6	Very low	31.3	Very low	181 Å²	181	143.5 Å²	143.5	89%	0.892	82%	0.824	S	S	*	*			trans	-148.5	151	167.1	-83.1	-148.3	-176.8	0	0	111.7
16	V	30.2	Very low	30.9	Very low	133 Å²	133	143.6 Å²	143.6	81%	0.806	83%	0.832	S	S	*	*			trans	91.9	119.1	165.1	-171.2	0	0	0	0	117.9
17	S	30.4	Very low	30.7	Very low	124 Å²	124	145 Å²	145	87%	0.867	84%	0.835	S	S	*	*			trans	80.3	110.6	155.7	-71	0	0	0	0	121.1
18	G	27.6	Very low	30.5	Very low	84 Å²	84	149.1 Å²	149.1	87%	0.866	84%	0.836	S	S	*	*			trans	-164.5	76.5	161.9	0	0	0	0	0	109.4
19	A	29.8	Very low	30.3	Very low	95 Å²	95	148.1 Å²	148.1	79%	0.785	83%	0.827	S	S	*	*			trans	-96.9	117	-175.6	0	0	0	0	0	111.6
20	Q	28.6	Very low	30.2	Very low	197 Å²	197	148.4 Å²	148.4	92%	0.921	82%	0.824	S	S	*	*			trans	-157.5	121.2	156	-128.5	127.8	12.9	0	0	113.2
21	Q	30.7	Very low	30	Very low	185 Å²	185	144 Å²	144	86%	0.864	82%	0.819	S	S	*	*			trans	-125.7	149.8	157.4	-108.3	-173.7	0.9	0	0	105.5
22	P	41.1	Very low	29.9	Very low	108 Å²	108	143.6 Å²	143.6	70%	0.701	82%	0.818	S	S	*	*				-142.6	-169.7	70.2	41.8	-22.6	0	0	0	111.9
23	Q	29.9	Very low	30.1	Very low	191 Å²	191	143 Å²	143	89%	0.893	82%	0.817	S	S	*	*			cis	-163.5	164.4	12.1	-147.4	165.8	31.5	0	0	110.1
24	G	27.7	Very low	30	Very low	66 Å²	66	141.3 Å²	141.3	68%	0.68	82%	0.817	S	S	*	*			trans	108.9	88.9	163.9	0	0	0	0	0	115.5
25	Q	29.9	Very low	30.1	Very low	208 Å²	208	141.9 Å²	141.9	97%	0.972	81%	0.814	S	S	*	*				75.4	119	84.8	-77.5	-167.7	-8.7	0	0	116.3
26	G	27.8	Very low	29.9	Very low	80 Å²	80	144.9 Å²	144.9	83%	0.825	82%	0.815	S	S	*	*			trans	169.2	96.7	169.3	0	0	0	0	0	113.4
27	N	29.4	Very low	29.8	Very low	165 Å²	165	142.8 Å²	142.8	88%	0.882	81%	0.807	S	S	*	*			trans	-86.1	144.5	-178.5	-77.1	-25.9	0	0	0	113.7
28	R	27.9	Very low	29.7	Very low	222 Å²	222	146.2 Å²	146.2	84%	0.838	81%	0.809	S	S	*	*			trans	148.5	125.2	135.1	-86.5	-179.7	164.3	156.3	-1.8	110.5
29	Q	27.9	Very low	29.5	Very low	138 Å²	138	145.6 Å²	145.6	65%	0.645	80%	0.802	S	S	*	*				96.4	119.2	55.1	-169.5	177.2	5	0	0	111.4
30	E	26.8	Very low	29.3	Very low	159 Å²	159	153.2 Å²	153.2	74%	0.743	81%	0.811	S	S	*	*			trans	43.2	124.5	159.4	-62.3	167.3	114.5	0	0	118.8
31	S	27.8	Very low	29.2	Very low	116 Å²	116	150.2 Å²	150.2	81%	0.811	81%	0.806	S	S	*	*				174.7	156.9	74.8	42.6	0	0	0	0	112.1
32	N	29.8	Very low	29	Very low	137 Å²	137	147.1 Å²	147.1	73%	0.733	81%	0.805	S	S	*	*			trans	-95.3	150	164.9	-176.7	21	0	0	0	108.7
33	P	39.7	Very low	28.2	Very low	117 Å²	117	147.7 Å²	147.7	76%	0.76	81%	0.812	S	S	*	*			trans	-143.8	152.4	130.7	34.3	-18.9	0	0	0	116.2
34	Q	28.2	Very low	28.1	Very low	182 Å²	182	147.4 Å²	147.4	85%	0.85	81%	0.81	S	S	*	*			trans	-94.7	141.9	165.2	-62.2	171.5	-58.4	0	0	111.6
35	A	29.7	Very low	28	Very low	92 Å²	92	152.4 Å²	152.4	76%	0.76	82%	0.816	S	S	*	*			trans	-175.4	127.3	143.3	0	0	0	0	0	108.2
36	R	26.9	Very low	27.8	Very low	244 Å²	244	151.7 Å²	151.7	92%	0.921	81%	0.81	S	S	*	*				51.4	132.6	84.4	-85.5	-175.1	174.9	-175.6	-0.6	113.3
37	S	27.5	Very low	27.9	Very low	89 Å²	89	156.9 Å²	156.9	62%	0.622	81%	0.813	S	S	*	*			cis	-171.7	156.1	18.3	48.8	0	0	0	0	113.6
38	Q	28.3	Very low	27.7	Very low	195 Å²	195	154 Å²	154	91%	0.911	81%	0.806	S	S	*	*			trans	60.7	142.4	154	-64.4	164.4	9.5	0	0	117.8
39	G	24.9	Very low	27.6	Very low	71 Å²	71	149 Å²	149	73%	0.732	80%	0.804	S	S	*	*			cis	146.3	122.4	-4.4	0	0	0	0	0	111.3
40	R	25.1	Very low	27.6	Very low	256 Å²	256	152 Å²	152	97%	0.966	82%	0.818	S	S	*	*			trans	-162.6	151.2	159.3	-119.8	173.1	-175.8	177.4	0.8	113.3
41	T	26.8	Very low	27.8	Very low	133 Å²	133	152.3 Å²	152.3	82%	0.816	83%	0.825	S	S	*	*			trans	-88.6	142.9	-173.9	47.1	0	0	0	0	113.5
42	S	25.3	Very low	27.7	Very low	121 Å²	121	149.5 Å²	149.5	85%	0.846	82%	0.815	S	S	*	*				-165.7	129.1	126.6	58.5	0	0	0	0	111.1
43	S	25.8	Very low	27.6	Very low	120 Å²	120	151.1 Å²	151.1	84%	0.839	82%	0.822	S	S	*	*			trans	-84	134.2	169.9	-33.7	0	0	0	0	109.7
44	Q	26.2	Very low	27.4	Very low	184 Å²	184	154.8 Å²	154.8	86%	0.86	83%	0.829	S	S	*	*			trans	-164.1	154.1	147.1	-117.7	164.6	-11.1	0	0	112.1
45	E	27.1	Very low	27.5	Very low	171 Å²	171	156 Å²	156	80%	0.799	83%	0.826	S	S	*	*			trans	-70	153.7	-174.1	-60.5	123.6	135.9	0	0	112.8
46	F	25.5	Very low	27.6	Very low	193 Å²	193	156.8 Å²	156.8	85%	0.846	81%	0.814	S	S	*	*			trans	-140.7	102.7	160.3	-107.5	-87.7	0	0	0	110
47	E	28.9	Very low	27.6	Very low	190 Å²	190	152.7 Å²	152.7	89%	0.888	80%	0.803	S	S	*	*			trans	-63.9	137.7	139.8	-69.3	177.5	122.2	0	0	107.6
48	S	24.9	Very low	27.8	Very low	105 Å²	105	153.4 Å²	153.4	73%	0.734	80%	0.799	S	S	*	*			trans	-134.3	100.1	167.1	65.8	0	0	0	0	110.2
49	S	26.4	Very low	27.9	Very low	116 Å²	116	153.6 Å²	153.6	81%	0.811	79%	0.793	S	S	*	*			trans	-59.3	146.4	165.5	-52.2	0	0	0	0	111.1
50	E	28.9	Very low	28.1	Very low	200 Å²	200	155.6 Å²	155.6	94%	0.935	80%	0.796	S	S	*	*			trans	-70.7	142.5	168.4	-61.1	175.5	119.2	0	0	110.4
51	D	29.7	Very low	28.3	Very low	167 Å²	167	147.2 Å²	147.2	89%	0.893	79%	0.789	S	S	*	*			trans	-148.2	143.3	175.8	-159.7	6.6	0	0	0	112.2
52	G	26.7	Very low	28.5	Very low	57 Å²	57	151.2 Å²	151.2	59%	0.588	79%	0.789	S	S	*	*			trans	68.9	121.5	171.2	0	0	0	0	0	117.1
53	L	27.8	Very low	28.8	Very low	170 Å²	170	156.1 Å²	156.1	89%	0.89	79%	0.789	S	S	*	*			cis	-162.9	111.6	41	-82.7	163.7	0	0	0	111.7
54	E	34	Very low	29	Very low	194 Å²	194	155.6 Å²	155.6	91%	0.907	79%	0.786	S	S	*	*			trans	-98.4	136.8	146.7	-95.8	-163.3	158.1	0	0	109.2
55	R	32.3	Very low	29.1	Very low	207 Å²	207	157.7 Å²	157.7	78%	0.781	79%	0.786	S	S	*	*			trans	-161.6	135.2	162	-87.1	-149.3	172.8	-157.4	9.7	106.9
56	E	31.8	Very low	29.3	Very low	110 Å²	110	161.2 Å²	161.2	51%	0.514	79%	0.792	S	S	.	*			cis	-158.9	135.5	8.7	-108	-176.7	-177.3	0	0	109
57	F	27	Very low	29.5	Very low	158 Å²	158	157 Å²	157	69%	0.693	79%	0.792	S	S	*	*				84.6	145.7	106.6	-71.8	-8.7	0	0	0	117.6
58	L	30.9	Very low	30	Very low	103 Å²	103	156.4 Å²	156.4	54%	0.539	79%	0.794	S	S	.	*			cis	-164.9	156.7	-8.4	-108.9	172.8	0	0	0	112.8
59	Y	30.3	Very low	30.3	Very low	200 Å²	200	156.2 Å²	156.2	78%	0.784	80%	0.799	S	S	*	*			trans	54	154.3	145.6	-73.1	-42.1	0	0	0	121.2
60	S	29	Very low	30.6	Very low	112 Å²	112	158.1 Å²	158.1	78%	0.783	80%	0.8	S	S	*	*			cis	-161.1	152.4	-1.4	-119.5	0	0	0	0	110.4
61	G	28.9	Very low	30.9	Very low	80 Å²	80	154 Å²	154	83%	0.825	79%	0.793	S	S	*	*			trans	-179.6	117.6	169.8	0	0	0	0	0	114.1
62	R	31.8	Very low	31.7	Very low	218 Å²	218	154.9 Å²	154.9	82%	0.823	79%	0.792	S	S	*	*			trans	-103.1	145.8	-167.2	-83.6	176.4	168.7	176.6	-2	114.5
63	R	30.9	Very low	32.4	Very low	223 Å²	223	161 Å²	161	84%	0.842	81%	0.806	S	S	*	*			trans	60.2	131.9	147.9	-63	169.1	176.1	-175	-2.9	116.9
64	S	29.4	Very low	33.3	Very low	110 Å²	110	158.6 Å²	158.6	77%	0.769	80%	0.8	S	S	*	*				-177.2	157.7	53.2	-165.4	0	0	0	0	114.2
65	R	30.2	Very low	33.9	Very low	227 Å²	227	157.6 Å²	157.6	86%	0.857	80%	0.801	S	S	*	*			trans	-4.2	127.2	165.6	-66.2	175.6	172.7	174.8	-2.6	122.9
66	R	31.2	Very low	34.5	Very low	246 Å²	246	151 Å²	151	93%	0.928	80%	0.798	S	S	*	*			trans	35.6	125.7	130.3	-67	-175.2	-179.3	174.9	-0.2	121.2
67	A	27.7	Very low	35.1	Very low	103 Å²	103	152.3 Å²	152.3	85%	0.851	82%	0.817	S	S	*	*				-147.7	148.8	128.7	0	0	0	0	0	109.9
68	L	39.8	Very low	36.2	Very low	178 Å²	178	150.2 Å²	150.2	93%	0.932	82%	0.822	S	S	*	*			trans	-89.2	139.3	166.3	-80.7	88	0	0	0	109.3
69	A	32	Very low	37.3	Very low	102 Å²	102	154.2 Å²	154.2	84%	0.843	83%	0.832	S	S	*	*			trans	-149.2	134.9	152.8	0	0	0	0	0	108.9
70	D	33.5	Very low	38.3	Very low	155 Å²	155	150.2 Å²	150.2	83%	0.829	83%	0.828	S	S	*	*			trans	-85.5	130.3	-179.7	-179	19.7	0	0	0	110.4
71	S	34.1	Very low	39.1	Very low	113 Å²	113	153 Å²	153	79%	0.79	83%	0.827	S	S	*	*			trans	179.3	137.8	149.6	31.6	0	0	0	0	111.4
72	Q	47.1	Very low	40.3	Very low	187 Å²	187	156.6 Å²	156.6	87%	0.874	83%	0.825	S	S	*	*			trans	-81.1	122.3	-179.3	-66	160.7	-25.9	0	0	111.4
73	Q	41.2	Very low	41.2	Very low	185 Å²	185	152 Å²	152	86%	0.864	82%	0.821	S	S	*	*			trans	-138.1	145.2	150.8	-73.1	-159.7	-7	0	0	110.2
74	P	46.7	Very low	41.8	Very low	119 Å²	119	146.5 Å²	146.5	77%	0.773	81%	0.814	S	S	*	*			trans	-77.9	145	174.6	32.7	-33.4	0	0	0	110.9	G76	P74-G76 PolarHBondContact O-N 3.47Å
75	D	47	Very low	42.8	Very low	174 Å²	174	149.7 Å²	149.7	93%	0.93	82%	0.817	S	S	*	*			trans	-59.1	104.8	173.3	-70.7	-52	0	0	0	111.2
76	G	43.8	Very low	43.8	Very low	69 Å²	69	147.8 Å²	147.8	71%	0.711	82%	0.818	S	S	*	*			trans	-102.4	111.6	169.8	0	0	0	0	0	110.2	P74 S78	P74-G76 PolarHBondContact O-N 3.47Å; G76-S78 PolarHBondContact O-N 3.19Å; G76-S78 VanDerWaalsContact O-N 3.15Å
77	C	45.3	Very low	44.7	Very low	137 Å²	137	144.1 Å²	144.1	93%	0.926	81%	0.809	S	S	*	*			trans	-63.4	114.5	170.3	-60.8	0	0	0	0	109.7
78	S	50.3	Low	45.9	Very low	114 Å²	114	145.2 Å²	145.2	80%	0.797	80%	0.804	S	S	*	*			trans	-81.6	136.6	168.3	56.1	0	0	0	0	110.1	G76	G76-S78 PolarHBondContact O-N 3.19Å; G76-S78 VanDerWaalsContact O-N 3.15Å
79	Y	53.5	Low	46.5	Very low	187 Å²	187	143.4 Å²	143.4	73%	0.733	80%	0.801	S	S	*	*			trans	-119.2	117.6	176.6	-153.7	-88.2	0	0	0	109.6	F81	Y79-F81 HydrophobicContact CD1-CD2 4.08Å; Y79-F81 HydrophobicContact CD1-CE1 4.23Å; Y79-F81 AromaticContact CD1-CE2 3.75Å; Y79-F81 HydrophobicContact CD1-CE2 3.75Å; Y79-F81 HydrophobicContact CD1-CG 4.46Å; Y79-F81 AromaticContact CD1-CZ 3.83Å; Y79-F81 HydrophobicContact CD1-CZ 3.83Å; Y79-F81 HydrophobicContact CE1-CD1 4.37Å; Y79-F81 HydrophobicContact CE1-CE1 4.02Å; Y79-F81 HydrophobicContact CE1-CE2 4.37Å; Y79-F81 HydrophobicContact CE1-CZ 4.02Å
80	T	51.5	Low	47.4	Very low	115 Å²	115	140.9 Å²	140.9	71%	0.706	79%	0.785	S	S	*	*			trans	-102.1	109.6	-179	-53.4	0	0	0	0	109.6	I82	T80-I82 PolarHBondContact O-N 3.35Å
81	F	45	Very low	48.1	Very low	172 Å²	172	138 Å²	138	75%	0.754	78%	0.782	S	S	*	*			trans	-75.7	108.8	173.4	-72.8	-87.6	0	0	0	110.6	Y79 V83	Y79-F81 HydrophobicContact CD1-CD2 4.08Å; Y79-F81 HydrophobicContact CD1-CE1 4.23Å; Y79-F81 AromaticContact CD1-CE2 3.75Å; Y79-F81 HydrophobicContact CD1-CE2 3.75Å; Y79-F81 HydrophobicContact CD1-CG 4.46Å; Y79-F81 AromaticContact CD1-CZ 3.83Å; Y79-F81 HydrophobicContact CD1-CZ 3.83Å; Y79-F81 HydrophobicContact CE1-CD1 4.37Å; Y79-F81 HydrophobicContact CE1-CE1 4.02Å; Y79-F81 HydrophobicContact CE1-CE2 4.37Å; Y79-F81 HydrophobicContact CE1-CZ 4.02Å; F81-V83 PolarHBondContact O-N 3.04Å
82	I	54.9	Low	48.8	Very low	154 Å²	154	139.5 Å²	139.5	79%	0.79	78%	0.78	S	S	*	*			trans	-83.5	103	169.4	-58.3	177.1	0	0	0	107.9	T80 P84	T80-I82 PolarHBondContact O-N 3.35Å; I82-P84 WeakPolarHBondContact O-CD 3.38Å
83	V	49.4	Very low	48.5	Very low	123 Å²	123	136.2 Å²	136.2	75%	0.745	78%	0.777	S	S	*	*			trans	-76.5	121.7	172.8	-176.6	0	0	0	0	108.8	F81 Q85	F81-V83 PolarHBondContact O-N 3.04Å; V83-Q85 PolarHBondContact O-N 3.41Å
84	P	45.1	Very low	48.9	Very low	107 Å²	107	133 Å²	133	70%	0.695	77%	0.769	S	S	*	*			trans	-65.9	130.7	175.4	-17.7	31.1	0	0	0	110.4	I82 Q86	I82-P84 WeakPolarHBondContact O-CD 3.38Å; P84-Q86 PolarHBondContact O-N 3.49Å
85	Q	49.7	Very low	48.6	Very low	177 Å²	177	134.9 Å²	134.9	83%	0.827	77%	0.773	S	S	*	*			trans	-68.1	101	169.3	-71.3	-172.9	-3.8	0	0	109.6	V83 K87	V83-Q85 PolarHBondContact O-N 3.41Å; Q85-K87 PolarHBondContact O-N 3.39Å
86	Q	50.9	Low	48.9	Very low	186 Å²	186	137.4 Å²	137.4	87%	0.869	77%	0.769	S	S	*	*			trans	-64.8	99.5	163.9	-85.9	-172.7	-31.4	0	0	109	P84 V88	P84-Q86 PolarHBondContact O-N 3.49Å; Q86-V88 PolarHBondContact O-N 3.31Å
87	K	49.8	Very low	48.8	Very low	170 Å²	170	142.5 Å²	142.5	74%	0.739	77%	0.772	S	S	*	*			trans	-69.8	113.7	167.3	-70.2	-175.5	-178	-178.5	0	108.4	Q85 T89	Q85-K87 PolarHBondContact O-N 3.39Å; K87-T89 PolarHBondContact O-N 3.02Å
88	V	53.3	Low	48.7	Very low	126 Å²	126	144.2 Å²	144.2	76%	0.764	77%	0.766	S	S	*	*			trans	-68.7	97.3	172.6	-179.8	0	0	0	0	108.7	Q86 G90	Q86-V88 PolarHBondContact O-N 3.31Å; V88-G90 PolarHBondContact O-N 3.11Å
89	T	51.9	Low	48.6	Very low	139 Å²	139	144.2 Å²	144.2	85%	0.853	76%	0.764	S	S	*	*			trans	-89.8	76.4	173.2	51.6	0	0	0	0	110.1	K87	K87-T89 PolarHBondContact O-N 3.02Å
90	G	51	Low	48.3	Very low	49 Å²	49	144.9 Å²	144.9	51%	0.505	77%	0.773	S	S	.	*	S	Bend	trans	-156.3	139.1	174.6	0	0	0	0	0	110.2	V88 I92	V88-G90 PolarHBondContact O-N 3.11Å; G90-I92 PolarHBondContact O-N 3.41Å
91	A	48.7	Very low	48.2	Very low	95 Å²	95	143.2 Å²	143.2	79%	0.785	77%	0.772	S	S	*	*			trans	-70.2	116.3	-177.4	0	0	0	0	0	111.1	C93	A91-C93 PolarHBondContact O-N 3.28Å; A91-C93 VanDerWaalsContact O-N 3.13Å
92	I	48	Very low	48.4	Very low	145 Å²	145	141.3 Å²	141.3	74%	0.744	77%	0.774	S	S	*	*			trans	-81.1	91.2	173.4	-56.9	176.3	0	0	0	108.4	G90 V94	G90-I92 PolarHBondContact O-N 3.41Å; I92-V94 HydrophobicContact CG2-CG2 3.92Å; I92-V94 PolarHBondContact O-N 2.98Å; I92-V94 VanDerWaalsContact O-N 3.15Å
93	C	42.6	Very low	48.1	Very low	118 Å²	118	142.1 Å²	142.1	80%	0.797	78%	0.779	S	S	*	*			trans	-77.6	93.1	174.5	-67.1	0	0	0	0	110.9	A91 N95	A91-C93 PolarHBondContact O-N 3.28Å; A91-C93 VanDerWaalsContact O-N 3.13Å; C93-N95 PolarHBondContact O-N 3.49Å
94	V	49.6	Very low	48.2	Very low	117 Å²	117	143.8 Å²	143.8	71%	0.709	78%	0.778	S	S	*	*			trans	-84.2	93.2	169.6	-169.2	0	0	0	0	109.1	I92 R96	I92-V94 HydrophobicContact CG2-CG2 3.92Å; I92-V94 PolarHBondContact O-N 2.98Å; I92-V94 VanDerWaalsContact O-N 3.15Å; V94-R96 PolarHBondContact O-N 3.35Å
95	N	40.1	Very low	48.7	Very low	159 Å²	159	146 Å²	146	85%	0.85	79%	0.785	S	S	*	*			trans	-73.4	119.2	172.4	-167.7	13.9	0	0	0	109.6	C93	C93-N95 PolarHBondContact O-N 3.49Å
96	R	53.3	Low	48.9	Very low	227 Å²	227	149.6 Å²	149.6	86%	0.857	79%	0.79	S	S	*	*			trans	-124.4	79.1	-173.1	-165.9	-176.8	-167.3	-171.4	4.6	110.3	V94	V94-R96 PolarHBondContact O-N 3.35Å
97	K	40.9	Very low	49.2	Very low	175 Å²	175	145.5 Å²	145.5	76%	0.761	78%	0.778	S	S	*	*			trans	-168.7	111.3	157.5	-109.5	165.7	-178.5	-171.4	0	113.2
98	E	42.3	Very low	50	Low	173 Å²	173	141.5 Å²	141.5	81%	0.808	77%	0.765	S	S	*	*			trans	64.3	152.1	149.2	-65.4	161.3	-142.1	0	0	120.5
99	P	48.3	Very low	50.8	Low	115 Å²	115	142.8 Å²	142.8	75%	0.747	76%	0.76	S	S	*	*			cis	-113.3	168.9	-7.6	33.7	-17.9	0	0	0	114	A101	P99-A101 PolarHBondContact O-N 3.11Å
100	E	48.8	Very low	51.8	Low	200 Å²	200	142.5 Å²	142.5	94%	0.935	75%	0.749	S	S	*	*	S	Bend	trans	-73.9	49.7	-177.1	-62.6	-175.2	126.4	0	0	114.7
101	A	48.8	Very low	52.9	Low	81 Å²	81	145.7 Å²	145.7	67%	0.669	75%	0.751	S	S	*	*	S	Bend	trans	-144.4	37.4	-173.6	0	0	0	0	0	116.1	P99	P99-A101 PolarHBondContact O-N 3.11Å
102	V	48.6	Very low	54.1	Low	132 Å²	132	145.8 Å²	145.8	80%	0.8	74%	0.738	S	S	*	*			trans	-157.9	82.3	147	-174.8	0	0	0	0	108.2
103	L	49.2	Very low	55.6	Low	171 Å²	171	144.2 Å²	144.2	90%	0.895	73%	0.727	S	S	*	*			trans	-114.8	10.1	173.9	-99.3	170.1	0	0	0	114.1
104	E	51.1	Low	57.6	Low	158 Å²	158	144.6 Å²	144.6	74%	0.738	72%	0.721	S	S	*	*	S	Bend	trans	-104.6	140.8	165.7	-64.5	-174.3	154.6	0	0	109.4
105	N	55.4	Low	59.1	Low	154 Å²	154	144.9 Å²	144.9	82%	0.824	72%	0.717	S	S	*	*	S	Bend	trans	74.8	50.4	173.4	-47.8	-47.6	0	0	0	117.9
106	R	53.4	Low	61.2	Low	251 Å²	251	141.3 Å²	141.3	95%	0.947	70%	0.698	S	S	*	*			trans	-131.3	17.4	158.9	-107.1	-170.5	-176.4	-165.5	1.5	117.3
107	V	59	Low	62.9	Low	100 Å²	100	132.3 Å²	132.3	61%	0.606	68%	0.676	S	S	*	*	S	Bend	trans	-101	114.2	145.8	-171.1	0	0	0	0	105.8	K109 L112	V107-K109 PolarHBondContact O-N 3.46Å; V107-K109 VanDerWaalsContact O-N 3.16Å; V107-L112 HydrophobicContact CB-CD1 4.25Å; V107-L112 HydrophobicContact CG1-CD1 3.44Å; V107-L112 VanDerWaalsContact CG1-CD1 3.44Å; V107-L112 HydrophobicContact CG1-CG 3.61Å
108	N	65	Low	65.2	Low	87 Å²	87	127.8 Å²	127.8	47%	0.465	66%	0.658	S	S	.	*			trans	-67.3	116.7	-178.1	-157.8	1.5	0	0	0	107.4	Q110 E111 L112	N108-Q110 PolarHBondContact O-N 3.03Å; N108-E111 HydrophobicContact CB-CB 4.19Å; N108-E111 VanDerWaalsContact CB-CD 3.43Å; N108-E111 HydrophobicContact CB-CG 3.89Å; N108-E111 PolarHBondContact ND2-OE1 3.12Å; N108-E111 WeakPolarHBondContact O-CB 3.3Å; N108-E111 PolarHBondContact O-N 3.49Å; N108-L112 PolarHBondContact O-N 3.07Å
109	K	70.3	Confident	67.4	Low	152 Å²	152	124.7 Å²	124.7	66%	0.661	65%	0.646	S	S	*	*	H	α-helix	trans	-51.9	-36.6	-174.2	178.4	177.8	168.4	-178.8	0	111.8	V107 E111 L112 E113	V107-K109 PolarHBondContact O-N 3.46Å; V107-K109 VanDerWaalsContact O-N 3.16Å; K109-E111 PolarHBondContact O-N 3.36Å; K109-L112 PolarHBondContact O-N 3.2Å; K109-E113 WeakPolarHBondContact CE-OE1 3.44Å; K109-E113 IonicContact NZ-OE1 3.21Å; K109-E113 WeakPolarHBondContact O-CG 3.45Å; K109-E113 PolarHBondContact O-N 3.41Å
110	Q	73	Confident	69.4	Low	133 Å²	133	123.4 Å²	123.4	62%	0.621	63%	0.63	S	S	*	*	H	α-helix	trans	-66.1	-30.9	177.8	-163.8	167	-2.3	0	0	114	N108 L114	N108-Q110 PolarHBondContact O-N 3.03Å; Q110-L114 WeakPolarHBondContact O-CB 3.4Å; Q110-L114 PolarHBondContact O-N 3.4Å
111	E	74	Confident	71.4	Confident	116 Å²	116	118.7 Å²	118.7	54%	0.542	61%	0.606	S	S	.	*	H	α-helix	trans	-75.6	-38.8	174.5	-71.2	163	-163.9	0	0	111.4	N108 K109 L114 L115	N108-E111 HydrophobicContact CB-CB 4.19Å; N108-E111 VanDerWaalsContact CB-CD 3.43Å; N108-E111 HydrophobicContact CB-CG 3.89Å; N108-E111 PolarHBondContact ND2-OE1 3.12Å; N108-E111 WeakPolarHBondContact O-CB 3.3Å; N108-E111 PolarHBondContact O-N 3.49Å; K109-E111 PolarHBondContact O-N 3.36Å; E111-L114 PolarHBondContact O-N 2.98Å; E111-L115 WeakPolarHBondContact O-CB 3.43Å; E111-L115 PolarHBondContact O-N 3.31Å
112	L	75.1	Confident	73.2	Confident	98 Å²	98	119.5 Å²	119.5	51%	0.513	60%	0.597	S	S	.	*	H	α-helix	trans	-62.8	-42.1	171.6	-98.5	171.1	0	0	0	111.8	V107 N108 K109 L115 N116	V107-L112 HydrophobicContact CB-CD1 4.25Å; V107-L112 HydrophobicContact CG1-CD1 3.44Å; V107-L112 VanDerWaalsContact CG1-CD1 3.44Å; V107-L112 HydrophobicContact CG1-CG 3.61Å; N108-L112 PolarHBondContact O-N 3.07Å; K109-L112 PolarHBondContact O-N 3.2Å; L112-L115 PolarHBondContact O-N 3.07Å; L112-N116 VanDerWaalsContact O-CB 3.26Å; L112-N116 WeakPolarHBondContact O-CB 3.32Å; L112-N116 PolarHBondContact O-N 2.86Å
113	E	78.5	Confident	75.1	Confident	111 Å²	111	119.4 Å²	119.4	52%	0.519	59%	0.585	S	S	.	*	H	α-helix	trans	-66.5	-40.2	176.3	-75	172.3	174.9	0	0	112	K109 G117	K109-E113 WeakPolarHBondContact CE-OE1 3.44Å; K109-E113 IonicContact NZ-OE1 3.21Å; K109-E113 WeakPolarHBondContact O-CG 3.45Å; K109-E113 PolarHBondContact O-N 3.41Å; E113-G117 PolarHBondContact O-N 3.36Å
114	L	84	Confident	77.1	Confident	127 Å²	127	118.6 Å²	118.6	67%	0.665	57%	0.57	S	S	*	*	H	α-helix	trans	-61.2	-47.3	172	-104.5	156.3	0	0	0	112.4	Q110 E111 G117 E118	Q110-L114 WeakPolarHBondContact O-CB 3.4Å; Q110-L114 PolarHBondContact O-N 3.4Å; E111-L114 PolarHBondContact O-N 2.98Å; L114-G117 PolarHBondContact O-N 3.47Å; L114-E118 PolarHBondContact O-N 3.26Å
115	L	81.4	Confident	78.8	Confident	122 Å²	122	116.1 Å²	116.1	64%	0.639	56%	0.559	S	S	*	*	H	α-helix	trans	-64.7	-41.7	179.1	-174.1	66.3	0	0	0	111.5	E111 L112 G117 E118 L119	E111-L115 WeakPolarHBondContact O-CB 3.43Å; E111-L115 PolarHBondContact O-N 3.31Å; L112-L115 PolarHBondContact O-N 3.07Å; L115-G117 VanDerWaalsContact C-N 3.33Å; L115-E118 PolarHBondContact O-N 3.46Å; L115-L119 VanDerWaalsContact O-CB 3.3Å; L115-L119 WeakPolarHBondContact O-CB 3.33Å; L115-L119 PolarHBondContact O-N 3.27Å
116	N	84.3	Confident	80.3	Confident	84 Å²	84	113.3 Å²	113.3	45%	0.449	54%	0.543	S	S	.	.	H	α-helix	trans	-64.2	-38.5	174.4	-171.6	15.4	0	0	0	111.4	L112 L119 Q120	L112-N116 VanDerWaalsContact O-CB 3.26Å; L112-N116 WeakPolarHBondContact O-CB 3.32Å; L112-N116 PolarHBondContact O-N 2.86Å; N116-L119 PolarHBondContact O-N 3.04Å; N116-Q120 WeakPolarHBondContact O-CB 3.27Å; N116-Q120 VanDerWaalsContact O-CG 3.29Å; N116-Q120 WeakPolarHBondContact O-CG 3.34Å; N116-Q120 PolarHBondContact O-N 3.18Å; N116-Q120 PolarHBondContact OD1-NE2 2.9Å
117	G	89.8	Confident	82	Confident	38 Å²	38	105.4 Å²	105.4	39%	0.392	52%	0.517	S	S	.	.	H	α-helix	trans	-60.3	-48	173.4	0	0	0	0	0	112.9	E113 L114 L115 Q120 K121	E113-G117 PolarHBondContact O-N 3.36Å; L114-G117 PolarHBondContact O-N 3.47Å; L115-G117 VanDerWaalsContact C-N 3.33Å; G117-Q120 PolarHBondContact O-N 2.95Å; G117-K121 WeakPolarHBondContact O-CB 3.36Å; G117-K121 PolarHBondContact O-N 3.46Å
118	E	87.9	Confident	83.3	Confident	80 Å²	80	105 Å²	105	37%	0.374	52%	0.515	S	S	.	.	H	α-helix	trans	-70.3	-36	178.7	-162.8	61.5	-150.5	0	0	111.9	L114 L115 K121 Q122	L114-E118 PolarHBondContact O-N 3.26Å; L115-E118 PolarHBondContact O-N 3.46Å; E118-K121 WeakPolarHBondContact O-CB 3.39Å; E118-K121 PolarHBondContact O-N 3.34Å; E118-K121 IonicContact OE1-NZ 2.72Å; E118-K121 PolarHBondContact OE1-NZ 2.9Å; E118-K121 IonicContact OE2-NZ 2.8Å; E118-K121 PolarHBondContact OE2-NZ 3.41Å; E118-Q122 WeakPolarHBondContact O-CG 3.43Å; E118-Q122 PolarHBondContact O-N 3.47Å
119	L	90.1	Very high	83.9	Confident	108 Å²	108	106 Å²	106	57%	0.565	52%	0.519	S	S	*	.	H	α-helix	trans	-62.7	-42.7	173.2	-166.9	79.5	0	0	0	111.9	L115 N116 K121 Q122 K123	L115-L119 VanDerWaalsContact O-CB 3.3Å; L115-L119 WeakPolarHBondContact O-CB 3.33Å; L115-L119 PolarHBondContact O-N 3.27Å; N116-L119 PolarHBondContact O-N 3.04Å; L119-K121 VanDerWaalsContact C-N 3.3Å; L119-K121 PolarHBondContact O-N 3.04Å; L119-Q122 PolarHBondContact O-N 2.98Å; L119-K123 WeakPolarHBondContact O-CB 3.5Å; L119-K123 PolarHBondContact O-N 3.07Å
120	Q	89.1	Confident	84.5	Confident	88 Å²	88	104.8 Å²	104.8	41%	0.411	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-33.6	174.5	-75.6	-179.7	26.7	0	0	112.7	N116 G117 R124	N116-Q120 WeakPolarHBondContact O-CB 3.27Å; N116-Q120 VanDerWaalsContact O-CG 3.29Å; N116-Q120 WeakPolarHBondContact O-CG 3.34Å; N116-Q120 PolarHBondContact O-N 3.18Å; N116-Q120 PolarHBondContact OD1-NE2 2.9Å; G117-Q120 PolarHBondContact O-N 2.95Å; Q120-R124 WeakPolarHBondContact O-CG 3.22Å; Q120-R124 PolarHBondContact O-N 2.92Å; Q120-R124 VanDerWaalsContact O-N 3.14Å; Q120-R124 PolarHBondContact O-NE 3.4Å
121	K	90.9	Very high	84.9	Confident	101 Å²	101	104.7 Å²	104.7	44%	0.439	52%	0.515	S	S	.	.	H	α-helix	trans	-70.4	-44.8	175.9	177.3	176.3	157.6	-133.9	0	111.3	G117 E118 L119 K123 R124 Q125	G117-K121 WeakPolarHBondContact O-CB 3.36Å; G117-K121 PolarHBondContact O-N 3.46Å; E118-K121 WeakPolarHBondContact O-CB 3.39Å; E118-K121 PolarHBondContact O-N 3.34Å; E118-K121 IonicContact OE1-NZ 2.72Å; E118-K121 PolarHBondContact OE1-NZ 2.9Å; E118-K121 IonicContact OE2-NZ 2.8Å; E118-K121 PolarHBondContact OE2-NZ 3.41Å; L119-K121 VanDerWaalsContact C-N 3.3Å; L119-K121 PolarHBondContact O-N 3.04Å; K121-K123 VanDerWaalsContact C-N 3.35Å; K121-K123 PolarHBondContact O-N 3.32Å; K121-R124 PolarHBondContact O-N 2.93Å; K121-Q125 WeakPolarHBondContact O-CG 3.48Å; K121-Q125 PolarHBondContact O-N 3.36Å
122	Q	86.6	Confident	85.1	Confident	99 Å²	99	104.1 Å²	104.1	46%	0.463	52%	0.516	S	S	.	.	H	α-helix	trans	-60.5	-42.5	172.2	-73.6	-177.4	-9.4	0	0	111.8	E118 L119 R124 Q125 I126	E118-Q122 WeakPolarHBondContact O-CG 3.43Å; E118-Q122 PolarHBondContact O-N 3.47Å; L119-Q122 PolarHBondContact O-N 2.98Å; Q122-R124 PolarHBondContact O-N 3.01Å; Q122-Q125 WeakPolarHBondContact O-CB 3.48Å; Q122-Q125 PolarHBondContact O-N 3.43Å; Q122-I126 WeakPolarHBondContact O-CG1 3.44Å; Q122-I126 PolarHBondContact O-N 3.39Å
123	K	89.6	Confident	85.2	Confident	130 Å²	130	104.3 Å²	104.3	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-57.8	-48.2	175.6	-176.4	176.3	171.6	-179	0	112.1	L119 K121 Q125 I126 E127	L119-K123 WeakPolarHBondContact O-CB 3.5Å; L119-K123 PolarHBondContact O-N 3.07Å; K121-K123 VanDerWaalsContact C-N 3.35Å; K121-K123 PolarHBondContact O-N 3.32Å; K123-Q125 VanDerWaalsContact C-N 3.31Å; K123-Q125 PolarHBondContact O-N 3.07Å; K123-I126 PolarHBondContact O-N 3.4Å; K123-E127 WeakPolarHBondContact CE-OE1 3.45Å; K123-E127 IonicContact NZ-OE1 2.69Å; K123-E127 WeakPolarHBondContact O-CG 3.49Å; K123-E127 PolarHBondContact O-N 3.2Å
124	R	89.9	Confident	85.2	Confident	153 Å²	153	106.3 Å²	106.3	58%	0.577	53%	0.53	S	S	*	.	H	α-helix	trans	-62.1	-36.4	176	-70.9	179.1	-127.4	-170.4	-1.3	112.7	Q120 K121 Q122 T128	Q120-R124 WeakPolarHBondContact O-CG 3.22Å; Q120-R124 PolarHBondContact O-N 2.92Å; Q120-R124 VanDerWaalsContact O-N 3.14Å; Q120-R124 PolarHBondContact O-NE 3.4Å; K121-R124 PolarHBondContact O-N 2.93Å; Q122-R124 PolarHBondContact O-N 3.01Å; R124-T128 WeakPolarHBondContact O-CB 3.32Å; R124-T128 PolarHBondContact O-N 2.91Å; R124-T128 PolarHBondContact O-OG1 2.99Å
125	Q	88	Confident	84.9	Confident	106 Å²	106	104.7 Å²	104.7	50%	0.495	53%	0.525	S	S	.	.	H	α-helix	trans	-65.5	-42.4	174.6	-74.5	178.5	-33.7	0	0	111.8	K121 Q122 K123 T128 L129	K121-Q125 WeakPolarHBondContact O-CG 3.48Å; K121-Q125 PolarHBondContact O-N 3.36Å; Q122-Q125 WeakPolarHBondContact O-CB 3.48Å; Q122-Q125 PolarHBondContact O-N 3.43Å; K123-Q125 VanDerWaalsContact C-N 3.31Å; K123-Q125 PolarHBondContact O-N 3.07Å; Q125-T128 PolarHBondContact O-N 3.42Å; Q125-L129 WeakPolarHBondContact O-CB 3.27Å; Q125-L129 VanDerWaalsContact O-CG 3.32Å; Q125-L129 WeakPolarHBondContact O-CG 3.37Å; Q125-L129 PolarHBondContact O-N 2.66Å
126	I	86.3	Confident	84.6	Confident	95 Å²	95	103 Å²	103	49%	0.487	52%	0.516	S	S	.	.	H	α-helix	trans	-63.6	-45.6	176.6	-67.8	164.2	0	0	0	111	Q122 K123 T128 L129 Q130	Q122-I126 WeakPolarHBondContact O-CG1 3.44Å; Q122-I126 PolarHBondContact O-N 3.39Å; K123-I126 PolarHBondContact O-N 3.4Å; I126-T128 VanDerWaalsContact C-N 3.3Å; I126-T128 PolarHBondContact O-N 2.97Å; I126-L129 PolarHBondContact O-N 2.82Å; I126-Q130 HydrophobicContact CG2-CG 4.45Å; I126-Q130 WeakPolarHBondContact O-CG 3.49Å; I126-Q130 PolarHBondContact O-N 3.37Å
127	E	88.1	Confident	84.6	Confident	85 Å²	85	100.5 Å²	100.5	40%	0.397	51%	0.511	S	S	.	.	H	α-helix	trans	-59.4	-40.8	176.2	-71.8	166.9	172.5	0	0	111.7	K123 Q130 Q131	K123-E127 WeakPolarHBondContact CE-OE1 3.45Å; K123-E127 IonicContact NZ-OE1 2.69Å; K123-E127 WeakPolarHBondContact O-CG 3.49Å; K123-E127 PolarHBondContact O-N 3.2Å; E127-Q130 PolarHBondContact O-N 3.06Å; E127-Q131 PolarHBondContact O-N 3.48Å
128	T	86.4	Confident	84.2	Confident	92 Å²	92	100.3 Å²	100.3	56%	0.564	51%	0.509	S	S	*	.	H	α-helix	trans	-65.7	-42.6	176.3	-51.6	0	0	0	0	112	R124 Q125 I126 Q131 L132	R124-T128 WeakPolarHBondContact O-CB 3.32Å; R124-T128 PolarHBondContact O-N 2.91Å; R124-T128 PolarHBondContact O-OG1 2.99Å; Q125-T128 PolarHBondContact O-N 3.42Å; I126-T128 VanDerWaalsContact C-N 3.3Å; I126-T128 PolarHBondContact O-N 2.97Å; T128-Q131 PolarHBondContact O-N 2.83Å; T128-L132 PolarHBondContact O-N 2.98Å
129	L	79	Confident	83.9	Confident	108 Å²	108	100.5 Å²	100.5	57%	0.565	51%	0.512	S	S	*	.	H	α-helix	trans	-67.8	-35.9	177.9	-74.1	168.3	0	0	0	112.2	Q125 I126 L132 V133	Q125-L129 WeakPolarHBondContact O-CB 3.27Å; Q125-L129 VanDerWaalsContact O-CG 3.32Å; Q125-L129 WeakPolarHBondContact O-CG 3.37Å; Q125-L129 PolarHBondContact O-N 2.66Å; I126-L129 PolarHBondContact O-N 2.82Å; L129-L132 PolarHBondContact O-N 3.01Å; L129-V133 WeakPolarHBondContact O-CG2 3.47Å; L129-V133 PolarHBondContact O-N 2.95Å
130	Q	81.6	Confident	83.3	Confident	126 Å²	126	98.9 Å²	98.9	59%	0.589	51%	0.506	S	S	*	.	H	α-helix	trans	-62.3	-44.1	175.5	-77.4	175.3	-21	0	0	111.8	I126 E127 L132 V133 E134	I126-Q130 HydrophobicContact CG2-CG 4.45Å; I126-Q130 WeakPolarHBondContact O-CG 3.49Å; I126-Q130 PolarHBondContact O-N 3.37Å; E127-Q130 PolarHBondContact O-N 3.06Å; Q130-L132 VanDerWaalsContact C-N 3.33Å; Q130-L132 PolarHBondContact O-N 3.45Å; Q130-V133 PolarHBondContact O-N 3.25Å; Q130-E134 PolarHBondContact O-N 3.07Å
131	Q	82.2	Confident	83	Confident	131 Å²	131	99.2 Å²	99.2	61%	0.612	51%	0.511	S	S	*	.	H	α-helix	trans	-61.8	-40.1	175.2	-70.1	177.3	-3.8	0	0	112.2	E127 T128 E134 V135	E127-Q131 PolarHBondContact O-N 3.48Å; T128-Q131 PolarHBondContact O-N 2.83Å; Q131-E134 PolarHBondContact O-N 3.04Å; Q131-V135 WeakPolarHBondContact O-CG2 3.21Å; Q131-V135 PolarHBondContact O-N 3.38Å; Q131-V135 VanDerWaalsContact O-N 3.13Å
132	L	78.4	Confident	82.9	Confident	105 Å²	105	100.6 Å²	100.6	55%	0.55	52%	0.519	S	S	.	.	H	α-helix	trans	-62.4	-45.6	176.6	-160.1	86	0	0	0	111.7	T128 L129 Q130 E134 V135 D136	T128-L132 PolarHBondContact O-N 2.98Å; L129-L132 PolarHBondContact O-N 3.01Å; Q130-L132 VanDerWaalsContact C-N 3.33Å; Q130-L132 PolarHBondContact O-N 3.45Å; L132-E134 VanDerWaalsContact C-N 3.32Å; L132-E134 PolarHBondContact O-N 2.99Å; L132-V135 PolarHBondContact O-N 3.31Å; L132-D136 PolarHBondContact O-N 3.47Å
133	V	76.6	Confident	82.7	Confident	101 Å²	101	98.4 Å²	98.4	61%	0.612	51%	0.512	S	S	*	.	H	α-helix	trans	-64.8	-34.1	179	170.5	0	0	0	0	112.2	L129 Q130 G137	L129-V133 WeakPolarHBondContact O-CG2 3.47Å; L129-V133 PolarHBondContact O-N 2.95Å; Q130-V133 PolarHBondContact O-N 3.25Å; V133-G137 PolarHBondContact O-N 2.88Å
134	E	78.2	Confident	82.5	Confident	154 Å²	154	98 Å²	98	72%	0.72	51%	0.511	S	S	*	.	H	α-helix	trans	-68.1	-42.6	175.6	-170.6	169.3	-162.2	0	0	111.9	Q130 Q131 L132 G137 G138	Q130-E134 PolarHBondContact O-N 3.07Å; Q131-E134 PolarHBondContact O-N 3.04Å; L132-E134 VanDerWaalsContact C-N 3.32Å; L132-E134 PolarHBondContact O-N 2.99Å; E134-G137 PolarHBondContact O-N 2.92Å; E134-G138 PolarHBondContact O-N 3.49Å
135	V	78.3	Confident	82.6	Confident	92 Å²	92	96.3 Å²	96.3	56%	0.558	51%	0.512	S	S	*	.	H	α-helix	trans	-62.7	-47.5	173.8	172.4	0	0	0	0	111.3	Q131 L132 G137 G138 I139	Q131-V135 WeakPolarHBondContact O-CG2 3.21Å; Q131-V135 PolarHBondContact O-N 3.38Å; Q131-V135 VanDerWaalsContact O-N 3.13Å; L132-V135 PolarHBondContact O-N 3.31Å; V135-G137 VanDerWaalsContact C-N 3.29Å; V135-G137 PolarHBondContact O-N 3.11Å; V135-G138 WeakPolarHBondContact O-CA 3.48Å; V135-G138 PolarHBondContact O-N 3.11Å; V135-G138 VanDerWaalsContact O-N 3.11Å; V135-I139 HydrophobicContact CG1-CD1 4.02Å; V135-I139 WeakPolarHBondContact O-CG1 3.32Å; V135-I139 PolarHBondContact O-N 3.28Å
136	D	75.9	Confident	82.5	Confident	86 Å²	86	96.2 Å²	96.2	46%	0.46	52%	0.515	S	S	.	.	H	α-helix	trans	-61.2	-37.5	176.1	-78.6	-17.5	0	0	0	111.9	L132 G138 I139 V140	L132-D136 PolarHBondContact O-N 3.47Å; D136-G138 VanDerWaalsContact C-N 3.34Å; D136-G138 PolarHBondContact O-N 3.42Å; D136-I139 PolarHBondContact O-N 3.3Å; D136-V140 WeakPolarHBondContact O-CG2 3.34Å; D136-V140 PolarHBondContact O-N 3.16Å
137	G	82.6	Confident	82.5	Confident	33 Å²	33	99.4 Å²	99.4	34%	0.34	52%	0.521	S	S	.	.	H	α-helix	trans	-61.4	-38.9	173.2	0	0	0	0	0	113.3	V133 E134 V135 N141	V133-G137 PolarHBondContact O-N 2.88Å; E134-G137 PolarHBondContact O-N 2.92Å; V135-G137 VanDerWaalsContact C-N 3.29Å; V135-G137 PolarHBondContact O-N 3.11Å; G137-N141 PolarHBondContact O-N 2.9Å; G137-N141 PolarHBondContact O-ND2 3.13Å
138	G	81.8	Confident	82.7	Confident	34 Å²	34	102.6 Å²	102.6	35%	0.351	53%	0.533	S	S	.	.	H	α-helix	trans	-60.9	-52.4	170.9	0	0	0	0	0	112.2	E134 V135 D136 V140 N141 E142	E134-G138 PolarHBondContact O-N 3.49Å; V135-G138 WeakPolarHBondContact O-CA 3.48Å; V135-G138 PolarHBondContact O-N 3.11Å; V135-G138 VanDerWaalsContact O-N 3.11Å; D136-G138 VanDerWaalsContact C-N 3.34Å; D136-G138 PolarHBondContact O-N 3.42Å; G138-V140 VanDerWaalsContact C-N 3.29Å; G138-V140 PolarHBondContact O-N 3.24Å; G138-N141 WeakPolarHBondContact O-CB 3.37Å; G138-N141 PolarHBondContact O-N 2.86Å; G138-E142 PolarHBondContact O-N 3.32Å; G138-E142 VanDerWaalsContact O-N 3.08Å
139	I	81.9	Confident	82.9	Confident	83 Å²	83	104 Å²	104	43%	0.426	53%	0.533	S	S	.	.	H	α-helix	trans	-57.3	-41	179.4	-66.1	166.1	0	0	0	111.3	V135 D136 N141 E142 V143	V135-I139 HydrophobicContact CG1-CD1 4.02Å; V135-I139 WeakPolarHBondContact O-CG1 3.32Å; V135-I139 PolarHBondContact O-N 3.28Å; D136-I139 PolarHBondContact O-N 3.3Å; I139-N141 VanDerWaalsContact C-N 3.27Å; I139-N141 PolarHBondContact O-N 2.88Å; I139-E142 PolarHBondContact O-N 2.85Å; I139-V143 HydrophobicContact CG2-CG2 4.32Å; I139-V143 WeakPolarHBondContact O-CB 3.48Å; I139-V143 WeakPolarHBondContact O-CG2 3.33Å; I139-V143 PolarHBondContact O-N 2.87Å
140	V	78.8	Confident	83.4	Confident	74 Å²	74	101.3 Å²	101.3	45%	0.448	52%	0.524	S	S	.	.	H	α-helix	trans	-61	-35.2	176.5	166.7	0	0	0	0	112.3	D136 G138 K144	D136-V140 WeakPolarHBondContact O-CG2 3.34Å; D136-V140 PolarHBondContact O-N 3.16Å; G138-V140 VanDerWaalsContact C-N 3.29Å; G138-V140 PolarHBondContact O-N 3.24Å; V140-K144 HydrophobicContact CG1-CD 4.4Å; V140-K144 VanDerWaalsContact O-CG 3.29Å; V140-K144 WeakPolarHBondContact O-CG 3.38Å; V140-K144 PolarHBondContact O-N 3.45Å
141	N	82.7	Confident	83.7	Confident	96 Å²	96	103.7 Å²	103.7	51%	0.513	53%	0.527	S	S	.	.	H	α-helix	trans	-75.2	-38.5	177.9	-69.7	-33.2	0	0	0	112.2	G137 G138 I139 K144 L145	G137-N141 PolarHBondContact O-N 2.9Å; G137-N141 PolarHBondContact O-ND2 3.13Å; G138-N141 WeakPolarHBondContact O-CB 3.37Å; G138-N141 PolarHBondContact O-N 2.86Å; I139-N141 VanDerWaalsContact C-N 3.27Å; I139-N141 PolarHBondContact O-N 2.88Å; N141-K144 WeakPolarHBondContact O-CB 3.38Å; N141-K144 PolarHBondContact O-N 3.35Å; N141-L145 PolarHBondContact O-N 3.34Å
142	E	88.2	Confident	84.1	Confident	129 Å²	129	102.5 Å²	102.5	60%	0.603	53%	0.525	S	S	*	.	H	α-helix	trans	-61.3	-45.6	171.1	-66.1	-174.3	166.8	0	0	111.5	G138 I139 K144 L145 L146	G138-E142 PolarHBondContact O-N 3.32Å; G138-E142 VanDerWaalsContact O-N 3.08Å; I139-E142 PolarHBondContact O-N 2.85Å; E142-K144 VanDerWaalsContact C-N 3.31Å; E142-K144 PolarHBondContact O-N 3.15Å; E142-L145 WeakPolarHBondContact O-CB 3.37Å; E142-L145 PolarHBondContact O-N 3.48Å; E142-L146 WeakPolarHBondContact O-CG 3.2Å; E142-L146 PolarHBondContact O-N 3.04Å
143	V	82.8	Confident	84.5	Confident	54 Å²	54	102.9 Å²	102.9	33%	0.327	53%	0.525	S	S	.	.	H	α-helix	trans	-62.3	-36	176	171.1	0	0	0	0	111.9	I139 R147	I139-V143 HydrophobicContact CG2-CG2 4.32Å; I139-V143 WeakPolarHBondContact O-CB 3.48Å; I139-V143 WeakPolarHBondContact O-CG2 3.33Å; I139-V143 PolarHBondContact O-N 2.87Å; V143-R147 WeakPolarHBondContact O-CB 3.49Å; V143-R147 VanDerWaalsContact O-CG 3.24Å; V143-R147 WeakPolarHBondContact O-CG 3.34Å; V143-R147 PolarHBondContact O-N 2.88Å
144	K	84.3	Confident	84.6	Confident	122 Å²	122	102.7 Å²	102.7	53%	0.53	52%	0.521	S	S	.	.	H	α-helix	trans	-64.3	-41.2	171.9	-77.1	168.4	-174.6	167.4	0	111.9	V140 N141 E142 R147 K148	V140-K144 HydrophobicContact CG1-CD 4.4Å; V140-K144 VanDerWaalsContact O-CG 3.29Å; V140-K144 WeakPolarHBondContact O-CG 3.38Å; V140-K144 PolarHBondContact O-N 3.45Å; N141-K144 WeakPolarHBondContact O-CB 3.38Å; N141-K144 PolarHBondContact O-N 3.35Å; E142-K144 VanDerWaalsContact C-N 3.31Å; E142-K144 PolarHBondContact O-N 3.15Å; K144-R147 PolarHBondContact O-N 3.17Å; K144-K148 PolarHBondContact O-N 3.45Å; K144-K148 VanDerWaalsContact O-N 3.11Å
145	L	91.6	Very high	85.1	Confident	116 Å²	116	98.2 Å²	98.2	61%	0.607	51%	0.507	S	S	*	.	H	α-helix	trans	-65.2	-49.5	177.5	-174.1	63.2	0	0	0	111.1	N141 E142 R147 K148 E149	N141-L145 PolarHBondContact O-N 3.34Å; E142-L145 WeakPolarHBondContact O-CB 3.37Å; E142-L145 PolarHBondContact O-N 3.48Å; L145-R147 VanDerWaalsContact C-N 3.3Å; L145-R147 PolarHBondContact O-N 3.05Å; L145-K148 WeakPolarHBondContact O-CA 3.03Å; L145-K148 WeakPolarHBondContact O-CB 3.3Å; L145-K148 PolarHBondContact O-N 3.06Å; L145-E149 PolarHBondContact O-N 2.77Å
146	L	87.5	Confident	85.7	Confident	104 Å²	104	101.8 Å²	101.8	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-58.4	-38.4	175.5	-69.5	170.9	0	0	0	112.2	E142 K148 E149 S150	E142-L146 WeakPolarHBondContact O-CG 3.2Å; E142-L146 PolarHBondContact O-N 3.04Å; L146-K148 VanDerWaalsContact C-N 3.3Å; L146-K148 PolarHBondContact O-N 3.32Å; L146-E149 PolarHBondContact O-N 3.47Å; L146-S150 WeakPolarHBondContact O-CB 3.32Å; L146-S150 PolarHBondContact O-N 3.09Å
147	R	86.6	Confident	86.4	Confident	163 Å²	163	101.6 Å²	101.6	62%	0.615	51%	0.512	S	S	*	.	H	α-helix	trans	-68.9	-23.4	173.3	-77	174	175.8	171.8	0.3	113.9	V143 K144 L145 R151	V143-R147 WeakPolarHBondContact O-CB 3.49Å; V143-R147 VanDerWaalsContact O-CG 3.24Å; V143-R147 WeakPolarHBondContact O-CG 3.34Å; V143-R147 PolarHBondContact O-N 2.88Å; K144-R147 PolarHBondContact O-N 3.17Å; L145-R147 VanDerWaalsContact C-N 3.3Å; L145-R147 PolarHBondContact O-N 3.05Å; R147-R151 WeakPolarHBondContact O-CG 3.38Å; R147-R151 PolarHBondContact O-NE 3.43Å
148	K	91.1	Very high	86.5	Confident	151 Å²	151	104 Å²	104	66%	0.657	52%	0.52	S	S	*	.	H	α-helix	trans	-80.9	-42.8	173.5	-175.7	179.1	177.6	-178.2	0	110.4	K144 L145 L146 R151 N152	K144-K148 PolarHBondContact O-N 3.45Å; K144-K148 VanDerWaalsContact O-N 3.11Å; L145-K148 WeakPolarHBondContact O-CA 3.03Å; L145-K148 WeakPolarHBondContact O-CB 3.3Å; L145-K148 PolarHBondContact O-N 3.06Å; L146-K148 VanDerWaalsContact C-N 3.3Å; L146-K148 PolarHBondContact O-N 3.32Å; K148-R151 PolarHBondContact O-N 2.89Å; K148-N152 PolarHBondContact O-N 3.43Å; K148-N152 VanDerWaalsContact O-N 3.1Å
149	E	90.8	Very high	87	Confident	121 Å²	121	108.4 Å²	108.4	57%	0.565	53%	0.532	S	S	*	.	H	α-helix	trans	-64.8	-45.5	175.6	-172.2	172.1	-164.7	0	0	111.9	L145 L146 R151 N152 M153	L145-E149 PolarHBondContact O-N 2.77Å; L146-E149 PolarHBondContact O-N 3.47Å; E149-R151 VanDerWaalsContact C-N 3.3Å; E149-R151 PolarHBondContact O-N 2.89Å; E149-N152 WeakPolarHBondContact O-CB 3.47Å; E149-N152 PolarHBondContact O-N 3.04Å; E149-N152 VanDerWaalsContact O-N 3.1Å; E149-M153 WeakPolarHBondContact O-CB 3.22Å; E149-M153 PolarHBondContact O-N 3.06Å
150	S	89.1	Confident	87.4	Confident	53 Å²	53	108.9 Å²	108.9	37%	0.371	53%	0.534	S	S	.	.	H	α-helix	trans	-56.8	-39.9	173.6	171.3	0	0	0	0	112.6	L146 N154	L146-S150 WeakPolarHBondContact O-CB 3.32Å; L146-S150 PolarHBondContact O-N 3.09Å; S150-N154 WeakPolarHBondContact O-CB 3.39Å; S150-N154 PolarHBondContact O-N 2.79Å
151	R	88.6	Confident	87.7	Confident	176 Å²	176	112.4 Å²	112.4	66%	0.664	54%	0.541	S	S	*	.	H	α-helix	trans	-65.6	-41.9	174.6	-84	-178.7	-86.5	178.3	-10.7	112.6	R147 K148 E149 S155	R147-R151 WeakPolarHBondContact O-CG 3.38Å; R147-R151 PolarHBondContact O-NE 3.43Å; K148-R151 PolarHBondContact O-N 2.89Å; E149-R151 VanDerWaalsContact C-N 3.3Å; E149-R151 PolarHBondContact O-N 2.89Å; R151-S155 PolarHBondContact O-N 3.49Å
152	N	90.1	Very high	87.8	Confident	106 Å²	106	112.1 Å²	112.1	57%	0.567	54%	0.538	S	S	*	.	H	α-helix	trans	-64.7	-46.8	175.2	-173.5	-43.2	0	0	0	111.3	K148 E149 N154 S155 R156	K148-N152 PolarHBondContact O-N 3.43Å; K148-N152 VanDerWaalsContact O-N 3.1Å; E149-N152 WeakPolarHBondContact O-CB 3.47Å; E149-N152 PolarHBondContact O-N 3.04Å; E149-N152 VanDerWaalsContact O-N 3.1Å; N152-N154 PolarHBondContact O-N 3.38Å; N152-S155 PolarHBondContact O-N 3.13Å; N152-S155 PolarHBondContact O-OG 2.83Å; N152-R156 WeakPolarHBondContact O-CB 3.33Å; N152-R156 PolarHBondContact O-N 3.16Å
153	M	87.1	Confident	87.9	Confident	113 Å²	113	112.1 Å²	112.1	56%	0.557	54%	0.537	S	S	*	.	H	α-helix	trans	-61.5	-42.7	177.2	-174.2	160.4	59.1	0	0	111.5	E149 R156 V157	E149-M153 WeakPolarHBondContact O-CB 3.22Å; E149-M153 PolarHBondContact O-N 3.06Å; M153-R156 PolarHBondContact O-N 3.17Å; M153-V157 WeakPolarHBondContact O-CG2 3.47Å; M153-V157 PolarHBondContact O-N 2.97Å
154	N	78.4	Confident	88.2	Confident	97 Å²	97	114 Å²	114	52%	0.519	55%	0.546	S	S	.	.	H	α-helix	trans	-61.1	-44.4	173.4	-80.5	-3.7	0	0	0	112.1	S150 N152 R156 V157 T158	S150-N154 WeakPolarHBondContact O-CB 3.39Å; S150-N154 PolarHBondContact O-N 2.79Å; N152-N154 PolarHBondContact O-N 3.38Å; N154-R156 VanDerWaalsContact C-N 3.28Å; N154-R156 PolarHBondContact O-N 3.38Å; N154-V157 PolarHBondContact O-N 3.47Å; N154-T158 PolarHBondContact O-N 3Å; N154-T158 PolarHBondContact O-OG1 2.96Å; N154-T158 VanDerWaalsContact O-OG1 3.09Å
155	S	89.5	Confident	88.4	Confident	60 Å²	60	111.2 Å²	111.2	42%	0.42	54%	0.536	S	S	.	.	H	α-helix	trans	-62.8	-37	177	65.6	0	0	0	0	112.2	R151 N152 T158 Q159	R151-S155 PolarHBondContact O-N 3.49Å; N152-S155 PolarHBondContact O-N 3.13Å; N152-S155 PolarHBondContact O-OG 2.83Å; S155-T158 PolarHBondContact O-N 3.38Å; S155-Q159 WeakPolarHBondContact O-CG 3.39Å; S155-Q159 PolarHBondContact O-N 3.4Å
156	R	90.8	Very high	88.2	Confident	166 Å²	166	111.6 Å²	111.6	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-69.3	-38.1	175.6	-175	172.2	171.7	170.4	-3.6	112.3	N152 M153 N154 Q159 L160	N152-R156 WeakPolarHBondContact O-CB 3.33Å; N152-R156 PolarHBondContact O-N 3.16Å; M153-R156 PolarHBondContact O-N 3.17Å; N154-R156 VanDerWaalsContact C-N 3.28Å; N154-R156 PolarHBondContact O-N 3.38Å; R156-Q159 PolarHBondContact O-N 2.98Å; R156-L160 HydrophobicContact CG-CD1 4.36Å; R156-L160 WeakPolarHBondContact O-CB 3.3Å; R156-L160 VanDerWaalsContact O-CG 3.31Å; R156-L160 WeakPolarHBondContact O-CG 3.19Å; R156-L160 PolarHBondContact O-N 3.3Å
157	V	89.6	Confident	88.3	Confident	82 Å²	82	111.2 Å²	111.2	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-63.3	-43.7	172.1	168.4	0	0	0	0	110.7	M153 N154 Q159 L160 Y161	M153-V157 WeakPolarHBondContact O-CG2 3.47Å; M153-V157 PolarHBondContact O-N 2.97Å; N154-V157 PolarHBondContact O-N 3.47Å; V157-Q159 PolarHBondContact O-N 3.38Å; V157-L160 PolarHBondContact O-N 2.65Å; V157-Y161 WeakPolarHBondContact O-CB 3.42Å; V157-Y161 PolarHBondContact O-N 3.17Å
158	T	86	Confident	88.2	Confident	85 Å²	85	108 Å²	108	52%	0.521	52%	0.523	S	S	.	.	H	α-helix	trans	-61.8	-42	174.6	-57.1	0	0	0	0	111.8	N154 S155 Y161 M162	N154-T158 PolarHBondContact O-N 3Å; N154-T158 PolarHBondContact O-OG1 2.96Å; N154-T158 VanDerWaalsContact O-OG1 3.09Å; S155-T158 PolarHBondContact O-N 3.38Å; T158-Y161 PolarHBondContact O-N 3.46Å; T158-M162 VanDerWaalsContact O-CG 3.3Å; T158-M162 WeakPolarHBondContact O-CG 3.19Å; T158-M162 PolarHBondContact O-N 2.94Å
159	Q	92	Very high	87.8	Confident	125 Å²	125	104.6 Å²	104.6	58%	0.584	51%	0.512	S	S	*	.	H	α-helix	trans	-61.5	-47	174.7	-76.4	173.6	-15.4	0	0	112.2	S155 R156 V157 Y161 M162 Q163	S155-Q159 WeakPolarHBondContact O-CG 3.39Å; S155-Q159 PolarHBondContact O-N 3.4Å; R156-Q159 PolarHBondContact O-N 2.98Å; V157-Q159 PolarHBondContact O-N 3.38Å; Q159-Y161 VanDerWaalsContact C-N 3.34Å; Q159-Y161 PolarHBondContact O-N 3.28Å; Q159-M162 PolarHBondContact O-N 3.32Å; Q159-Q163 WeakPolarHBondContact O-CG 3.37Å; Q159-Q163 PolarHBondContact O-N 3.25Å
160	L	89.3	Confident	87.5	Confident	93 Å²	93	107.2 Å²	107.2	49%	0.487	52%	0.517	S	S	.	.	H	α-helix	trans	-63.4	-39.1	177	-71.9	169.2	0	0	0	112	R156 V157 Q163 L164	R156-L160 HydrophobicContact CG-CD1 4.36Å; R156-L160 WeakPolarHBondContact O-CB 3.3Å; R156-L160 VanDerWaalsContact O-CG 3.31Å; R156-L160 WeakPolarHBondContact O-CG 3.19Å; R156-L160 PolarHBondContact O-N 3.3Å; V157-L160 PolarHBondContact O-N 2.65Å; L160-Q163 PolarHBondContact O-N 2.92Å; L160-L164 VanDerWaalsContact O-CB 3.3Å; L160-L164 WeakPolarHBondContact O-CB 3.45Å; L160-L164 PolarHBondContact O-N 3.09Å
161	Y	85.9	Confident	87.2	Confident	148 Å²	148	110.9 Å²	110.9	58%	0.58	53%	0.526	S	S	*	.	H	α-helix	trans	-61.7	-45.6	174.2	179.5	-96.8	0	0	0	111.5	V157 T158 Q159 L164 L165	V157-Y161 WeakPolarHBondContact O-CB 3.42Å; V157-Y161 PolarHBondContact O-N 3.17Å; T158-Y161 PolarHBondContact O-N 3.46Å; Q159-Y161 VanDerWaalsContact C-N 3.34Å; Q159-Y161 PolarHBondContact O-N 3.28Å; Y161-L164 PolarHBondContact O-N 3.31Å; Y161-L165 VanDerWaalsContact O-CB 3.32Å; Y161-L165 WeakPolarHBondContact O-CB 3.36Å; Y161-L165 PolarHBondContact O-N 2.68Å
162	M	85	Confident	87	Confident	91 Å²	91	110.7 Å²	110.7	45%	0.448	53%	0.525	S	S	.	.	H	α-helix	trans	-66.2	-39.7	176.9	-67.1	-62.4	-80.1	0	0	112	T158 Q159 L165 H166	T158-M162 VanDerWaalsContact O-CG 3.3Å; T158-M162 WeakPolarHBondContact O-CG 3.19Å; T158-M162 PolarHBondContact O-N 2.94Å; Q159-M162 PolarHBondContact O-N 3.32Å; M162-L165 PolarHBondContact O-N 2.84Å; M162-L165 HydrophobicContact SD-CD2 4.4Å; M162-H166 PolarHBondContact O-N 3.09Å; M162-H166 PolarHBondContact O-ND1 3.18Å
163	Q	90.3	Very high	86.4	Confident	128 Å²	128	109.4 Å²	109.4	60%	0.598	52%	0.518	S	S	*	.	H	α-helix	trans	-61.8	-47.9	174.2	-76.9	178.5	-24	0	0	111.7	Q159 L160 L165 H166 E167	Q159-Q163 WeakPolarHBondContact O-CG 3.37Å; Q159-Q163 PolarHBondContact O-N 3.25Å; L160-Q163 PolarHBondContact O-N 2.92Å; Q163-L165 VanDerWaalsContact C-N 3.32Å; Q163-L165 PolarHBondContact O-N 3.46Å; Q163-H166 PolarHBondContact O-N 2.7Å; Q163-E167 PolarHBondContact O-N 2.87Å
164	L	88.8	Confident	86.4	Confident	95 Å²	95	108.1 Å²	108.1	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-40.3	176.8	-179.7	62.8	0	0	0	111.6	L160 Y161 E167 I168	L160-L164 VanDerWaalsContact O-CB 3.3Å; L160-L164 WeakPolarHBondContact O-CB 3.45Å; L160-L164 PolarHBondContact O-N 3.09Å; Y161-L164 PolarHBondContact O-N 3.31Å; L164-E167 PolarHBondContact O-N 3.44Å; L164-I168 HydrophobicContact CD1-CD1 4.04Å; L164-I168 HydrophobicContact CD1-CG1 4.25Å; L164-I168 HydrophobicContact CD2-CD1 4.47Å; L164-I168 HydrophobicContact CG-CD1 3.81Å; L164-I168 HydrophobicContact CG-CG1 4.43Å; L164-I168 WeakPolarHBondContact O-CB 3Å; L164-I168 VanDerWaalsContact O-CG1 3.23Å; L164-I168 WeakPolarHBondContact O-CG1 3.34Å; L164-I168 PolarHBondContact O-N 2.9Å
165	L	87.7	Confident	86.6	Confident	63 Å²	63	107 Å²	107	33%	0.33	51%	0.514	S	S	.	.	H	α-helix	trans	-62	-45.5	176	-174.3	66.4	0	0	0	111.6	Y161 M162 Q163 E167 I168 I169	Y161-L165 VanDerWaalsContact O-CB 3.32Å; Y161-L165 WeakPolarHBondContact O-CB 3.36Å; Y161-L165 PolarHBondContact O-N 2.68Å; M162-L165 PolarHBondContact O-N 2.84Å; M162-L165 HydrophobicContact SD-CD2 4.4Å; Q163-L165 VanDerWaalsContact C-N 3.32Å; Q163-L165 PolarHBondContact O-N 3.46Å; L165-E167 PolarHBondContact O-N 3.01Å; L165-I168 PolarHBondContact O-N 3.33Å; L165-I169 HydrophobicContact CD1-CD1 4.31Å; L165-I169 HydrophobicContact CG-CD1 4Å; L165-I169 VanDerWaalsContact O-CG1 3.27Å; L165-I169 WeakPolarHBondContact O-CG1 3.31Å; L165-I169 PolarHBondContact O-N 2.91Å
166	H	88.4	Confident	86.4	Confident	123 Å²	123	109 Å²	109	57%	0.569	52%	0.519	S	S	*	.	H	α-helix	trans	-63	-40	174.9	-76.2	80	0	0	0	112	M162 Q163 R170	M162-H166 PolarHBondContact O-N 3.09Å; M162-H166 PolarHBondContact O-ND1 3.18Å; Q163-H166 PolarHBondContact O-N 2.7Å; H166-R170 VanDerWaalsContact O-CB 3.27Å; H166-R170 WeakPolarHBondContact O-CB 3.4Å; H166-R170 PolarHBondContact O-N 3.35Å
167	E	90.3	Very high	86.1	Confident	97 Å²	97	106.7 Å²	106.7	45%	0.453	52%	0.515	S	S	.	.	H	α-helix	trans	-67.7	-39	177.3	-160.8	-170.8	153	0	0	112	Q163 L164 L165 K171	Q163-E167 PolarHBondContact O-N 2.87Å; L164-E167 PolarHBondContact O-N 3.44Å; L165-E167 PolarHBondContact O-N 3.01Å; E167-K171 HydrophobicContact CG-CD 4.28Å; E167-K171 VanDerWaalsContact O-CB 3.29Å; E167-K171 WeakPolarHBondContact O-CB 3.44Å; E167-K171 WeakPolarHBondContact O-CG 3.46Å; E167-K171 PolarHBondContact O-N 3.03Å; E167-K171 WeakPolarHBondContact OE1-CE 3.45Å; E167-K171 IonicContact OE1-NZ 3.18Å; E167-K171 PolarHBondContact OE1-NZ 2.98Å
168	I	84.5	Confident	85.8	Confident	94 Å²	94	107.2 Å²	107.2	48%	0.482	52%	0.515	S	S	.	.	H	α-helix	trans	-64.3	-46.7	175	-72.8	167.8	0	0	0	110.9	L164 L165 K171 R172	L164-I168 HydrophobicContact CD1-CD1 4.04Å; L164-I168 HydrophobicContact CD1-CG1 4.25Å; L164-I168 HydrophobicContact CD2-CD1 4.47Å; L164-I168 HydrophobicContact CG-CD1 3.81Å; L164-I168 HydrophobicContact CG-CG1 4.43Å; L164-I168 WeakPolarHBondContact O-CB 3Å; L164-I168 VanDerWaalsContact O-CG1 3.23Å; L164-I168 WeakPolarHBondContact O-CG1 3.34Å; L164-I168 PolarHBondContact O-N 2.9Å; L165-I168 PolarHBondContact O-N 3.33Å; I168-K171 PolarHBondContact O-N 2.83Å; I168-R172 WeakPolarHBondContact O-CB 3.32Å; I168-R172 PolarHBondContact O-N 2.03Å
169	I	80.8	Confident	85.7	Confident	81 Å²	81	105.5 Å²	105.5	42%	0.415	51%	0.507	S	S	.	.	H	α-helix	trans	-60.8	-52.7	177.3	-69	166.4	0	0	0	109.4	L165 K171 R172 D173	L165-I169 HydrophobicContact CD1-CD1 4.31Å; L165-I169 HydrophobicContact CG-CD1 4Å; L165-I169 VanDerWaalsContact O-CG1 3.27Å; L165-I169 WeakPolarHBondContact O-CG1 3.31Å; L165-I169 PolarHBondContact O-N 2.91Å; I169-K171 VanDerWaalsContact C-N 3.34Å; I169-K171 PolarHBondContact O-N 2.87Å; I169-R172 WeakPolarHBondContact O-CA 3.47Å; I169-R172 WeakPolarHBondContact O-CB 3.36Å; I169-R172 PolarHBondContact O-N 3.47Å; I169-D173 WeakPolarHBondContact CG2-OD2 3.48Å; I169-D173 VanDerWaalsContact O-CG 3.28Å; I169-D173 PolarHBondContact O-N 3.21Å
170	R	86.1	Confident	85.5	Confident	176 Å²	176	103.9 Å²	103.9	66%	0.664	50%	0.499	S	S	*	.	H	α-helix	trans	-57.4	-42.6	178	-179.5	178.5	170.9	164.7	-0.8	113	H166 R172 N174	H166-R170 VanDerWaalsContact O-CB 3.27Å; H166-R170 WeakPolarHBondContact O-CB 3.4Å; H166-R170 PolarHBondContact O-N 3.35Å; R170-R172 VanDerWaalsContact C-N 3.34Å; R170-N174 VanDerWaalsContact O-CB 3.31Å; R170-N174 WeakPolarHBondContact O-CB 3.37Å; R170-N174 PolarHBondContact O-N 3.44Å; R170-N174 PolarHBondContact O-OD1 2.86Å
171	K	82.2	Confident	85.4	Confident	130 Å²	130	104.1 Å²	104.1	57%	0.565	50%	0.499	S	S	*	.	H	α-helix	trans	-67.7	-34.1	176.6	-79.8	177	170.9	170.6	0	112.1	E167 I168 I169 S175	E167-K171 HydrophobicContact CG-CD 4.28Å; E167-K171 VanDerWaalsContact O-CB 3.29Å; E167-K171 WeakPolarHBondContact O-CB 3.44Å; E167-K171 WeakPolarHBondContact O-CG 3.46Å; E167-K171 PolarHBondContact O-N 3.03Å; E167-K171 WeakPolarHBondContact OE1-CE 3.45Å; E167-K171 IonicContact OE1-NZ 3.18Å; E167-K171 PolarHBondContact OE1-NZ 2.98Å; I168-K171 PolarHBondContact O-N 2.83Å; I169-K171 VanDerWaalsContact C-N 3.34Å; I169-K171 PolarHBondContact O-N 2.87Å; K171-S175 VanDerWaalsContact O-CB 3.25Å; K171-S175 WeakPolarHBondContact O-CB 3.45Å; K171-S175 PolarHBondContact O-N 3.04Å
172	R	83.5	Confident	85.4	Confident	171 Å²	171	101.6 Å²	101.6	65%	0.645	49%	0.492	S	S	*	.	H	α-helix	trans	-66.3	-47.7	174	-179.2	-177	-176.6	152.6	2.9	111.3	I168 I169 R170 S175 L176	I168-R172 WeakPolarHBondContact O-CB 3.32Å; I168-R172 PolarHBondContact O-N 2.03Å; I169-R172 WeakPolarHBondContact O-CA 3.47Å; I169-R172 WeakPolarHBondContact O-CB 3.36Å; I169-R172 PolarHBondContact O-N 3.47Å; R170-R172 VanDerWaalsContact C-N 3.34Å; R172-S175 WeakPolarHBondContact O-CB 3.36Å; R172-S175 PolarHBondContact O-N 2.68Å; R172-S175 VanDerWaalsContact O-N 3.16Å; R172-L176 PolarHBondContact O-N 2.77Å
173	D	79.2	Confident	85.4	Confident	79 Å²	79	100.9 Å²	100.9	42%	0.422	49%	0.49	S	S	.	.	H	α-helix	trans	-66.3	-45.5	-177.8	-60.6	-22.2	0	0	0	110.5	I169 S175 L176 E177	I169-D173 WeakPolarHBondContact CG2-OD2 3.48Å; I169-D173 VanDerWaalsContact O-CG 3.28Å; I169-D173 PolarHBondContact O-N 3.21Å; D173-S175 VanDerWaalsContact C-N 3.28Å; D173-S175 PolarHBondContact O-N 2.83Å; D173-L176 WeakPolarHBondContact O-CB 3.15Å; D173-L176 PolarHBondContact O-N 2.84Å; D173-L176 VanDerWaalsContact O-N 3.09Å; D173-E177 PolarHBondContact O-N 3.47Å
174	N	85.8	Confident	85.5	Confident	86 Å²	86	102 Å²	102	46%	0.46	49%	0.489	S	S	.	.	H	α-helix	trans	-57.1	-39.5	170.9	-74.3	18	0	0	0	112.5	R170 L178	R170-N174 VanDerWaalsContact O-CB 3.31Å; R170-N174 WeakPolarHBondContact O-CB 3.37Å; R170-N174 PolarHBondContact O-N 3.44Å; R170-N174 PolarHBondContact O-OD1 2.86Å; N174-L178 WeakPolarHBondContact O-CB 3.33Å; N174-L178 PolarHBondContact O-N 3.24Å
175	S	83.8	Confident	85.7	Confident	75 Å²	75	102.2 Å²	102.2	52%	0.524	49%	0.49	S	S	.	.	H	α-helix	trans	-69.9	-31.9	177.3	-174.3	0	0	0	0	112.6	K171 R172 D173 S179	K171-S175 VanDerWaalsContact O-CB 3.25Å; K171-S175 WeakPolarHBondContact O-CB 3.45Å; K171-S175 PolarHBondContact O-N 3.04Å; R172-S175 WeakPolarHBondContact O-CB 3.36Å; R172-S175 PolarHBondContact O-N 2.68Å; R172-S175 VanDerWaalsContact O-N 3.16Å; D173-S175 VanDerWaalsContact C-N 3.28Å; D173-S175 PolarHBondContact O-N 2.83Å; S175-S179 WeakPolarHBondContact O-CB 3.31Å; S175-S179 PolarHBondContact O-N 3.3Å
176	L	84.1	Confident	85.8	Confident	100 Å²	100	101.4 Å²	101.4	52%	0.524	49%	0.486	S	S	.	.	H	α-helix	trans	-70.4	-44.2	174.6	-179	63.7	0	0	0	110.6	R172 D173 L178 S179 Q180	R172-L176 PolarHBondContact O-N 2.77Å; D173-L176 WeakPolarHBondContact O-CB 3.15Å; D173-L176 PolarHBondContact O-N 2.84Å; D173-L176 VanDerWaalsContact O-N 3.09Å; L176-L178 VanDerWaalsContact C-N 3.34Å; L176-L178 PolarHBondContact O-N 2.81Å; L176-S179 PolarHBondContact O-N 3.41Å; L176-Q180 WeakPolarHBondContact O-CG 3.44Å; L176-Q180 PolarHBondContact O-N 2.92Å
177	E	85.5	Confident	85.9	Confident	118 Å²	118	99.7 Å²	99.7	55%	0.551	48%	0.481	S	S	*	.	H	α-helix	trans	-60.2	-42.6	172.9	-71.7	-170.5	161.6	0	0	112	D173 Q180 M181	D173-E177 PolarHBondContact O-N 3.47Å; E177-Q180 PolarHBondContact O-N 2.87Å; E177-M181 PolarHBondContact O-N 2.93Å
178	L	83.6	Confident	86.1	Confident	93 Å²	93	100.8 Å²	100.8	49%	0.487	49%	0.486	S	S	.	.	H	α-helix	trans	-58.9	-50.7	175.9	-154.6	87.2	0	0	0	110.7	N174 L176 Q180 M181 E182	N174-L178 WeakPolarHBondContact O-CB 3.33Å; N174-L178 PolarHBondContact O-N 3.24Å; L176-L178 VanDerWaalsContact C-N 3.34Å; L176-L178 PolarHBondContact O-N 2.81Å; L178-Q180 VanDerWaalsContact C-N 3.3Å; L178-Q180 PolarHBondContact O-N 2.71Å; L178-M181 PolarHBondContact O-N 2.95Å; L178-E182 WeakPolarHBondContact O-CG 3.46Å; L178-E182 PolarHBondContact O-N 3.02Å
179	S	82.2	Confident	86.4	Confident	50 Å²	50	98.9 Å²	98.9	35%	0.35	48%	0.478	S	S	.	.	H	α-helix	trans	-60.2	-37.8	177.3	-173.3	0	0	0	0	112.6	S175 L176 N183	S175-S179 WeakPolarHBondContact O-CB 3.31Å; S175-S179 PolarHBondContact O-N 3.3Å; L176-S179 PolarHBondContact O-N 3.41Å; S179-N183 PolarHBondContact O-N 2.99Å; S179-N183 PolarHBondContact O-ND2 2.99Å
180	Q	88.2	Confident	87	Confident	91 Å²	91	96.7 Å²	96.7	43%	0.425	47%	0.47	S	S	.	.	H	α-helix	trans	-70.3	-30.2	174.8	-72.7	-179.9	15.8	0	0	113.4	L176 E177 L178 R184	L176-Q180 WeakPolarHBondContact O-CG 3.44Å; L176-Q180 PolarHBondContact O-N 2.92Å; E177-Q180 PolarHBondContact O-N 2.87Å; L178-Q180 VanDerWaalsContact C-N 3.3Å; L178-Q180 PolarHBondContact O-N 2.71Å; Q180-R184 PolarHBondContact O-N 3.46Å; Q180-R184 PolarHBondContact O-NE 2.96Å; Q180-R184 VanDerWaalsContact O-NE 3.14Å
181	M	88.3	Confident	87.4	Confident	98 Å²	98	93.3 Å²	93.3	48%	0.483	46%	0.462	S	S	.	.	H	α-helix	trans	-74.3	-42.4	172.3	-76	-167.4	-73.9	0	0	111.3	E177 L178 N183 R184 I185	E177-M181 PolarHBondContact O-N 2.93Å; L178-M181 PolarHBondContact O-N 2.95Å; M181-N183 PolarHBondContact O-N 3.27Å; M181-R184 PolarHBondContact O-N 3.46Å; M181-R184 VanDerWaalsContact O-N 3.11Å; M181-I185 WeakPolarHBondContact O-CG1 3.4Å; M181-I185 PolarHBondContact O-N 3.18Å
182	E	85.4	Confident	87.9	Confident	94 Å²	94	93.1 Å²	93.1	44%	0.439	47%	0.465	S	S	.	.	H	α-helix	trans	-56.9	-47.6	174.7	-74.1	173.5	169.9	0	0	111.8	L178 R184 I185 L186	L178-E182 WeakPolarHBondContact O-CG 3.46Å; L178-E182 PolarHBondContact O-N 3.02Å; E182-R184 VanDerWaalsContact C-N 3.3Å; E182-R184 PolarHBondContact O-N 3.35Å; E182-I185 PolarHBondContact O-N 3.42Å; E182-L186 VanDerWaalsContact O-CB 3.28Å; E182-L186 WeakPolarHBondContact O-CB 3.42Å; E182-L186 PolarHBondContact O-N 2.85Å
183	N	85.7	Confident	88	Confident	77 Å²	77	88.6 Å²	88.6	41%	0.412	45%	0.451	S	S	.	.	H	α-helix	trans	-62.8	-34.7	176.2	-78.7	-79.7	0	0	0	112.6	S179 M181 N187	S179-N183 PolarHBondContact O-N 2.99Å; S179-N183 PolarHBondContact O-ND2 2.99Å; M181-N183 PolarHBondContact O-N 3.27Å; N183-N187 PolarHBondContact O-N 3.43Å
184	R	92.4	Very high	88.7	Confident	150 Å²	150	89.7 Å²	89.7	57%	0.566	45%	0.454	S	S	*	.	H	α-helix	trans	-69.4	-43.6	174.8	-84.5	-177.9	-89.7	-154.5	-4.6	112.4	Q180 M181 E182 L186 N187 Q188	Q180-R184 PolarHBondContact O-N 3.46Å; Q180-R184 PolarHBondContact O-NE 2.96Å; Q180-R184 VanDerWaalsContact O-NE 3.14Å; M181-R184 PolarHBondContact O-N 3.46Å; M181-R184 VanDerWaalsContact O-N 3.11Å; E182-R184 VanDerWaalsContact C-N 3.3Å; E182-R184 PolarHBondContact O-N 3.35Å; R184-L186 VanDerWaalsContact C-N 3.33Å; R184-N187 PolarHBondContact O-N 2.77Å; R184-Q188 WeakPolarHBondContact O-CG 3.36Å; R184-Q188 PolarHBondContact O-N 3.18Å
185	I	92.5	Very high	89.2	Confident	100 Å²	100	91.3 Å²	91.3	51%	0.513	46%	0.461	S	S	.	.	H	α-helix	trans	-61.9	-42.7	174.8	-69.4	163	0	0	0	110.3	M181 E182 N187 Q188 T189	M181-I185 WeakPolarHBondContact O-CG1 3.4Å; M181-I185 PolarHBondContact O-N 3.18Å; E182-I185 PolarHBondContact O-N 3.42Å; I185-N187 PolarHBondContact O-N 2.92Å; I185-Q188 PolarHBondContact O-N 3Å; I185-T189 VanDerWaalsContact O-CB 3.31Å; I185-T189 WeakPolarHBondContact O-CB 3.49Å; I185-T189 PolarHBondContact O-N 3.34Å; I185-T189 PolarHBondContact O-OG1 2.84Å
186	L	89.4	Confident	89.6	Confident	47 Å²	47	91 Å²	91	25%	0.246	46%	0.456	C	S	.	.	H	α-helix	trans	-61.3	-43.2	176.8	-167.1	68.4	0	0	0	111.7	E182 R184 T189 S190 L324 L333	E182-L186 VanDerWaalsContact O-CB 3.28Å; E182-L186 WeakPolarHBondContact O-CB 3.42Å; E182-L186 PolarHBondContact O-N 2.85Å; R184-L186 VanDerWaalsContact C-N 3.33Å; L186-T189 PolarHBondContact O-N 3.02Å; L186-S190 PolarHBondContact O-N 2.9Å; L186-L324 HydrophobicContact CD1-CD1 4.18Å; L186-L333 HydrophobicContact CD1-CB 4.12Å; L186-L333 HydrophobicContact CD1-CD1 4.28Å; L186-L333 HydrophobicContact CD2-CB 4.05Å; L186-L333 HydrophobicContact CG-CB 4.34Å; L186-L333 HydrophobicContact CG-CD1 4.45Å
187	N	91.8	Very high	90	Very high	87 Å²	87	91.2 Å²	91.2	47%	0.465	46%	0.458	S	S	.	.	H	α-helix	trans	-65	-47.1	175.4	-171.9	67.9	0	0	0	112.2	N183 R184 I185 T189 S190 E191	N183-N187 PolarHBondContact O-N 3.43Å; R184-N187 PolarHBondContact O-N 2.77Å; I185-N187 PolarHBondContact O-N 2.92Å; N187-T189 VanDerWaalsContact C-N 3.28Å; N187-T189 PolarHBondContact O-N 3.48Å; N187-S190 WeakPolarHBondContact O-CB 3.44Å; N187-S190 PolarHBondContact O-N 2.81Å; N187-E191 PolarHBondContact ND2-OE1 3.2Å; N187-E191 PolarHBondContact O-N 2.85Å
188	Q	93.1	Very high	90.5	Very high	120 Å²	120	93.9 Å²	93.9	56%	0.561	46%	0.463	S	S	*	.	H	α-helix	trans	-62.7	-34.3	176.8	-73.3	-174.4	-30.5	0	0	112.6	R184 I185 E191 M192	R184-Q188 WeakPolarHBondContact O-CG 3.36Å; R184-Q188 PolarHBondContact O-N 3.18Å; I185-Q188 PolarHBondContact O-N 3Å; Q188-E191 PolarHBondContact O-N 2.96Å; Q188-M192 WeakPolarHBondContact O-CB 3.31Å; Q188-M192 PolarHBondContact O-N 3.44Å
189	T	92.1	Very high	91	Very high	53 Å²	53	96.9 Å²	96.9	33%	0.325	47%	0.469	S	S	.	.	H	α-helix	trans	-67.1	-41	175.4	-57.3	0	0	0	0	111	I185 L186 N187 M192 Q193	I185-T189 VanDerWaalsContact O-CB 3.31Å; I185-T189 WeakPolarHBondContact O-CB 3.49Å; I185-T189 PolarHBondContact O-N 3.34Å; I185-T189 PolarHBondContact O-OG1 2.84Å; L186-T189 PolarHBondContact O-N 3.02Å; N187-T189 VanDerWaalsContact C-N 3.28Å; N187-T189 PolarHBondContact O-N 3.48Å; T189-M192 PolarHBondContact O-N 2.87Å; T189-Q193 WeakPolarHBondContact O-CG 3.25Å; T189-Q193 PolarHBondContact O-N 2.97Å
190	S	92.8	Very high	91.6	Very high	36 Å²	36	100.1 Å²	100.1	25%	0.252	48%	0.477	S	S	.	.	H	α-helix	trans	-61.4	-47.1	173	176.9	0	0	0	0	111.9	L186 N187 M192 Q193 Q194	L186-S190 PolarHBondContact O-N 2.9Å; N187-S190 WeakPolarHBondContact O-CB 3.44Å; N187-S190 PolarHBondContact O-N 2.81Å; S190-M192 PolarHBondContact O-N 3.4Å; S190-Q193 PolarHBondContact O-N 2.67Å; S190-Q194 WeakPolarHBondContact O-CG 3.32Å; S190-Q194 PolarHBondContact O-N 2.95Å
191	E	94.6	Very high	91.8	Very high	105 Å²	105	99.5 Å²	99.5	49%	0.491	48%	0.477	S	S	.	.	H	α-helix	trans	-61	-42.7	176	-72.1	172.5	-168.8	0	0	112	N187 Q188 Q194 L195	N187-E191 PolarHBondContact ND2-OE1 3.2Å; N187-E191 PolarHBondContact O-N 2.85Å; Q188-E191 PolarHBondContact O-N 2.96Å; E191-Q194 PolarHBondContact O-N 2.91Å; E191-L195 PolarHBondContact O-N 3Å
192	M	93.1	Very high	92.2	Very high	125 Å²	125	100.2 Å²	100.2	62%	0.616	48%	0.482	S	S	*	.	H	α-helix	trans	-64.8	-40.2	177.3	-171.3	161.2	65.9	0	0	112	Q188 T189 S190 L195 T196	Q188-M192 WeakPolarHBondContact O-CB 3.31Å; Q188-M192 PolarHBondContact O-N 3.44Å; T189-M192 PolarHBondContact O-N 2.87Å; S190-M192 PolarHBondContact O-N 3.4Å; M192-L195 PolarHBondContact O-N 2.63Å; M192-T196 PolarHBondContact O-N 2.91Å; M192-T196 PolarHBondContact O-OG1 3.08Å
193	Q	85.6	Confident	92.6	Very high	76 Å²	76	100.3 Å²	100.3	36%	0.355	48%	0.482	S	S	.	.	H	α-helix	trans	-62.8	-41.2	173	-75.5	-178	-10.4	0	0	112.4	T189 S190 L195 T196 N197	T189-Q193 WeakPolarHBondContact O-CG 3.25Å; T189-Q193 PolarHBondContact O-N 2.97Å; S190-Q193 PolarHBondContact O-N 2.67Å; Q193-L195 VanDerWaalsContact C-N 3.32Å; Q193-L195 PolarHBondContact O-N 2.86Å; Q193-T196 PolarHBondContact O-N 2.89Å; Q193-N197 PolarHBondContact O-N 2.84Å
194	Q	93.1	Very high	93	Very high	103 Å²	103	102.7 Å²	102.7	48%	0.481	49%	0.491	S	S	.	.	H	α-helix	trans	-61.4	-41.4	174.7	-70.3	-179.5	32.7	0	0	111.8	S190 E191 N197 R198	S190-Q194 WeakPolarHBondContact O-CG 3.32Å; S190-Q194 PolarHBondContact O-N 2.95Å; E191-Q194 PolarHBondContact O-N 2.91Å; Q194-N197 PolarHBondContact O-N 3.03Å; Q194-R198 WeakPolarHBondContact O-CG 3.2Å; Q194-R198 PolarHBondContact O-N 2.88Å; Q194-R198 VanDerWaalsContact O-N 3.09Å
195	L	95.8	Very high	93	Very high	119 Å²	119	100.7 Å²	100.7	62%	0.623	49%	0.486	S	S	*	.	H	α-helix	trans	-64.3	-43.3	175.7	-173.4	65	0	0	0	111.7	E191 M192 Q193 N197 R198 Y199	E191-L195 PolarHBondContact O-N 3Å; M192-L195 PolarHBondContact O-N 2.63Å; Q193-L195 VanDerWaalsContact C-N 3.32Å; Q193-L195 PolarHBondContact O-N 2.86Å; L195-N197 VanDerWaalsContact C-N 3.31Å; L195-N197 PolarHBondContact O-N 3.36Å; L195-R198 PolarHBondContact O-N 2.86Å; L195-Y199 PolarHBondContact O-N 2.97Å
196	T	93.6	Very high	93.2	Very high	68 Å²	68	103.9 Å²	103.9	42%	0.417	49%	0.493	S	S	.	.	H	α-helix	trans	-58.3	-41.5	174.9	-56.4	0	0	0	0	112.1	M192 Q193 Y199 K200	M192-T196 PolarHBondContact O-N 2.91Å; M192-T196 PolarHBondContact O-OG1 3.08Å; Q193-T196 PolarHBondContact O-N 2.89Å; T196-Y199 PolarHBondContact O-N 2.83Å; T196-K200 PolarHBondContact O-N 2.9Å; T196-K200 VanDerWaalsContact O-N 3.09Å
197	N	91.1	Very high	93.4	Very high	105 Å²	105	106.6 Å²	106.6	56%	0.561	50%	0.504	S	S	*	.	H	α-helix	trans	-67.4	-40	177.9	-71.5	-16.8	0	0	0	112.3	Q193 Q194 L195 Y199 K200 D201	Q193-N197 PolarHBondContact O-N 2.84Å; Q194-N197 PolarHBondContact O-N 3.03Å; L195-N197 VanDerWaalsContact C-N 3.31Å; L195-N197 PolarHBondContact O-N 3.36Å; N197-Y199 VanDerWaalsContact C-N 3.32Å; N197-Y199 PolarHBondContact O-N 2.91Å; N197-K200 PolarHBondContact O-N 3.18Å; N197-D201 PolarHBondContact O-N 2.87Å; N197-D201 VanDerWaalsContact O-N 3.15Å
198	R	95.7	Very high	93.5	Very high	174 Å²	174	108.5 Å²	108.5	66%	0.657	51%	0.51	S	S	*	.	H	α-helix	trans	-63.7	-36.4	173	-69.2	-179.7	-171.2	-174.5	5.4	112.4	Q194 L195 D201 L202	Q194-R198 WeakPolarHBondContact O-CG 3.2Å; Q194-R198 PolarHBondContact O-N 2.88Å; Q194-R198 VanDerWaalsContact O-N 3.09Å; L195-R198 PolarHBondContact O-N 2.86Å; R198-D201 PolarHBondContact O-N 2.96Å; R198-L202 PolarHBondContact O-N 3.02Å
199	Y	95	Very high	93.6	Very high	156 Å²	156	108 Å²	108	61%	0.612	51%	0.51	S	S	*	.	H	α-helix	trans	-64.2	-44.9	176.3	-170.4	-90.8	0	0	0	111.6	L195 T196 N197 D201 L202 E203	L195-Y199 PolarHBondContact O-N 2.97Å; T196-Y199 PolarHBondContact O-N 2.83Å; N197-Y199 VanDerWaalsContact C-N 3.32Å; N197-Y199 PolarHBondContact O-N 2.91Å; Y199-D201 PolarHBondContact O-N 2.93Å; Y199-L202 WeakPolarHBondContact O-CB 3.28Å; Y199-L202 PolarHBondContact O-N 3.24Å; Y199-E203 WeakPolarHBondContact O-CB 3.25Å; Y199-E203 PolarHBondContact O-N 2.84Å
200	K	93.9	Very high	93.7	Very high	118 Å²	118	108.1 Å²	108.1	51%	0.513	51%	0.512	S	S	.	.	H	α-helix	trans	-60.7	-40.8	175.8	-72.4	179.9	175.6	-178.2	0	113.3	T196 N197 E203 H204	T196-K200 PolarHBondContact O-N 2.9Å; T196-K200 VanDerWaalsContact O-N 3.09Å; N197-K200 PolarHBondContact O-N 3.18Å; K200-E203 PolarHBondContact O-N 2.86Å; K200-H204 PolarHBondContact O-CD2 3.46Å; K200-H204 PolarHBondContact O-N 2.66Å
201	D	93.4	Very high	93.6	Very high	79 Å²	79	109 Å²	109	42%	0.422	52%	0.517	S	S	.	.	H	α-helix	trans	-63.3	-41.1	174.1	169.3	62.6	0	0	0	111.8	N197 R198 Y199 H204 K205	N197-D201 PolarHBondContact O-N 2.87Å; N197-D201 VanDerWaalsContact O-N 3.15Å; R198-D201 PolarHBondContact O-N 2.96Å; Y199-D201 PolarHBondContact O-N 2.93Å; D201-H204 PolarHBondContact O-N 2.96Å; D201-K205 VanDerWaalsContact CG-NZ 3.28Å; D201-K205 WeakPolarHBondContact O-CG 3.4Å; D201-K205 PolarHBondContact O-N 2.59Å; D201-K205 WeakPolarHBondContact OD1-CE 3.31Å; D201-K205 IonicContact OD1-NZ 2.69Å; D201-K205 PolarHBondContact OD1-NZ 2.74Å; D201-K205 VanDerWaalsContact OD1-NZ 3.17Å; D201-K205 WeakPolarHBondContact OD2-CE 3.28Å; D201-K205 IonicContact OD2-NZ 3.77Å; D201-K205 PolarHBondContact OD2-NZ 2.89Å
202	L	95.4	Very high	93.6	Very high	112 Å²	112	107.7 Å²	107.7	59%	0.586	51%	0.514	S	S	*	.	H	α-helix	trans	-65.9	-37.7	175.3	-167.2	66.5	0	0	0	112.3	R198 Y199 K205 Y206	R198-L202 PolarHBondContact O-N 3.02Å; Y199-L202 WeakPolarHBondContact O-CB 3.28Å; Y199-L202 PolarHBondContact O-N 3.24Å; L202-K205 PolarHBondContact O-N 2.93Å; L202-Y206 PolarHBondContact O-N 2.84Å
203	E	93.7	Very high	93.6	Very high	96 Å²	96	103.9 Å²	103.9	45%	0.449	50%	0.502	S	S	.	.	H	α-helix	trans	-65.4	-43.1	176	-171.9	168.3	-164.9	0	0	111.8	Y199 K200 K205 Y206 Q207	Y199-E203 WeakPolarHBondContact O-CB 3.25Å; Y199-E203 PolarHBondContact O-N 2.84Å; K200-E203 PolarHBondContact O-N 2.86Å; E203-K205 PolarHBondContact O-N 2.88Å; E203-Y206 PolarHBondContact O-N 3.36Å; E203-Q207 WeakPolarHBondContact O-CG 3.28Å; E203-Q207 PolarHBondContact O-N 3.37Å
204	H	94.1	Very high	93.8	Very high	128 Å²	128	104.9 Å²	104.9	59%	0.593	51%	0.51	S	S	*	.	H	α-helix	trans	-60.8	-41.7	171.3	-84.4	-60.9	0	0	0	112.8	K200 D201 Y206 Q207 H208	K200-H204 PolarHBondContact O-CD2 3.46Å; K200-H204 PolarHBondContact O-N 2.66Å; D201-H204 PolarHBondContact O-N 2.96Å; H204-Y206 VanDerWaalsContact C-N 3.32Å; H204-Y206 PolarHBondContact O-N 3.23Å; H204-Q207 PolarHBondContact O-N 3.45Å; H204-H208 PolarHBondContact O-N 2.86Å
205	K	92.8	Very high	93.8	Very high	108 Å²	108	105.2 Å²	105.2	47%	0.47	52%	0.515	S	S	.	.	H	α-helix	trans	-63.5	-38.1	175.4	-74.5	165.2	-179.8	165.9	0	112.1	D201 L202 E203 H208 L209	D201-K205 VanDerWaalsContact CG-NZ 3.28Å; D201-K205 WeakPolarHBondContact O-CG 3.4Å; D201-K205 PolarHBondContact O-N 2.59Å; D201-K205 WeakPolarHBondContact OD1-CE 3.31Å; D201-K205 IonicContact OD1-NZ 2.69Å; D201-K205 PolarHBondContact OD1-NZ 2.74Å; D201-K205 VanDerWaalsContact OD1-NZ 3.17Å; D201-K205 WeakPolarHBondContact OD2-CE 3.28Å; D201-K205 IonicContact OD2-NZ 3.77Å; D201-K205 PolarHBondContact OD2-NZ 2.89Å; L202-K205 PolarHBondContact O-N 2.93Å; E203-K205 PolarHBondContact O-N 2.88Å; K205-H208 PolarHBondContact O-N 2.84Å; K205-L209 PolarHBondContact O-N 3.03Å
206	Y	96.3	Very high	93.6	Very high	167 Å²	167	104.8 Å²	104.8	66%	0.655	51%	0.51	S	S	*	.	H	α-helix	trans	-64.8	-48	174.6	-173.2	-96.6	0	0	0	111.6	L202 E203 H204 H208 L209 T210	L202-Y206 PolarHBondContact O-N 2.84Å; E203-Y206 PolarHBondContact O-N 3.36Å; H204-Y206 VanDerWaalsContact C-N 3.32Å; H204-Y206 PolarHBondContact O-N 3.23Å; Y206-H208 VanDerWaalsContact C-N 3.29Å; Y206-H208 PolarHBondContact O-N 3.49Å; Y206-L209 WeakPolarHBondContact O-CB 3.39Å; Y206-L209 PolarHBondContact O-N 3.32Å; Y206-L209 VanDerWaalsContact O-N 3.07Å; Y206-T210 PolarHBondContact O-N 3.38Å; Y206-T210 PolarHBondContact O-OG1 2.84Å; Y206-T210 VanDerWaalsContact O-OG1 3.06Å
207	Q	93.9	Very high	93.5	Very high	104 Å²	104	105 Å²	105	49%	0.486	51%	0.514	S	S	.	.	H	α-helix	trans	-56.6	-41.1	175.7	-70.3	171.7	5.4	0	0	112.4	E203 H204 T210 S211	E203-Q207 WeakPolarHBondContact O-CG 3.28Å; E203-Q207 PolarHBondContact O-N 3.37Å; H204-Q207 PolarHBondContact O-N 3.45Å; Q207-T210 PolarHBondContact O-N 3.3Å; Q207-S211 PolarHBondContact O-N 3.11Å
208	H	94.2	Very high	93.5	Very high	126 Å²	126	104.3 Å²	104.3	58%	0.583	51%	0.513	S	S	*	.	H	α-helix	trans	-64.9	-40.2	174.9	-176.8	-81.5	0	0	0	112.7	H204 K205 Y206 S211 L212	H204-H208 PolarHBondContact O-N 2.86Å; K205-H208 PolarHBondContact O-N 2.84Å; Y206-H208 VanDerWaalsContact C-N 3.29Å; Y206-H208 PolarHBondContact O-N 3.49Å; H208-S211 PolarHBondContact O-N 2.85Å; H208-S211 PolarHBondContact O-OG 2.82Å; H208-L212 PolarHBondContact O-N 3.16Å
209	L	95.3	Very high	93.3	Very high	109 Å²	109	101.2 Å²	101.2	57%	0.571	51%	0.509	S	S	*	.	H	α-helix	trans	-64.8	-39.9	174.1	-79.4	162.6	0	0	0	111.9	K205 Y206 L212 A213	K205-L209 PolarHBondContact O-N 3.03Å; Y206-L209 WeakPolarHBondContact O-CB 3.39Å; Y206-L209 PolarHBondContact O-N 3.32Å; Y206-L209 VanDerWaalsContact O-N 3.07Å; L209-L212 PolarHBondContact O-N 2.94Å; L209-A213 WeakPolarHBondContact O-CB 3.45Å; L209-A213 PolarHBondContact O-N 3.11Å
210	T	93.4	Very high	93	Very high	57 Å²	57	98 Å²	98	35%	0.35	50%	0.502	S	S	.	.	H	α-helix	trans	-62.2	-42.2	174.6	-49.5	0	0	0	0	111.9	Y206 Q207 A213 N214	Y206-T210 PolarHBondContact O-N 3.38Å; Y206-T210 PolarHBondContact O-OG1 2.84Å; Y206-T210 VanDerWaalsContact O-OG1 3.06Å; Q207-T210 PolarHBondContact O-N 3.3Å; T210-A213 PolarHBondContact O-N 3.41Å; T210-N214 VanDerWaalsContact O-CG 3.25Å; T210-N214 PolarHBondContact O-N 3.02Å; T210-N214 PolarHBondContact O-ND2 3.42Å
211	S	92.6	Very high	92.7	Very high	53 Å²	53	94.9 Å²	94.9	37%	0.371	50%	0.498	S	S	.	.	H	α-helix	trans	-66.5	-39.4	177.8	71.9	0	0	0	0	112.3	Q207 H208 N214 N215	Q207-S211 PolarHBondContact O-N 3.11Å; H208-S211 PolarHBondContact O-N 2.85Å; H208-S211 PolarHBondContact O-OG 2.82Å; S211-N214 PolarHBondContact O-N 2.96Å; S211-N215 VanDerWaalsContact O-CG 3.23Å; S211-N215 PolarHBondContact O-N 2.93Å; S211-N215 PolarHBondContact O-ND2 3.47Å
212	L	93.4	Very high	92.3	Very high	79 Å²	79	95.8 Å²	95.8	41%	0.414	50%	0.502	S	S	.	.	H	α-helix	trans	-64	-43.8	175.1	-175	64.9	0	0	0	112	H208 L209 N215 Q216	H208-L212 PolarHBondContact O-N 3.16Å; L209-L212 PolarHBondContact O-N 2.94Å; L212-N215 PolarHBondContact O-N 3.24Å; L212-Q216 WeakPolarHBondContact O-CG 3.37Å; L212-Q216 PolarHBondContact O-N 2.96Å
213	A	92.5	Very high	91.7	Very high	45 Å²	45	94.9 Å²	94.9	37%	0.372	50%	0.497	S	S	.	.	H	α-helix	trans	-61.4	-44.1	176	0	0	0	0	0	111.7	L209 T210 N215 Q216 S217	L209-A213 WeakPolarHBondContact O-CB 3.45Å; L209-A213 PolarHBondContact O-N 3.11Å; T210-A213 PolarHBondContact O-N 3.41Å; A213-N215 PolarHBondContact O-N 3.17Å; A213-Q216 PolarHBondContact O-N 2.68Å; A213-S217 PolarHBondContact O-N 2.75Å; A213-S217 PolarHBondContact O-OG 2.99Å; A213-S217 VanDerWaalsContact O-OG 3.07Å
214	N	91.3	Very high	91.2	Very high	97 Å²	97	95.9 Å²	95.9	52%	0.519	50%	0.502	S	S	.	.	H	α-helix	trans	-60.9	-43.8	175.4	-71.2	-15.2	0	0	0	112	T210 S211 Q216 S217 V218	T210-N214 VanDerWaalsContact O-CG 3.25Å; T210-N214 PolarHBondContact O-N 3.02Å; T210-N214 PolarHBondContact O-ND2 3.42Å; S211-N214 PolarHBondContact O-N 2.96Å; N214-Q216 VanDerWaalsContact C-N 3.34Å; N214-Q216 PolarHBondContact O-N 2.83Å; N214-S217 PolarHBondContact O-N 2.84Å; N214-V218 WeakPolarHBondContact O-CG2 3.43Å; N214-V218 PolarHBondContact O-N 2.78Å
215	N	92.2	Very high	90.6	Very high	109 Å²	109	96.6 Å²	96.6	58%	0.583	51%	0.506	S	S	*	.	H	α-helix	trans	-62.7	-39.7	176.6	-70.5	-16.5	0	0	0	112	S211 L212 A213 V218 L219	S211-N215 VanDerWaalsContact O-CG 3.23Å; S211-N215 PolarHBondContact O-N 2.93Å; S211-N215 PolarHBondContact O-ND2 3.47Å; L212-N215 PolarHBondContact O-N 3.24Å; A213-N215 PolarHBondContact O-N 3.17Å; N215-V218 PolarHBondContact O-N 2.98Å; N215-L219 PolarHBondContact O-N 2.76Å
216	Q	91.9	Very high	89.7	Confident	111 Å²	111	98.8 Å²	98.8	52%	0.519	52%	0.517	S	S	.	.	H	α-helix	trans	-64.2	-44	174	-73.7	176.3	-13.5	0	0	111.7	L212 A213 N214 V218 L219 I220	L212-Q216 WeakPolarHBondContact O-CG 3.37Å; L212-Q216 PolarHBondContact O-N 2.96Å; A213-Q216 PolarHBondContact O-N 2.68Å; N214-Q216 VanDerWaalsContact C-N 3.34Å; N214-Q216 PolarHBondContact O-N 2.83Å; Q216-V218 VanDerWaalsContact C-N 3.33Å; Q216-V218 PolarHBondContact O-N 2.71Å; Q216-L219 PolarHBondContact O-N 2.86Å; Q216-I220 WeakPolarHBondContact O-CD1 2.98Å; Q216-I220 VanDerWaalsContact O-CG1 3.27Å; Q216-I220 WeakPolarHBondContact O-CG1 3.44Å; Q216-I220 PolarHBondContact O-N 2.83Å
217	S	91.8	Very high	88.4	Confident	73 Å²	73	95.6 Å²	95.6	51%	0.51	52%	0.519	S	S	.	.	H	α-helix	trans	-59.2	-40.9	175.9	-61.1	0	0	0	0	112.7	A213 N214 I220 A221	A213-S217 PolarHBondContact O-N 2.75Å; A213-S217 PolarHBondContact O-OG 2.99Å; A213-S217 VanDerWaalsContact O-OG 3.07Å; N214-S217 PolarHBondContact O-N 2.84Å; S217-I220 PolarHBondContact O-N 3.1Å; S217-A221 PolarHBondContact O-N 3.04Å; S217-A221 VanDerWaalsContact O-N 3.07Å
218	V	91.8	Very high	87	Confident	90 Å²	90	98.7 Å²	98.7	55%	0.545	53%	0.533	S	S	.	.	H	α-helix	trans	-65.8	-42.2	175	172.7	0	0	0	0	111.4	N214 N215 Q216 I220 A221 L222	N214-V218 WeakPolarHBondContact O-CG2 3.43Å; N214-V218 PolarHBondContact O-N 2.78Å; N215-V218 PolarHBondContact O-N 2.98Å; Q216-V218 VanDerWaalsContact C-N 3.33Å; Q216-V218 PolarHBondContact O-N 2.71Å; V218-I220 VanDerWaalsContact C-N 3.34Å; V218-I220 PolarHBondContact O-N 3.24Å; V218-A221 PolarHBondContact O-N 3.11Å; V218-L222 HydrophobicContact CG1-CD1 4.27Å; V218-L222 WeakPolarHBondContact O-CG 3.36Å; V218-L222 PolarHBondContact O-N 2.81Å; V218-L222 VanDerWaalsContact O-N 3.11Å
219	L	90.6	Very high	85.1	Confident	109 Å²	109	95.8 Å²	95.8	57%	0.571	54%	0.537	S	S	*	.	H	α-helix	trans	-64.8	-39	178.3	-154.8	95.8	0	0	0	112	N215 Q216 L222 L223	N215-L219 PolarHBondContact O-N 2.76Å; Q216-L219 PolarHBondContact O-N 2.86Å; L219-L222 PolarHBondContact O-N 2.77Å; L219-L223 HydrophobicContact CD2-CD1 4.25Å; L219-L223 VanDerWaalsContact O-CG 3.32Å; L219-L223 WeakPolarHBondContact O-CG 3.39Å; L219-L223 PolarHBondContact O-N 3.06Å; L219-L223 VanDerWaalsContact O-N 3.07Å
220	I	89.1	Confident	83.1	Confident	88 Å²	88	98.2 Å²	98.2	45%	0.451	55%	0.546	S	S	.	.	H	α-helix	trans	-62.1	-47.9	175.1	-70	161.9	0	0	0	110.2	Q216 S217 V218 L222 L223 E224	Q216-I220 WeakPolarHBondContact O-CD1 2.98Å; Q216-I220 VanDerWaalsContact O-CG1 3.27Å; Q216-I220 WeakPolarHBondContact O-CG1 3.44Å; Q216-I220 PolarHBondContact O-N 2.83Å; S217-I220 PolarHBondContact O-N 3.1Å; V218-I220 VanDerWaalsContact C-N 3.34Å; V218-I220 PolarHBondContact O-N 3.24Å; I220-L222 VanDerWaalsContact C-N 3.32Å; I220-L222 PolarHBondContact O-N 3.46Å; I220-L223 PolarHBondContact O-N 3.45Å; I220-L223 VanDerWaalsContact O-N 3.12Å; I220-E224 HydrophobicContact CG2-CG 4.3Å; I220-E224 WeakPolarHBondContact O-CG 3.34Å; I220-E224 PolarHBondContact O-N 2.94Å
221	A	86.4	Confident	81.4	Confident	53 Å²	53	101.6 Å²	101.6	44%	0.438	57%	0.569	S	S	.	*	H	α-helix	trans	-58.8	-41.6	178.6	0	0	0	0	0	112.7	S217 V218 E224 E225	S217-A221 PolarHBondContact O-N 3.04Å; S217-A221 VanDerWaalsContact O-N 3.07Å; V218-A221 PolarHBondContact O-N 3.11Å; A221-E224 PolarHBondContact O-N 3.25Å; A221-E225 PolarHBondContact O-N 3.47Å
222	L	85.9	Confident	79.1	Confident	98 Å²	98	105.5 Å²	105.5	51%	0.513	59%	0.59	S	S	.	*	H	α-helix	trans	-64.4	-39.3	175.3	-70.3	169.5	0	0	0	112.5	V218 L219 I220 Q226	V218-L222 HydrophobicContact CG1-CD1 4.27Å; V218-L222 WeakPolarHBondContact O-CG 3.36Å; V218-L222 PolarHBondContact O-N 2.81Å; V218-L222 VanDerWaalsContact O-N 3.11Å; L219-L222 PolarHBondContact O-N 2.77Å; I220-L222 VanDerWaalsContact C-N 3.32Å; I220-L222 PolarHBondContact O-N 3.46Å; L222-Q226 WeakPolarHBondContact O-CB 3.33Å; L222-Q226 PolarHBondContact O-N 3.48Å
223	L	83.5	Confident	77.4	Confident	92 Å²	92	106.6 Å²	106.6	48%	0.482	60%	0.604	S	S	.	*	H	α-helix	trans	-70.6	-35.8	176.7	-71.3	167.8	0	0	0	112.3	L219 I220 Q226 C227	L219-L223 HydrophobicContact CD2-CD1 4.25Å; L219-L223 VanDerWaalsContact O-CG 3.32Å; L219-L223 WeakPolarHBondContact O-CG 3.39Å; L219-L223 PolarHBondContact O-N 3.06Å; L219-L223 VanDerWaalsContact O-N 3.07Å; I220-L223 PolarHBondContact O-N 3.45Å; I220-L223 VanDerWaalsContact O-N 3.12Å; L223-Q226 PolarHBondContact O-N 3.47Å; L223-C227 WeakPolarHBondContact O-CB 3.42Å; L223-C227 PolarHBondContact O-N 3.37Å; L223-C227 PolarHBondContact O-SG 3.08Å; L223-C227 VanDerWaalsContact O-SG 3.36Å
224	E	83.3	Confident	75.3	Confident	117 Å²	117	112.2 Å²	112.2	55%	0.547	63%	0.627	S	S	.	*	H	α-helix	trans	-64.7	-44	173.8	-74.1	-179.8	168.2	0	0	111.5	I220 A221 Q226 C227 Q228	I220-E224 HydrophobicContact CG2-CG 4.3Å; I220-E224 WeakPolarHBondContact O-CG 3.34Å; I220-E224 PolarHBondContact O-N 2.94Å; A221-E224 PolarHBondContact O-N 3.25Å; E224-Q226 VanDerWaalsContact C-N 3.34Å; E224-Q226 PolarHBondContact O-N 3.02Å; E224-C227 PolarHBondContact O-N 3.22Å; E224-Q228 WeakPolarHBondContact O-CG 3.26Å; E224-Q228 PolarHBondContact O-N 3.28Å; E224-Q228 VanDerWaalsContact O-N 3.11Å
225	E	79.7	Confident	73.3	Confident	143 Å²	143	112.7 Å²	112.7	67%	0.668	64%	0.635	S	S	*	*	H	α-helix	trans	-60	-43.8	173.8	-171.9	177.1	-174.1	0	0	111.4	A221 C227 Q228	A221-E225 PolarHBondContact O-N 3.47Å; E225-C227 VanDerWaalsContact C-N 3.32Å; E225-C227 PolarHBondContact O-N 3.42Å; E225-Q228 PolarHBondContact O-N 2.84Å
226	Q	75.4	Confident	71.4	Confident	154 Å²	154	118.1 Å²	118.1	72%	0.72	65%	0.648	S	S	*	*	H	α-helix	trans	-68.4	-28.5	179.1	-160.4	166.8	14.1	0	0	113.2	L222 L223 E224	L222-Q226 WeakPolarHBondContact O-CB 3.33Å; L222-Q226 PolarHBondContact O-N 3.48Å; L223-Q226 PolarHBondContact O-N 3.47Å; E224-Q226 VanDerWaalsContact C-N 3.34Å; E224-Q226 PolarHBondContact O-N 3.02Å
227	C	69.1	Low	69	Low	101 Å²	101	118.2 Å²	118.2	68%	0.682	66%	0.658	S	S	*	*	H	α-helix	trans	-78.8	-26.6	174.8	-79	0	0	0	0	113.9	L223 E224 E225 G229	L223-C227 WeakPolarHBondContact O-CB 3.42Å; L223-C227 PolarHBondContact O-N 3.37Å; L223-C227 PolarHBondContact O-SG 3.08Å; L223-C227 VanDerWaalsContact O-SG 3.36Å; E224-C227 PolarHBondContact O-N 3.22Å; E225-C227 VanDerWaalsContact C-N 3.32Å; E225-C227 PolarHBondContact O-N 3.42Å; C227-G229 PolarHBondContact O-N 2.94Å
228	Q	63.8	Low	67	Low	169 Å²	169	121 Å²	121	79%	0.79	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-5.1	178.1	-74.4	-177.1	22.5	0	0	113.9	E224 E225 Q230	E224-Q228 WeakPolarHBondContact O-CG 3.26Å; E224-Q228 PolarHBondContact O-N 3.28Å; E224-Q228 VanDerWaalsContact O-N 3.11Å; E225-Q228 PolarHBondContact O-N 2.84Å; Q228-Q230 PolarHBondContact O-N 2.9Å
229	G	54.7	Low	64.8	Low	65 Å²	65	121.6 Å²	121.6	67%	0.67	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	1.1	179.3	0	0	0	0	0	117.2	C227	C227-G229 PolarHBondContact O-N 2.94Å
230	Q	53.5	Low	62.7	Low	160 Å²	160	122.2 Å²	122.2	75%	0.748	69%	0.685	S	S	*	*			trans	-109.2	120.8	179.8	-74.6	-165.8	-11.3	0	0	113.5	Q228 V232	Q228-Q230 PolarHBondContact O-N 2.9Å; Q230-V232 PolarHBondContact O-N 3.42Å
231	P	56.5	Low	61.3	Low	128 Å²	128	123.8 Å²	123.8	83%	0.831	70%	0.702	S	S	*	*			trans	-85.6	101.3	172.6	32.8	-30.7	0	0	0	110.9
232	V	45.8	Very low	59.5	Low	134 Å²	134	129.7 Å²	129.7	81%	0.812	72%	0.72	S	S	*	*			trans	-118.9	97.8	163.3	-175.1	0	0	0	0	109.8	Q230	Q230-V232 PolarHBondContact O-N 3.42Å
233	S	56	Low	57.7	Low	103 Å²	103	130.5 Å²	130.5	72%	0.72	73%	0.731	S	S	*	*			trans	-78.4	126.9	170.1	54.5	0	0	0	0	111.2
234	L	48.8	Very low	56	Low	163 Å²	163	137.6 Å²	137.6	85%	0.853	75%	0.751	S	S	*	*			trans	173	162.8	143.6	-96.6	160.9	0	0	0	111.6
235	P	49.9	Very low	54.4	Low	106 Å²	106	137.8 Å²	137.8	69%	0.688	76%	0.763	S	S	*	*				-104.4	161.3	-103.5	34.3	-21.5	0	0	0	114.4	P237	P235-P237 VanDerWaalsContact O-CD 3.3Å; P235-P237 WeakPolarHBondContact O-CD 3.42Å
236	R	51	Low	53.2	Low	223 Å²	223	139.3 Å²	139.3	84%	0.842	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-65.6	123.4	178.5	-178.7	-175.5	-167.8	-168.9	7.1	113.1
237	P	43	Very low	52.4	Low	113 Å²	113	137.5 Å²	137.5	73%	0.734	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-84.4	156.4	157.2	-8.2	28.4	0	0	0	111.5	P235	P235-P237 VanDerWaalsContact O-CD 3.3Å; P235-P237 WeakPolarHBondContact O-CD 3.42Å
238	V	49.7	Very low	51.9	Low	131 Å²	131	138.2 Å²	138.2	79%	0.794	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-70.9	149.3	-177.5	176.2	0	0	0	0	111.4
239	P	46.1	Very low	51.2	Low	103 Å²	103	136 Å²	136	67%	0.669	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-71.6	131.5	-177.7	-11.7	27.5	0	0	0	112.5
240	V	46.4	Very low	50.9	Low	122 Å²	122	137 Å²	137	74%	0.739	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-87	130.2	163.8	-179.7	0	0	0	0	108.4	Q242	V240-Q242 PolarHBondContact O-N 2.98Å
241	P	57.9	Low	50.6	Low	122 Å²	122	135.4 Å²	135.4	79%	0.792	78%	0.781	S	S	*	*			trans	-80.4	114.3	180	30.6	-32.8	0	0	0	111.4
242	Q	50.4	Low	49.9	Very low	176 Å²	176	134.8 Å²	134.8	82%	0.822	78%	0.779	S	S	*	*			trans	-135.7	157.6	166.8	-81.4	-158.5	-0.5	0	0	110.7	V240	V240-Q242 PolarHBondContact O-N 2.98Å
243	P	46.5	Very low	50	Low	115 Å²	115	136.5 Å²	136.5	75%	0.747	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-82.2	158.8	-138.3	30.3	-36.4	0	0	0	114.9	P245	P243-P245 WeakPolarHBondContact O-CD 3.26Å
244	R	48.6	Very low	49.4	Very low	241 Å²	241	137.3 Å²	137.3	91%	0.909	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-51.5	123.2	174.9	-69.6	-176.2	-177.7	-170.4	0.5	111.2
245	P	49.2	Very low	48.9	Very low	121 Å²	121	136.2 Å²	136.2	79%	0.786	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-61.1	134.7	150.8	-15.3	30.8	0	0	0	108.2	P243	P243-P245 WeakPolarHBondContact O-CD 3.26Å
246	Q	54.7	Low	48.6	Very low	175 Å²	175	138.7 Å²	138.7	82%	0.818	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-65.8	146	168.6	-64.8	177.4	-1.1	0	0	108.8
247	P	58.6	Low	47.9	Very low	116 Å²	116	136.5 Å²	136.5	75%	0.753	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-62.2	132.3	173.6	26.3	-33.1	0	0	0	109.4
248	P	60	Low	47.6	Very low	116 Å²	116	136.7 Å²	136.7	75%	0.753	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-59	143.2	163.4	26.7	-32.4	0	0	0	108.6
249	P	49	Very low	47	Very low	124 Å²	124	141.5 Å²	141.5	81%	0.805	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-62.3	145.7	-172.8	25	-34	0	0	0	111.3
250	A	47	Very low	46.6	Very low	86 Å²	86	144.9 Å²	144.9	71%	0.711	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-54.7	146.4	173.8	0	0	0	0	0	110.8	S252	A250-S252 PolarHBondContact O-N 3.49Å
251	P	47	Very low	46.2	Very low	126 Å²	126	144.1 Å²	144.1	82%	0.818	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-57.5	117.9	171.4	24.9	-32.9	0	0	0	108.6	Q253	P251-Q253 PolarHBondContact O-N 3.47Å
252	S	43.3	Very low	45.2	Very low	114 Å²	114	143.4 Å²	143.4	80%	0.797	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-59.7	129.8	174.4	35.6	0	0	0	0	108.9	A250	A250-S252 PolarHBondContact O-N 3.49Å
253	Q	47.6	Very low	44.5	Very low	171 Å²	171	141.6 Å²	141.6	80%	0.799	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-54.3	145.4	174.5	-68.2	-176.3	-12.5	0	0	110.1	P251 I255	P251-Q253 PolarHBondContact O-N 3.47Å; Q253-I255 PolarHBondContact O-N 3.27Å
254	P	42.6	Very low	43.9	Very low	120 Å²	120	145.4 Å²	145.4	78%	0.779	79%	0.787	S	S	*	*			trans	-59.8	113.5	176	24.9	-33.2	0	0	0	109.4	N256	P254-N256 PolarHBondContact O-N 3.43Å
255	I	38	Very low	43.3	Very low	139 Å²	139	139.8 Å²	139.8	71%	0.713	78%	0.782	S	S	*	*			trans	-68.1	102.5	172.7	-66.2	174.8	0	0	0	107.3	Q253 K257	Q253-I255 PolarHBondContact O-N 3.27Å; I255-K257 HydrophobicContact CG2-CB 4.39Å; I255-K257 HydrophobicContact CG2-CD 4.3Å; I255-K257 HydrophobicContact CG2-CG 3.85Å; I255-K257 PolarHBondContact O-N 2.85Å
256	N	43.5	Very low	42.5	Very low	159 Å²	159	144.9 Å²	144.9	85%	0.85	79%	0.786	S	S	*	*			trans	-62.9	86.6	161.2	-88.2	-21	0	0	0	108.8	P254	P254-N256 PolarHBondContact O-N 3.43Å
257	K	37.3	Very low	41.4	Very low	177 Å²	177	144.2 Å²	144.2	77%	0.77	79%	0.787	S	S	*	*			trans	-90.3	115.1	160.4	-97.3	175.8	179.2	-177.2	0	107.8	I255 Y259	I255-K257 HydrophobicContact CG2-CB 4.39Å; I255-K257 HydrophobicContact CG2-CD 4.3Å; I255-K257 HydrophobicContact CG2-CG 3.85Å; I255-K257 PolarHBondContact O-N 2.85Å; K257-Y259 PolarHBondContact O-N 2.94Å
258	P	36.5	Very low	40	Very low	117 Å²	117	144.1 Å²	144.1	76%	0.76	78%	0.784	S	S	*	*			trans	-57.7	133	169.4	-21.5	33.1	0	0	0	109.7	Q260	P258-Q260 PolarHBondContact O-N 2.86Å; P258-Q260 VanDerWaalsContact O-N 3.11Å
259	Y	37.6	Very low	38.7	Very low	231 Å²	231	145.5 Å²	145.5	91%	0.906	79%	0.785	S	S	*	*			trans	-68.1	107.8	175.8	-138	-94.7	0	0	0	108.6	K257	K257-Y259 PolarHBondContact O-N 2.94Å
260	Q	37.2	Very low	37.9	Very low	175 Å²	175	148.2 Å²	148.2	82%	0.818	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-85.4	131.4	168.2	-81.8	-175	-32.5	0	0	109.2	P258	P258-Q260 PolarHBondContact O-N 2.86Å; P258-Q260 VanDerWaalsContact O-N 3.11Å
261	P	37	Very low	37.2	Very low	106 Å²	106	151.2 Å²	151.2	69%	0.688	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-69.2	148.4	174.3	29.8	-34.2	0	0	0	110.6	T263	P261-T263 PolarHBondContact O-N 2.8Å
262	P	37.8	Very low	36.5	Very low	106 Å²	106	152.1 Å²	152.1	69%	0.688	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-68.9	122.6	-177	27.1	-33.9	0	0	0	111.8	Y264	P262-Y264 PolarHBondContact O-N 3.28Å
263	T	36.3	Very low	36.1	Very low	138 Å²	138	154.1 Å²	154.1	85%	0.847	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-74.4	116.4	168.1	45.1	0	0	0	0	110.6	P261	P261-T263 PolarHBondContact O-N 2.8Å
264	Y	33.9	Very low	35.3	Very low	195 Å²	195	154.7 Å²	154.7	77%	0.765	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-65.7	137.5	168.5	-61.3	-86.3	0	0	0	110.6	P262 R266	P262-Y264 PolarHBondContact O-N 3.28Å; Y264-R266 PolarHBondContact O-N 3.37Å
265	P	35.4	Very low	34.8	Very low	123 Å²	123	157.1 Å²	157.1	80%	0.799	80%	0.797	S	S	*	*			trans	-68.2	115.5	174.8	27.4	-32.7	0	0	0	110.1	L267	P265-L267 PolarHBondContact O-N 3.19Å; P265-L267 VanDerWaalsContact O-N 3.16Å
266	R	32.5	Very low	34.5	Very low	228 Å²	228	159.3 Å²	159.3	86%	0.86	80%	0.804	S	S	*	*			trans	-73.6	103.7	175.8	-165.6	-177.4	-165.4	-162.6	5	109.1	Y264 T268	Y264-R266 PolarHBondContact O-N 3.37Å; R266-T268 PolarHBondContact O-N 3.06Å
267	L	31.3	Very low	33.9	Very low	162 Å²	162	156.2 Å²	156.2	85%	0.848	80%	0.795	S	S	*	*			trans	-62.5	97.6	167.8	-100.2	145.6	0	0	0	109.6	P265 N269	P265-L267 PolarHBondContact O-N 3.19Å; P265-L267 VanDerWaalsContact O-N 3.16Å; L267-N269 PolarHBondContact O-N 3.35Å; L267-N269 VanDerWaalsContact O-N 3.11Å
268	T	30	Very low	33.5	Very low	114 Å²	114	154.3 Å²	154.3	70%	0.699	79%	0.793	S	S	*	*			trans	-73.3	92.3	169.2	32.3	0	0	0	0	110.1	R266 Q270	R266-T268 PolarHBondContact O-N 3.06Å; T268-Q270 PolarHBondContact O-N 3.35Å
269	N	31.5	Very low	33.4	Very low	144 Å²	144	155.8 Å²	155.8	77%	0.77	79%	0.79	S	S	*	*			trans	-72.1	116.6	154.3	-78.7	-10.2	0	0	0	108	L267 I271	L267-N269 PolarHBondContact O-N 3.35Å; L267-N269 VanDerWaalsContact O-N 3.11Å; N269-I271 PolarHBondContact O-N 2.79Å
270	Q	33	Very low	33	Very low	182 Å²	182	153.3 Å²	153.3	85%	0.85	78%	0.784	S	S	*	*			trans	-68.1	118	171.3	-71.1	174.6	-17.8	0	0	109.2	T268	T268-Q270 PolarHBondContact O-N 3.35Å
271	I	32.9	Very low	32.6	Very low	149 Å²	149	150 Å²	150	76%	0.764	78%	0.78	S	S	*	*			trans	-120.4	110.7	153.7	-66.2	178.7	0	0	0	105.6	N269 N273	N269-I271 PolarHBondContact O-N 2.79Å; I271-N273 PolarHBondContact O-N 3.04Å
272	N	32	Very low	32.3	Very low	144 Å²	144	151.6 Å²	151.6	77%	0.77	79%	0.787	S	S	*	*			trans	-59.8	133.4	167.2	-70.4	-22.1	0	0	0	108.4
273	N	33.4	Very low	31.9	Very low	157 Å²	157	154.3 Å²	154.3	84%	0.84	80%	0.796	S	S	*	*			trans	-147.3	126.4	143.7	-93.3	-37.1	0	0	0	108.1	I271	I271-N273 PolarHBondContact O-N 3.04Å
274	E	31.6	Very low	31.9	Very low	183 Å²	183	153.5 Å²	153.5	86%	0.855	79%	0.792	S	S	*	*			trans	-71.4	142.7	177.7	-58.3	162	143.1	0	0	109.3
275	I	32.6	Very low	31.9	Very low	170 Å²	170	151 Å²	151	87%	0.872	80%	0.797	S	S	*	*			trans	-164.4	128.1	136.8	-93.9	143.7	0	0	0	106.1
276	Q	30.7	Very low	31.7	Very low	185 Å²	185	152.9 Å²	152.9	86%	0.864	80%	0.8	S	S	*	*			trans	-116.5	151.4	-175.1	-166.6	175.4	32.8	0	0	108.8
277	S	31.1	Very low	31.9	Very low	95 Å²	95	147.3 Å²	147.3	66%	0.664	79%	0.793	S	S	*	*			trans	67.6	146.7	177.9	-87.5	0	0	0	0	116.6
278	D	29	Very low	32.2	Very low	136 Å²	136	146.2 Å²	146.2	73%	0.727	79%	0.793	S	S	*	*			cis	-148.9	171.6	3.1	-128.6	-50.6	0	0	0	114.4
279	Q	34.9	Very low	32.3	Very low	148 Å²	148	148.6 Å²	148.6	69%	0.692	80%	0.798	S	S	*	*			trans	-78	146.3	-170.1	-45.9	168.5	-7.3	0	0	114.4
280	K	28.4	Very low	32.5	Very low	180 Å²	180	146.7 Å²	146.7	78%	0.783	79%	0.794	S	S	*	*				163.8	159.9	101.4	-105.4	162.2	-175.6	167.9	0	115.9
281	S	28.9	Very low	32.7	Very low	106 Å²	106	144.4 Å²	144.4	74%	0.741	80%	0.798	S	S	*	*			trans	85.5	108.4	153.6	67.5	0	0	0	0	122
282	V	31.2	Very low	32.6	Very low	138 Å²	138	140.3 Å²	140.3	84%	0.836	79%	0.792	S	S	*	*			trans	65.4	113.7	132.5	-171.9	0	0	0	0	119.7
283	L	29.9	Very low	33	Very low	164 Å²	164	140.8 Å²	140.8	86%	0.859	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-89.4	137.2	162.2	-70.4	164.2	0	0	0	110.9
284	P	34.9	Very low	32.7	Very low	120 Å²	120	136.8 Å²	136.8	78%	0.779	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-80.5	143.2	164.2	-5.9	23.7	0	0	0	111.6
285	V	35.4	Very low	32.7	Very low	143 Å²	143	133.3 Å²	133.3	87%	0.867	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-78.4	136	172.6	176.2	0	0	0	0	110.1
286	L	31.4	Very low	33	Very low	162 Å²	162	130.5 Å²	130.5	85%	0.848	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-99.7	144.2	174.3	-158.7	70	0	0	0	110.4
287	P	34.9	Very low	33	Very low	112 Å²	112	126.6 Å²	126.6	73%	0.727	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-76.5	145.9	-164.5	-17.5	32.4	0	0	0	115.8
288	T	38.2	Very low	33.1	Very low	138 Å²	138	127.9 Å²	127.9	85%	0.847	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-70.6	129	164.9	-45.2	0	0	0	0	110.9
289	M	33	Very low	33.5	Very low	164 Å²	164	126 Å²	126	81%	0.808	78%	0.776	S	S	*	*			trans	-144.2	158.2	166.1	-88	-50.1	-92.2	0	0	110.3
290	P	34.9	Very low	33.8	Very low	104 Å²	104	126.8 Å²	126.8	68%	0.675	79%	0.785	S	S	*	*				-98.9	162.3	-129.6	-4	23.5	0	0	0	115.8	G292	P290-G292 PolarHBondContact O-N 3.45Å
291	S	37.4	Very low	34.8	Very low	134 Å²	134	123.2 Å²	123.2	94%	0.937	77%	0.77	S	S	*	*			trans	-58.8	112.8	164.1	-54.4	0	0	0	0	111.2
292	G	30.9	Very low	35.9	Very low	63 Å²	63	123.1 Å²	123.1	65%	0.649	77%	0.766	S	S	*	*			trans	-144.9	94.8	179.3	0	0	0	0	0	112.3	P290	P290-G292 PolarHBondContact O-N 3.45Å
293	T	39.4	Very low	37.7	Very low	154 Å²	154	121.2 Å²	121.2	95%	0.945	76%	0.759	S	S	*	*			trans	6.3	113	157.4	47.2	0	0	0	0	118.4
294	G	28.8	Very low	39.6	Very low	73 Å²	73	114.3 Å²	114.3	75%	0.753	73%	0.728	S	S	*	*			trans	-177.7	52	172.6	0	0	0	0	0	113.2	P296	G294-P296 WeakPolarHBondContact O-CD 3.49Å
295	S	29.7	Very low	42	Very low	111 Å²	111	111.1 Å²	111.1	78%	0.776	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-66.8	118.7	179.3	-161.7	0	0	0	0	110.3	S297	S295-S297 PolarHBondContact O-N 2.95Å
296	P	39.7	Very low	44.7	Very low	111 Å²	111	105.1 Å²	105.1	72%	0.721	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-67.2	130.6	168.9	28.3	-30.6	0	0	0	108.3	G294 T298	G294-P296 WeakPolarHBondContact O-CD 3.49Å; P296-T298 PolarHBondContact O-N 2.61Å
297	S	29.9	Very low	47.6	Very low	102 Å²	102	100.4 Å²	100.4	71%	0.713	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-46.9	119.7	-174.1	50.5	0	0	0	0	113.3	S295 T299	S295-S297 PolarHBondContact O-N 2.95Å; S297-T299 VanDerWaalsContact C-N 3.32Å; S297-T299 PolarHBondContact O-N 3.06Å
298	T	35.1	Very low	50.5	Low	122 Å²	122	95.1 Å²	95.1	75%	0.748	61%	0.607	S	S	*	*			trans	-64.9	89.7	165	49.2	0	0	0	0	109.7	P296 N300	P296-T298 PolarHBondContact O-N 2.61Å; T298-N300 PolarHBondContact O-N 3.34Å
299	T	36.4	Very low	53.2	Low	96 Å²	96	88.6 Å²	88.6	59%	0.589	57%	0.567	S	S	*	*			trans	-73.9	112.6	169.8	46.2	0	0	0	0	109.3	S297 K301	S297-T299 VanDerWaalsContact C-N 3.32Å; S297-T299 PolarHBondContact O-N 3.06Å; T299-K301 PolarHBondContact O-N 3.49Å
300	N	42.4	Very low	56.2	Low	165 Å²	165	81.7 Å²	81.7	88%	0.882	53%	0.533	S	S	*	.			trans	-70.9	41.3	173.4	-70.8	-36	0	0	0	113	T298	T298-N300 PolarHBondContact O-N 3.34Å
301	K	47.8	Very low	59	Low	106 Å²	106	79.8 Å²	79.8	46%	0.461	52%	0.515	S	S	.	.	S	Bend	trans	-98.7	144.6	173	-74	-172.9	170.1	-177.6	0	109.4	T299 S303 D315	T299-K301 PolarHBondContact O-N 3.49Å; K301-S303 PolarHBondContact O-N 3.14Å; K301-D315 VanDerWaalsContact CD-O 3.22Å; K301-D315 WeakPolarHBondContact CD-O 3.45Å; K301-D315 WeakPolarHBondContact CE-O 3.41Å; K301-D315 PolarHBondContact NZ-O 2.89Å
302	P	52.7	Low	61.7	Low	104 Å²	104	73.4 Å²	73.4	68%	0.675	47%	0.471	S	S	*	.			trans	-64.8	125.4	177	26.5	-32.9	0	0	0	110.4	G304	P302-G304 PolarHBondContact O-N 3.26Å
303	S	68.4	Low	64.8	Low	98 Å²	98	72.2 Å²	72.2	69%	0.685	45%	0.449	S	S	*	.			trans	-74.9	66.9	177	-52.2	0	0	0	0	111.6	K301	K301-S303 PolarHBondContact O-N 3.14Å
304	G	69.2	Low	67.4	Low	19 Å²	19	71 Å²	71	20%	0.196	43%	0.433	C	S	.	.			trans	70.1	-173.3	176.8	0	0	0	0	0	114.7	P302	P302-G304 PolarHBondContact O-N 3.26Å
305	P	87.2	Confident	70.4	Confident	52 Å²	52	70.2 Å²	70.2	34%	0.338	41%	0.411	S	S	.	.			cis	-77.4	149.5	0.3	33.3	-36.8	0	0	0	113.3	L324 K326 L333	P305-L324 WeakPolarHBondContact CA-O 3.48Å; P305-K326 HydrophobicContact CB-CB 3.87Å; P305-K326 HydrophobicContact CG-CB 4.1Å; P305-L333 HydrophobicContact CB-CD2 3.51Å; P305-L333 HydrophobicContact CG-CD2 3.89Å
306	W	91.7	Very high	73.4	Confident	17 Å²	17	67 Å²	67	6%	0.064	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-101.6	156.3	176.6	-56.2	-84.3	0	0	0	111.3	D308 Q311 A312 D315 H317 Y323 L324 V325 K326	W306-D308 VanDerWaalsContact C-N 3.31Å; W306-D308 WeakPolarHBondContact CB-O 3.28Å; W306-D308 PolarHBondContact O-N 3.47Å; W306-Q311 HydrophobicContact CB-CB 4.37Å; W306-A312 HydrophobicContact CB-CB 4.32Å; W306-A312 HydrophobicContact CD2-CB 3.8Å; W306-A312 HydrophobicContact CE3-CB 4.34Å; W306-A312 HydrophobicContact CG-CB 3.76Å; W306-D315 PolarHBondContact NE1-OD2 2.92Å; W306-H317 AromaticContact CZ2-CE1 3.56Å; W306-H317 AromaticContact CZ2-ND1 3.92Å; W306-H317 AromaticContact CZ2-NE2 3.75Å; W306-Y323 AromaticContact CE3-CD1 3.9Å; W306-Y323 HydrophobicContact CE3-CD1 3.9Å; W306-Y323 AromaticContact CH2-CD1 3.87Å; W306-Y323 HydrophobicContact CH2-CD1 3.87Å; W306-Y323 HydrophobicContact CH2-CE1 4.32Å; W306-Y323 AromaticContact CZ3-CD1 3.55Å; W306-Y323 HydrophobicContact CZ3-CD1 3.55Å; W306-Y323 HydrophobicContact CZ3-CE1 4.42Å; W306-Y323 HydrophobicContact CZ3-CG 4.35Å; W306-L324 VanDerWaalsContact CE3-O 3.27Å; W306-L324 PolarHBondContact N-O 3.34Å; W306-V325 CarbonylContact O-C 3.6Å; W306-V325 WeakPolarHBondContact O-CA 3.44Å; W306-V325 WeakPolarHBondContact O-CG1 3.28Å; W306-K326 PolarHBondContact O-N 2.92Å
307	K	92.4	Very high	76	Confident	64 Å²	64	63.7 Å²	63.7	28%	0.278	37%	0.371	S	S	.	.	S	Bend	trans	-69.7	-28.5	176.8	78.2	-171.1	-178	-179.7	0	113.7	Q311 V325 K326 E328 Q391	K307-Q311 HydrophobicContact CD-CB 4.48Å; K307-Q311 HydrophobicContact CG-CB 4.07Å; K307-V325 WeakPolarHBondContact O-CG1 3.38Å; K307-K326 WeakPolarHBondContact CA-O 3.37Å; K307-E328 HydrophobicContact CB-CG 4.17Å; K307-E328 WeakPolarHBondContact CD-OE1 3.37Å; K307-Q391 PolarHBondContact O-NE2 3.29Å
308	D	94.4	Very high	79	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.005	37%	0.365	C	S	.	.	S	Bend	trans	-164.8	177.5	-179.7	59	44.8	0	0	0	109.9	W306 L310 Q311 A312 Y394 P518	W306-D308 VanDerWaalsContact C-N 3.31Å; W306-D308 WeakPolarHBondContact CB-O 3.28Å; W306-D308 PolarHBondContact O-N 3.47Å; D308-L310 VanDerWaalsContact C-N 3.29Å; D308-L310 PolarHBondContact O-N 2.55Å; D308-L310 WeakPolarHBondContact OD1-CA 3.37Å; D308-L310 VanDerWaalsContact OD1-CB 3.31Å; D308-L310 WeakPolarHBondContact OD1-CB 3.38Å; D308-L310 PolarHBondContact OD1-N 3.22Å; D308-Q311 PolarHBondContact OD1-N 3.07Å; D308-A312 PolarHBondContact O-N 3.4Å; D308-Y394 PolarHBondContact OD2-OH 3.32Å; D308-P518 WeakPolarHBondContact OD2-CG 3.44Å
309	C	96.1	Very high	81.8	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-70.1	-19.8	177.2	-69.8	0	0	0	0	114.7	L313 C338 Q340 T348	C309-L313 PolarHBondContact O-N 3.14Å; C309-C338 VanDerWaalsContact CA-SG 3.55Å; C309-C338 HydrophobicContact CB-CB 3.62Å; C309-C338 WeakPolarHBondContact CB-SG 3.1Å; C309-C338 WeakPolarHBondContact SG-CA 3.33Å; C309-C338 WeakPolarHBondContact SG-CB 3.5Å; C309-C338 CovalentContact SG-SG 2.03Å; C309-C338 PolarHBondContact SG-SG 2.87Å; C309-Q340 PolarHBondContact O-NE2 3.41Å; C309-T348 WeakPolarHBondContact CB-OG1 3.47Å; C309-T348 PolarHBondContact N-OG1 3.31Å; C309-T348 VanDerWaalsContact SG-CA 3.55Å; C309-T348 PolarHBondContact SG-OG1 2.83Å; C309-T348 VanDerWaalsContact SG-OG1 3.35Å
310	L	95.7	Very high	84.5	Confident	20 Å²	20	57.2 Å²	57.2	11%	0.105	33%	0.334	C	S	.	.	H	α-helix	trans	-74	-42.9	177.8	179.5	63	0	0	0	110.3	D308 A312 L313 E314 R517 P518	D308-L310 VanDerWaalsContact C-N 3.29Å; D308-L310 PolarHBondContact O-N 2.55Å; D308-L310 WeakPolarHBondContact OD1-CA 3.37Å; D308-L310 VanDerWaalsContact OD1-CB 3.31Å; D308-L310 WeakPolarHBondContact OD1-CB 3.38Å; D308-L310 PolarHBondContact OD1-N 3.22Å; L310-A312 VanDerWaalsContact C-N 3.28Å; L310-A312 PolarHBondContact O-N 2.93Å; L310-L313 WeakPolarHBondContact O-CA 3.4Å; L310-L313 WeakPolarHBondContact O-CB 3.33Å; L310-L313 PolarHBondContact O-N 2.94Å; L310-E314 WeakPolarHBondContact O-CG 3.33Å; L310-E314 PolarHBondContact O-N 2.97Å; L310-R517 HydrophobicContact CD2-CG 4.46Å; L310-P518 HydrophobicContact CB-CG 4.32Å; L310-P518 HydrophobicContact CD2-CB 4Å; L310-P518 HydrophobicContact CD2-CG 3.87Å
311	Q	94.6	Very high	86.9	Confident	63 Å²	63	50 Å²	50	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-60.8	-39.1	172.9	-171.6	-176.9	18.6	0	0	111.5	W306 K307 D308 L313 E314 D315	W306-Q311 HydrophobicContact CB-CB 4.37Å; K307-Q311 HydrophobicContact CD-CB 4.48Å; K307-Q311 HydrophobicContact CG-CB 4.07Å; D308-Q311 PolarHBondContact OD1-N 3.07Å; Q311-L313 VanDerWaalsContact C-N 3.27Å; Q311-L313 PolarHBondContact O-N 2.85Å; Q311-E314 PolarHBondContact O-N 3.31Å; Q311-D315 WeakPolarHBondContact O-CB 3.4Å; Q311-D315 PolarHBondContact O-N 3.47Å
312	A	93.9	Very high	89	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-60.1	-38.8	174.2	0	0	0	0	0	112.1	W306 D308 L310 G316 H317 Y323	W306-A312 HydrophobicContact CB-CB 4.32Å; W306-A312 HydrophobicContact CD2-CB 3.8Å; W306-A312 HydrophobicContact CE3-CB 4.34Å; W306-A312 HydrophobicContact CG-CB 3.76Å; D308-A312 PolarHBondContact O-N 3.4Å; L310-A312 VanDerWaalsContact C-N 3.28Å; L310-A312 PolarHBondContact O-N 2.93Å; A312-G316 PolarHBondContact O-N 3.02Å; A312-H317 WeakPolarHBondContact O-CA 3.46Å; A312-H317 WeakPolarHBondContact O-CB 3.49Å; A312-H317 PolarHBondContact O-N 3.3Å; A312-H317 PolarHBondContact O-ND1 3.32Å; A312-H317 VanDerWaalsContact O-ND1 3.13Å; A312-Y323 HydrophobicContact CB-CD1 3.91Å; A312-Y323 HydrophobicContact CB-CE1 4.12Å
313	L	94.9	Very high	90.7	Very high	37 Å²	37	45.7 Å²	45.7	19%	0.194	27%	0.271	C	S	.	.	H	α-helix	trans	-68.7	-43.2	175.9	-176.9	60.8	0	0	0	112.3	C309 L310 Q311 D315 G316 T318 Q340	C309-L313 PolarHBondContact O-N 3.14Å; L310-L313 WeakPolarHBondContact O-CA 3.4Å; L310-L313 WeakPolarHBondContact O-CB 3.33Å; L310-L313 PolarHBondContact O-N 2.94Å; Q311-L313 VanDerWaalsContact C-N 3.27Å; Q311-L313 PolarHBondContact O-N 2.85Å; L313-D315 VanDerWaalsContact C-N 3.31Å; L313-D315 PolarHBondContact O-N 3.13Å; L313-G316 VanDerWaalsContact O-CA 3.32Å; L313-G316 WeakPolarHBondContact O-CA 3.44Å; L313-G316 PolarHBondContact O-N 2.93Å; L313-T318 HydrophobicContact CD1-CG2 3.85Å; L313-Q340 HydrophobicContact CD1-CB 4.31Å
314	E	94.1	Very high	91.8	Very high	130 Å²	130	42.8 Å²	42.8	61%	0.607	25%	0.248	S	C	*	.	H	α-helix	trans	-62.2	-37.9	175.2	-70.1	170.4	168.3	0	0	111.5	L310 Q311 G316	L310-E314 WeakPolarHBondContact O-CG 3.33Å; L310-E314 PolarHBondContact O-N 2.97Å; Q311-E314 PolarHBondContact O-N 3.31Å; E314-G316 PolarHBondContact O-N 3.27Å; E314-G316 VanDerWaalsContact O-N 3.11Å
315	D	93.3	Very high	92.8	Very high	56 Å²	56	42 Å²	42	30%	0.299	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-2.1	169.2	-79.7	-20.2	0	0	0	113.3	K301 W306 Q311 L313	K301-D315 VanDerWaalsContact CD-O 3.22Å; K301-D315 WeakPolarHBondContact CD-O 3.45Å; K301-D315 WeakPolarHBondContact CE-O 3.41Å; K301-D315 PolarHBondContact NZ-O 2.89Å; W306-D315 PolarHBondContact NE1-OD2 2.92Å; Q311-D315 WeakPolarHBondContact O-CB 3.4Å; Q311-D315 PolarHBondContact O-N 3.47Å; L313-D315 VanDerWaalsContact C-N 3.31Å; L313-D315 PolarHBondContact O-N 3.13Å
316	G	92.7	Very high	93	Very high	44 Å²	44	43.7 Å²	43.7	45%	0.454	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.1	10.3	174.5	0	0	0	0	0	115.2	A312 L313 E314 T318	A312-G316 PolarHBondContact O-N 3.02Å; L313-G316 VanDerWaalsContact O-CA 3.32Å; L313-G316 WeakPolarHBondContact O-CA 3.44Å; L313-G316 PolarHBondContact O-N 2.93Å; E314-G316 PolarHBondContact O-N 3.27Å; E314-G316 VanDerWaalsContact O-N 3.11Å; G316-T318 PolarHBondContact O-N 3.43Å; G316-T318 VanDerWaalsContact O-N 3.16Å
317	H	92.5	Very high	92.9	Very high	40 Å²	40	43 Å²	43	19%	0.185	24%	0.238	C	C	.	.			trans	-85.5	85.6	176.9	-55.2	82	0	0	0	110.5	W306 A312 Y323 Q340	W306-H317 AromaticContact CZ2-CE1 3.56Å; W306-H317 AromaticContact CZ2-ND1 3.92Å; W306-H317 AromaticContact CZ2-NE2 3.75Å; A312-H317 WeakPolarHBondContact O-CA 3.46Å; A312-H317 WeakPolarHBondContact O-CB 3.49Å; A312-H317 PolarHBondContact O-N 3.3Å; A312-H317 PolarHBondContact O-ND1 3.32Å; A312-H317 VanDerWaalsContact O-ND1 3.13Å; H317-Y323 HydrophobicContact CB-CE1 3.61Å; H317-Y323 WeakPolarHBondContact CB-OH 3.22Å; H317-Q340 WeakPolarHBondContact O-CG 3.17Å; H317-Q340 PolarHBondContact O-NE2 2.72Å
318	T	93.7	Very high	92.5	Very high	97 Å²	97	45.9 Å²	45.9	60%	0.595	25%	0.253	S	S	*	.			trans	-86.8	-1.9	-174.7	56.9	0	0	0	0	114.8	L313 G316 Q340	L313-T318 HydrophobicContact CD1-CG2 3.85Å; G316-T318 PolarHBondContact O-N 3.43Å; G316-T318 VanDerWaalsContact O-N 3.16Å; T318-Q340 WeakPolarHBondContact O-CB 3.35Å
319	A	93.2	Very high	91.7	Very high	55 Å²	55	51.1 Å²	51.1	46%	0.455	28%	0.281	S	S	.	.	S	Bend	trans	-83.4	134.2	177.7	0	0	0	0	0	110.9	Y323 Q340	A319-Y323 WeakPolarHBondContact O-CE2 3.41Å; A319-Y323 PolarHBondContact O-OH 2.94Å; A319-Q340 VanDerWaalsContact O-CG 3.27Å; A319-Q340 WeakPolarHBondContact O-CG 3.28Å
320	S	94.7	Very high	90.8	Very high	33 Å²	33	51.2 Å²	51.2	23%	0.231	28%	0.282	C	S	.	.			trans	-79.2	139.9	170.5	-49.6	0	0	0	0	110.2	C338 Q340 R341	S320-C338 WeakPolarHBondContact CA-O 3.48Å; S320-C338 WeakPolarHBondContact CB-O 3.37Å; S320-Q340 PolarHBondContact OG-N 3.09Å; S320-R341 WeakPolarHBondContact OG-CG 3.4Å; S320-R341 PolarHBondContact OG-N 2.78Å
321	G	91.4	Very high	89.7	Confident	14 Å²	14	58.2 Å²	58.2	14%	0.144	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.5	-163.4	-174.7	0	0	0	0	0	112.3	Y323 W337 C338	G321-Y323 WeakPolarHBondContact O-CD2 2.98Å; G321-W337 WeakPolarHBondContact O-CA 3.47Å; G321-C338 PolarHBondContact N-O 3.4Å; G321-C338 VanDerWaalsContact N-O 3.16Å; G321-C338 PolarHBondContact O-N 2.87Å
322	M	92.3	Very high	89	Confident	90 Å²	90	59.1 Å²	59.1	44%	0.443	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	133.3	175.6	-67.8	-168.3	-76.2	0	0	112.6	V336 W337 I374 D375	M322-V336 CarbonylContact C-O 3.58Å; M322-V336 WeakPolarHBondContact CA-O 3.25Å; M322-W337 HydrophobicContact CG-CE3 4.4Å; M322-I374 HydrophobicContact CG-CB 4.29Å; M322-I374 HydrophobicContact CG-CG2 3.76Å; M322-I374 HydrophobicContact SD-CB 4.01Å; M322-I374 HydrophobicContact SD-CG2 4.12Å; M322-D375 WeakPolarHBondContact CE-OD2 3.43Å; M322-D375 WeakPolarHBondContact CG-OD1 3.34Å
323	Y	88.9	Confident	88.7	Confident	29 Å²	29	60.6 Å²	60.6	11%	0.114	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	154.3	175.7	-73.1	-101.4	0	0	0	110.6	W306 A312 H317 A319 G321 Q335 V336 C338	W306-Y323 AromaticContact CE3-CD1 3.9Å; W306-Y323 HydrophobicContact CE3-CD1 3.9Å; W306-Y323 AromaticContact CH2-CD1 3.87Å; W306-Y323 HydrophobicContact CH2-CD1 3.87Å; W306-Y323 HydrophobicContact CH2-CE1 4.32Å; W306-Y323 AromaticContact CZ3-CD1 3.55Å; W306-Y323 HydrophobicContact CZ3-CD1 3.55Å; W306-Y323 HydrophobicContact CZ3-CE1 4.42Å; W306-Y323 HydrophobicContact CZ3-CG 4.35Å; A312-Y323 HydrophobicContact CB-CD1 3.91Å; A312-Y323 HydrophobicContact CB-CE1 4.12Å; H317-Y323 HydrophobicContact CB-CE1 3.61Å; H317-Y323 WeakPolarHBondContact CB-OH 3.22Å; A319-Y323 WeakPolarHBondContact O-CE2 3.41Å; A319-Y323 PolarHBondContact O-OH 2.94Å; G321-Y323 WeakPolarHBondContact O-CD2 2.98Å; Y323-Q335 WeakPolarHBondContact O-CA 3.48Å; Y323-V336 PolarHBondContact N-O 2.96Å; Y323-V336 PolarHBondContact O-N 3.34Å; Y323-C338 VanDerWaalsContact CB-SG 3.54Å; Y323-C338 HydrophobicContact CD2-CB 3.53Å; Y323-C338 WeakPolarHBondContact CD2-SG 3.36Å; Y323-C338 HydrophobicContact CE2-CB 3.93Å; Y323-C338 HydrophobicContact CG-CB 4.25Å; Y323-C338 VanDerWaalsContact CG-SG 3.55Å
324	L	91.2	Very high	88.4	Confident	37 Å²	37	59.3 Å²	59.3	19%	0.194	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	112.8	177.6	-168.8	70	0	0	0	110.3	L186 P305 W306 L333 Q335	L186-L324 HydrophobicContact CD1-CD1 4.18Å; P305-L324 WeakPolarHBondContact CA-O 3.48Å; W306-L324 VanDerWaalsContact CE3-O 3.27Å; W306-L324 PolarHBondContact N-O 3.34Å; L324-L333 HydrophobicContact CD1-CB 4.32Å; L324-L333 HydrophobicContact CD1-CD2 4.46Å; L324-L333 HydrophobicContact CD2-CD2 3.96Å; L324-L333 HydrophobicContact CG-CD2 3.92Å; L324-Q335 HydrophobicContact CD1-CG 3.86Å
325	V	91.1	Very high	88.2	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.006	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	143	-175.4	163.3	0	0	0	0	111.3	W306 K307 L333 M334 V336 L388	W306-V325 CarbonylContact O-C 3.6Å; W306-V325 WeakPolarHBondContact O-CA 3.44Å; W306-V325 WeakPolarHBondContact O-CG1 3.28Å; K307-V325 WeakPolarHBondContact O-CG1 3.38Å; V325-L333 WeakPolarHBondContact O-CA 3.34Å; V325-M334 HydrophobicContact CB-CG 4.1Å; V325-M334 HydrophobicContact CG1-CG 4.16Å; V325-M334 HydrophobicContact CG1-SD 4.4Å; V325-M334 PolarHBondContact N-O 2.82Å; V325-M334 WeakPolarHBondContact O-CG 3.37Å; V325-M334 PolarHBondContact O-N 3.1Å; V325-V336 HydrophobicContact CB-CG2 4.08Å; V325-V336 HydrophobicContact CG2-CG2 3.53Å; V325-L388 HydrophobicContact CG1-CD2 3.9Å
326	K	91	Very high	88.3	Confident	89 Å²	89	55 Å²	55	39%	0.387	30%	0.299	S	S	.	.			trans	-133.9	101.9	172	-174.2	-174.9	174.9	-173.9	0	108.9	P305 W306 K307 A330 L333	P305-K326 HydrophobicContact CB-CB 3.87Å; P305-K326 HydrophobicContact CG-CB 4.1Å; W306-K326 PolarHBondContact O-N 2.92Å; K307-K326 WeakPolarHBondContact CA-O 3.37Å; K326-A330 WeakPolarHBondContact CE-O 3.44Å; K326-L333 HydrophobicContact CB-CD2 3.83Å; K326-L333 HydrophobicContact CG-CD2 4.43Å
327	P	89.1	Confident	88.4	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.006	29%	0.288	C	S	.	.			trans	-58.2	144.8	174.6	-21	31.5	0	0	0	111.5	N329 A330 M334 W387 L388	P327-N329 VanDerWaalsContact C-N 3.3Å; P327-N329 PolarHBondContact O-N 3.4Å; P327-A330 HydrophobicContact CB-CB 3.87Å; P327-A330 HydrophobicContact CG-CB 4.1Å; P327-A330 PolarHBondContact O-N 3.42Å; P327-M334 HydrophobicContact CG-CE 3.62Å; P327-M334 HydrophobicContact CG-SD 4.33Å; P327-W387 HydrophobicContact CB-CB 4.14Å; P327-W387 HydrophobicContact CG-CB 4.06Å; P327-L388 HydrophobicContact CG-CD2 3.9Å; P327-L388 HydrophobicContact CG-CG 4.07Å
328	E	83.4	Confident	88.6	Confident	126 Å²	126	53.8 Å²	53.8	59%	0.589	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-41.7	-170.5	-66.4	177.8	-174.3	0	0	112.7	K307	K307-E328 HydrophobicContact CB-CG 4.17Å; K307-E328 WeakPolarHBondContact CD-OE1 3.37Å
329	N	78.6	Confident	88.8	Confident	110 Å²	110	50.9 Å²	50.9	59%	0.588	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	2.1	-179.7	-65.3	-38.6	0	0	0	113.9	P327 W387	P327-N329 VanDerWaalsContact C-N 3.3Å; P327-N329 PolarHBondContact O-N 3.4Å; N329-W387 HydrophobicContact CB-CE3 4.26Å; N329-W387 HydrophobicContact CB-CZ3 4.18Å; N329-W387 WeakPolarHBondContact O-CZ3 3.45Å
330	A	77.6	Confident	88.8	Confident	2 Å²	2	49 Å²	49	2%	0.017	24%	0.241	C	C	.	.			trans	-109.6	129.9	-175.7	0	0	0	0	0	112.4	K326 P327 R332 W387	K326-A330 WeakPolarHBondContact CE-O 3.44Å; P327-A330 HydrophobicContact CB-CB 3.87Å; P327-A330 HydrophobicContact CG-CB 4.1Å; P327-A330 PolarHBondContact O-N 3.42Å; A330-R332 PolarHBondContact O-N 3.08Å; A330-W387 HydrophobicContact CB-CB 3.95Å; A330-W387 HydrophobicContact CB-CD2 3.95Å; A330-W387 HydrophobicContact CB-CE3 4.22Å; A330-W387 HydrophobicContact CB-CG 3.8Å
331	N	72.3	Confident	88.7	Confident	167 Å²	167	57.2 Å²	57.2	89%	0.893	27%	0.268	S	S	*	.	S	Bend	trans	-77.7	10.2	170.1	-74.1	-29.1	0	0	0	113.4
332	R	78.6	Confident	88.7	Confident	82 Å²	82	60.5 Å²	60.5	31%	0.309	28%	0.279	S	S	.	.			trans	-113.7	129.1	-174.6	-167.9	175.8	-170.3	171.3	4.3	111.7	A330	A330-R332 PolarHBondContact O-N 3.08Å
333	L	87.5	Confident	88.6	Confident	33 Å²	33	62.9 Å²	62.9	17%	0.173	29%	0.294	C	S	.	.			trans	-81.9	138.6	165.8	-74.4	159.1	0	0	0	109.5	L186 P305 L324 V325 K326	L186-L333 HydrophobicContact CD1-CB 4.12Å; L186-L333 HydrophobicContact CD1-CD1 4.28Å; L186-L333 HydrophobicContact CD2-CB 4.05Å; L186-L333 HydrophobicContact CG-CB 4.34Å; L186-L333 HydrophobicContact CG-CD1 4.45Å; P305-L333 HydrophobicContact CB-CD2 3.51Å; P305-L333 HydrophobicContact CG-CD2 3.89Å; L324-L333 HydrophobicContact CD1-CB 4.32Å; L324-L333 HydrophobicContact CD1-CD2 4.46Å; L324-L333 HydrophobicContact CD2-CD2 3.96Å; L324-L333 HydrophobicContact CG-CD2 3.92Å; V325-L333 WeakPolarHBondContact O-CA 3.34Å; K326-L333 HydrophobicContact CB-CD2 3.83Å; K326-L333 HydrophobicContact CG-CD2 4.43Å
334	M	89.1	Confident	88.7	Confident	10 Å²	10	64.3 Å²	64.3	5%	0.049	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	142.3	177.1	61	-175.2	70.9	0	0	110.3	V325 P327 V336 N384 L388	V325-M334 HydrophobicContact CB-CG 4.1Å; V325-M334 HydrophobicContact CG1-CG 4.16Å; V325-M334 HydrophobicContact CG1-SD 4.4Å; V325-M334 PolarHBondContact N-O 2.82Å; V325-M334 WeakPolarHBondContact O-CG 3.37Å; V325-M334 PolarHBondContact O-N 3.1Å; P327-M334 HydrophobicContact CG-CE 3.62Å; P327-M334 HydrophobicContact CG-SD 4.33Å; M334-V336 HydrophobicContact CG-CG1 4.17Å; M334-V336 HydrophobicContact SD-CG1 4.37Å; M334-N384 HydrophobicContact CE-CB 3.65Å; M334-N384 HydrophobicContact SD-CB 3.85Å; M334-L388 HydrophobicContact SD-CD1 3.75Å; M334-L388 HydrophobicContact SD-CD2 4.46Å; M334-L388 HydrophobicContact SD-CG 4.01Å
335	Q	90.8	Very high	88.9	Confident	95 Å²	95	62.7 Å²	62.7	44%	0.444	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	135.2	170.9	-66.3	179.4	88.4	0	0	108.5	Y323 L324 I374	Y323-Q335 WeakPolarHBondContact O-CA 3.48Å; L324-Q335 HydrophobicContact CD1-CG 3.86Å; Q335-I374 HydrophobicContact CB-CD1 3.31Å; Q335-I374 WeakPolarHBondContact O-CD1 3.46Å
336	V	94.6	Very high	89.1	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	151.4	-178.4	-64	0	0	0	0	110.7	M322 Y323 V325 M334 T348 L380	M322-V336 CarbonylContact C-O 3.58Å; M322-V336 WeakPolarHBondContact CA-O 3.25Å; Y323-V336 PolarHBondContact N-O 2.96Å; Y323-V336 PolarHBondContact O-N 3.34Å; V325-V336 HydrophobicContact CB-CG2 4.08Å; V325-V336 HydrophobicContact CG2-CG2 3.53Å; M334-V336 HydrophobicContact CG-CG1 4.17Å; M334-V336 HydrophobicContact SD-CG1 4.37Å; V336-T348 HydrophobicContact CB-CG2 3.97Å; V336-T348 HydrophobicContact CG1-CG2 3.88Å; V336-T348 HydrophobicContact CG2-CG2 4.19Å; V336-L380 HydrophobicContact CG1-CD1 3.81Å; V336-L380 HydrophobicContact CG1-CD2 3.97Å
337	W	95.9	Very high	89.4	Confident	58 Å²	58	58.5 Å²	58.5	22%	0.22	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	119.6	164.6	-175.5	-80.5	0	0	0	109.5	G321 M322 V349 R352 I374 D375 Y378	G321-W337 WeakPolarHBondContact O-CA 3.47Å; M322-W337 HydrophobicContact CG-CE3 4.4Å; W337-V349 HydrophobicContact CB-CB 4.32Å; W337-V349 WeakPolarHBondContact O-CB 3.32Å; W337-V349 PolarHBondContact O-N 3.11Å; W337-R352 VanDerWaalsContact CG-NH1 3.29Å; W337-I374 HydrophobicContact CB-CG2 3.94Å; W337-D375 VanDerWaalsContact CZ3-OD1 3.3Å; W337-D375 WeakPolarHBondContact CZ3-OD1 3.24Å; W337-Y378 HydrophobicContact CB-CE1 4.21Å; W337-Y378 WeakPolarHBondContact CB-OH 3.4Å; W337-Y378 PolarHBondContact N-OH 3.02Å
338	C	96.3	Very high	89.9	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	124.4	171.2	-61.8	0	0	0	0	110.4	C309 S320 G321 Y323 Q340 W347	C309-C338 VanDerWaalsContact CA-SG 3.55Å; C309-C338 HydrophobicContact CB-CB 3.62Å; C309-C338 WeakPolarHBondContact CB-SG 3.1Å; C309-C338 WeakPolarHBondContact SG-CA 3.33Å; C309-C338 WeakPolarHBondContact SG-CB 3.5Å; C309-C338 CovalentContact SG-SG 2.03Å; C309-C338 PolarHBondContact SG-SG 2.87Å; S320-C338 WeakPolarHBondContact CA-O 3.48Å; S320-C338 WeakPolarHBondContact CB-O 3.37Å; G321-C338 PolarHBondContact N-O 3.4Å; G321-C338 VanDerWaalsContact N-O 3.16Å; G321-C338 PolarHBondContact O-N 2.87Å; Y323-C338 VanDerWaalsContact CB-SG 3.54Å; Y323-C338 HydrophobicContact CD2-CB 3.53Å; Y323-C338 WeakPolarHBondContact CD2-SG 3.36Å; Y323-C338 HydrophobicContact CE2-CB 3.93Å; Y323-C338 HydrophobicContact CG-CB 4.25Å; Y323-C338 VanDerWaalsContact CG-SG 3.55Å; C338-Q340 HydrophobicContact CB-CG 4.22Å; C338-W347 CarbonylContact C-O 3.59Å; C338-W347 WeakPolarHBondContact CA-O 3.41Å
339	D	96.9	Very high	90.6	Very high	37 Å²	37	52.6 Å²	52.6	20%	0.198	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	104.4	163.7	-164.3	-24.7	0	0	0	109.6	R341 H342 G346 W347	D339-R341 PolarHBondContact OD1-N 2.82Å; D339-H342 PolarHBondContact OD1-N 2.94Å; D339-G346 PolarHBondContact O-N 3.13Å; D339-W347 HydrophobicContact CB-CB 4.21Å; D339-W347 PolarHBondContact N-O 3.19Å; D339-W347 PolarHBondContact O-N 3.44Å; D339-W347 VanDerWaalsContact O-N 3.13Å
340	Q	94.8	Very high	91.5	Very high	14 Å²	14	47.4 Å²	47.4	7%	0.065	23%	0.225	C	C	.	.			trans	-96.5	-3.1	178.9	-53.3	-61.1	34.7	0	0	112.5	C309 L313 H317 T318 A319 S320 C338	C309-Q340 PolarHBondContact O-NE2 3.41Å; L313-Q340 HydrophobicContact CD1-CB 4.31Å; H317-Q340 WeakPolarHBondContact O-CG 3.17Å; H317-Q340 PolarHBondContact O-NE2 2.72Å; T318-Q340 WeakPolarHBondContact O-CB 3.35Å; A319-Q340 VanDerWaalsContact O-CG 3.27Å; A319-Q340 WeakPolarHBondContact O-CG 3.28Å; S320-Q340 PolarHBondContact OG-N 3.09Å; C338-Q340 HydrophobicContact CB-CG 4.22Å
341	R	92.4	Very high	92.5	Very high	207 Å²	207	47.3 Å²	47.3	78%	0.781	22%	0.224	S	C	*	.	S	Bend	trans	-106.4	-28.3	-175.5	-70	178.6	-177.8	-151.6	4.5	113	S320 D339 D343	S320-R341 WeakPolarHBondContact OG-CG 3.4Å; S320-R341 PolarHBondContact OG-N 2.78Å; D339-R341 PolarHBondContact OD1-N 2.82Å; R341-D343 PolarHBondContact O-N 3.04Å
342	H	90.6	Very high	93.8	Very high	82 Å²	82	40.4 Å²	40.4	38%	0.38	19%	0.185	S	C	.	.	S	Bend	trans	-72.7	111.4	174.1	-163.5	85.1	0	0	0	109.9	D339 G345 W347	D339-H342 PolarHBondContact OD1-N 2.94Å; H342-G345 WeakPolarHBondContact O-CA 3.47Å; H342-G345 PolarHBondContact O-N 3.01Å; H342-W347 AromaticContact CD2-NE1 3.95Å; H342-W347 PolarHBondContact O-NE1 2.65Å
343	D	89.2	Confident	94.7	Very high	141 Å²	141	36.7 Å²	36.7	75%	0.754	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48	135.1	-176.7	-173.2	68.8	0	0	0	112.3	R341 W347	R341-D343 PolarHBondContact O-N 3.04Å; D343-W347 PolarHBondContact O-NE1 2.83Å
344	P	92.4	Very high	95.1	Very high	59 Å²	59	38 Å²	38	38%	0.383	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	cis	-88.4	19.7	-0.2	38.5	-39.3	0	0	0	114.7
345	G	94.2	Very high	95.4	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.021	19%	0.191	C	C	.	.			trans	72.8	176.9	-172.9	0	0	0	0	0	113.6	H342 R517	H342-G345 WeakPolarHBondContact O-CA 3.47Å; H342-G345 PolarHBondContact O-N 3.01Å; G345-R517 WeakPolarHBondContact O-CD 3.35Å; G345-R517 PolarHBondContact O-NE 2.89Å
346	G	96.3	Very high	95.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.187	C	C	.	.			trans	81.3	23.6	179.6	0	0	0	0	0	113.6	D339	D339-G346 PolarHBondContact O-N 3.13Å
347	W	98	Very high	95.6	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.008	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	120	-175.6	-67.1	106.9	0	0	0	111.9	C338 D339 H342 D343 K395 L397 M515 R517	C338-W347 CarbonylContact C-O 3.59Å; C338-W347 WeakPolarHBondContact CA-O 3.41Å; D339-W347 HydrophobicContact CB-CB 4.21Å; D339-W347 PolarHBondContact N-O 3.19Å; D339-W347 PolarHBondContact O-N 3.44Å; D339-W347 VanDerWaalsContact O-N 3.13Å; H342-W347 AromaticContact CD2-NE1 3.95Å; H342-W347 PolarHBondContact O-NE1 2.65Å; D343-W347 PolarHBondContact O-NE1 2.83Å; W347-K395 HydrophobicContact CH2-CD 4.13Å; W347-K395 VanDerWaalsContact CH2-CE 3.45Å; W347-K395 HydrophobicContact CH2-CG 4.2Å; W347-K395 HydrophobicContact CZ3-CG 4.25Å; W347-L397 HydrophobicContact CD2-CD2 4.47Å; W347-L397 HydrophobicContact CE3-CB 4.19Å; W347-L397 HydrophobicContact CH2-CB 3.43Å; W347-L397 VanDerWaalsContact CH2-CB 3.43Å; W347-L397 HydrophobicContact CH2-CD2 3.81Å; W347-L397 HydrophobicContact CH2-CG 4.22Å; W347-L397 HydrophobicContact CZ2-CB 4.13Å; W347-L397 HydrophobicContact CZ2-CD2 3.59Å; W347-L397 HydrophobicContact CZ2-CG 4.48Å; W347-L397 HydrophobicContact CZ3-CB 3.47Å; W347-L397 VanDerWaalsContact CZ3-CB 3.47Å; W347-L397 HydrophobicContact CZ3-CD2 4.35Å; W347-M515 HydrophobicContact CB-CB 4.16Å; W347-M515 HydrophobicContact CB-CG 4.08Å; W347-M515 HydrophobicContact CB-SD 3.66Å; W347-M515 HydrophobicContact CD2-CG 3.91Å; W347-M515 HydrophobicContact CD2-SD 3.83Å; W347-M515 HydrophobicContact CE3-CB 4.28Å; W347-M515 HydrophobicContact CE3-CG 3.61Å; W347-M515 HydrophobicContact CE3-SD 4.18Å; W347-M515 HydrophobicContact CG-CG 4.15Å; W347-M515 HydrophobicContact CG-SD 3.62Å; W347-M515 HydrophobicContact CZ3-CG 4.28Å; W347-R517 HydrophobicContact CD2-CB 4.02Å; W347-R517 HydrophobicContact CE3-CB 3.44Å; W347-R517 VanDerWaalsContact CE3-CB 3.44Å; W347-R517 HydrophobicContact CH2-CB 4.29Å; W347-R517 HydrophobicContact CZ3-CB 3.6Å
348	T	98	Very high	95.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	110.9	170.1	-51.1	0	0	0	0	109.2	C309 V336 I350 L388 M515 I516	C309-T348 WeakPolarHBondContact CB-OG1 3.47Å; C309-T348 PolarHBondContact N-OG1 3.31Å; C309-T348 VanDerWaalsContact SG-CA 3.55Å; C309-T348 PolarHBondContact SG-OG1 2.83Å; C309-T348 VanDerWaalsContact SG-OG1 3.35Å; V336-T348 HydrophobicContact CB-CG2 3.97Å; V336-T348 HydrophobicContact CG1-CG2 3.88Å; V336-T348 HydrophobicContact CG2-CG2 4.19Å; T348-I350 PolarHBondContact O-N 2.84Å; T348-L388 HydrophobicContact CG2-CD1 4.16Å; T348-M515 CarbonylContact O-C 3.57Å; T348-M515 VanDerWaalsContact O-CA 3.26Å; T348-M515 WeakPolarHBondContact O-CA 3.38Å; T348-I516 PolarHBondContact N-O 3.34Å; T348-I516 PolarHBondContact O-N 2.98Å
349	V	98.3	Very high	95.6	Very high	4 Å²	4	44 Å²	44	2%	0.024	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	125.9	177.3	178.6	0	0	0	0	109.6	W337 R352 Y378 M515	W337-V349 HydrophobicContact CB-CB 4.32Å; W337-V349 WeakPolarHBondContact O-CB 3.32Å; W337-V349 PolarHBondContact O-N 3.11Å; V349-R352 HydrophobicContact CG1-CB 4.25Å; V349-Y378 VanDerWaalsContact CB-OH 3.28Å; V349-Y378 WeakPolarHBondContact CB-OH 3.3Å; V349-Y378 HydrophobicContact CG1-CE1 4.22Å; V349-Y378 WeakPolarHBondContact CG1-OH 3.24Å; V349-Y378 PolarHBondContact O-OH 2.82Å; V349-M515 HydrophobicContact CG2-CB 4.06Å
350	I	98.5	Very high	95.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-22	-178.1	63.2	166	0	0	0	113.1	T348 L380 I385 L396 F415 M514 I516	T348-I350 PolarHBondContact O-N 2.84Å; I350-L380 HydrophobicContact CB-CB 4.37Å; I350-L380 HydrophobicContact CB-CD2 4.43Å; I350-L380 HydrophobicContact CG2-CD2 3.93Å; I350-L380 WeakPolarHBondContact O-CB 3.45Å; I350-L380 PolarHBondContact O-N 3.09Å; I350-I385 HydrophobicContact CB-CD1 4.01Å; I350-I385 HydrophobicContact CB-CG1 4.02Å; I350-I385 HydrophobicContact CD1-CD1 4.26Å; I350-I385 HydrophobicContact CD1-CG2 4.33Å; I350-I385 HydrophobicContact CG2-CG1 4.06Å; I350-L396 HydrophobicContact CD1-CD1 4.32Å; I350-F415 HydrophobicContact CD1-CE1 3.85Å; I350-F415 HydrophobicContact CD1-CZ 3.87Å; I350-M514 HydrophobicContact CD1-CB 4.25Å; I350-M514 HydrophobicContact CG1-CB 3.78Å; I350-M514 WeakPolarHBondContact CG1-O 3.38Å; I350-M514 PolarHBondContact N-O 3.26Å; I350-I516 HydrophobicContact CD1-CG2 3.91Å; I350-I516 HydrophobicContact CG1-CG2 4.45Å; I350-I516 HydrophobicContact CG2-CD1 3.89Å; I350-I516 HydrophobicContact CG2-CG1 3.87Å; I350-I516 HydrophobicContact CG2-CG2 4.33Å
351	Q	98.6	Very high	95.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	140.7	175.3	-170	-97.6	38.4	0	0	109.6	F360 Y378 W379 L479 N480 S513 M514	Q351-F360 HydrophobicContact CG-CE1 4.18Å; Q351-Y378 WeakPolarHBondContact CA-O 3.29Å; Q351-W379 HydrophobicContact CB-CE3 3.86Å; Q351-W379 HydrophobicContact CB-CZ3 4.08Å; Q351-W379 HydrophobicContact CG-CE3 3.71Å; Q351-W379 HydrophobicContact CG-CZ3 4.12Å; Q351-L479 PolarHBondContact NE2-O 3.17Å; Q351-N480 WeakPolarHBondContact CG-OD1 3.48Å; Q351-N480 PolarHBondContact NE2-OD1 2.78Å; Q351-S513 WeakPolarHBondContact O-CA 3.38Å; Q351-M514 HydrophobicContact CB-CB 3.95Å; Q351-M514 HydrophobicContact CB-CG 4.09Å; Q351-M514 HydrophobicContact CB-SD 4.01Å; Q351-M514 HydrophobicContact CG-SD 4.4Å; Q351-M514 PolarHBondContact N-O 2.86Å; Q351-M514 PolarHBondContact O-N 3.37Å
352	R	98.4	Very high	96	Very high	22 Å²	22	39.8 Å²	39.8	8%	0.083	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	133.5	172.2	-173.1	162.3	64.8	-148.2	-3.2	112.4	W337 V349 I374 D375 G376 E377 Y378 V512	W337-R352 VanDerWaalsContact CG-NH1 3.29Å; V349-R352 HydrophobicContact CG1-CB 4.25Å; R352-I374 PolarHBondContact NH2-O 2.74Å; R352-D375 PolarHBondContact NH2-O 3.42Å; R352-G376 VanDerWaalsContact CZ-O 3.27Å; R352-G376 PolarHBondContact NE-O 2.77Å; R352-G376 PolarHBondContact NH2-O 3.02Å; R352-E377 VanDerWaalsContact O-CA 3.29Å; R352-E377 WeakPolarHBondContact O-CA 3.38Å; R352-E377 WeakPolarHBondContact O-CB 3.4Å; R352-Y378 HydrophobicContact CB-CD1 4.44Å; R352-Y378 HydrophobicContact CB-CE1 4.46Å; R352-Y378 PolarHBondContact N-O 3.04Å; R352-Y378 PolarHBondContact O-N 3Å; R352-V512 WeakPolarHBondContact CA-O 3.36Å
353	R	98.3	Very high	96.3	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.015	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.8	170.2	-45.5	-58.2	-62.7	-85.5	8.9	109.5	E377 L479 G481 V497 R511 V512	R353-E377 WeakPolarHBondContact CA-OE1 3.46Å; R353-E377 IonicContact NE-OE1 3.65Å; R353-E377 IonicContact NE-OE2 2.7Å; R353-L479 WeakPolarHBondContact CG-O 3.26Å; R353-L479 PolarHBondContact NH1-O 2.9Å; R353-G481 PolarHBondContact NH1-O 3.03Å; R353-G481 PolarHBondContact NH2-O 3.32Å; R353-V497 HydrophobicContact CG-CG1 4.32Å; R353-V497 VanDerWaalsContact NH1-CG2 3.31Å; R353-R511 CarbonylContact O-C 3.58Å; R353-R511 VanDerWaalsContact O-CA 3.26Å; R353-R511 WeakPolarHBondContact O-CA 3.3Å; R353-V512 HydrophobicContact CB-CB 4.11Å; R353-V512 HydrophobicContact CG-CB 4.19Å; R353-V512 PolarHBondContact N-O 2.85Å; R353-V512 PolarHBondContact O-N 3.3Å; R353-V512 VanDerWaalsContact O-O 3.1Å
354	Q	95.5	Very high	96.7	Very high	60 Å²	60	31.6 Å²	31.6	28%	0.28	17%	0.174	S	C	.	.	S	Bend	trans	-158.7	-24.1	-178.4	70.6	-175.6	13.4	0	0	115.9	E377 K510 R511	Q354-E377 HydrophobicContact CG-CG 3.95Å; Q354-E377 PolarHBondContact N-OE1 2.87Å; Q354-K510 CarbonylContact C-O 3.54Å; Q354-K510 WeakPolarHBondContact CA-O 3.41Å; Q354-R511 HydrophobicContact CB-CG 4.13Å
355	D	95.3	Very high	97	Very high	67 Å²	67	32.7 Å²	32.7	36%	0.358	17%	0.174	S	C	.	.	S	Bend	trans	-150.8	-9.1	-166.7	56.5	33.4	0	0	0	115.2	S357 E377 W483	D355-S357 VanDerWaalsContact C-N 3.27Å; D355-S357 PolarHBondContact O-N 3.43Å; D355-S357 WeakPolarHBondContact OD1-CB 3.46Å; D355-S357 PolarHBondContact OD1-N 3.2Å; D355-S357 PolarHBondContact OD1-OG 3Å; D355-E377 PolarHBondContact N-OE1 3.29Å; D355-E377 WeakPolarHBondContact OD1-CG 3.34Å; D355-W483 VanDerWaalsContact O-CZ3 3.28Å; D355-W483 WeakPolarHBondContact O-CZ3 3.48Å
356	G	94.6	Very high	97.2	Very high	35 Å²	35	34.6 Å²	34.6	36%	0.361	19%	0.185	S	C	.	.	S	Bend	trans	72.1	14.7	-177.4	0	0	0	0	0	114.8	V358 E377	G356-V358 PolarHBondContact O-N 3.31Å; G356-E377 WeakPolarHBondContact CA-OE2 3.44Å; G356-E377 VanDerWaalsContact N-CD 3.32Å; G356-E377 PolarHBondContact N-OE1 2.72Å; G356-E377 PolarHBondContact N-OE2 3.13Å
357	S	94.4	Very high	97.3	Very high	82 Å²	82	34.6 Å²	34.6	57%	0.573	19%	0.185	S	C	*	.			trans	-64.9	-24.7	179	57.4	0	0	0	0	113.5	D355 E377	D355-S357 VanDerWaalsContact C-N 3.27Å; D355-S357 PolarHBondContact O-N 3.43Å; D355-S357 WeakPolarHBondContact OD1-CB 3.46Å; D355-S357 PolarHBondContact OD1-N 3.2Å; D355-S357 PolarHBondContact OD1-OG 3Å; S357-E377 PolarHBondContact N-OE2 3.22Å
358	V	96.4	Very high	97.3	Very high	24 Å²	24	36.2 Å²	36.2	15%	0.145	19%	0.192	C	C	.	.	S	Bend	trans	-113	131.3	-179.4	176	0	0	0	0	110.5	G356 F360 F371 E377	G356-V358 PolarHBondContact O-N 3.31Å; V358-F360 HydrophobicContact CB-CD2 4.43Å; V358-F360 HydrophobicContact CB-CE2 4Å; V358-F360 HydrophobicContact CG1-CD2 4.14Å; V358-F360 HydrophobicContact CG1-CE2 3.88Å; V358-F360 WeakPolarHBondContact O-CD2 3.28Å; V358-F371 HydrophobicContact CG1-CD2 3.71Å; V358-F371 HydrophobicContact CG1-CE2 3.87Å; V358-E377 HydrophobicContact CB-CB 3.93Å; V358-E377 HydrophobicContact CG2-CB 3.96Å; V358-E377 WeakPolarHBondContact CG2-O 3.48Å; V358-E377 PolarHBondContact N-OE2 3.48Å
359	N	95.8	Very high	97.2	Very high	82 Å²	82	39.4 Å²	39.4	44%	0.439	21%	0.207	S	C	.	.			trans	-78.4	123.1	171.9	175.5	17	0	0	0	110.1	F361 R362	N359-F361 WeakPolarHBondContact OD1-CB 3.47Å; N359-F361 PolarHBondContact OD1-N 3.16Å; N359-R362 PolarHBondContact O-NE 2.92Å
360	F	98.1	Very high	97.1	Very high	3 Å²	3	40.4 Å²	40.4	1%	0.013	22%	0.218	C	C	.	.			trans	-97.4	-5.4	177.4	-80.4	-113.5	0	0	0	113.6	Q351 V358 R362 Y367 F371 E377 W379 N480	Q351-F360 HydrophobicContact CG-CE1 4.18Å; V358-F360 HydrophobicContact CB-CD2 4.43Å; V358-F360 HydrophobicContact CB-CE2 4Å; V358-F360 HydrophobicContact CG1-CD2 4.14Å; V358-F360 HydrophobicContact CG1-CE2 3.88Å; V358-F360 WeakPolarHBondContact O-CD2 3.28Å; F360-R362 VanDerWaalsContact C-N 3.27Å; F360-R362 PolarHBondContact O-N 3.02Å; F360-Y367 WeakPolarHBondContact O-CE2 3.21Å; F360-Y367 PolarHBondContact O-OH 3.44Å; F360-F371 HydrophobicContact CB-CE2 4.43Å; F360-F371 HydrophobicContact CB-CZ 4.34Å; F360-F371 AromaticContact CD1-CE2 3.88Å; F360-F371 HydrophobicContact CD1-CE2 3.88Å; F360-F371 AromaticContact CD1-CZ 3.63Å; F360-F371 HydrophobicContact CD1-CZ 3.63Å; F360-F371 AromaticContact CD2-CE2 4Å; F360-F371 HydrophobicContact CD2-CE2 4Å; F360-F371 HydrophobicContact CE1-CE2 4.06Å; F360-F371 HydrophobicContact CE1-CZ 4.01Å; F360-F371 HydrophobicContact CE2-CE2 4.17Å; F360-F371 AromaticContact CG-CE2 3.84Å; F360-F371 HydrophobicContact CG-CE2 3.84Å; F360-F371 AromaticContact CG-CZ 3.92Å; F360-F371 HydrophobicContact CG-CZ 3.92Å; F360-F371 HydrophobicContact CZ-CE2 4.2Å; F360-E377 HydrophobicContact CE2-CB 4.25Å; F360-W379 HydrophobicContact CE1-CB 4.12Å; F360-N480 WeakPolarHBondContact CB-O 3.43Å; F360-N480 HydrophobicContact CD1-CB 4.13Å
361	F	97.8	Very high	97	Very high	72 Å²	72	41.8 Å²	41.8	32%	0.316	22%	0.224	S	C	.	.			trans	-76	82.7	170	-169.8	-129.3	0	0	0	109.6	N359 L450 K466	N359-F361 WeakPolarHBondContact OD1-CB 3.47Å; N359-F361 PolarHBondContact OD1-N 3.16Å; F361-L450 HydrophobicContact CD1-CD2 4.25Å; F361-L450 HydrophobicContact CD2-CB 4.4Å; F361-L450 HydrophobicContact CD2-CD2 3.92Å; F361-L450 HydrophobicContact CE1-CD2 4.07Å; F361-L450 HydrophobicContact CE2-CB 3.58Å; F361-L450 HydrophobicContact CE2-CD2 3.75Å; F361-L450 HydrophobicContact CE2-CG 4.31Å; F361-L450 HydrophobicContact CG-CD2 4.18Å; F361-L450 HydrophobicContact CZ-CB 3.82Å; F361-L450 HydrophobicContact CZ-CD2 3.82Å; F361-L450 HydrophobicContact CZ-CG 4.39Å; F361-K466 WeakPolarHBondContact CA-O 3.42Å; F361-K466 VanDerWaalsContact CB-O 3.3Å; F361-K466 WeakPolarHBondContact CB-O 3.32Å; F361-K466 HydrophobicContact CD2-CB 4.11Å; F361-K466 HydrophobicContact CD2-CD 4.4Å; F361-K466 WeakPolarHBondContact CD2-O 3.36Å; F361-K466 HydrophobicContact CE2-CD 4.2Å; F361-K466 HydrophobicContact CG-CB 4.44Å; F361-K466 HydrophobicContact CZ-CD 4.41Å
362	R	97.4	Very high	96.9	Very high	95 Å²	95	44.1 Å²	44.1	36%	0.358	25%	0.249	S	C	.	.			trans	-126.5	161.5	-172.2	-57.6	-58.4	-174.5	-173.5	12.6	111.8	N359 F360 T366 Y367 F371 L450	N359-R362 PolarHBondContact O-NE 2.92Å; F360-R362 VanDerWaalsContact C-N 3.27Å; F360-R362 PolarHBondContact O-N 3.02Å; R362-T366 HydrophobicContact CB-CG2 3.95Å; R362-T366 HydrophobicContact CG-CG2 3.98Å; R362-Y367 HydrophobicContact CB-CD2 3.92Å; R362-Y367 HydrophobicContact CB-CE2 3.77Å; R362-F371 HydrophobicContact CB-CE1 4.46Å; R362-F371 HydrophobicContact CG-CD2 4.41Å; R362-F371 HydrophobicContact CG-CE1 4.21Å; R362-F371 HydrophobicContact CG-CE2 4.13Å; R362-F371 HydrophobicContact CG-CZ 4.01Å; R362-L450 WeakPolarHBondContact O-CD2 3.21Å
363	N	96.9	Very high	96.6	Very high	50 Å²	50	47.3 Å²	47.3	27%	0.267	27%	0.267	S	S	.	.			trans	-83.3	173.8	179.3	79.8	-25.1	0	0	0	112.1	E365 T366 Y367 D451	N363-E365 PolarHBondContact O-N 3.09Å; N363-T366 PolarHBondContact O-N 2.87Å; N363-T366 WeakPolarHBondContact OD1-CB 3.44Å; N363-T366 PolarHBondContact OD1-N 3.01Å; N363-T366 VanDerWaalsContact OD1-N 3.16Å; N363-T366 PolarHBondContact OD1-OG1 2.8Å; N363-Y367 PolarHBondContact O-N 2.89Å; N363-Y367 VanDerWaalsContact O-N 3.14Å; N363-D451 WeakPolarHBondContact CA-OD1 3.36Å; N363-D451 HydrophobicContact CB-CB 4.48Å; N363-D451 WeakPolarHBondContact CB-OD2 3.07Å
364	W	98.3	Very high	96.2	Very high	1 Å²	1	48.7 Å²	48.7	0%	0.004	28%	0.275	C	S	.	.	H	α-helix	trans	-54.1	-52.8	-177.3	-176.5	-91.1	0	0	0	113	T366 Y367 K368 E420 F423 Y424 F447 T449 D451 R452 H454	W364-T366 VanDerWaalsContact C-N 3.29Å; W364-T366 PolarHBondContact O-N 3.19Å; W364-Y367 CarbonylContact O-C 3.51Å; W364-Y367 WeakPolarHBondContact O-CA 3.31Å; W364-Y367 WeakPolarHBondContact O-CB 3.11Å; W364-Y367 PolarHBondContact O-N 3.49Å; W364-K368 WeakPolarHBondContact O-CB 3.27Å; W364-K368 PolarHBondContact O-N 2.8Å; W364-E420 HydrophobicContact CZ2-CG 4.19Å; W364-E420 PolarHBondContact NE1-OE1 2.83Å; W364-F423 HydrophobicContact CH2-CB 4.09Å; W364-F423 HydrophobicContact CH2-CD1 4.47Å; W364-Y424 AromaticContact CH2-CD2 3.93Å; W364-Y424 HydrophobicContact CH2-CD2 3.93Å; W364-Y424 HydrophobicContact CH2-CE2 4.47Å; W364-Y424 AromaticContact CZ2-CD2 3.57Å; W364-Y424 HydrophobicContact CZ2-CD2 3.57Å; W364-Y424 AromaticContact CZ2-CE2 3.67Å; W364-Y424 HydrophobicContact CZ2-CE2 3.67Å; W364-F447 HydrophobicContact CH2-CB 4.33Å; W364-F447 HydrophobicContact CZ3-CB 4.19Å; W364-F447 HydrophobicContact CZ3-CD1 4.15Å; W364-F447 WeakPolarHBondContact CZ3-O 3.35Å; W364-T449 HydrophobicContact CE3-CG2 4.25Å; W364-T449 PolarHBondContact N-OG1 3.37Å; W364-D451 PolarHBondContact N-OD1 3.09Å; W364-D451 PolarHBondContact N-OD2 2.99Å; W364-R452 HydrophobicContact CB-CG 4.08Å; W364-R452 VanDerWaalsContact CD1-NH1 3.3Å; W364-R452 HydrophobicContact CD2-CG 4.4Å; W364-R452 VanDerWaalsContact CE2-NH1 3.28Å; W364-R452 HydrophobicContact CE3-CB 3.94Å; W364-R452 HydrophobicContact CE3-CG 4.25Å; W364-R452 HydrophobicContact CG-CG 4.35Å; W364-R452 HydrophobicContact CZ3-CB 4.45Å; W364-H454 AromaticContact CH2-CE1 3.92Å; W364-H454 AromaticContact CZ3-CE1 3.69Å; W364-H454 AromaticContact CZ3-ND1 3.71Å
365	E	98	Very high	95.8	Very high	82 Å²	82	49.8 Å²	49.8	38%	0.383	28%	0.282	S	S	.	.	H	α-helix	trans	-62.8	-36.9	-173.9	-169.4	57.6	-147	0	0	112.1	N363 K368 Q369	N363-E365 PolarHBondContact O-N 3.09Å; E365-K368 PolarHBondContact O-N 2.72Å; E365-Q369 HydrophobicContact CG-CG 4.48Å; E365-Q369 WeakPolarHBondContact O-CG 3.41Å; E365-Q369 PolarHBondContact O-N 3.06Å; E365-Q369 WeakPolarHBondContact OE1-CG 3.26Å; E365-Q369 PolarHBondContact OE1-NE2 2.91Å
366	T	97.3	Very high	95.8	Very high	42 Å²	42	47 Å²	47	26%	0.258	27%	0.269	S	S	.	.	H	α-helix	trans	-66.1	-41.3	174.6	-51.2	0	0	0	0	111	R362 N363 W364 K368 G370 F371	R362-T366 HydrophobicContact CB-CG2 3.95Å; R362-T366 HydrophobicContact CG-CG2 3.98Å; N363-T366 PolarHBondContact O-N 2.87Å; N363-T366 WeakPolarHBondContact OD1-CB 3.44Å; N363-T366 PolarHBondContact OD1-N 3.01Å; N363-T366 VanDerWaalsContact OD1-N 3.16Å; N363-T366 PolarHBondContact OD1-OG1 2.8Å; W364-T366 VanDerWaalsContact C-N 3.29Å; W364-T366 PolarHBondContact O-N 3.19Å; T366-K368 VanDerWaalsContact C-N 3.33Å; T366-G370 PolarHBondContact O-N 3.35Å; T366-F371 HydrophobicContact CG2-CB 3.7Å; T366-F371 HydrophobicContact CG2-CD1 3.61Å; T366-F371 HydrophobicContact CG2-CE1 4.41Å; T366-F371 HydrophobicContact CG2-CG 3.8Å
367	Y	98.6	Very high	95.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.4	-30.8	174.1	-93.9	-74.5	0	0	0	113.5	F360 R362 N363 W364 F371 W379 G381 L382 F447 T449 G468	F360-Y367 WeakPolarHBondContact O-CE2 3.21Å; F360-Y367 PolarHBondContact O-OH 3.44Å; R362-Y367 HydrophobicContact CB-CD2 3.92Å; R362-Y367 HydrophobicContact CB-CE2 3.77Å; N363-Y367 PolarHBondContact O-N 2.89Å; N363-Y367 VanDerWaalsContact O-N 3.14Å; W364-Y367 CarbonylContact O-C 3.51Å; W364-Y367 WeakPolarHBondContact O-CA 3.31Å; W364-Y367 WeakPolarHBondContact O-CB 3.11Å; W364-Y367 PolarHBondContact O-N 3.49Å; Y367-F371 AromaticContact CD1-CE1 3.88Å; Y367-F371 HydrophobicContact CD1-CE1 3.88Å; Y367-F371 HydrophobicContact CD2-CE1 4.35Å; Y367-F371 AromaticContact CE1-CE1 3.76Å; Y367-F371 HydrophobicContact CE1-CE1 3.76Å; Y367-F371 AromaticContact CE1-CZ 3.97Å; Y367-F371 HydrophobicContact CE1-CZ 3.97Å; Y367-F371 HydrophobicContact CE2-CE1 4.25Å; Y367-F371 HydrophobicContact CE2-CZ 4.39Å; Y367-F371 HydrophobicContact CG-CE1 4.16Å; Y367-F371 AromaticContact CZ-CE1 3.94Å; Y367-F371 AromaticContact CZ-CZ 3.87Å; Y367-W379 AromaticContact CD1-CD1 3.75Å; Y367-W379 HydrophobicContact CD1-CD2 4.1Å; Y367-W379 AromaticContact CD1-CE2 3.78Å; Y367-W379 HydrophobicContact CD1-CG 4.1Å; Y367-W379 HydrophobicContact CD1-CZ2 4.36Å; Y367-W379 AromaticContact CD1-NE1 3.55Å; Y367-W379 HydrophobicContact CE1-CD2 4.11Å; Y367-W379 HydrophobicContact CE1-CG 4.18Å; Y367-W379 PolarHBondContact O-NE1 2.94Å; Y367-G381 CarbonylContact O-C 3.58Å; Y367-G381 WeakPolarHBondContact O-CA 3.35Å; Y367-L382 WeakPolarHBondContact O-CG 3.23Å; Y367-L382 PolarHBondContact O-N 3.19Å; Y367-F447 AromaticContact CD1-CE1 3.77Å; Y367-F447 HydrophobicContact CD1-CE1 3.77Å; Y367-F447 AromaticContact CD1-CZ 3.52Å; Y367-F447 HydrophobicContact CD1-CZ 3.52Å; Y367-F447 HydrophobicContact CD2-CE1 4.34Å; Y367-F447 HydrophobicContact CE1-CE1 4.43Å; Y367-F447 AromaticContact CE1-CZ 3.92Å; Y367-F447 HydrophobicContact CE1-CZ 3.92Å; Y367-F447 AromaticContact CG-CE1 3.73Å; Y367-F447 HydrophobicContact CG-CE1 3.73Å; Y367-F447 AromaticContact CG-CZ 4Å; Y367-F447 HydrophobicContact CG-CZ 4Å; Y367-T449 HydrophobicContact CD2-CG2 3.7Å; Y367-T449 HydrophobicContact CE2-CG2 4.43Å; Y367-T449 HydrophobicContact CG-CG2 4.16Å; Y367-G468 VanDerWaalsContact CZ-N 3.26Å; Y367-G468 PolarHBondContact OH-N 3.32Å
368	K	97.9	Very high	96.1	Very high	35 Å²	35	41.6 Å²	41.6	15%	0.152	23%	0.225	C	C	.	.	H	α-helix	trans	-67.6	-52.2	175.1	174.5	172.7	178.3	-178.8	0	112.1	W364 E365 T366 G381 L382 E383 E420 Y424	W364-K368 WeakPolarHBondContact O-CB 3.27Å; W364-K368 PolarHBondContact O-N 2.8Å; E365-K368 PolarHBondContact O-N 2.72Å; T366-K368 VanDerWaalsContact C-N 3.33Å; K368-G381 CarbonylContact O-C 3.44Å; K368-G381 WeakPolarHBondContact O-CA 3.31Å; K368-L382 PolarHBondContact O-N 3.16Å; K368-L382 VanDerWaalsContact O-N 3.13Å; K368-E383 HydrophobicContact CG-CB 4.17Å; K368-E383 WeakPolarHBondContact O-CB 3.42Å; K368-E383 PolarHBondContact O-N 3.33Å; K368-E420 WeakPolarHBondContact CE-OE2 3.16Å; K368-E420 IonicContact NZ-OE1 2.61Å; K368-E420 PolarHBondContact NZ-OE1 3.23Å; K368-E420 IonicContact NZ-OE2 3.96Å; K368-E420 PolarHBondContact NZ-OE2 2.64Å; K368-Y424 WeakPolarHBondContact CE-OH 3.3Å; K368-Y424 WeakPolarHBondContact CG-OH 3.3Å
369	Q	95.9	Very high	96.2	Very high	68 Å²	68	40.5 Å²	40.5	32%	0.318	22%	0.219	S	C	.	.	H	α-helix	trans	-77.6	-31.3	-174.1	-61.6	-62.4	-20	0	0	113.7	E365 N384	E365-Q369 HydrophobicContact CG-CG 4.48Å; E365-Q369 WeakPolarHBondContact O-CG 3.41Å; E365-Q369 PolarHBondContact O-N 3.06Å; E365-Q369 WeakPolarHBondContact OE1-CG 3.26Å; E365-Q369 PolarHBondContact OE1-NE2 2.91Å; Q369-N384 PolarHBondContact O-ND2 3.21Å
370	G	96.8	Very high	96.3	Very high	25 Å²	25	37.1 Å²	37.1	26%	0.258	20%	0.2	S	C	.	.			trans	103.5	155.5	-171	0	0	0	0	0	112.3	T366 W379	T366-G370 PolarHBondContact O-N 3.35Å; G370-W379 CarbonylContact C-O 3.56Å; G370-W379 WeakPolarHBondContact CA-O 3.43Å
371	F	97.4	Very high	96.3	Very high	28 Å²	28	37 Å²	37	12%	0.123	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	160.5	-178.5	64.3	-89.1	0	0	0	112.7	V358 F360 R362 T366 Y367 Y378 W379	V358-F371 HydrophobicContact CG1-CD2 3.71Å; V358-F371 HydrophobicContact CG1-CE2 3.87Å; F360-F371 HydrophobicContact CB-CE2 4.43Å; F360-F371 HydrophobicContact CB-CZ 4.34Å; F360-F371 AromaticContact CD1-CE2 3.88Å; F360-F371 HydrophobicContact CD1-CE2 3.88Å; F360-F371 AromaticContact CD1-CZ 3.63Å; F360-F371 HydrophobicContact CD1-CZ 3.63Å; F360-F371 AromaticContact CD2-CE2 4Å; F360-F371 HydrophobicContact CD2-CE2 4Å; F360-F371 HydrophobicContact CE1-CE2 4.06Å; F360-F371 HydrophobicContact CE1-CZ 4.01Å; F360-F371 HydrophobicContact CE2-CE2 4.17Å; F360-F371 AromaticContact CG-CE2 3.84Å; F360-F371 HydrophobicContact CG-CE2 3.84Å; F360-F371 AromaticContact CG-CZ 3.92Å; F360-F371 HydrophobicContact CG-CZ 3.92Å; F360-F371 HydrophobicContact CZ-CE2 4.2Å; R362-F371 HydrophobicContact CB-CE1 4.46Å; R362-F371 HydrophobicContact CG-CD2 4.41Å; R362-F371 HydrophobicContact CG-CE1 4.21Å; R362-F371 HydrophobicContact CG-CE2 4.13Å; R362-F371 HydrophobicContact CG-CZ 4.01Å; T366-F371 HydrophobicContact CG2-CB 3.7Å; T366-F371 HydrophobicContact CG2-CD1 3.61Å; T366-F371 HydrophobicContact CG2-CE1 4.41Å; T366-F371 HydrophobicContact CG2-CG 3.8Å; Y367-F371 AromaticContact CD1-CE1 3.88Å; Y367-F371 HydrophobicContact CD1-CE1 3.88Å; Y367-F371 HydrophobicContact CD2-CE1 4.35Å; Y367-F371 AromaticContact CE1-CE1 3.76Å; Y367-F371 HydrophobicContact CE1-CE1 3.76Å; Y367-F371 AromaticContact CE1-CZ 3.97Å; Y367-F371 HydrophobicContact CE1-CZ 3.97Å; Y367-F371 HydrophobicContact CE2-CE1 4.25Å; Y367-F371 HydrophobicContact CE2-CZ 4.39Å; Y367-F371 HydrophobicContact CG-CE1 4.16Å; Y367-F371 AromaticContact CZ-CE1 3.94Å; Y367-F371 AromaticContact CZ-CZ 3.87Å; F371-Y378 CarbonylContact O-C 3.59Å; F371-Y378 VanDerWaalsContact O-CA 3.28Å; F371-Y378 WeakPolarHBondContact O-CA 3.33Å; F371-Y378 WeakPolarHBondContact O-CB 3.24Å; F371-W379 HydrophobicContact CD1-CB 3.88Å; F371-W379 HydrophobicContact CD1-CG 4.29Å; F371-W379 HydrophobicContact CE1-CB 3.53Å; F371-W379 AromaticContact CE1-CD1 3.77Å; F371-W379 AromaticContact CE1-CG 3.82Å; F371-W379 HydrophobicContact CE1-CG 3.82Å; F371-W379 HydrophobicContact CE2-CB 4.25Å; F371-W379 HydrophobicContact CG-CB 4.42Å; F371-W379 HydrophobicContact CZ-CB 3.72Å; F371-W379 HydrophobicContact CZ-CG 4.35Å; F371-W379 PolarHBondContact N-O 3.4Å; F371-W379 PolarHBondContact O-N 3.43Å
372	G	95.2	Very high	96.3	Very high	50 Å²	50	33.5 Å²	33.5	52%	0.515	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	104.8	-157.6	179	0	0	0	0	0	112.2	E377	G372-E377 WeakPolarHBondContact CA-O 3.48Å
373	N	91.9	Very high	96.3	Very high	89 Å²	89	30.8 Å²	30.8	48%	0.476	18%	0.176	S	C	.	.			trans	-120.8	127.9	177	-178.1	-1.4	0	0	0	109.9	D375 G376 E377 Y378	N373-D375 PolarHBondContact O-N 3.19Å; N373-D375 PolarHBondContact OD1-N 2.92Å; N373-G376 CarbonylContact O-C 3.55Å; N373-G376 VanDerWaalsContact O-C 3.24Å; N373-G376 WeakPolarHBondContact O-CA 3.44Å; N373-G376 PolarHBondContact O-N 3.03Å; N373-E377 PolarHBondContact N-O 2.69Å; N373-E377 CarbonylContact O-C 3.57Å; N373-Y378 WeakPolarHBondContact O-CD1 3.28Å
374	I	90.8	Very high	96.2	Very high	33 Å²	33	28.9 Å²	28.9	17%	0.169	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-23.7	-178.1	-56.5	170.3	0	0	0	111.8	M322 Q335 W337 R352 Y378	M322-I374 HydrophobicContact CG-CB 4.29Å; M322-I374 HydrophobicContact CG-CG2 3.76Å; M322-I374 HydrophobicContact SD-CB 4.01Å; M322-I374 HydrophobicContact SD-CG2 4.12Å; Q335-I374 HydrophobicContact CB-CD1 3.31Å; Q335-I374 WeakPolarHBondContact O-CD1 3.46Å; W337-I374 HydrophobicContact CB-CG2 3.94Å; R352-I374 PolarHBondContact NH2-O 2.74Å; I374-Y378 HydrophobicContact CG2-CE1 4.41Å
375	D	87.9	Confident	96.2	Very high	82 Å²	82	28.9 Å²	28.9	44%	0.439	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-8.4	171.1	-67	-24.4	0	0	0	113.5	M322 W337 R352 N373	M322-D375 WeakPolarHBondContact CE-OD2 3.43Å; M322-D375 WeakPolarHBondContact CG-OD1 3.34Å; W337-D375 VanDerWaalsContact CZ3-OD1 3.3Å; W337-D375 WeakPolarHBondContact CZ3-OD1 3.24Å; R352-D375 PolarHBondContact NH2-O 3.42Å; N373-D375 PolarHBondContact O-N 3.19Å; N373-D375 PolarHBondContact OD1-N 2.92Å
376	G	93.6	Very high	96.2	Very high	8 Å²	8	27 Å²	27	8%	0.082	16%	0.155	C	C	.	.	S	Bend	trans	-127.7	-136.5	-175.1	0	0	0	0	0	113.1	R352 N373	R352-G376 VanDerWaalsContact CZ-O 3.27Å; R352-G376 PolarHBondContact NE-O 2.77Å; R352-G376 PolarHBondContact NH2-O 3.02Å; N373-G376 CarbonylContact O-C 3.55Å; N373-G376 VanDerWaalsContact O-C 3.24Å; N373-G376 WeakPolarHBondContact O-CA 3.44Å; N373-G376 PolarHBondContact O-N 3.03Å
377	E	97.6	Very high	96.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.157	C	C	.	.	S	Bend	trans	-79.8	134.8	167.8	-64.3	-165.9	152.8	0	0	111.2	R352 R353 Q354 D355 G356 S357 V358 F360 G372 N373	R352-E377 VanDerWaalsContact O-CA 3.29Å; R352-E377 WeakPolarHBondContact O-CA 3.38Å; R352-E377 WeakPolarHBondContact O-CB 3.4Å; R353-E377 WeakPolarHBondContact CA-OE1 3.46Å; R353-E377 IonicContact NE-OE1 3.65Å; R353-E377 IonicContact NE-OE2 2.7Å; Q354-E377 HydrophobicContact CG-CG 3.95Å; Q354-E377 PolarHBondContact N-OE1 2.87Å; D355-E377 PolarHBondContact N-OE1 3.29Å; D355-E377 WeakPolarHBondContact OD1-CG 3.34Å; G356-E377 WeakPolarHBondContact CA-OE2 3.44Å; G356-E377 VanDerWaalsContact N-CD 3.32Å; G356-E377 PolarHBondContact N-OE1 2.72Å; G356-E377 PolarHBondContact N-OE2 3.13Å; S357-E377 PolarHBondContact N-OE2 3.22Å; V358-E377 HydrophobicContact CB-CB 3.93Å; V358-E377 HydrophobicContact CG2-CB 3.96Å; V358-E377 WeakPolarHBondContact CG2-O 3.48Å; V358-E377 PolarHBondContact N-OE2 3.48Å; F360-E377 HydrophobicContact CE2-CB 4.25Å; G372-E377 WeakPolarHBondContact CA-O 3.48Å; N373-E377 PolarHBondContact N-O 2.69Å; N373-E377 CarbonylContact O-C 3.57Å
378	Y	98.1	Very high	95.9	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.016	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	167.7	174.6	73	-84	0	0	0	113.6	W337 V349 Q351 R352 F371 N373 I374 L380	W337-Y378 HydrophobicContact CB-CE1 4.21Å; W337-Y378 WeakPolarHBondContact CB-OH 3.4Å; W337-Y378 PolarHBondContact N-OH 3.02Å; V349-Y378 VanDerWaalsContact CB-OH 3.28Å; V349-Y378 WeakPolarHBondContact CB-OH 3.3Å; V349-Y378 HydrophobicContact CG1-CE1 4.22Å; V349-Y378 WeakPolarHBondContact CG1-OH 3.24Å; V349-Y378 PolarHBondContact O-OH 2.82Å; Q351-Y378 WeakPolarHBondContact CA-O 3.29Å; R352-Y378 HydrophobicContact CB-CD1 4.44Å; R352-Y378 HydrophobicContact CB-CE1 4.46Å; R352-Y378 PolarHBondContact N-O 3.04Å; R352-Y378 PolarHBondContact O-N 3Å; F371-Y378 CarbonylContact O-C 3.59Å; F371-Y378 VanDerWaalsContact O-CA 3.28Å; F371-Y378 WeakPolarHBondContact O-CA 3.33Å; F371-Y378 WeakPolarHBondContact O-CB 3.24Å; N373-Y378 WeakPolarHBondContact O-CD1 3.28Å; I374-Y378 HydrophobicContact CG2-CE1 4.41Å; Y378-L380 HydrophobicContact CE2-CB 4.18Å
379	W	98.6	Very high	95.8	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.008	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.7	166.1	173.4	-101.7	0	0	0	108.2	Q351 F360 Y367 G370 F371 G381 L382 I385 F447 W470	Q351-W379 HydrophobicContact CB-CE3 3.86Å; Q351-W379 HydrophobicContact CB-CZ3 4.08Å; Q351-W379 HydrophobicContact CG-CE3 3.71Å; Q351-W379 HydrophobicContact CG-CZ3 4.12Å; F360-W379 HydrophobicContact CE1-CB 4.12Å; Y367-W379 AromaticContact CD1-CD1 3.75Å; Y367-W379 HydrophobicContact CD1-CD2 4.1Å; Y367-W379 AromaticContact CD1-CE2 3.78Å; Y367-W379 HydrophobicContact CD1-CG 4.1Å; Y367-W379 HydrophobicContact CD1-CZ2 4.36Å; Y367-W379 AromaticContact CD1-NE1 3.55Å; Y367-W379 HydrophobicContact CE1-CD2 4.11Å; Y367-W379 HydrophobicContact CE1-CG 4.18Å; Y367-W379 PolarHBondContact O-NE1 2.94Å; G370-W379 CarbonylContact C-O 3.56Å; G370-W379 WeakPolarHBondContact CA-O 3.43Å; F371-W379 HydrophobicContact CD1-CB 3.88Å; F371-W379 HydrophobicContact CD1-CG 4.29Å; F371-W379 HydrophobicContact CE1-CB 3.53Å; F371-W379 AromaticContact CE1-CD1 3.77Å; F371-W379 AromaticContact CE1-CG 3.82Å; F371-W379 HydrophobicContact CE1-CG 3.82Å; F371-W379 HydrophobicContact CE2-CB 4.25Å; F371-W379 HydrophobicContact CG-CB 4.42Å; F371-W379 HydrophobicContact CZ-CB 3.72Å; F371-W379 HydrophobicContact CZ-CG 4.35Å; F371-W379 PolarHBondContact N-O 3.4Å; F371-W379 PolarHBondContact O-N 3.43Å; W379-G381 VanDerWaalsContact C-N 3.26Å; W379-G381 VanDerWaalsContact CD1-N 3.29Å; W379-G381 PolarHBondContact O-N 2.86Å; W379-L382 HydrophobicContact CZ2-CD2 3.73Å; W379-L382 HydrophobicContact CZ2-CG 4.02Å; W379-I385 HydrophobicContact CH2-CD1 3.98Å; W379-I385 HydrophobicContact CZ2-CD1 3.74Å; W379-F447 HydrophobicContact CH2-CE2 4.37Å; W379-F447 HydrophobicContact CZ2-CE2 4.31Å; W379-F447 HydrophobicContact CZ2-CZ 4.34Å; W379-W470 AromaticContact CH2-CH2 3.92Å; W379-W470 HydrophobicContact CH2-CH2 3.92Å
380	L	97.8	Very high	95.8	Very high	10 Å²	10	25.8 Å²	25.8	5%	0.052	15%	0.146	C	C	.	.			trans	-67.9	-23.1	-172.4	-176.9	58.7	0	0	0	113.8	V336 I350 Y378 N384 I385 L388	V336-L380 HydrophobicContact CG1-CD1 3.81Å; V336-L380 HydrophobicContact CG1-CD2 3.97Å; I350-L380 HydrophobicContact CB-CB 4.37Å; I350-L380 HydrophobicContact CB-CD2 4.43Å; I350-L380 HydrophobicContact CG2-CD2 3.93Å; I350-L380 WeakPolarHBondContact O-CB 3.45Å; I350-L380 PolarHBondContact O-N 3.09Å; Y378-L380 HydrophobicContact CE2-CB 4.18Å; L380-N384 HydrophobicContact CG-CB 3.98Å; L380-N384 PolarHBondContact O-ND2 2.93Å; L380-I385 HydrophobicContact CB-CD1 4.39Å; L380-I385 HydrophobicContact CB-CG1 4.22Å; L380-I385 HydrophobicContact CD2-CG1 4.3Å; L380-I385 HydrophobicContact CG-CG1 4.49Å; L380-L388 HydrophobicContact CD2-CD1 3.69Å
381	G	97.9	Very high	95.6	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.14	C	C	.	.			trans	105.8	132	-176	0	0	0	0	0	112.3	Y367 K368 W379 E383 N384 I385	Y367-G381 CarbonylContact O-C 3.58Å; Y367-G381 WeakPolarHBondContact O-CA 3.35Å; K368-G381 CarbonylContact O-C 3.44Å; K368-G381 WeakPolarHBondContact O-CA 3.31Å; W379-G381 VanDerWaalsContact C-N 3.26Å; W379-G381 VanDerWaalsContact CD1-N 3.29Å; W379-G381 PolarHBondContact O-N 2.86Å; G381-E383 VanDerWaalsContact C-N 3.27Å; G381-E383 PolarHBondContact O-N 2.81Å; G381-N384 PolarHBondContact O-N 3.31Å; G381-I385 WeakPolarHBondContact O-CD1 3.24Å; G381-I385 VanDerWaalsContact O-CG1 3.26Å; G381-I385 WeakPolarHBondContact O-CG1 3.36Å; G381-I385 PolarHBondContact O-N 2.64Å
382	L	98.4	Very high	95.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.6	-39.7	-179.2	-67.1	157.7	0	0	0	111.9	Y367 K368 W379 I385 Y386 L417 Y424 F447 W470	Y367-L382 WeakPolarHBondContact O-CG 3.23Å; Y367-L382 PolarHBondContact O-N 3.19Å; K368-L382 PolarHBondContact O-N 3.16Å; K368-L382 VanDerWaalsContact O-N 3.13Å; W379-L382 HydrophobicContact CZ2-CD2 3.73Å; W379-L382 HydrophobicContact CZ2-CG 4.02Å; L382-I385 PolarHBondContact O-N 3.36Å; L382-Y386 VanDerWaalsContact O-CB 3.28Å; L382-Y386 WeakPolarHBondContact O-CB 3.4Å; L382-Y386 PolarHBondContact O-N 3.13Å; L382-L417 HydrophobicContact CD2-CD1 4.09Å; L382-Y424 HydrophobicContact CB-CD1 3.84Å; L382-Y424 HydrophobicContact CB-CD2 3.75Å; L382-Y424 HydrophobicContact CB-CE1 3.92Å; L382-Y424 HydrophobicContact CB-CE2 3.82Å; L382-Y424 HydrophobicContact CB-CG 3.75Å; L382-Y424 HydrophobicContact CD1-CD2 3.68Å; L382-Y424 HydrophobicContact CD1-CE2 4.04Å; L382-Y424 HydrophobicContact CD1-CG 4.25Å; L382-Y424 HydrophobicContact CD2-CD2 4.47Å; L382-Y424 HydrophobicContact CD2-CG 4.22Å; L382-Y424 HydrophobicContact CG-CD2 4.17Å; L382-Y424 HydrophobicContact CG-CG 4.3Å; L382-F447 HydrophobicContact CD1-CD1 3.58Å; L382-F447 HydrophobicContact CD1-CD2 4.49Å; L382-F447 HydrophobicContact CD1-CE1 3.75Å; L382-F447 HydrophobicContact CD1-CG 3.96Å; L382-F447 HydrophobicContact CD1-CZ 4.26Å; L382-F447 HydrophobicContact CD2-CD1 4.3Å; L382-F447 HydrophobicContact CD2-CD2 3.72Å; L382-F447 HydrophobicContact CD2-CE1 4.41Å; L382-F447 HydrophobicContact CD2-CE2 3.84Å; L382-F447 HydrophobicContact CD2-CG 3.93Å; L382-F447 HydrophobicContact CD2-CZ 4.18Å; L382-F447 HydrophobicContact CG-CE1 4.49Å; L382-W470 HydrophobicContact CD2-CZ2 4.25Å
383	E	96.4	Very high	95.3	Very high	38 Å²	38	26.5 Å²	26.5	18%	0.178	14%	0.142	C	C	.	.	H	α-helix	trans	-61.5	-46.9	177.6	-170.3	65.1	-158	0	0	110.9	K368 G381 Y386 W387 Y424	K368-E383 HydrophobicContact CG-CB 4.17Å; K368-E383 WeakPolarHBondContact O-CB 3.42Å; K368-E383 PolarHBondContact O-N 3.33Å; G381-E383 VanDerWaalsContact C-N 3.27Å; G381-E383 PolarHBondContact O-N 2.81Å; E383-Y386 WeakPolarHBondContact O-CB 3.42Å; E383-Y386 PolarHBondContact O-N 3.14Å; E383-W387 PolarHBondContact O-N 3.3Å; E383-W387 VanDerWaalsContact O-N 3.09Å; E383-W387 PolarHBondContact OE1-NE1 3.42Å; E383-Y424 PolarHBondContact OE2-OH 3.45Å
384	N	95.9	Very high	95.5	Very high	10 Å²	10	22.6 Å²	22.6	5%	0.053	12%	0.12	C	C	.	.	H	α-helix	trans	-65.8	-41.2	-179.7	-64.9	-28.6	0	0	0	111.5	M334 Q369 L380 G381 W387 L388	M334-N384 HydrophobicContact CE-CB 3.65Å; M334-N384 HydrophobicContact SD-CB 3.85Å; Q369-N384 PolarHBondContact O-ND2 3.21Å; L380-N384 HydrophobicContact CG-CB 3.98Å; L380-N384 PolarHBondContact O-ND2 2.93Å; G381-N384 PolarHBondContact O-N 3.31Å; N384-W387 PolarHBondContact O-N 2.94Å; N384-L388 WeakPolarHBondContact O-CG 3.25Å; N384-L388 PolarHBondContact O-N 3.07Å; N384-L388 VanDerWaalsContact O-N 3.08Å
385	I	97.8	Very high	95.8	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-68.3	-37.3	176.2	-60.8	161.5	0	0	0	111.2	I350 W379 L380 G381 L382 L388 T389 F415 L417	I350-I385 HydrophobicContact CB-CD1 4.01Å; I350-I385 HydrophobicContact CB-CG1 4.02Å; I350-I385 HydrophobicContact CD1-CD1 4.26Å; I350-I385 HydrophobicContact CD1-CG2 4.33Å; I350-I385 HydrophobicContact CG2-CG1 4.06Å; W379-I385 HydrophobicContact CH2-CD1 3.98Å; W379-I385 HydrophobicContact CZ2-CD1 3.74Å; L380-I385 HydrophobicContact CB-CD1 4.39Å; L380-I385 HydrophobicContact CB-CG1 4.22Å; L380-I385 HydrophobicContact CD2-CG1 4.3Å; L380-I385 HydrophobicContact CG-CG1 4.49Å; G381-I385 WeakPolarHBondContact O-CD1 3.24Å; G381-I385 VanDerWaalsContact O-CG1 3.26Å; G381-I385 WeakPolarHBondContact O-CG1 3.36Å; G381-I385 PolarHBondContact O-N 2.64Å; L382-I385 PolarHBondContact O-N 3.36Å; I385-L388 PolarHBondContact O-N 3.31Å; I385-T389 HydrophobicContact CG2-CG2 4.18Å; I385-T389 WeakPolarHBondContact O-CB 3.19Å; I385-T389 WeakPolarHBondContact O-CG2 3.35Å; I385-T389 PolarHBondContact O-N 2.9Å; I385-T389 PolarHBondContact O-OG1 2.91Å; I385-F415 HydrophobicContact CG2-CE1 3.74Å; I385-F415 HydrophobicContact CG2-CZ 4.12Å; I385-L417 HydrophobicContact CB-CD1 3.91Å; I385-L417 HydrophobicContact CG2-CD1 3.58Å; I385-L417 HydrophobicContact CG2-CG 4.04Å
386	Y	97.2	Very high	96.3	Very high	42 Å²	42	18.3 Å²	18.3	17%	0.165	10%	0.097	C	C	.	.	H	α-helix	trans	-58.1	-52.1	173.7	165.2	-99.1	0	0	0	111.1	L382 E383 L388 T389 N390 L417 E418 P419	L382-Y386 VanDerWaalsContact O-CB 3.28Å; L382-Y386 WeakPolarHBondContact O-CB 3.4Å; L382-Y386 PolarHBondContact O-N 3.13Å; E383-Y386 WeakPolarHBondContact O-CB 3.42Å; E383-Y386 PolarHBondContact O-N 3.14Å; Y386-L388 PolarHBondContact O-N 2.63Å; Y386-T389 PolarHBondContact O-N 2.84Å; Y386-T389 PolarHBondContact O-OG1 3.14Å; Y386-N390 WeakPolarHBondContact CD2-ND2 3.28Å; Y386-N390 HydrophobicContact CE2-CB 4.45Å; Y386-N390 VanDerWaalsContact CE2-ND2 3.31Å; Y386-N390 WeakPolarHBondContact CE2-ND2 3.38Å; Y386-N390 WeakPolarHBondContact O-CB 3.44Å; Y386-N390 PolarHBondContact O-N 3.42Å; Y386-N390 PolarHBondContact O-ND2 2.8Å; Y386-L417 WeakPolarHBondContact CD2-O 3.43Å; Y386-E418 WeakPolarHBondContact CD2-O 3.48Å; Y386-P419 HydrophobicContact CD2-CB 4.48Å; Y386-P419 HydrophobicContact CE2-CB 3.81Å; Y386-P419 HydrophobicContact CE2-CG 4.41Å
387	W	95.9	Very high	96.5	Very high	75 Å²	75	18.2 Å²	18.2	28%	0.284	9%	0.094	S	C	.	.	H	α-helix	trans	-62.3	-42.3	178.8	-70.5	113.2	0	0	0	112.8	P327 N329 A330 E383 N384 T389	P327-W387 HydrophobicContact CB-CB 4.14Å; P327-W387 HydrophobicContact CG-CB 4.06Å; N329-W387 HydrophobicContact CB-CE3 4.26Å; N329-W387 HydrophobicContact CB-CZ3 4.18Å; N329-W387 WeakPolarHBondContact O-CZ3 3.45Å; A330-W387 HydrophobicContact CB-CB 3.95Å; A330-W387 HydrophobicContact CB-CD2 3.95Å; A330-W387 HydrophobicContact CB-CE3 4.22Å; A330-W387 HydrophobicContact CB-CG 3.8Å; E383-W387 PolarHBondContact O-N 3.3Å; E383-W387 VanDerWaalsContact O-N 3.09Å; E383-W387 PolarHBondContact OE1-NE1 3.42Å; N384-W387 PolarHBondContact O-N 2.94Å; W387-T389 PolarHBondContact O-N 3.35Å
388	L	95.4	Very high	96.6	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62.6	-38.1	175.9	-77.1	167.7	0	0	0	113	V325 P327 M334 T348 L380 N384 I385 Y386 Q391 Y394 I516	V325-L388 HydrophobicContact CG1-CD2 3.9Å; P327-L388 HydrophobicContact CG-CD2 3.9Å; P327-L388 HydrophobicContact CG-CG 4.07Å; M334-L388 HydrophobicContact SD-CD1 3.75Å; M334-L388 HydrophobicContact SD-CD2 4.46Å; M334-L388 HydrophobicContact SD-CG 4.01Å; T348-L388 HydrophobicContact CG2-CD1 4.16Å; L380-L388 HydrophobicContact CD2-CD1 3.69Å; N384-L388 WeakPolarHBondContact O-CG 3.25Å; N384-L388 PolarHBondContact O-N 3.07Å; N384-L388 VanDerWaalsContact O-N 3.08Å; I385-L388 PolarHBondContact O-N 3.31Å; Y386-L388 PolarHBondContact O-N 2.63Å; L388-Q391 WeakPolarHBondContact O-CG 3.34Å; L388-Y394 WeakPolarHBondContact O-CD2 3.48Å; L388-Y394 WeakPolarHBondContact O-CE2 3.39Å; L388-Y394 VanDerWaalsContact O-CZ 3.23Å; L388-I516 HydrophobicContact CB-CD1 3.97Å; L388-I516 HydrophobicContact CD1-CD1 4.37Å
389	T	95.8	Very high	96.6	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.006	10%	0.103	C	C	.	.	H	α-helix	trans	-90.4	-6.8	-175.6	57.4	0	0	0	0	114.5	I385 Y386 W387 G392 F415 L417 I516	I385-T389 HydrophobicContact CG2-CG2 4.18Å; I385-T389 WeakPolarHBondContact O-CB 3.19Å; I385-T389 WeakPolarHBondContact O-CG2 3.35Å; I385-T389 PolarHBondContact O-N 2.9Å; I385-T389 PolarHBondContact O-OG1 2.91Å; Y386-T389 PolarHBondContact O-N 2.84Å; Y386-T389 PolarHBondContact O-OG1 3.14Å; W387-T389 PolarHBondContact O-N 3.35Å; T389-G392 VanDerWaalsContact O-O 3.07Å; T389-F415 HydrophobicContact CG2-CD1 3.64Å; T389-F415 HydrophobicContact CG2-CE1 3.78Å; T389-F415 WeakPolarHBondContact CG2-O 3.36Å; T389-L417 PolarHBondContact OG1-N 3.01Å; T389-I516 HydrophobicContact CG2-CD1 3.84Å
390	N	94.8	Very high	96.6	Very high	44 Å²	44	19.7 Å²	19.7	24%	0.235	10%	0.104	C	C	.	.	H	α-helix	trans	-105.3	0.1	177.1	-75.7	-89.1	0	0	0	114.1	Y386 G392 R416 L417	Y386-N390 WeakPolarHBondContact CD2-ND2 3.28Å; Y386-N390 HydrophobicContact CE2-CB 4.45Å; Y386-N390 VanDerWaalsContact CE2-ND2 3.31Å; Y386-N390 WeakPolarHBondContact CE2-ND2 3.38Å; Y386-N390 WeakPolarHBondContact O-CB 3.44Å; Y386-N390 PolarHBondContact O-N 3.42Å; Y386-N390 PolarHBondContact O-ND2 2.8Å; N390-G392 VanDerWaalsContact C-N 3.35Å; N390-R416 VanDerWaalsContact OD1-CD 3.28Å; N390-R416 WeakPolarHBondContact OD1-CD 3.46Å; N390-R416 PolarHBondContact OD1-NE 3.34Å; N390-L417 PolarHBondContact ND2-O 3.02Å
391	Q	92.2	Very high	96.6	Very high	30 Å²	30	20 Å²	20	14%	0.14	11%	0.105	C	C	.	.	S	Bend	trans	-84.3	-5.2	169.3	69.4	-173.3	-9.6	0	0	113.9	K307 L388 Y394	K307-Q391 PolarHBondContact O-NE2 3.29Å; L388-Q391 WeakPolarHBondContact O-CG 3.34Å; Q391-Y394 HydrophobicContact CG-CE2 4.02Å; Q391-Y394 PolarHBondContact NE2-OH 3.3Å
392	G	91.9	Very high	96.6	Very high	41 Å²	41	20 Å²	20	42%	0.423	11%	0.105	S	C	.	.	S	Bend	trans	174	-175.6	178.4	0	0	0	0	0	111.4	T389 N390 Y394	T389-G392 VanDerWaalsContact O-O 3.07Å; N390-G392 VanDerWaalsContact C-N 3.35Å; G392-Y394 WeakPolarHBondContact O-CD2 3.33Å
393	N	94.4	Very high	96.6	Very high	48 Å²	48	23.5 Å²	23.5	26%	0.257	12%	0.118	S	C	.	.			trans	-81.5	128.7	171	-177.2	59.6	0	0	0	111	A413 S414 N519 T522	N393-A413 PolarHBondContact ND2-O 3.04Å; N393-S414 VanDerWaalsContact OD1-CB 3.32Å; N393-S414 WeakPolarHBondContact OD1-CB 3.43Å; N393-S414 PolarHBondContact OD1-OG 2.86Å; N393-N519 PolarHBondContact ND2-O 3.27Å; N393-N519 PolarHBondContact O-N 2.99Å; N393-T522 PolarHBondContact ND2-OG1 3.26Å
394	Y	96.8	Very high	96.6	Very high	6 Å²	6	25.9 Å²	25.9	2%	0.024	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	140.1	178.5	-80.5	-109.8	0	0	0	110	D308 L388 Q391 G392 S414 F415 I516 R517 P518	D308-Y394 PolarHBondContact OD2-OH 3.32Å; L388-Y394 WeakPolarHBondContact O-CD2 3.48Å; L388-Y394 WeakPolarHBondContact O-CE2 3.39Å; L388-Y394 VanDerWaalsContact O-CZ 3.23Å; Q391-Y394 HydrophobicContact CG-CE2 4.02Å; Q391-Y394 PolarHBondContact NE2-OH 3.3Å; G392-Y394 WeakPolarHBondContact O-CD2 3.33Å; Y394-S414 CarbonylContact O-C 3.43Å; Y394-S414 VanDerWaalsContact O-CA 3.24Å; Y394-S414 WeakPolarHBondContact O-CA 3.28Å; Y394-F415 PolarHBondContact O-N 2.68Å; Y394-I516 HydrophobicContact CD1-CB 4.05Å; Y394-I516 HydrophobicContact CD1-CD1 3.93Å; Y394-I516 HydrophobicContact CD1-CG1 3.96Å; Y394-I516 HydrophobicContact CE1-CD1 4.36Å; Y394-I516 HydrophobicContact CE1-CG1 4.47Å; Y394-R517 CarbonylContact C-O 3.44Å; Y394-R517 WeakPolarHBondContact CA-O 3.44Å; Y394-R517 VanDerWaalsContact CD1-C 3.48Å; Y394-P518 HydrophobicContact CD1-CG 4.45Å; Y394-P518 HydrophobicContact CE1-CG 3.81Å; Y394-P518 HydrophobicContact CE2-CG 4.48Å
395	K	97.3	Very high	96.6	Very high	26 Å²	26	27.3 Å²	27.3	11%	0.113	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	147.4	163.6	65.3	172.4	-175.7	153.2	0	110.6	W347 E411 Y412 I516 R517 N519	W347-K395 HydrophobicContact CH2-CD 4.13Å; W347-K395 VanDerWaalsContact CH2-CE 3.45Å; W347-K395 HydrophobicContact CH2-CG 4.2Å; W347-K395 HydrophobicContact CZ3-CG 4.25Å; K395-E411 HydrophobicContact CD-CG 4.26Å; K395-E411 WeakPolarHBondContact CD-OE1 3.28Å; K395-E411 IonicContact NZ-OE1 2.65Å; K395-E411 PolarHBondContact NZ-OE1 2.64Å; K395-E411 IonicContact NZ-OE2 2.64Å; K395-E411 PolarHBondContact NZ-OE2 2.76Å; K395-Y412 VanDerWaalsContact CA-O 3.28Å; K395-Y412 WeakPolarHBondContact CA-O 3.44Å; K395-Y412 VanDerWaalsContact CB-O 3.31Å; K395-Y412 WeakPolarHBondContact CB-O 3.25Å; K395-I516 VanDerWaalsContact O-CA 3.28Å; K395-I516 WeakPolarHBondContact O-CA 3.37Å; K395-R517 HydrophobicContact CG-CB 4.5Å; K395-R517 PolarHBondContact N-O 3.27Å; K395-R517 PolarHBondContact O-N 3.41Å; K395-R517 VanDerWaalsContact O-N 3.08Å; K395-N519 HydrophobicContact CB-CB 3.9Å; K395-N519 HydrophobicContact CD-CB 4.45Å; K395-N519 HydrophobicContact CG-CB 4.03Å
396	L	98.4	Very high	96.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	131.3	172.4	168.5	70.8	0	0	0	109.1	I350 V398 E411 Y412 F415 L439 M514 I516	I350-L396 HydrophobicContact CD1-CD1 4.32Å; L396-V398 HydrophobicContact CD1-CG2 4.19Å; L396-V398 HydrophobicContact CD2-CG2 3.9Å; L396-V398 HydrophobicContact CG-CG2 3.92Å; L396-E411 CarbonylContact O-C 3.54Å; L396-E411 VanDerWaalsContact O-CA 3.28Å; L396-E411 WeakPolarHBondContact O-CA 3.33Å; L396-Y412 HydrophobicContact CD2-CD2 4.04Å; L396-Y412 HydrophobicContact CG-CD2 4.41Å; L396-Y412 PolarHBondContact N-O 3.01Å; L396-Y412 PolarHBondContact O-N 3.26Å; L396-F415 HydrophobicContact CB-CB 3.53Å; L396-F415 HydrophobicContact CB-CD1 4.35Å; L396-F415 HydrophobicContact CB-CD2 4.04Å; L396-F415 HydrophobicContact CB-CG 3.73Å; L396-F415 HydrophobicContact CD2-CD2 3.67Å; L396-F415 HydrophobicContact CD2-CE2 3.98Å; L396-F415 HydrophobicContact CD2-CG 4.24Å; L396-F415 HydrophobicContact CG-CD2 4.34Å; L396-F415 HydrophobicContact CG-CG 4.44Å; L396-L439 HydrophobicContact CD2-CD2 3.6Å; L396-M514 HydrophobicContact CD1-CB 4.11Å; L396-M514 HydrophobicContact CD1-CE 4.16Å; L396-M514 HydrophobicContact CD2-CE 4.11Å; L396-I516 HydrophobicContact CB-CG2 4.45Å; L396-I516 HydrophobicContact CD1-CG2 3.99Å
397	L	98.4	Very high	96.7	Very high	6 Å²	6	39.7 Å²	39.7	3%	0.031	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.8	165.6	176.6	65.4	0	0	0	109.1	W347 T399 F409 E411 M515	W347-L397 HydrophobicContact CD2-CD2 4.47Å; W347-L397 HydrophobicContact CE3-CB 4.19Å; W347-L397 HydrophobicContact CH2-CB 3.43Å; W347-L397 VanDerWaalsContact CH2-CB 3.43Å; W347-L397 HydrophobicContact CH2-CD2 3.81Å; W347-L397 HydrophobicContact CH2-CG 4.22Å; W347-L397 HydrophobicContact CZ2-CB 4.13Å; W347-L397 HydrophobicContact CZ2-CD2 3.59Å; W347-L397 HydrophobicContact CZ2-CG 4.48Å; W347-L397 HydrophobicContact CZ3-CB 3.47Å; W347-L397 VanDerWaalsContact CZ3-CB 3.47Å; W347-L397 HydrophobicContact CZ3-CD2 4.35Å; L397-T399 HydrophobicContact CD1-CG2 4.43Å; L397-T399 HydrophobicContact CD2-CG2 4.18Å; L397-T399 HydrophobicContact CG-CG2 4.08Å; L397-F409 HydrophobicContact CD1-CB 3.96Å; L397-F409 HydrophobicContact CD1-CD2 3.76Å; L397-F409 HydrophobicContact CD1-CG 4.24Å; L397-E411 HydrophobicContact CD1-CB 4.2Å; L397-M515 HydrophobicContact CB-CG 3.93Å; L397-M515 HydrophobicContact CD2-CE 4.25Å; L397-M515 HydrophobicContact CD2-CG 4.31Å; L397-M515 HydrophobicContact CD2-SD 4.03Å; L397-M515 HydrophobicContact CG-CG 4.34Å; L397-M515 PolarHBondContact N-O 3.44Å; L397-M515 PolarHBondContact O-N 2.64Å
398	V	98.6	Very high	96.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	117.5	172.6	-173.8	0	0	0	0	107.8	L396 L400 F409 A410 L479 W499 S513 M514	L396-V398 HydrophobicContact CD1-CG2 4.19Å; L396-V398 HydrophobicContact CD2-CG2 3.9Å; L396-V398 HydrophobicContact CG-CG2 3.92Å; V398-L400 HydrophobicContact CG1-CD2 3.68Å; V398-L400 HydrophobicContact CG1-CG 4.27Å; V398-F409 CarbonylContact O-C 3.24Å; V398-F409 WeakPolarHBondContact O-CA 3.44Å; V398-A410 HydrophobicContact CB-CB 4.37Å; V398-A410 PolarHBondContact N-O 2.93Å; V398-A410 PolarHBondContact O-N 3.28Å; V398-L479 HydrophobicContact CG1-CD1 3.65Å; V398-W499 HydrophobicContact CG1-CZ3 4.26Å; V398-S513 WeakPolarHBondContact CA-O 3.29Å; V398-M514 HydrophobicContact CG1-CG 4.36Å; V398-M514 HydrophobicContact CG2-CG 4.26Å
399	T	98.3	Very high	96.9	Very high	33 Å²	33	40 Å²	40	20%	0.202	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	137.5	173.8	58	0	0	0	0	110.5	L397 F409 V512 S513 M515	L397-T399 HydrophobicContact CD1-CG2 4.43Å; L397-T399 HydrophobicContact CD2-CG2 4.18Å; L397-T399 HydrophobicContact CG-CG2 4.08Å; T399-F409 HydrophobicContact CG2-CB 4.35Å; T399-V512 CarbonylContact O-C 3.34Å; T399-V512 WeakPolarHBondContact O-CA 3.43Å; T399-S513 PolarHBondContact N-O 3.16Å; T399-S513 PolarHBondContact O-N 3.25Å; T399-M515 HydrophobicContact CG2-CE 3.88Å
400	L	98.6	Very high	97	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133	-172.9	-50.8	175.5	0	0	0	109.9	V398 K407 V408 A435 L479 W499 F502 L509 V512	V398-L400 HydrophobicContact CG1-CD2 3.68Å; V398-L400 HydrophobicContact CG1-CG 4.27Å; L400-K407 VanDerWaalsContact O-CA 3.3Å; L400-K407 WeakPolarHBondContact O-CA 3.37Å; L400-V408 HydrophobicContact CB-CG2 3.87Å; L400-V408 HydrophobicContact CD1-CG2 4.1Å; L400-V408 HydrophobicContact CG-CG2 4.43Å; L400-V408 PolarHBondContact N-O 2.88Å; L400-V408 PolarHBondContact O-N 2.94Å; L400-A435 HydrophobicContact CD1-CB 3.99Å; L400-L479 HydrophobicContact CD2-CD2 4.07Å; L400-W499 HydrophobicContact CD1-CB 3.73Å; L400-W499 HydrophobicContact CD1-CD2 3.76Å; L400-W499 HydrophobicContact CD1-CE3 4.22Å; L400-W499 HydrophobicContact CD1-CG 3.56Å; L400-F502 HydrophobicContact CB-CD1 4.4Å; L400-F502 HydrophobicContact CB-CE1 4.46Å; L400-F502 HydrophobicContact CD1-CD1 4.31Å; L400-L509 HydrophobicContact CB-CD1 4.13Å; L400-L509 HydrophobicContact CD1-CD1 4.14Å; L400-L509 HydrophobicContact CD2-CD1 3.81Å; L400-L509 HydrophobicContact CG-CD1 4.25Å; L400-V512 HydrophobicContact CD2-CB 4.36Å; L400-V512 HydrophobicContact CD2-CG1 3.95Å; L400-V512 HydrophobicContact CD2-CG2 3.85Å
401	E	98.5	Very high	97.2	Very high	16 Å²	16	39.8 Å²	39.8	8%	0.075	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.4	173.5	-167.1	-174.5	120.3	0	0	109.6	R406 K407 K510 R511	E401-R406 WeakPolarHBondContact CA-O 3.3Å; E401-K407 HydrophobicContact CB-CG 4.31Å; E401-K407 HydrophobicContact CG-CG 3.98Å; E401-K407 WeakPolarHBondContact OE2-CE 3.35Å; E401-K407 IonicContact OE2-NZ 3.79Å; E401-K510 WeakPolarHBondContact O-CB 3.26Å; E401-K510 PolarHBondContact O-N 2.91Å; E401-K510 WeakPolarHBondContact OE1-CE 3.44Å; E401-K510 IonicContact OE1-NZ 3.44Å; E401-K510 PolarHBondContact OE1-NZ 2.88Å; E401-R511 HydrophobicContact CB-CB 3.88Å; E401-R511 HydrophobicContact CB-CG 4.4Å; E401-R511 PolarHBondContact N-O 3.16Å; E401-R511 PolarHBondContact O-N 2.76Å; E401-R511 IonicContact OE1-NH1 2.68Å; E401-R511 IonicContact OE2-NH1 3.75Å; E401-R511 PolarHBondContact OE2-NH1 3.42Å
402	D	98	Very high	97.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.202	C	C	.	.			trans	-87.6	174.8	172.4	79.7	14.8	0	0	0	113	S404 G405 R406 F502 R503 Y507 L509	D402-S404 PolarHBondContact O-N 2.85Å; D402-S404 VanDerWaalsContact OD1-C 3.24Å; D402-S404 VanDerWaalsContact OD1-CA 3.25Å; D402-S404 WeakPolarHBondContact OD1-CA 3.46Å; D402-S404 WeakPolarHBondContact OD1-CB 3.27Å; D402-S404 PolarHBondContact OD1-N 3.4Å; D402-S404 PolarHBondContact OD1-OG 3.49Å; D402-S404 PolarHBondContact OD2-OG 2.93Å; D402-G405 PolarHBondContact O-N 3.43Å; D402-G405 VanDerWaalsContact O-N 3.09Å; D402-G405 PolarHBondContact OD1-N 3.36Å; D402-R406 PolarHBondContact N-O 2.88Å; D402-R406 PolarHBondContact OD1-N 3.39Å; D402-R406 WeakPolarHBondContact OD2-CB 3.12Å; D402-F502 HydrophobicContact CB-CE1 4Å; D402-F502 HydrophobicContact CB-CZ 4.04Å; D402-R503 IonicContact OD2-CZ 3.17Å; D402-R503 IonicContact OD2-NE 3.91Å; D402-R503 IonicContact OD2-NH1 2.84Å; D402-R503 PolarHBondContact OD2-NH1 3.49Å; D402-R503 IonicContact OD2-NH2 2.68Å; D402-Y507 HydrophobicContact CB-CE1 3.95Å; D402-L509 HydrophobicContact CB-CD2 4.48Å
403	W	97.7	Very high	97.7	Very high	74 Å²	74	37.8 Å²	37.8	28%	0.28	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-14.5	-178.8	-66.5	82.9	0	0	0	114.2	G405 W483 Y484 R485 G486 G487 Y507 S508 K510	W403-G405 VanDerWaalsContact C-N 3.32Å; W403-W483 AromaticContact CH2-CH2 3.52Å; W403-W483 HydrophobicContact CH2-CH2 3.52Å; W403-W483 AromaticContact CH2-CZ2 3.44Å; W403-W483 HydrophobicContact CH2-CZ2 3.44Å; W403-W483 VanDerWaalsContact CH2-CZ2 3.44Å; W403-W483 HydrophobicContact CH2-CZ3 4.46Å; W403-W483 AromaticContact CZ2-CH2 3.92Å; W403-W483 HydrophobicContact CZ2-CH2 3.92Å; W403-W483 AromaticContact CZ2-CZ2 3.52Å; W403-W483 HydrophobicContact CZ2-CZ2 3.52Å; W403-Y484 WeakPolarHBondContact CZ2-O 3.32Å; W403-R485 HydrophobicContact CH2-CB 4.21Å; W403-R485 HydrophobicContact CH2-CG 3.75Å; W403-R485 HydrophobicContact CZ3-CG 4.04Å; W403-G486 VanDerWaalsContact CE2-N 3.28Å; W403-G486 VanDerWaalsContact CZ2-N 3.3Å; W403-G487 VanDerWaalsContact NE1-N 3.15Å; W403-Y507 WeakPolarHBondContact CB-OH 3.35Å; W403-Y507 AromaticContact CD1-CE1 3.96Å; W403-Y507 AromaticContact CD1-CZ 3.83Å; W403-Y507 PolarHBondContact N-OH 2.95Å; W403-S508 PolarHBondContact NE1-O 3Å; W403-K510 HydrophobicContact CD2-CB 3.82Å; W403-K510 HydrophobicContact CD2-CD 4.26Å; W403-K510 HydrophobicContact CD2-CG 3.98Å; W403-K510 HydrophobicContact CE3-CB 4.42Å; W403-K510 HydrophobicContact CE3-CD 4.12Å; W403-K510 HydrophobicContact CE3-CG 4.06Å; W403-K510 HydrophobicContact CG-CB 4.03Å; W403-K510 HydrophobicContact CH2-CG 4.11Å; W403-K510 HydrophobicContact CZ2-CB 4.06Å; W403-K510 HydrophobicContact CZ2-CG 4.04Å; W403-K510 HydrophobicContact CZ3-CD 4.45Å; W403-K510 HydrophobicContact CZ3-CG 4.13Å
404	S	97	Very high	97.8	Very high	88 Å²	88	36.8 Å²	36.8	62%	0.615	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	2	168.9	37.7	0	0	0	0	113.3	D402 R406	D402-S404 PolarHBondContact O-N 2.85Å; D402-S404 VanDerWaalsContact OD1-C 3.24Å; D402-S404 VanDerWaalsContact OD1-CA 3.25Å; D402-S404 WeakPolarHBondContact OD1-CA 3.46Å; D402-S404 WeakPolarHBondContact OD1-CB 3.27Å; D402-S404 PolarHBondContact OD1-N 3.4Å; D402-S404 PolarHBondContact OD1-OG 3.49Å; D402-S404 PolarHBondContact OD2-OG 2.93Å; S404-R406 VanDerWaalsContact C-N 3.32Å
405	G	96.4	Very high	97.8	Very high	40 Å²	40	36.5 Å²	36.5	41%	0.412	19%	0.189	S	C	.	.			trans	79.6	8.2	179.6	0	0	0	0	0	114.7	D402 W403 K407	D402-G405 PolarHBondContact O-N 3.43Å; D402-G405 VanDerWaalsContact O-N 3.09Å; D402-G405 PolarHBondContact OD1-N 3.36Å; W403-G405 VanDerWaalsContact C-N 3.32Å; G405-K407 PolarHBondContact O-N 3.3Å
406	R	97.8	Very high	97.9	Very high	156 Å²	156	40 Å²	40	59%	0.589	20%	0.202	S	C	*	.			trans	-70.8	128.6	173	-174.2	-176.6	-70.4	-175.7	0	108.7	E401 D402 S404 F502	E401-R406 WeakPolarHBondContact CA-O 3.3Å; D402-R406 PolarHBondContact N-O 2.88Å; D402-R406 PolarHBondContact OD1-N 3.39Å; D402-R406 WeakPolarHBondContact OD2-CB 3.12Å; S404-R406 VanDerWaalsContact C-N 3.32Å; R406-F502 HydrophobicContact CB-CZ 4.36Å; R406-F502 HydrophobicContact CG-CE2 4.25Å; R406-F502 HydrophobicContact CG-CZ 4.19Å
407	K	97.9	Very high	97.9	Very high	145 Å²	145	40 Å²	40	63%	0.63	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.1	177.9	-64.2	179.5	-177.7	-177.2	0	110.3	L400 E401 G405	L400-K407 VanDerWaalsContact O-CA 3.3Å; L400-K407 WeakPolarHBondContact O-CA 3.37Å; E401-K407 HydrophobicContact CB-CG 4.31Å; E401-K407 HydrophobicContact CG-CG 3.98Å; E401-K407 WeakPolarHBondContact OE2-CE 3.35Å; E401-K407 IonicContact OE2-NZ 3.79Å; G405-K407 PolarHBondContact O-N 3.3Å
408	V	98.4	Very high	97.9	Very high	15 Å²	15	40.6 Å²	40.6	9%	0.091	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	164.6	175.2	-62.9	0	0	0	0	109.9	L400 N434 A435 F502	L400-V408 HydrophobicContact CB-CG2 3.87Å; L400-V408 HydrophobicContact CD1-CG2 4.1Å; L400-V408 HydrophobicContact CG-CG2 4.43Å; L400-V408 PolarHBondContact N-O 2.88Å; L400-V408 PolarHBondContact O-N 2.94Å; V408-N434 VanDerWaalsContact CA-OD1 3.25Å; V408-N434 WeakPolarHBondContact CA-OD1 3.49Å; V408-N434 VanDerWaalsContact CB-OD1 3.31Å; V408-N434 WeakPolarHBondContact CB-OD1 3.47Å; V408-A435 HydrophobicContact CB-CB 3.94Å; V408-A435 HydrophobicContact CG2-CB 3.59Å; V408-F502 HydrophobicContact CB-CD2 4.47Å; V408-F502 HydrophobicContact CB-CE2 4.33Å; V408-F502 HydrophobicContact CG1-CD2 3.97Å; V408-F502 HydrophobicContact CG1-CE2 3.56Å; V408-F502 HydrophobicContact CG1-CZ 4.01Å; V408-F502 HydrophobicContact CG2-CB 4.46Å; V408-F502 HydrophobicContact CG2-CD1 3.58Å; V408-F502 HydrophobicContact CG2-CD2 3.71Å; V408-F502 HydrophobicContact CG2-CE1 3.63Å; V408-F502 HydrophobicContact CG2-CE2 3.75Å; V408-F502 HydrophobicContact CG2-CG 3.66Å; V408-F502 HydrophobicContact CG2-CZ 3.72Å
409	F	98.4	Very high	97.8	Very high	66 Å²	66	42.7 Å²	42.7	29%	0.289	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	157	178.6	75.5	-81.7	0	0	0	113.2	L397 V398 T399 E411 H432 G433 N434 A435	L397-F409 HydrophobicContact CD1-CB 3.96Å; L397-F409 HydrophobicContact CD1-CD2 3.76Å; L397-F409 HydrophobicContact CD1-CG 4.24Å; V398-F409 CarbonylContact O-C 3.24Å; V398-F409 WeakPolarHBondContact O-CA 3.44Å; T399-F409 HydrophobicContact CG2-CB 4.35Å; F409-E411 HydrophobicContact CD2-CB 4.46Å; F409-E411 HydrophobicContact CE2-CB 4.5Å; F409-H432 AromaticContact CE2-CE1 3.94Å; F409-H432 AromaticContact CE2-ND1 3.97Å; F409-H432 AromaticContact CZ-CE1 3.91Å; F409-G433 WeakPolarHBondContact O-CA 3.41Å; F409-N434 WeakPolarHBondContact CD1-OD1 3.41Å; F409-N434 PolarHBondContact N-OD1 2.9Å; F409-N434 PolarHBondContact O-N 3.42Å; F409-N434 PolarHBondContact O-OD1 3.48Å; F409-A435 VanDerWaalsContact O-CB 3.32Å; F409-A435 WeakPolarHBondContact O-CB 3.48Å; F409-A435 PolarHBondContact O-N 3.33Å
410	A	98.3	Very high	97.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	118.7	169.7	0	0	0	0	0	108.7	V398 Y412 Y431 A435 W499	V398-A410 HydrophobicContact CB-CB 4.37Å; V398-A410 PolarHBondContact N-O 2.93Å; V398-A410 PolarHBondContact O-N 3.28Å; A410-Y412 HydrophobicContact CB-CE2 3.84Å; A410-Y431 HydrophobicContact CB-CD2 4.37Å; A410-Y431 HydrophobicContact CB-CE2 3.66Å; A410-A435 HydrophobicContact CB-CB 4.29Å; A410-W499 HydrophobicContact CB-CH2 3.82Å; A410-W499 HydrophobicContact CB-CZ2 3.53Å
411	E	98.1	Very high	97.7	Very high	42 Å²	42	48 Å²	48	20%	0.196	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.4	173.6	-175.8	165.7	117.2	0	0	110.4	K395 L396 L397 F409 Y431 H432	K395-E411 HydrophobicContact CD-CG 4.26Å; K395-E411 WeakPolarHBondContact CD-OE1 3.28Å; K395-E411 IonicContact NZ-OE1 2.65Å; K395-E411 PolarHBondContact NZ-OE1 2.64Å; K395-E411 IonicContact NZ-OE2 2.64Å; K395-E411 PolarHBondContact NZ-OE2 2.76Å; L396-E411 CarbonylContact O-C 3.54Å; L396-E411 VanDerWaalsContact O-CA 3.28Å; L396-E411 WeakPolarHBondContact O-CA 3.33Å; L397-E411 HydrophobicContact CD1-CB 4.2Å; F409-E411 HydrophobicContact CD2-CB 4.46Å; F409-E411 HydrophobicContact CE2-CB 4.5Å; E411-Y431 CarbonylContact O-C 3.6Å; E411-Y431 WeakPolarHBondContact O-CA 3.45Å; E411-H432 WeakPolarHBondContact CA-O 3.32Å; E411-H432 WeakPolarHBondContact CB-O 3.49Å; E411-H432 PolarHBondContact N-O 3.24Å; E411-H432 PolarHBondContact O-N 2.82Å
412	Y	97.9	Very high	97.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	121.5	175.8	-61.1	-93.3	0	0	0	108.7	K395 L396 A410 S414 V428 R430 Y431 D437 L439 W499	K395-Y412 VanDerWaalsContact CA-O 3.28Å; K395-Y412 WeakPolarHBondContact CA-O 3.44Å; K395-Y412 VanDerWaalsContact CB-O 3.31Å; K395-Y412 WeakPolarHBondContact CB-O 3.25Å; L396-Y412 HydrophobicContact CD2-CD2 4.04Å; L396-Y412 HydrophobicContact CG-CD2 4.41Å; L396-Y412 PolarHBondContact N-O 3.01Å; L396-Y412 PolarHBondContact O-N 3.26Å; A410-Y412 HydrophobicContact CB-CE2 3.84Å; Y412-S414 PolarHBondContact O-N 2.98Å; Y412-S414 VanDerWaalsContact O-N 3.1Å; Y412-V428 HydrophobicContact CD1-CB 4.11Å; Y412-V428 HydrophobicContact CD1-CG1 4.48Å; Y412-V428 HydrophobicContact CG-CB 4.49Å; Y412-V428 HydrophobicContact CG-CG1 4.49Å; Y412-R430 WeakPolarHBondContact CA-O 3.3Å; Y412-Y431 HydrophobicContact CD1-CD2 4.46Å; Y412-Y431 AromaticContact CE1-CD2 3.73Å; Y412-Y431 HydrophobicContact CE1-CD2 3.73Å; Y412-Y431 HydrophobicContact CE1-CG 4.32Å; Y412-Y431 HydrophobicContact CE2-CD2 4.28Å; Y412-Y431 AromaticContact CZ-CD2 3.58Å; Y412-Y431 WeakPolarHBondContact OH-CD2 3.39Å; Y412-D437 WeakPolarHBondContact CE1-OD1 3.4Å; Y412-D437 PolarHBondContact OH-OD1 2.92Å; Y412-L439 HydrophobicContact CD2-CD2 4.12Å; Y412-L439 HydrophobicContact CE1-CB 4.09Å; Y412-L439 HydrophobicContact CE2-CB 4.01Å; Y412-L439 HydrophobicContact CE2-CD2 3.8Å; Y412-L439 VanDerWaalsContact OH-CB 3.25Å; Y412-L439 WeakPolarHBondContact OH-CB 3.27Å; Y412-W499 HydrophobicContact CE2-CH2 4.26Å; Y412-W499 WeakPolarHBondContact OH-CH2 3.35Å
413	A	96.4	Very high	97.7	Very high	28 Å²	28	53.7 Å²	53.7	23%	0.231	28%	0.283	C	S	.	.	S	Bend	trans	-63.2	-19.5	-171.4	0	0	0	0	0	114.8	N393 R430 N519 T522	N393-A413 PolarHBondContact ND2-O 3.04Å; A413-R430 HydrophobicContact CB-CB 4.42Å; A413-R430 PolarHBondContact N-O 2.61Å; A413-N519 PolarHBondContact O-ND2 3.28Å; A413-T522 HydrophobicContact CB-CG2 4.26Å
414	S	96.5	Very high	97.8	Very high	27 Å²	27	50.1 Å²	50.1	19%	0.189	27%	0.27	C	S	.	.			trans	-139.9	143.2	170.6	-173.6	0	0	0	0	109.2	N393 Y394 Y412 V428 G429	N393-S414 VanDerWaalsContact OD1-CB 3.32Å; N393-S414 WeakPolarHBondContact OD1-CB 3.43Å; N393-S414 PolarHBondContact OD1-OG 2.86Å; Y394-S414 CarbonylContact O-C 3.43Å; Y394-S414 VanDerWaalsContact O-CA 3.24Å; Y394-S414 WeakPolarHBondContact O-CA 3.28Å; Y412-S414 PolarHBondContact O-N 2.98Å; Y412-S414 VanDerWaalsContact O-N 3.1Å; S414-V428 CarbonylContact O-C 3.52Å; S414-V428 WeakPolarHBondContact O-CA 3.38Å; S414-G429 PolarHBondContact O-N 3.4Å
415	F	98	Very high	97.8	Very high	1 Å²	1	47.6 Å²	47.6	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	120	174.6	170.1	-97.6	0	0	0	109	I350 I385 T389 Y394 L396 L417 L426 R427 V428 W470 I516	I350-F415 HydrophobicContact CD1-CE1 3.85Å; I350-F415 HydrophobicContact CD1-CZ 3.87Å; I385-F415 HydrophobicContact CG2-CE1 3.74Å; I385-F415 HydrophobicContact CG2-CZ 4.12Å; T389-F415 HydrophobicContact CG2-CD1 3.64Å; T389-F415 HydrophobicContact CG2-CE1 3.78Å; T389-F415 WeakPolarHBondContact CG2-O 3.36Å; Y394-F415 PolarHBondContact O-N 2.68Å; L396-F415 HydrophobicContact CB-CB 3.53Å; L396-F415 HydrophobicContact CB-CD1 4.35Å; L396-F415 HydrophobicContact CB-CD2 4.04Å; L396-F415 HydrophobicContact CB-CG 3.73Å; L396-F415 HydrophobicContact CD2-CD2 3.67Å; L396-F415 HydrophobicContact CD2-CE2 3.98Å; L396-F415 HydrophobicContact CD2-CG 4.24Å; L396-F415 HydrophobicContact CG-CD2 4.34Å; L396-F415 HydrophobicContact CG-CG 4.44Å; F415-L417 HydrophobicContact CE2-CD2 4.37Å; F415-L417 HydrophobicContact CZ-CD2 4.11Å; F415-L426 HydrophobicContact CD2-CD1 3.77Å; F415-L426 HydrophobicContact CE2-CD1 3.44Å; F415-L426 VanDerWaalsContact CE2-CD1 3.44Å; F415-L426 HydrophobicContact CZ-CD1 4.46Å; F415-R427 WeakPolarHBondContact CA-O 3.45Å; F415-V428 HydrophobicContact CD2-CG1 4.03Å; F415-W470 HydrophobicContact CE2-CH2 4.4Å; F415-W470 HydrophobicContact CZ-CH2 4.33Å; F415-I516 HydrophobicContact CD1-CG2 3.65Å; F415-I516 HydrophobicContact CE1-CG2 3.84Å
416	R	97.5	Very high	97.9	Very high	100 Å²	100	45.7 Å²	45.7	38%	0.377	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	147.1	179	-167.7	-179.7	96.4	162.9	2.6	111.2	N390 E418 R427	N390-R416 VanDerWaalsContact OD1-CD 3.28Å; N390-R416 WeakPolarHBondContact OD1-CD 3.46Å; N390-R416 PolarHBondContact OD1-NE 3.34Å; R416-E418 IonicContact CZ-OE2 3.2Å; R416-E418 IonicContact NE-OE2 3.7Å; R416-E418 IonicContact NH2-OE1 3.89Å; R416-E418 IonicContact NH2-OE2 2.85Å; R416-E418 PolarHBondContact NH2-OE2 2.93Å; R416-R427 HydrophobicContact CB-CB 4.23Å; R416-R427 PolarHBondContact N-O 3.24Å; R416-R427 WeakPolarHBondContact O-CB 3.44Å; R416-R427 PolarHBondContact O-N 2.04Å
417	L	98.4	Very high	98	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	141.5	166	-51.7	-173.6	0	0	0	110.1	L382 I385 Y386 T389 N390 F415 L426 W470	L382-L417 HydrophobicContact CD2-CD1 4.09Å; I385-L417 HydrophobicContact CB-CD1 3.91Å; I385-L417 HydrophobicContact CG2-CD1 3.58Å; I385-L417 HydrophobicContact CG2-CG 4.04Å; Y386-L417 WeakPolarHBondContact CD2-O 3.43Å; T389-L417 PolarHBondContact OG1-N 3.01Å; N390-L417 PolarHBondContact ND2-O 3.02Å; F415-L417 HydrophobicContact CE2-CD2 4.37Å; F415-L417 HydrophobicContact CZ-CD2 4.11Å; L417-L426 HydrophobicContact CD2-CD1 3.96Å; L417-W470 HydrophobicContact CD1-CZ2 4.03Å; L417-W470 HydrophobicContact CD2-CH2 4.22Å; L417-W470 HydrophobicContact CD2-CZ2 3.34Å; L417-W470 HydrophobicContact CG-CZ2 4.35Å
418	E	98.3	Very high	97.9	Very high	17 Å²	17	37 Å²	37	8%	0.079	19%	0.193	C	C	.	.			trans	-72.5	167.1	164.8	-53.7	-62.1	-162	0	0	110.4	Y386 R416 D422 Y424 K425 R427	Y386-E418 WeakPolarHBondContact CD2-O 3.48Å; R416-E418 IonicContact CZ-OE2 3.2Å; R416-E418 IonicContact NE-OE2 3.7Å; R416-E418 IonicContact NH2-OE1 3.89Å; R416-E418 IonicContact NH2-OE2 2.85Å; R416-E418 PolarHBondContact NH2-OE2 2.93Å; E418-D422 HydrophobicContact CB-CB 3.57Å; E418-D422 HydrophobicContact CG-CB 4.37Å; E418-Y424 WeakPolarHBondContact O-CA 3.24Å; E418-K425 HydrophobicContact CB-CB 4.07Å; E418-K425 HydrophobicContact CG-CB 3.78Å; E418-K425 HydrophobicContact CG-CD 4.31Å; E418-K425 HydrophobicContact CG-CG 4.36Å; E418-K425 PolarHBondContact N-O 2.78Å; E418-R427 IonicContact OE1-CZ 2.63Å; E418-R427 IonicContact OE1-NE 3.82Å; E418-R427 PolarHBondContact OE1-NE 3.05Å; E418-R427 IonicContact OE1-NH2 3.88Å; E418-R427 PolarHBondContact OE1-NH2 2.9Å
419	P	97.6	Very high	97.8	Very high	45 Å²	45	37.5 Å²	37.5	29%	0.292	20%	0.201	S	C	.	.			trans	-66.8	172.7	178.1	26.3	-36.2	0	0	0	113.5	Y386 A421 D422 F423 Y424	Y386-P419 HydrophobicContact CD2-CB 4.48Å; Y386-P419 HydrophobicContact CE2-CB 3.81Å; Y386-P419 HydrophobicContact CE2-CG 4.41Å; P419-A421 PolarHBondContact O-N 2.86Å; P419-D422 CarbonylContact O-C 3.53Å; P419-D422 WeakPolarHBondContact O-CA 3.22Å; P419-D422 PolarHBondContact O-N 3.21Å; P419-F423 PolarHBondContact O-N 3.44Å; P419-Y424 PolarHBondContact O-N 3.15Å; P419-Y424 VanDerWaalsContact O-N 3.16Å
420	E	97.4	Very high	97.7	Very high	56 Å²	56	44.8 Å²	44.8	26%	0.262	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-57.6	-32.2	176	-171.6	170.9	-150	0	0	113	W364 K368 D422 F423 Y424 R452	W364-E420 HydrophobicContact CZ2-CG 4.19Å; W364-E420 PolarHBondContact NE1-OE1 2.83Å; K368-E420 WeakPolarHBondContact CE-OE2 3.16Å; K368-E420 IonicContact NZ-OE1 2.61Å; K368-E420 PolarHBondContact NZ-OE1 3.23Å; K368-E420 IonicContact NZ-OE2 3.96Å; K368-E420 PolarHBondContact NZ-OE2 2.64Å; E420-D422 PolarHBondContact O-N 2.85Å; E420-F423 WeakPolarHBondContact O-CA 3.18Å; E420-F423 PolarHBondContact O-N 3.43Å; E420-Y424 HydrophobicContact CB-CE1 4.19Å; E420-Y424 HydrophobicContact CB-CE2 3.83Å; E420-Y424 HydrophobicContact CG-CE2 3.77Å; E420-R452 IonicContact OE1-NH1 3.58Å
421	A	97.7	Very high	97.7	Very high	91 Å²	91	47.4 Å²	47.4	75%	0.752	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-61.5	-23.4	175.1	0	0	0	0	0	113.3	P419	P419-A421 PolarHBondContact O-N 2.86Å
422	D	97.9	Very high	97.5	Very high	64 Å²	64	51.1 Å²	51.1	34%	0.342	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-105.1	17.3	172.7	-103.2	-54.3	0	0	0	111.8	E418 P419 E420 Y424 K425	E418-D422 HydrophobicContact CB-CB 3.57Å; E418-D422 HydrophobicContact CG-CB 4.37Å; P419-D422 CarbonylContact O-C 3.53Å; P419-D422 WeakPolarHBondContact O-CA 3.22Å; P419-D422 PolarHBondContact O-N 3.21Å; E420-D422 PolarHBondContact O-N 2.85Å; D422-Y424 VanDerWaalsContact C-N 3.3Å; D422-Y424 PolarHBondContact O-N 2.73Å; D422-K425 WeakPolarHBondContact O-CB 3.44Å; D422-K425 PolarHBondContact O-N 3.25Å; D422-K425 IonicContact OD1-NZ 3.51Å; D422-K425 PolarHBondContact OD1-NZ 3.3Å
423	F	98.3	Very high	97.5	Very high	72 Å²	72	52.4 Å²	52.4	32%	0.316	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	38.1	178.5	-47.4	-76.2	0	0	0	114.1	W364 P419 E420 K425 Q446 F447 H454	W364-F423 HydrophobicContact CH2-CB 4.09Å; W364-F423 HydrophobicContact CH2-CD1 4.47Å; P419-F423 PolarHBondContact O-N 3.44Å; E420-F423 WeakPolarHBondContact O-CA 3.18Å; E420-F423 PolarHBondContact O-N 3.43Å; F423-K425 PolarHBondContact O-N 3.15Å; F423-Q446 HydrophobicContact CB-CB 3.95Å; F423-Q446 HydrophobicContact CB-CG 4.02Å; F423-Q446 HydrophobicContact CD2-CG 4.25Å; F423-F447 WeakPolarHBondContact O-CB 3.37Å; F423-F447 PolarHBondContact O-N 3.32Å; F423-H454 AromaticContact CD1-CE1 3.43Å; F423-H454 VanDerWaalsContact CD1-CE1 3.43Å; F423-H454 WeakPolarHBondContact CD1-CE1 3.48Å; F423-H454 AromaticContact CD1-NE2 3.47Å; F423-H454 WeakPolarHBondContact CD1-NE2 3.34Å; F423-H454 AromaticContact CE1-NE2 3.61Å; F423-H454 AromaticContact CG-CE1 3.98Å
424	Y	98.6	Very high	97.5	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	36	-179.2	-56.5	-75.6	0	0	0	114.3	W364 K368 L382 E383 E418 P419 E420 D422 L426 W470	W364-Y424 AromaticContact CH2-CD2 3.93Å; W364-Y424 HydrophobicContact CH2-CD2 3.93Å; W364-Y424 HydrophobicContact CH2-CE2 4.47Å; W364-Y424 AromaticContact CZ2-CD2 3.57Å; W364-Y424 HydrophobicContact CZ2-CD2 3.57Å; W364-Y424 AromaticContact CZ2-CE2 3.67Å; W364-Y424 HydrophobicContact CZ2-CE2 3.67Å; K368-Y424 WeakPolarHBondContact CE-OH 3.3Å; K368-Y424 WeakPolarHBondContact CG-OH 3.3Å; L382-Y424 HydrophobicContact CB-CD1 3.84Å; L382-Y424 HydrophobicContact CB-CD2 3.75Å; L382-Y424 HydrophobicContact CB-CE1 3.92Å; L382-Y424 HydrophobicContact CB-CE2 3.82Å; L382-Y424 HydrophobicContact CB-CG 3.75Å; L382-Y424 HydrophobicContact CD1-CD2 3.68Å; L382-Y424 HydrophobicContact CD1-CE2 4.04Å; L382-Y424 HydrophobicContact CD1-CG 4.25Å; L382-Y424 HydrophobicContact CD2-CD2 4.47Å; L382-Y424 HydrophobicContact CD2-CG 4.22Å; L382-Y424 HydrophobicContact CG-CD2 4.17Å; L382-Y424 HydrophobicContact CG-CG 4.3Å; E383-Y424 PolarHBondContact OE2-OH 3.45Å; E418-Y424 WeakPolarHBondContact O-CA 3.24Å; P419-Y424 PolarHBondContact O-N 3.15Å; P419-Y424 VanDerWaalsContact O-N 3.16Å; E420-Y424 HydrophobicContact CB-CE1 4.19Å; E420-Y424 HydrophobicContact CB-CE2 3.83Å; E420-Y424 HydrophobicContact CG-CE2 3.77Å; D422-Y424 VanDerWaalsContact C-N 3.3Å; D422-Y424 PolarHBondContact O-N 2.73Å; Y424-L426 PolarHBondContact O-N 2.95Å; Y424-W470 PolarHBondContact O-NE1 3.05Å
425	K	98.6	Very high	97.6	Very high	35 Å²	35	54.5 Å²	54.5	15%	0.152	27%	0.272	C	S	.	.			trans	-50.9	132	-178.1	-177.8	-170.8	-56.5	149.3	0	112.3	E418 D422 F423 G444 K445 Q446	E418-K425 HydrophobicContact CB-CB 4.07Å; E418-K425 HydrophobicContact CG-CB 3.78Å; E418-K425 HydrophobicContact CG-CD 4.31Å; E418-K425 HydrophobicContact CG-CG 4.36Å; E418-K425 PolarHBondContact N-O 2.78Å; D422-K425 WeakPolarHBondContact O-CB 3.44Å; D422-K425 PolarHBondContact O-N 3.25Å; D422-K425 IonicContact OD1-NZ 3.51Å; D422-K425 PolarHBondContact OD1-NZ 3.3Å; F423-K425 PolarHBondContact O-N 3.15Å; K425-G444 WeakPolarHBondContact CG-O 3.35Å; K425-K445 CarbonylContact C-O 3.59Å; K425-K445 VanDerWaalsContact CA-O 3.28Å; K425-K445 WeakPolarHBondContact CA-O 3.02Å; K425-Q446 HydrophobicContact CB-CG 4.28Å; K425-Q446 HydrophobicContact CG-CG 4.47Å
426	L	98.6	Very high	97.5	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	134	-176.6	-178.2	61.5	0	0	0	111.5	F415 L417 Y424 V428 L439 H442 N443 G444 K445 W470	F415-L426 HydrophobicContact CD2-CD1 3.77Å; F415-L426 HydrophobicContact CE2-CD1 3.44Å; F415-L426 VanDerWaalsContact CE2-CD1 3.44Å; F415-L426 HydrophobicContact CZ-CD1 4.46Å; L417-L426 HydrophobicContact CD2-CD1 3.96Å; Y424-L426 PolarHBondContact O-N 2.95Å; L426-V428 HydrophobicContact CD1-CG1 3.93Å; L426-V428 HydrophobicContact CD2-CG1 4.17Å; L426-V428 HydrophobicContact CG-CG1 4.06Å; L426-L439 HydrophobicContact CD2-CD1 4.3Å; L426-L439 HydrophobicContact CD2-CG 4.35Å; L426-H442 HydrophobicContact CD2-CB 4.04Å; L426-N443 PolarHBondContact O-OD1 2.86Å; L426-G444 VanDerWaalsContact O-CA 3.3Å; L426-G444 WeakPolarHBondContact O-CA 3.41Å; L426-G444 PolarHBondContact O-N 3.36Å; L426-K445 PolarHBondContact N-O 3.46Å; L426-W470 HydrophobicContact CB-CB 4.15Å; L426-W470 HydrophobicContact CB-CD2 3.9Å; L426-W470 HydrophobicContact CB-CG 3.62Å; L426-W470 HydrophobicContact CD1-CD2 4.26Å; L426-W470 HydrophobicContact CD1-CE3 4.41Å; L426-W470 HydrophobicContact CD1-CZ2 4.39Å; L426-W470 HydrophobicContact CD2-CB 4.28Å; L426-W470 HydrophobicContact CD2-CD2 4.01Å; L426-W470 HydrophobicContact CD2-CE3 3.99Å; L426-W470 HydrophobicContact CD2-CG 4.16Å; L426-W470 HydrophobicContact CG-CD2 4.28Å; L426-W470 HydrophobicContact CG-CG 4.4Å
427	R	98.3	Very high	97.6	Very high	105 Å²	105	52.1 Å²	52.1	40%	0.396	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	121.4	162.4	-56.3	-59.7	-173	170.1	6.2	108.9	F415 R416 E418 N443	F415-R427 WeakPolarHBondContact CA-O 3.45Å; R416-R427 HydrophobicContact CB-CB 4.23Å; R416-R427 PolarHBondContact N-O 3.24Å; R416-R427 WeakPolarHBondContact O-CB 3.44Å; R416-R427 PolarHBondContact O-N 2.04Å; E418-R427 IonicContact OE1-CZ 2.63Å; E418-R427 IonicContact OE1-NE 3.82Å; E418-R427 PolarHBondContact OE1-NE 3.05Å; E418-R427 IonicContact OE1-NH2 3.88Å; E418-R427 PolarHBondContact OE1-NH2 2.9Å; R427-N443 WeakPolarHBondContact CA-OD1 3.46Å
428	V	97.4	Very high	97.5	Very high	12 Å²	12	52.1 Å²	52.1	7%	0.073	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	141.3	169.8	-72.5	0	0	0	0	111.2	Y412 S414 F415 L426 L439 N443	Y412-V428 HydrophobicContact CD1-CB 4.11Å; Y412-V428 HydrophobicContact CD1-CG1 4.48Å; Y412-V428 HydrophobicContact CG-CB 4.49Å; Y412-V428 HydrophobicContact CG-CG1 4.49Å; S414-V428 CarbonylContact O-C 3.52Å; S414-V428 WeakPolarHBondContact O-CA 3.38Å; F415-V428 HydrophobicContact CD2-CG1 4.03Å; L426-V428 HydrophobicContact CD1-CG1 3.93Å; L426-V428 HydrophobicContact CD2-CG1 4.17Å; L426-V428 HydrophobicContact CG-CG1 4.06Å; V428-L439 HydrophobicContact CG1-CD2 4.12Å; V428-N443 HydrophobicContact CG2-CB 3.57Å; V428-N443 VanDerWaalsContact CG2-CG 3.43Å; V428-N443 PolarHBondContact N-OD1 2.86Å; V428-N443 PolarHBondContact O-ND2 3.07Å
429	G	95.3	Very high	97.5	Very high	26 Å²	26	51.3 Å²	51.3	27%	0.268	27%	0.267	S	S	.	.			trans	-90.5	-159.7	175.2	0	0	0	0	0	113	S414 Y431	S414-G429 PolarHBondContact O-N 3.4Å; G429-Y431 PolarHBondContact O-N 2.83Å
430	R	96.4	Very high	97.5	Very high	220 Å²	220	52 Å²	52	83%	0.83	27%	0.271	S	S	*	.			trans	-59	130	-178	-176.9	177.6	179.3	178.6	1.1	112.3	Y412 A413	Y412-R430 WeakPolarHBondContact CA-O 3.3Å; A413-R430 HydrophobicContact CB-CB 4.42Å; A413-R430 PolarHBondContact N-O 2.61Å
431	Y	97.6	Very high	97.6	Very high	55 Å²	55	53.6 Å²	53.6	22%	0.216	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	146.1	172.9	170.7	-96.7	0	0	0	113.3	A410 E411 Y412 G429 G433 G436 D437	A410-Y431 HydrophobicContact CB-CD2 4.37Å; A410-Y431 HydrophobicContact CB-CE2 3.66Å; E411-Y431 CarbonylContact O-C 3.6Å; E411-Y431 WeakPolarHBondContact O-CA 3.45Å; Y412-Y431 HydrophobicContact CD1-CD2 4.46Å; Y412-Y431 AromaticContact CE1-CD2 3.73Å; Y412-Y431 HydrophobicContact CE1-CD2 3.73Å; Y412-Y431 HydrophobicContact CE1-CG 4.32Å; Y412-Y431 HydrophobicContact CE2-CD2 4.28Å; Y412-Y431 AromaticContact CZ-CD2 3.58Å; Y412-Y431 WeakPolarHBondContact OH-CD2 3.39Å; G429-Y431 PolarHBondContact O-N 2.83Å; Y431-G433 PolarHBondContact OH-O 3.24Å; Y431-G436 WeakPolarHBondContact CE2-O 3.23Å; Y431-G436 VanDerWaalsContact CZ-C 3.48Å; Y431-G436 WeakPolarHBondContact OH-CA 3.45Å; Y431-G436 PolarHBondContact OH-N 3.46Å; Y431-G436 PolarHBondContact OH-O 2.81Å; Y431-D437 WeakPolarHBondContact CB-OD2 3.36Å; Y431-D437 HydrophobicContact CD1-CB 3.95Å; Y431-D437 HydrophobicContact CD2-CB 3.78Å; Y431-D437 HydrophobicContact CE1-CB 4.14Å; Y431-D437 HydrophobicContact CE2-CB 3.92Å; Y431-D437 HydrophobicContact CG-CB 3.77Å
432	H	95.7	Very high	97.6	Very high	120 Å²	120	49.3 Å²	49.3	56%	0.556	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-151	133.4	163	162.2	-101.1	0	0	0	109.7	F409 E411	F409-H432 AromaticContact CE2-CE1 3.94Å; F409-H432 AromaticContact CE2-ND1 3.97Å; F409-H432 AromaticContact CZ-CE1 3.91Å; E411-H432 WeakPolarHBondContact CA-O 3.32Å; E411-H432 WeakPolarHBondContact CB-O 3.49Å; E411-H432 PolarHBondContact N-O 3.24Å; E411-H432 PolarHBondContact O-N 2.82Å
433	G	96.7	Very high	97.6	Very high	26 Å²	26	49.2 Å²	49.2	27%	0.268	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	168	-174.9	176	0	0	0	0	0	114	F409 Y431	F409-G433 WeakPolarHBondContact O-CA 3.41Å; Y431-G433 PolarHBondContact OH-O 3.24Å
434	N	97.6	Very high	97.6	Very high	96 Å²	96	47.2 Å²	47.2	51%	0.513	24%	0.238	S	C	.	.	S	Bend	trans	-118.7	4.4	176.9	70	-6.4	0	0	0	113.7	V408 F409 G436	V408-N434 VanDerWaalsContact CA-OD1 3.25Å; V408-N434 WeakPolarHBondContact CA-OD1 3.49Å; V408-N434 VanDerWaalsContact CB-OD1 3.31Å; V408-N434 WeakPolarHBondContact CB-OD1 3.47Å; F409-N434 WeakPolarHBondContact CD1-OD1 3.41Å; F409-N434 PolarHBondContact N-OD1 2.9Å; F409-N434 PolarHBondContact O-N 3.42Å; F409-N434 PolarHBondContact O-OD1 3.48Å; N434-G436 VanDerWaalsContact C-N 3.34Å
435	A	96.9	Very high	97.6	Very high	3 Å²	3	49.4 Å²	49.4	3%	0.025	25%	0.248	C	C	.	.	S	Bend	trans	-82.7	-8.4	172.8	0	0	0	0	0	114.2	L400 V408 F409 A410 W499	L400-A435 HydrophobicContact CD1-CB 3.99Å; V408-A435 HydrophobicContact CB-CB 3.94Å; V408-A435 HydrophobicContact CG2-CB 3.59Å; F409-A435 VanDerWaalsContact O-CB 3.32Å; F409-A435 WeakPolarHBondContact O-CB 3.48Å; F409-A435 PolarHBondContact O-N 3.33Å; A410-A435 HydrophobicContact CB-CB 4.29Å; A435-W499 PolarHBondContact O-NE1 3.04Å
436	G	97.5	Very high	97.6	Very high	16 Å²	16	50.5 Å²	50.5	17%	0.165	25%	0.253	C	S	.	.			trans	72.6	167.4	-159.3	0	0	0	0	0	112.6	Y431 N434 W499 E501	Y431-G436 WeakPolarHBondContact CE2-O 3.23Å; Y431-G436 VanDerWaalsContact CZ-C 3.48Å; Y431-G436 WeakPolarHBondContact OH-CA 3.45Å; Y431-G436 PolarHBondContact OH-N 3.46Å; Y431-G436 PolarHBondContact OH-O 2.81Å; N434-G436 VanDerWaalsContact C-N 3.34Å; G436-W499 WeakPolarHBondContact O-CZ2 3.48Å; G436-W499 PolarHBondContact O-NE1 3.41Å; G436-E501 VanDerWaalsContact C-OE2 3.24Å; G436-E501 WeakPolarHBondContact CA-OE2 3.32Å
437	D	97.9	Very high	97.6	Very high	35 Å²	35	50.5 Å²	50.5	19%	0.187	25%	0.253	C	S	.	.			trans	-102.1	92.5	-177.1	-170.9	-2.3	0	0	0	112	Y412 Y431 L439 T440 E501	Y412-D437 WeakPolarHBondContact CE1-OD1 3.4Å; Y412-D437 PolarHBondContact OH-OD1 2.92Å; Y431-D437 WeakPolarHBondContact CB-OD2 3.36Å; Y431-D437 HydrophobicContact CD1-CB 3.95Å; Y431-D437 HydrophobicContact CD2-CB 3.78Å; Y431-D437 HydrophobicContact CE1-CB 4.14Å; Y431-D437 HydrophobicContact CE2-CB 3.92Å; Y431-D437 HydrophobicContact CG-CB 3.77Å; D437-L439 PolarHBondContact OD1-N 2.82Å; D437-L439 VanDerWaalsContact OD1-N 3.14Å; D437-T440 VanDerWaalsContact CG-OG1 3.26Å; D437-T440 PolarHBondContact OD1-N 3.39Å; D437-T440 PolarHBondContact OD1-OG1 2.95Å; D437-T440 WeakPolarHBondContact OD2-CB 3.31Å; D437-T440 PolarHBondContact OD2-OG1 3.48Å; D437-E501 PolarHBondContact N-OE2 2.84Å
438	S	97.9	Very high	97.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.234	C	C	.	.			trans	-105.7	17.5	174.7	-56.5	0	0	0	0	113.6	H442 H476 S477 W499 A500 E501	S438-H442 PolarHBondContact O-CD2 2.79Å; S438-H476 WeakPolarHBondContact CB-O 3.49Å; S438-H476 CarbonylContact O-C 3.57Å; S438-S477 VanDerWaalsContact O-CB 3.24Å; S438-S477 WeakPolarHBondContact O-CB 3.2Å; S438-S477 PolarHBondContact O-N 3.4Å; S438-S477 PolarHBondContact O-OG 3.3Å; S438-W499 PolarHBondContact OG-NE1 2.92Å; S438-A500 PolarHBondContact OG-N 2.94Å; S438-E501 PolarHBondContact OG-N 3.21Å; S438-E501 VanDerWaalsContact OG-N 3.07Å
439	L	98.3	Very high	97.7	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	-117.6	-29.1	177.2	-164.5	66.2	0	0	0	113.7	L396 Y412 L426 V428 D437 W441 H442 W469 W499	L396-L439 HydrophobicContact CD2-CD2 3.6Å; Y412-L439 HydrophobicContact CD2-CD2 4.12Å; Y412-L439 HydrophobicContact CE1-CB 4.09Å; Y412-L439 HydrophobicContact CE2-CB 4.01Å; Y412-L439 HydrophobicContact CE2-CD2 3.8Å; Y412-L439 VanDerWaalsContact OH-CB 3.25Å; Y412-L439 WeakPolarHBondContact OH-CB 3.27Å; L426-L439 HydrophobicContact CD2-CD1 4.3Å; L426-L439 HydrophobicContact CD2-CG 4.35Å; V428-L439 HydrophobicContact CG1-CD2 4.12Å; D437-L439 PolarHBondContact OD1-N 2.82Å; D437-L439 VanDerWaalsContact OD1-N 3.14Å; L439-W441 PolarHBondContact O-N 3.19Å; L439-W441 VanDerWaalsContact O-N 3.13Å; L439-H442 HydrophobicContact CD1-CB 4.34Å; L439-H442 WeakPolarHBondContact O-CA 3.3Å; L439-H442 VanDerWaalsContact O-CB 3.26Å; L439-H442 WeakPolarHBondContact O-CB 3.4Å; L439-H442 PolarHBondContact O-N 3.36Å; L439-W469 HydrophobicContact CD1-CH2 4.41Å; L439-W469 HydrophobicContact CD1-CZ2 3.62Å; L439-W499 HydrophobicContact CB-CH2 3.83Å; L439-W499 HydrophobicContact CB-CZ3 4.29Å
440	T	97.9	Very high	97.8	Very high	59 Å²	59	46.1 Å²	46.1	36%	0.362	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-60.3	-27.8	-180	-66.5	0	0	0	0	113.1	D437 H442 N443	D437-T440 VanDerWaalsContact CG-OG1 3.26Å; D437-T440 PolarHBondContact OD1-N 3.39Å; D437-T440 PolarHBondContact OD1-OG1 2.95Å; D437-T440 WeakPolarHBondContact OD2-CB 3.31Å; D437-T440 PolarHBondContact OD2-OG1 3.48Å; T440-H442 PolarHBondContact O-N 3.21Å; T440-N443 WeakPolarHBondContact O-CB 3.27Å; T440-N443 PolarHBondContact O-N 3.04Å
441	W	97.6	Very high	97.8	Very high	91 Å²	91	39.2 Å²	39.2	35%	0.345	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-66.4	-14.2	172.8	-167.3	68.2	0	0	0	114.4	L439 N472 H476	L439-W441 PolarHBondContact O-N 3.19Å; L439-W441 VanDerWaalsContact O-N 3.13Å; W441-N472 HydrophobicContact CD2-CB 4.14Å; W441-N472 VanDerWaalsContact CD2-ND2 3.34Å; W441-N472 HydrophobicContact CE3-CB 3.76Å; W441-N472 HydrophobicContact CH2-CB 3.79Å; W441-N472 HydrophobicContact CZ2-CB 4.1Å; W441-N472 HydrophobicContact CZ3-CB 3.6Å; W441-N472 PolarHBondContact NE1-ND2 2.94Å; W441-N472 PolarHBondContact O-ND2 2.95Å; W441-H476 AromaticContact CD2-CD2 3.71Å; W441-H476 AromaticContact CD2-CE1 3.89Å; W441-H476 AromaticContact CD2-NE2 3.63Å; W441-H476 AromaticContact CE2-NE2 3.91Å; W441-H476 HydrophobicContact CE3-CB 4.29Å; W441-H476 AromaticContact CE3-CD2 3.36Å; W441-H476 AromaticContact CE3-CG 3.73Å; W441-H476 AromaticContact CE3-NE2 3.77Å; W441-H476 AromaticContact CG-CE1 3.76Å; W441-H476 AromaticContact CG-ND1 3.88Å; W441-H476 AromaticContact CZ3-CD2 3.66Å
442	H	98.3	Very high	97.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-94.7	-3.3	173.4	-60.9	-95.8	0	0	0	112.7	L426 S438 L439 T440 G444 K445 W469 W470 A475 H476 S477	L426-H442 HydrophobicContact CD2-CB 4.04Å; S438-H442 PolarHBondContact O-CD2 2.79Å; L439-H442 HydrophobicContact CD1-CB 4.34Å; L439-H442 WeakPolarHBondContact O-CA 3.3Å; L439-H442 VanDerWaalsContact O-CB 3.26Å; L439-H442 WeakPolarHBondContact O-CB 3.4Å; L439-H442 PolarHBondContact O-N 3.36Å; T440-H442 PolarHBondContact O-N 3.21Å; H442-G444 PolarHBondContact O-N 3.07Å; H442-K445 WeakPolarHBondContact O-CB 3.34Å; H442-K445 WeakPolarHBondContact O-CG 3.32Å; H442-K445 PolarHBondContact O-N 2.85Å; H442-W469 AromaticContact CE1-CD1 3.5Å; H442-W469 AromaticContact CE1-NE1 3.35Å; H442-W469 PolarHBondContact CE1-NE1 3.41Å; H442-W469 AromaticContact CG-NE1 3.92Å; H442-W469 AromaticContact ND1-CD1 3.52Å; H442-W469 AromaticContact ND1-NE1 3.4Å; H442-W469 PolarHBondContact ND1-NE1 3.17Å; H442-W469 AromaticContact NE2-NE1 3.87Å; H442-W470 HydrophobicContact CB-CB 4.36Å; H442-W470 PolarHBondContact ND1-O 2.8Å; H442-A475 VanDerWaalsContact CE1-CA 3.48Å; H442-A475 WeakPolarHBondContact CE1-CA 3.24Å; H442-A475 VanDerWaalsContact CE1-CB 3.44Å; H442-A475 WeakPolarHBondContact CE1-CB 3.12Å; H442-H476 PolarHBondContact NE2-N 3.34Å; H442-S477 PolarHBondContact NE2-N 3.04Å
443	N	98.3	Very high	97.9	Very high	62 Å²	62	38.9 Å²	38.9	33%	0.332	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	136.4	-180	-161.6	7	0	0	0	111.3	L426 R427 V428 T440 K445	L426-N443 PolarHBondContact O-OD1 2.86Å; R427-N443 WeakPolarHBondContact CA-OD1 3.46Å; V428-N443 HydrophobicContact CG2-CB 3.57Å; V428-N443 VanDerWaalsContact CG2-CG 3.43Å; V428-N443 PolarHBondContact N-OD1 2.86Å; V428-N443 PolarHBondContact O-ND2 3.07Å; T440-N443 WeakPolarHBondContact O-CB 3.27Å; T440-N443 PolarHBondContact O-N 3.04Å; N443-K445 PolarHBondContact O-N 3.04Å
444	G	98.1	Very high	97.9	Very high	30 Å²	30	39.5 Å²	39.5	31%	0.309	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	4	-176.8	0	0	0	0	0	115.3	K425 L426 H442	K425-G444 WeakPolarHBondContact CG-O 3.35Å; L426-G444 VanDerWaalsContact O-CA 3.3Å; L426-G444 WeakPolarHBondContact O-CA 3.41Å; L426-G444 PolarHBondContact O-N 3.36Å; H442-G444 PolarHBondContact O-N 3.07Å
445	K	98.5	Very high	97.9	Very high	47 Å²	47	35.8 Å²	35.8	20%	0.204	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-87	145.7	177.4	-56.8	-61.3	174.8	161.3	0	111.9	K425 L426 H442 N443 W470 N472	K425-K445 CarbonylContact C-O 3.59Å; K425-K445 VanDerWaalsContact CA-O 3.28Å; K425-K445 WeakPolarHBondContact CA-O 3.02Å; L426-K445 PolarHBondContact N-O 3.46Å; H442-K445 WeakPolarHBondContact O-CB 3.34Å; H442-K445 WeakPolarHBondContact O-CG 3.32Å; H442-K445 PolarHBondContact O-N 2.85Å; N443-K445 PolarHBondContact O-N 3.04Å; K445-W470 HydrophobicContact CB-CB 4.23Å; K445-N472 HydrophobicContact CD-CB 4.32Å; K445-N472 VanDerWaalsContact CE-ND2 3.35Å; K445-N472 WeakPolarHBondContact CE-ND2 3.21Å; K445-N472 WeakPolarHBondContact CE-OD1 3.47Å; K445-N472 HydrophobicContact CG-CB 4.18Å; K445-N472 PolarHBondContact NZ-OD1 2.7Å
446	Q	98.6	Very high	97.9	Very high	58 Å²	58	39.8 Å²	39.8	27%	0.271	21%	0.209	S	C	.	.	P	Polyproline II helix	trans	-77	154.9	175.9	-70.9	167.4	-15.9	0	0	109.7	F423 K425 H454 W470	F423-Q446 HydrophobicContact CB-CB 3.95Å; F423-Q446 HydrophobicContact CB-CG 4.02Å; F423-Q446 HydrophobicContact CD2-CG 4.25Å; K425-Q446 HydrophobicContact CB-CG 4.28Å; K425-Q446 HydrophobicContact CG-CG 4.47Å; Q446-H454 HydrophobicContact CB-CB 3.7Å; Q446-W470 WeakPolarHBondContact O-CA 3.37Å
447	F	98.8	Very high	97.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-75.5	139.9	175.6	-159.3	-96.8	0	0	0	109.8	W364 Y367 W379 L382 F423 T449 H454 G468 W470	W364-F447 HydrophobicContact CH2-CB 4.33Å; W364-F447 HydrophobicContact CZ3-CB 4.19Å; W364-F447 HydrophobicContact CZ3-CD1 4.15Å; W364-F447 WeakPolarHBondContact CZ3-O 3.35Å; Y367-F447 AromaticContact CD1-CE1 3.77Å; Y367-F447 HydrophobicContact CD1-CE1 3.77Å; Y367-F447 AromaticContact CD1-CZ 3.52Å; Y367-F447 HydrophobicContact CD1-CZ 3.52Å; Y367-F447 HydrophobicContact CD2-CE1 4.34Å; Y367-F447 HydrophobicContact CE1-CE1 4.43Å; Y367-F447 AromaticContact CE1-CZ 3.92Å; Y367-F447 HydrophobicContact CE1-CZ 3.92Å; Y367-F447 AromaticContact CG-CE1 3.73Å; Y367-F447 HydrophobicContact CG-CE1 3.73Å; Y367-F447 AromaticContact CG-CZ 4Å; Y367-F447 HydrophobicContact CG-CZ 4Å; W379-F447 HydrophobicContact CH2-CE2 4.37Å; W379-F447 HydrophobicContact CZ2-CE2 4.31Å; W379-F447 HydrophobicContact CZ2-CZ 4.34Å; L382-F447 HydrophobicContact CD1-CD1 3.58Å; L382-F447 HydrophobicContact CD1-CD2 4.49Å; L382-F447 HydrophobicContact CD1-CE1 3.75Å; L382-F447 HydrophobicContact CD1-CG 3.96Å; L382-F447 HydrophobicContact CD1-CZ 4.26Å; L382-F447 HydrophobicContact CD2-CD1 4.3Å; L382-F447 HydrophobicContact CD2-CD2 3.72Å; L382-F447 HydrophobicContact CD2-CE1 4.41Å; L382-F447 HydrophobicContact CD2-CE2 3.84Å; L382-F447 HydrophobicContact CD2-CG 3.93Å; L382-F447 HydrophobicContact CD2-CZ 4.18Å; L382-F447 HydrophobicContact CG-CE1 4.49Å; F423-F447 WeakPolarHBondContact O-CB 3.37Å; F423-F447 PolarHBondContact O-N 3.32Å; F447-T449 HydrophobicContact CD1-CG2 3.96Å; F447-T449 HydrophobicContact CE1-CG2 3.64Å; F447-H454 PolarHBondContact O-ND1 2.93Å; F447-G468 VanDerWaalsContact CZ-O 3.3Å; F447-G468 WeakPolarHBondContact CZ-O 3.48Å; F447-W470 AromaticContact CD2-CD1 3.83Å; F447-W470 AromaticContact CD2-CD2 3.9Å; F447-W470 HydrophobicContact CD2-CD2 3.9Å; F447-W470 AromaticContact CD2-CE2 3.61Å; F447-W470 HydrophobicContact CD2-CG 4.04Å; F447-W470 HydrophobicContact CD2-CZ2 4.06Å; F447-W470 AromaticContact CD2-NE1 3.6Å; F447-W470 HydrophobicContact CE2-CD2 4.34Å; F447-W470 HydrophobicContact CE2-CZ2 4.26Å
448	T	98.6	Very high	97.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-130	137.9	-178.1	-71.6	0	0	0	0	110.1	R452 H454 D455 A462 G468 W469 Y471	T448-R452 WeakPolarHBondContact CA-O 2.97Å; T448-H454 WeakPolarHBondContact OG1-CA 3.4Å; T448-H454 PolarHBondContact OG1-N 2.98Å; T448-D455 HydrophobicContact CG2-CB 4.41Å; T448-D455 PolarHBondContact OG1-N 3.44Å; T448-A462 HydrophobicContact CG2-CB 4.28Å; T448-G468 VanDerWaalsContact O-CA 3.3Å; T448-G468 WeakPolarHBondContact O-CA 3.47Å; T448-W469 PolarHBondContact N-O 3.31Å; T448-W469 PolarHBondContact O-N 2.9Å; T448-W469 VanDerWaalsContact O-N 3.07Å; T448-Y471 HydrophobicContact CG2-CD2 4.02Å
449	T	98.4	Very high	97.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-130.4	173.3	176.4	55.7	0	0	0	0	110.5	W364 Y367 F447 D451 R452 N460	W364-T449 HydrophobicContact CE3-CG2 4.25Å; W364-T449 PolarHBondContact N-OG1 3.37Å; Y367-T449 HydrophobicContact CD2-CG2 3.7Å; Y367-T449 HydrophobicContact CE2-CG2 4.43Å; Y367-T449 HydrophobicContact CG-CG2 4.16Å; F447-T449 HydrophobicContact CD1-CG2 3.96Å; F447-T449 HydrophobicContact CE1-CG2 3.64Å; T449-D451 VanDerWaalsContact CB-OD1 3.3Å; T449-D451 WeakPolarHBondContact CB-OD1 3.35Å; T449-D451 PolarHBondContact O-N 3.43Å; T449-D451 PolarHBondContact OG1-OD1 3.44Å; T449-R452 PolarHBondContact N-O 2.89Å; T449-R452 CarbonylContact O-C 3.59Å; T449-R452 PolarHBondContact O-N 2.82Å; T449-R452 VanDerWaalsContact O-O 3.04Å; T449-N460 PolarHBondContact O-ND2 2.86Å
450	L	97.4	Very high	97.5	Very high	50 Å²	50	50.8 Å²	50.8	26%	0.262	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-19.1	-179.1	71.3	91.9	0	0	0	114.5	F361 R362 H463	F361-L450 HydrophobicContact CD1-CD2 4.25Å; F361-L450 HydrophobicContact CD2-CB 4.4Å; F361-L450 HydrophobicContact CD2-CD2 3.92Å; F361-L450 HydrophobicContact CE1-CD2 4.07Å; F361-L450 HydrophobicContact CE2-CB 3.58Å; F361-L450 HydrophobicContact CE2-CD2 3.75Å; F361-L450 HydrophobicContact CE2-CG 4.31Å; F361-L450 HydrophobicContact CG-CD2 4.18Å; F361-L450 HydrophobicContact CZ-CB 3.82Å; F361-L450 HydrophobicContact CZ-CD2 3.82Å; F361-L450 HydrophobicContact CZ-CG 4.39Å; R362-L450 WeakPolarHBondContact O-CD2 3.21Å; L450-H463 PolarHBondContact O-CE1 3.32Å
451	D	97.9	Very high	97.5	Very high	75 Å²	75	48 Å²	48	40%	0.401	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-6.5	-176	62	-43.7	0	0	0	113.6	N363 W364 T449	N363-D451 WeakPolarHBondContact CA-OD1 3.36Å; N363-D451 HydrophobicContact CB-CB 4.48Å; N363-D451 WeakPolarHBondContact CB-OD2 3.07Å; W364-D451 PolarHBondContact N-OD1 3.09Å; W364-D451 PolarHBondContact N-OD2 2.99Å; T449-D451 VanDerWaalsContact CB-OD1 3.3Å; T449-D451 WeakPolarHBondContact CB-OD1 3.35Å; T449-D451 PolarHBondContact O-N 3.43Å; T449-D451 PolarHBondContact OG1-OD1 3.44Å
452	R	97.4	Very high	97.5	Very high	95 Å²	95	43.7 Å²	43.7	36%	0.358	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-141.7	108.9	175.7	-65.7	-160.8	-170.5	173.3	2.7	110.3	W364 E420 T448 T449	W364-R452 HydrophobicContact CB-CG 4.08Å; W364-R452 VanDerWaalsContact CD1-NH1 3.3Å; W364-R452 HydrophobicContact CD2-CG 4.4Å; W364-R452 VanDerWaalsContact CE2-NH1 3.28Å; W364-R452 HydrophobicContact CE3-CB 3.94Å; W364-R452 HydrophobicContact CE3-CG 4.25Å; W364-R452 HydrophobicContact CG-CG 4.35Å; W364-R452 HydrophobicContact CZ3-CB 4.45Å; E420-R452 IonicContact OE1-NH1 3.58Å; T448-R452 WeakPolarHBondContact CA-O 2.97Å; T449-R452 PolarHBondContact N-O 2.89Å; T449-R452 CarbonylContact O-C 3.59Å; T449-R452 PolarHBondContact O-N 2.82Å; T449-R452 VanDerWaalsContact O-O 3.04Å
453	D	98	Very high	97.4	Very high	73 Å²	73	48.1 Å²	48.1	39%	0.39	25%	0.254	S	S	.	.			trans	-92.7	113.2	-179.7	-162.5	-7.8	0	0	0	110.6	D455 N460	D453-D455 PolarHBondContact OD1-N 3.11Å; D453-N460 HydrophobicContact CB-CB 4.24Å; D453-N460 WeakPolarHBondContact OD2-CA 3.37Å; D453-N460 VanDerWaalsContact OD2-CB 3.24Å; D453-N460 WeakPolarHBondContact OD2-CB 3.28Å; D453-N460 PolarHBondContact OD2-N 3.32Å
454	H	97.1	Very high	97.3	Very high	39 Å²	39	48.9 Å²	48.9	18%	0.181	25%	0.253	C	S	.	.			trans	-134.7	20	176.2	-46.8	125.3	0	0	0	111.4	W364 F423 Q446 F447 T448	W364-H454 AromaticContact CH2-CE1 3.92Å; W364-H454 AromaticContact CZ3-CE1 3.69Å; W364-H454 AromaticContact CZ3-ND1 3.71Å; F423-H454 AromaticContact CD1-CE1 3.43Å; F423-H454 VanDerWaalsContact CD1-CE1 3.43Å; F423-H454 WeakPolarHBondContact CD1-CE1 3.48Å; F423-H454 AromaticContact CD1-NE2 3.47Å; F423-H454 WeakPolarHBondContact CD1-NE2 3.34Å; F423-H454 AromaticContact CE1-NE2 3.61Å; F423-H454 AromaticContact CG-CE1 3.98Å; Q446-H454 HydrophobicContact CB-CB 3.7Å; F447-H454 PolarHBondContact O-ND1 2.93Å; T448-H454 WeakPolarHBondContact OG1-CA 3.4Å; T448-H454 PolarHBondContact OG1-N 2.98Å
455	D	96.6	Very high	97.2	Very high	19 Å²	19	47.9 Å²	47.9	10%	0.102	24%	0.24	C	C	.	.	S	Bend	trans	-85.5	-175.9	175.2	73.5	59.3	0	0	0	110.9	T448 D453 Y457 C461	T448-D455 HydrophobicContact CG2-CB 4.41Å; T448-D455 PolarHBondContact OG1-N 3.44Å; D453-D455 PolarHBondContact OD1-N 3.11Å; D455-Y457 WeakPolarHBondContact OD1-CA 3.39Å; D455-Y457 WeakPolarHBondContact OD1-CB 3.09Å; D455-Y457 PolarHBondContact OD1-N 3.1Å; D455-C461 VanDerWaalsContact CG-SG 3.57Å; D455-C461 WeakPolarHBondContact OD2-CB 3.1Å; D455-C461 PolarHBondContact OD2-N 3.35Å; D455-C461 PolarHBondContact OD2-SG 3.13Å; D455-C461 VanDerWaalsContact OD2-SG 3.34Å
456	V	95.9	Very high	97.1	Very high	87 Å²	87	48.7 Å²	48.7	53%	0.527	24%	0.244	S	C	.	.	S	Bend	trans	-111.5	12.2	-177.5	-56.8	0	0	0	0	112.7	N472 A473	V456-N472 WeakPolarHBondContact CG2-O 3.38Å; V456-N472 WeakPolarHBondContact CG2-OD1 2.99Å; V456-N472 PolarHBondContact N-O 3.39Å; V456-A473 HydrophobicContact CG2-CB 4.29Å
457	Y	95.8	Very high	97.1	Very high	108 Å²	108	46 Å²	46	42%	0.424	23%	0.231	S	C	.	.	S	Bend	trans	-84.1	167	173	-172	-137	0	0	0	110.3	D455 G459 C461 Y464 A473 C474	D455-Y457 WeakPolarHBondContact OD1-CA 3.39Å; D455-Y457 WeakPolarHBondContact OD1-CB 3.09Å; D455-Y457 PolarHBondContact OD1-N 3.1Å; Y457-G459 WeakPolarHBondContact CD1-O 3.41Å; Y457-G459 PolarHBondContact O-N 3.1Å; Y457-C461 VanDerWaalsContact CB-SG 3.55Å; Y457-Y464 HydrophobicContact CE1-CD2 4.29Å; Y457-Y464 AromaticContact CE1-CE2 3.95Å; Y457-Y464 HydrophobicContact CE1-CE2 3.95Å; Y457-A473 HydrophobicContact CD2-CB 4.41Å; Y457-C474 VanDerWaalsContact CD1-SG 3.5Å
458	T	95.4	Very high	97.1	Very high	140 Å²	140	46 Å²	46	86%	0.859	23%	0.231	S	C	*	.	S	Bend	trans	-79	0.7	-177.9	47.1	0	0	0	0	113.7
459	G	95.1	Very high	97.1	Very high	20 Å²	20	46 Å²	46	21%	0.206	23%	0.231	C	C	.	.	S	Bend	trans	-166.7	165.9	169	0	0	0	0	0	110.3	Y457 C461	Y457-G459 WeakPolarHBondContact CD1-O 3.41Å; Y457-G459 PolarHBondContact O-N 3.1Å; G459-C461 PolarHBondContact O-N 3.02Å; G459-C461 VanDerWaalsContact O-N 3.17Å
460	N	97.3	Very high	97.1	Very high	14 Å²	14	46 Å²	46	8%	0.075	23%	0.231	C	C	.	.			trans	-59.8	113.7	-165.5	-170.9	-47.3	0	0	0	115	T449 D453 A462 H463 Y464	T449-N460 PolarHBondContact O-ND2 2.86Å; D453-N460 HydrophobicContact CB-CB 4.24Å; D453-N460 WeakPolarHBondContact OD2-CA 3.37Å; D453-N460 VanDerWaalsContact OD2-CB 3.24Å; D453-N460 WeakPolarHBondContact OD2-CB 3.28Å; D453-N460 PolarHBondContact OD2-N 3.32Å; N460-A462 VanDerWaalsContact C-N 3.28Å; N460-A462 PolarHBondContact O-N 3.11Å; N460-A462 VanDerWaalsContact OD1-CA 3.29Å; N460-A462 WeakPolarHBondContact OD1-CA 3.29Å; N460-A462 WeakPolarHBondContact OD1-CB 3.49Å; N460-A462 PolarHBondContact OD1-N 3.04Å; N460-H463 WeakPolarHBondContact O-CB 3.33Å; N460-H463 PolarHBondContact O-N 3.48Å; N460-H463 VanDerWaalsContact O-N 3.15Å; N460-H463 PolarHBondContact OD1-N 3.38Å; N460-Y464 WeakPolarHBondContact O-CD2 3.43Å; N460-Y464 WeakPolarHBondContact O-CE2 3.42Å
461	C	97.8	Very high	97.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.8	-28.5	177	-70.7	0	0	0	0	113.7	D455 Y457 G459 H463 Y464 Q465 Y471 C474	D455-C461 VanDerWaalsContact CG-SG 3.57Å; D455-C461 WeakPolarHBondContact OD2-CB 3.1Å; D455-C461 PolarHBondContact OD2-N 3.35Å; D455-C461 PolarHBondContact OD2-SG 3.13Å; D455-C461 VanDerWaalsContact OD2-SG 3.34Å; Y457-C461 VanDerWaalsContact CB-SG 3.55Å; G459-C461 PolarHBondContact O-N 3.02Å; G459-C461 VanDerWaalsContact O-N 3.17Å; C461-H463 VanDerWaalsContact C-N 3.3Å; C461-H463 PolarHBondContact O-N 3.29Å; C461-Y464 PolarHBondContact O-N 3.29Å; C461-Y464 VanDerWaalsContact O-N 3.15Å; C461-Q465 WeakPolarHBondContact O-CB 3.3Å; C461-Q465 PolarHBondContact O-N 3.3Å; C461-Y471 HydrophobicContact CB-CD1 4.19Å; C461-Y471 HydrophobicContact CB-CD2 3.83Å; C461-Y471 HydrophobicContact CB-CG 3.65Å; C461-C474 HydrophobicContact CB-CB 3.62Å; C461-C474 WeakPolarHBondContact CB-SG 3.44Å; C461-C474 WeakPolarHBondContact SG-CA 3.49Å; C461-C474 WeakPolarHBondContact SG-CB 3.21Å; C461-C474 CovalentContact SG-SG 2.04Å; C461-C474 PolarHBondContact SG-SG 3.21Å
462	A	97.6	Very high	97.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67.1	-29.1	175.6	0	0	0	0	0	112.4	T448 N460 Y464 K466 G467 Y471	T448-A462 HydrophobicContact CG2-CB 4.28Å; N460-A462 VanDerWaalsContact C-N 3.28Å; N460-A462 PolarHBondContact O-N 3.11Å; N460-A462 VanDerWaalsContact OD1-CA 3.29Å; N460-A462 WeakPolarHBondContact OD1-CA 3.29Å; N460-A462 WeakPolarHBondContact OD1-CB 3.49Å; N460-A462 PolarHBondContact OD1-N 3.04Å; A462-Y464 VanDerWaalsContact C-N 3.27Å; A462-Y464 PolarHBondContact O-N 3.08Å; A462-K466 WeakPolarHBondContact O-CA 3.2Å; A462-K466 PolarHBondContact O-N 3.33Å; A462-G467 VanDerWaalsContact CB-O 3.24Å; A462-G467 WeakPolarHBondContact CB-O 3.32Å; A462-Y471 HydrophobicContact CB-CD2 4.33Å; A462-Y471 HydrophobicContact CB-CE2 3.76Å
463	H	96.8	Very high	97	Very high	93 Å²	93	38.8 Å²	38.8	43%	0.431	21%	0.207	S	C	.	.	H	α-helix	trans	-65.1	-31.1	171.7	-74.9	-24	0	0	0	112.7	L450 N460 C461 K466	L450-H463 PolarHBondContact O-CE1 3.32Å; N460-H463 WeakPolarHBondContact O-CB 3.33Å; N460-H463 PolarHBondContact O-N 3.48Å; N460-H463 VanDerWaalsContact O-N 3.15Å; N460-H463 PolarHBondContact OD1-N 3.38Å; C461-H463 VanDerWaalsContact C-N 3.3Å; C461-H463 PolarHBondContact O-N 3.29Å; H463-K466 VanDerWaalsContact O-CE 3.28Å; H463-K466 WeakPolarHBondContact O-CE 3.47Å; H463-K466 PolarHBondContact O-NZ 3.02Å
464	Y	96.2	Very high	96.8	Very high	79 Å²	79	36.6 Å²	36.6	31%	0.31	20%	0.197	S	C	.	.	H	α-helix	trans	-87.2	-43.9	178.6	-58.4	-68.4	0	0	0	112.1	Y457 N460 C461 A462 Y493 D495	Y457-Y464 HydrophobicContact CE1-CD2 4.29Å; Y457-Y464 AromaticContact CE1-CE2 3.95Å; Y457-Y464 HydrophobicContact CE1-CE2 3.95Å; N460-Y464 WeakPolarHBondContact O-CD2 3.43Å; N460-Y464 WeakPolarHBondContact O-CE2 3.42Å; C461-Y464 PolarHBondContact O-N 3.29Å; C461-Y464 VanDerWaalsContact O-N 3.15Å; A462-Y464 VanDerWaalsContact C-N 3.27Å; A462-Y464 PolarHBondContact O-N 3.08Å; Y464-Y493 AromaticContact CD1-CD1 3.85Å; Y464-Y493 HydrophobicContact CD1-CD1 3.85Å; Y464-Y493 HydrophobicContact CD1-CD2 4.09Å; Y464-Y493 AromaticContact CD1-CE1 3.51Å; Y464-Y493 HydrophobicContact CD1-CE1 3.51Å; Y464-Y493 AromaticContact CD1-CE2 3.79Å; Y464-Y493 HydrophobicContact CD1-CE2 3.79Å; Y464-Y493 HydrophobicContact CD1-CG 4.12Å; Y464-Y493 AromaticContact CD1-CZ 3.48Å; Y464-Y493 VanDerWaalsContact CD1-CZ 3.48Å; Y464-Y493 AromaticContact CE1-CE1 3.96Å; Y464-Y493 HydrophobicContact CE1-CE1 3.96Å; Y464-Y493 HydrophobicContact CE1-CE2 4.35Å; Y464-Y493 AromaticContact CE1-CZ 3.76Å; Y464-Y493 HydrophobicContact CG-CD1 4.48Å; Y464-Y493 HydrophobicContact CG-CE1 4.5Å; Y464-D495 WeakPolarHBondContact O-CB 3.45Å
465	Q	96.4	Very high	96.8	Very high	8 Å²	8	35.6 Å²	35.6	4%	0.037	20%	0.196	C	C	.	.	H	α-helix	trans	-97.1	-4.6	-171.9	-65.9	-160.6	91.4	0	0	115.7	C461 G467 Y471 C474 A475 N478 Q494 Y498	C461-Q465 WeakPolarHBondContact O-CB 3.3Å; C461-Q465 PolarHBondContact O-N 3.3Å; Q465-G467 VanDerWaalsContact C-N 3.25Å; Q465-G467 PolarHBondContact O-N 2.95Å; Q465-G467 VanDerWaalsContact O-N 3.13Å; Q465-Y471 HydrophobicContact CB-CE1 4Å; Q465-Y471 HydrophobicContact CG-CE1 4.42Å; Q465-C474 VanDerWaalsContact NE2-CB 3.29Å; Q465-A475 VanDerWaalsContact NE2-CB 3.27Å; Q465-N478 PolarHBondContact O-ND2 3.45Å; Q465-Q494 PolarHBondContact OE1-O 3.34Å; Q465-Y498 PolarHBondContact OE1-OH 2.85Å
466	K	96.9	Very high	96.9	Very high	65 Å²	65	37.9 Å²	37.9	28%	0.283	21%	0.206	S	C	.	.			trans	61.1	20.7	167.7	-46.4	-58	-175	-174.9	0	116.4	F361 A462 H463 V482 D495	F361-K466 WeakPolarHBondContact CA-O 3.42Å; F361-K466 VanDerWaalsContact CB-O 3.3Å; F361-K466 WeakPolarHBondContact CB-O 3.32Å; F361-K466 HydrophobicContact CD2-CB 4.11Å; F361-K466 HydrophobicContact CD2-CD 4.4Å; F361-K466 WeakPolarHBondContact CD2-O 3.36Å; F361-K466 HydrophobicContact CE2-CD 4.2Å; F361-K466 HydrophobicContact CG-CB 4.44Å; F361-K466 HydrophobicContact CZ-CD 4.41Å; A462-K466 WeakPolarHBondContact O-CA 3.2Å; A462-K466 PolarHBondContact O-N 3.33Å; H463-K466 VanDerWaalsContact O-CE 3.28Å; H463-K466 WeakPolarHBondContact O-CE 3.47Å; H463-K466 PolarHBondContact O-NZ 3.02Å; K466-V482 HydrophobicContact CB-CG2 3.61Å; K466-V482 HydrophobicContact CG-CG2 3.87Å; K466-D495 HydrophobicContact CB-CB 4.49Å; K466-D495 HydrophobicContact CG-CB 3.88Å
467	G	97.3	Very high	97	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.01	18%	0.181	C	C	.	.	S	Bend	trans	-128.2	171.3	172.1	0	0	0	0	0	111.9	A462 Q465 Y471 N480	A462-G467 VanDerWaalsContact CB-O 3.24Å; A462-G467 WeakPolarHBondContact CB-O 3.32Å; Q465-G467 VanDerWaalsContact C-N 3.25Å; Q465-G467 PolarHBondContact O-N 2.95Å; Q465-G467 VanDerWaalsContact O-N 3.13Å; G467-Y471 PolarHBondContact N-OH 3.29Å; G467-Y471 WeakPolarHBondContact O-CE2 3.3Å; G467-Y471 PolarHBondContact O-OH 3.25Å; G467-Y471 VanDerWaalsContact O-OH 3.14Å; G467-N480 VanDerWaalsContact CA-O 3.25Å; G467-N480 WeakPolarHBondContact CA-O 3.42Å
468	G	98.5	Very high	97.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.16	C	C	.	.			trans	-95.5	129.1	161.2	0	0	0	0	0	109.2	Y367 F447 T448 N480	Y367-G468 VanDerWaalsContact CZ-N 3.26Å; Y367-G468 PolarHBondContact OH-N 3.32Å; F447-G468 VanDerWaalsContact CZ-O 3.3Å; F447-G468 WeakPolarHBondContact CZ-O 3.48Å; T448-G468 VanDerWaalsContact O-CA 3.3Å; T448-G468 WeakPolarHBondContact O-CA 3.47Å; G468-N480 WeakPolarHBondContact O-CB 3.35Å; G468-N480 PolarHBondContact O-ND2 3.39Å
469	W	98.7	Very high	97.2	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-159.4	167.7	-174.9	-159.7	-119.7	0	0	0	112.3	L439 H442 T448 Y471 S477 L479 N480 M514	L439-W469 HydrophobicContact CD1-CH2 4.41Å; L439-W469 HydrophobicContact CD1-CZ2 3.62Å; H442-W469 AromaticContact CE1-CD1 3.5Å; H442-W469 AromaticContact CE1-NE1 3.35Å; H442-W469 PolarHBondContact CE1-NE1 3.41Å; H442-W469 AromaticContact CG-NE1 3.92Å; H442-W469 AromaticContact ND1-CD1 3.52Å; H442-W469 AromaticContact ND1-NE1 3.4Å; H442-W469 PolarHBondContact ND1-NE1 3.17Å; H442-W469 AromaticContact NE2-NE1 3.87Å; T448-W469 PolarHBondContact N-O 3.31Å; T448-W469 PolarHBondContact O-N 2.9Å; T448-W469 VanDerWaalsContact O-N 3.07Å; W469-Y471 HydrophobicContact CB-CD1 3.83Å; W469-Y471 HydrophobicContact CB-CD2 4.05Å; W469-Y471 HydrophobicContact CB-CE1 3.49Å; W469-Y471 VanDerWaalsContact CB-CE1 3.49Å; W469-Y471 HydrophobicContact CB-CE2 3.74Å; W469-Y471 HydrophobicContact CB-CG 4.09Å; W469-Y471 VanDerWaalsContact CB-CZ 3.45Å; W469-Y471 AromaticContact CD1-CD1 3.91Å; W469-Y471 AromaticContact CD1-CE1 3.96Å; W469-Y471 HydrophobicContact CG-CD1 4.29Å; W469-Y471 HydrophobicContact CG-CE1 4.06Å; W469-Y471 PolarHBondContact O-N 2.98Å; W469-S477 PolarHBondContact NE1-O 3.43Å; W469-L479 HydrophobicContact CH2-CB 3.88Å; W469-L479 HydrophobicContact CH2-CD1 4.02Å; W469-L479 HydrophobicContact CH2-CG 4.03Å; W469-L479 HydrophobicContact CZ2-CB 4.48Å; W469-L479 HydrophobicContact CZ2-CG 4.31Å; W469-L479 HydrophobicContact CZ3-CB 4.18Å; W469-N480 HydrophobicContact CE3-CB 4.26Å; W469-M514 HydrophobicContact CH2-CE 3.88Å; W469-M514 HydrophobicContact CH2-SD 3.72Å; W469-M514 HydrophobicContact CZ3-CE 4.38Å; W469-M514 HydrophobicContact CZ3-SD 3.94Å
470	W	98.6	Very high	97.4	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.11	C	C	.	.			trans	-77.3	62.6	169.4	-55.7	-80.8	0	0	0	111	W379 L382 F415 L417 Y424 L426 H442 K445 Q446 F447 M514	W379-W470 AromaticContact CH2-CH2 3.92Å; W379-W470 HydrophobicContact CH2-CH2 3.92Å; L382-W470 HydrophobicContact CD2-CZ2 4.25Å; F415-W470 HydrophobicContact CE2-CH2 4.4Å; F415-W470 HydrophobicContact CZ-CH2 4.33Å; L417-W470 HydrophobicContact CD1-CZ2 4.03Å; L417-W470 HydrophobicContact CD2-CH2 4.22Å; L417-W470 HydrophobicContact CD2-CZ2 3.34Å; L417-W470 HydrophobicContact CG-CZ2 4.35Å; Y424-W470 PolarHBondContact O-NE1 3.05Å; L426-W470 HydrophobicContact CB-CB 4.15Å; L426-W470 HydrophobicContact CB-CD2 3.9Å; L426-W470 HydrophobicContact CB-CG 3.62Å; L426-W470 HydrophobicContact CD1-CD2 4.26Å; L426-W470 HydrophobicContact CD1-CE3 4.41Å; L426-W470 HydrophobicContact CD1-CZ2 4.39Å; L426-W470 HydrophobicContact CD2-CB 4.28Å; L426-W470 HydrophobicContact CD2-CD2 4.01Å; L426-W470 HydrophobicContact CD2-CE3 3.99Å; L426-W470 HydrophobicContact CD2-CG 4.16Å; L426-W470 HydrophobicContact CG-CD2 4.28Å; L426-W470 HydrophobicContact CG-CG 4.4Å; H442-W470 HydrophobicContact CB-CB 4.36Å; H442-W470 PolarHBondContact ND1-O 2.8Å; K445-W470 HydrophobicContact CB-CB 4.23Å; Q446-W470 WeakPolarHBondContact O-CA 3.37Å; F447-W470 AromaticContact CD2-CD1 3.83Å; F447-W470 AromaticContact CD2-CD2 3.9Å; F447-W470 HydrophobicContact CD2-CD2 3.9Å; F447-W470 AromaticContact CD2-CE2 3.61Å; F447-W470 HydrophobicContact CD2-CG 4.04Å; F447-W470 HydrophobicContact CD2-CZ2 4.06Å; F447-W470 AromaticContact CD2-NE1 3.6Å; F447-W470 HydrophobicContact CE2-CD2 4.34Å; F447-W470 HydrophobicContact CE2-CZ2 4.26Å; W470-M514 HydrophobicContact CZ3-CE 4.5Å
471	Y	98.6	Very high	97.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.107	C	C	.	.			trans	-62.8	150.2	-174.1	-67.6	-55.9	0	0	0	112.6	T448 C461 A462 Q465 G467 W469 A475 N478	T448-Y471 HydrophobicContact CG2-CD2 4.02Å; C461-Y471 HydrophobicContact CB-CD1 4.19Å; C461-Y471 HydrophobicContact CB-CD2 3.83Å; C461-Y471 HydrophobicContact CB-CG 3.65Å; A462-Y471 HydrophobicContact CB-CD2 4.33Å; A462-Y471 HydrophobicContact CB-CE2 3.76Å; Q465-Y471 HydrophobicContact CB-CE1 4Å; Q465-Y471 HydrophobicContact CG-CE1 4.42Å; G467-Y471 PolarHBondContact N-OH 3.29Å; G467-Y471 WeakPolarHBondContact O-CE2 3.3Å; G467-Y471 PolarHBondContact O-OH 3.25Å; G467-Y471 VanDerWaalsContact O-OH 3.14Å; W469-Y471 HydrophobicContact CB-CD1 3.83Å; W469-Y471 HydrophobicContact CB-CD2 4.05Å; W469-Y471 HydrophobicContact CB-CE1 3.49Å; W469-Y471 VanDerWaalsContact CB-CE1 3.49Å; W469-Y471 HydrophobicContact CB-CE2 3.74Å; W469-Y471 HydrophobicContact CB-CG 4.09Å; W469-Y471 VanDerWaalsContact CB-CZ 3.45Å; W469-Y471 AromaticContact CD1-CD1 3.91Å; W469-Y471 AromaticContact CD1-CE1 3.96Å; W469-Y471 HydrophobicContact CG-CD1 4.29Å; W469-Y471 HydrophobicContact CG-CE1 4.06Å; W469-Y471 PolarHBondContact O-N 2.98Å; Y471-A475 HydrophobicContact CD1-CB 4.06Å; Y471-A475 HydrophobicContact CE1-CB 4.24Å; Y471-N478 PolarHBondContact OH-OD1 3.46Å
472	N	96.9	Very high	97.4	Very high	17 Å²	17	22.6 Å²	22.6	9%	0.091	12%	0.12	C	C	.	.	S	Bend	trans	-113.5	-100.5	175.2	-171.9	-8.1	0	0	0	108	W441 K445 V456 C474	W441-N472 HydrophobicContact CD2-CB 4.14Å; W441-N472 VanDerWaalsContact CD2-ND2 3.34Å; W441-N472 HydrophobicContact CE3-CB 3.76Å; W441-N472 HydrophobicContact CH2-CB 3.79Å; W441-N472 HydrophobicContact CZ2-CB 4.1Å; W441-N472 HydrophobicContact CZ3-CB 3.6Å; W441-N472 PolarHBondContact NE1-ND2 2.94Å; W441-N472 PolarHBondContact O-ND2 2.95Å; K445-N472 HydrophobicContact CD-CB 4.32Å; K445-N472 VanDerWaalsContact CE-ND2 3.35Å; K445-N472 WeakPolarHBondContact CE-ND2 3.21Å; K445-N472 WeakPolarHBondContact CE-OD1 3.47Å; K445-N472 HydrophobicContact CG-CB 4.18Å; K445-N472 PolarHBondContact NZ-OD1 2.7Å; V456-N472 WeakPolarHBondContact CG2-O 3.38Å; V456-N472 WeakPolarHBondContact CG2-OD1 2.99Å; V456-N472 PolarHBondContact N-O 3.39Å; N472-C474 PolarHBondContact N-O 3.47Å
473	A	95.3	Very high	97.5	Very high	52 Å²	52	24.8 Å²	24.8	43%	0.43	13%	0.128	S	C	.	.	S	Bend	trans	-145.1	62.9	171.4	0	0	0	0	0	112.8	V456 Y457	V456-A473 HydrophobicContact CG2-CB 4.29Å; Y457-A473 HydrophobicContact CD2-CB 4.41Å
474	C	93.9	Very high	97.5	Very high	27 Å²	27	23.3 Å²	23.3	18%	0.182	12%	0.12	C	C	.	.	S	Bend	cis	-115.5	-49.7	6.6	-79.9	0	0	0	0	113.9	Y457 C461 Q465 N472	Y457-C474 VanDerWaalsContact CD1-SG 3.5Å; C461-C474 HydrophobicContact CB-CB 3.62Å; C461-C474 WeakPolarHBondContact CB-SG 3.44Å; C461-C474 WeakPolarHBondContact SG-CA 3.49Å; C461-C474 WeakPolarHBondContact SG-CB 3.21Å; C461-C474 CovalentContact SG-SG 2.04Å; C461-C474 PolarHBondContact SG-SG 3.21Å; Q465-C474 VanDerWaalsContact NE2-CB 3.29Å; N472-C474 PolarHBondContact N-O 3.47Å
475	A	97.3	Very high	97.5	Very high	17 Å²	17	29.7 Å²	29.7	14%	0.14	14%	0.143	C	C	.	.			trans	-151.3	155.2	173.8	0	0	0	0	0	114.7	H442 Q465 Y471 S477 Y498	H442-A475 VanDerWaalsContact CE1-CA 3.48Å; H442-A475 WeakPolarHBondContact CE1-CA 3.24Å; H442-A475 VanDerWaalsContact CE1-CB 3.44Å; H442-A475 WeakPolarHBondContact CE1-CB 3.12Å; Q465-A475 VanDerWaalsContact NE2-CB 3.27Å; Y471-A475 HydrophobicContact CD1-CB 4.06Å; Y471-A475 HydrophobicContact CE1-CB 4.24Å; A475-S477 WeakPolarHBondContact CB-O 3.4Å; A475-Y498 WeakPolarHBondContact CB-OH 3.38Å; A475-Y498 PolarHBondContact O-OH 2.69Å
476	H	97.9	Very high	97.4	Very high	68 Å²	68	31.3 Å²	31.3	32%	0.315	16%	0.162	S	C	.	.	S	Bend	trans	-100.5	-25	159.4	-72.5	-166.6	0	0	0	111	S438 W441 H442 Y498 A500	S438-H476 WeakPolarHBondContact CB-O 3.49Å; S438-H476 CarbonylContact O-C 3.57Å; W441-H476 AromaticContact CD2-CD2 3.71Å; W441-H476 AromaticContact CD2-CE1 3.89Å; W441-H476 AromaticContact CD2-NE2 3.63Å; W441-H476 AromaticContact CE2-NE2 3.91Å; W441-H476 HydrophobicContact CE3-CB 4.29Å; W441-H476 AromaticContact CE3-CD2 3.36Å; W441-H476 AromaticContact CE3-CG 3.73Å; W441-H476 AromaticContact CE3-NE2 3.77Å; W441-H476 AromaticContact CG-CE1 3.76Å; W441-H476 AromaticContact CG-ND1 3.88Å; W441-H476 AromaticContact CZ3-CD2 3.66Å; H442-H476 PolarHBondContact NE2-N 3.34Å; H476-Y498 WeakPolarHBondContact O-CE2 3.43Å; H476-A500 HydrophobicContact CB-CB 4.39Å; H476-A500 WeakPolarHBondContact O-CB 3.42Å; H476-A500 PolarHBondContact O-N 3.47Å
477	S	98.3	Very high	97.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-131.8	139.4	169.4	54.8	0	0	0	0	111.2	S438 H442 W469 A475 Y498 W499	S438-S477 VanDerWaalsContact O-CB 3.24Å; S438-S477 WeakPolarHBondContact O-CB 3.2Å; S438-S477 PolarHBondContact O-N 3.4Å; S438-S477 PolarHBondContact O-OG 3.3Å; H442-S477 PolarHBondContact NE2-N 3.04Å; W469-S477 PolarHBondContact NE1-O 3.43Å; A475-S477 WeakPolarHBondContact CB-O 3.4Å; S477-Y498 WeakPolarHBondContact CA-O 3.29Å; S477-W499 VanDerWaalsContact CB-CE3 3.46Å
478	N	98.3	Very high	97.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.181	C	C	.	.			trans	-133	60.2	179.4	-173.8	38.9	0	0	0	110.1	Q465 Y471 N480 G481 D495 G496 V497 Y498	Q465-N478 PolarHBondContact O-ND2 3.45Å; Y471-N478 PolarHBondContact OH-OD1 3.46Å; N478-N480 PolarHBondContact O-N 2.94Å; N478-N480 VanDerWaalsContact O-N 3.11Å; N478-G481 VanDerWaalsContact ND2-CA 3.28Å; N478-G481 WeakPolarHBondContact ND2-CA 3.33Å; N478-G481 PolarHBondContact O-N 3.31Å; N478-D495 PolarHBondContact ND2-O 3.25Å; N478-G496 PolarHBondContact ND2-O 2.89Å; N478-G496 VanDerWaalsContact ND2-O 3.1Å; N478-V497 WeakPolarHBondContact O-CA 3.35Å; N478-Y498 HydrophobicContact CB-CD1 3.75Å; N478-Y498 HydrophobicContact CB-CE1 3.37Å; N478-Y498 HydrophobicContact CB-CG 4.44Å; N478-Y498 PolarHBondContact N-O 3.4Å
479	L	98.6	Very high	96.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.6	-172.9	-57.7	-175.2	0	0	0	113.2	Q351 R353 V398 L400 W469 W499 V512 M514	Q351-L479 PolarHBondContact NE2-O 3.17Å; R353-L479 WeakPolarHBondContact CG-O 3.26Å; R353-L479 PolarHBondContact NH1-O 2.9Å; V398-L479 HydrophobicContact CG1-CD1 3.65Å; L400-L479 HydrophobicContact CD2-CD2 4.07Å; W469-L479 HydrophobicContact CH2-CB 3.88Å; W469-L479 HydrophobicContact CH2-CD1 4.02Å; W469-L479 HydrophobicContact CH2-CG 4.03Å; W469-L479 HydrophobicContact CZ2-CB 4.48Å; W469-L479 HydrophobicContact CZ2-CG 4.31Å; W469-L479 HydrophobicContact CZ3-CB 4.18Å; L479-W499 HydrophobicContact CD1-CE3 4.28Å; L479-W499 HydrophobicContact CD1-CZ3 4.15Å; L479-W499 HydrophobicContact CD2-CE3 4.12Å; L479-W499 HydrophobicContact CG-CE3 4.46Å; L479-V512 HydrophobicContact CB-CG1 4.18Å; L479-V512 HydrophobicContact CD1-CG1 3.88Å; L479-V512 HydrophobicContact CD2-CG1 3.99Å; L479-V512 HydrophobicContact CD2-CG2 4.19Å; L479-V512 HydrophobicContact CG-CG1 4.23Å; L479-M514 HydrophobicContact CD1-CG 4.01Å; L479-M514 HydrophobicContact CD1-SD 3.94Å
480	N	98.6	Very high	96.6	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	8.9	175.4	-72.2	-10	0	0	0	113.9	Q351 F360 G467 G468 W469 N478	Q351-N480 WeakPolarHBondContact CG-OD1 3.48Å; Q351-N480 PolarHBondContact NE2-OD1 2.78Å; F360-N480 WeakPolarHBondContact CB-O 3.43Å; F360-N480 HydrophobicContact CD1-CB 4.13Å; G467-N480 VanDerWaalsContact CA-O 3.25Å; G467-N480 WeakPolarHBondContact CA-O 3.42Å; G468-N480 WeakPolarHBondContact O-CB 3.35Å; G468-N480 PolarHBondContact O-ND2 3.39Å; W469-N480 HydrophobicContact CE3-CB 4.26Å; N478-N480 PolarHBondContact O-N 2.94Å; N478-N480 VanDerWaalsContact O-N 3.11Å
481	G	97.7	Very high	96.3	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.01	25%	0.25	C	C	.	.	S	Bend	trans	-70.8	-171.3	178.1	0	0	0	0	0	115.7	R353 N478 W483 D495 V497	R353-G481 PolarHBondContact NH1-O 3.03Å; R353-G481 PolarHBondContact NH2-O 3.32Å; N478-G481 VanDerWaalsContact ND2-CA 3.28Å; N478-G481 WeakPolarHBondContact ND2-CA 3.33Å; N478-G481 PolarHBondContact O-N 3.31Å; G481-W483 PolarHBondContact O-N 3.29Å; G481-D495 CarbonylContact C-O 3.52Å; G481-D495 WeakPolarHBondContact CA-O 3.44Å; G481-V497 WeakPolarHBondContact O-CG2 3.45Å
482	V	98.1	Very high	95.9	Very high	47 Å²	47	61.6 Å²	61.6	29%	0.285	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-68	124.1	174.2	-172.4	0	0	0	0	109.7	K466 Y484 D495 G496 V497 S508	K466-V482 HydrophobicContact CB-CG2 3.61Å; K466-V482 HydrophobicContact CG-CG2 3.87Å; V482-Y484 HydrophobicContact CB-CD2 4.16Å; V482-Y484 HydrophobicContact CB-CE2 3.6Å; V482-Y484 HydrophobicContact CG1-CD1 4.46Å; V482-Y484 HydrophobicContact CG1-CD2 4.08Å; V482-Y484 HydrophobicContact CG1-CE1 4.03Å; V482-Y484 HydrophobicContact CG1-CE2 3.63Å; V482-Y484 HydrophobicContact CG1-CG 4.48Å; V482-Y484 HydrophobicContact CG2-CE2 4.47Å; V482-Y484 PolarHBondContact O-N 3.5Å; V482-D495 HydrophobicContact CG2-CB 4.29Å; V482-D495 PolarHBondContact N-O 3.03Å; V482-G496 CarbonylContact O-C 3.37Å; V482-G496 VanDerWaalsContact O-CA 3.24Å; V482-G496 WeakPolarHBondContact O-CA 2.95Å; V482-V497 PolarHBondContact O-N 2.92Å; V482-V497 VanDerWaalsContact O-N 3.09Å; V482-S508 PolarHBondContact O-OG 3.42Å
483	W	98.2	Very high	95.8	Very high	46 Å²	46	64.5 Å²	64.5	17%	0.174	30%	0.299	C	S	.	.			trans	-80.7	116.7	174.1	-174.3	95.3	0	0	0	109.3	D355 W403 G481 R485 V497 L509 K510	D355-W483 VanDerWaalsContact O-CZ3 3.28Å; D355-W483 WeakPolarHBondContact O-CZ3 3.48Å; W403-W483 AromaticContact CH2-CH2 3.52Å; W403-W483 HydrophobicContact CH2-CH2 3.52Å; W403-W483 AromaticContact CH2-CZ2 3.44Å; W403-W483 HydrophobicContact CH2-CZ2 3.44Å; W403-W483 VanDerWaalsContact CH2-CZ2 3.44Å; W403-W483 HydrophobicContact CH2-CZ3 4.46Å; W403-W483 AromaticContact CZ2-CH2 3.92Å; W403-W483 HydrophobicContact CZ2-CH2 3.92Å; W403-W483 AromaticContact CZ2-CZ2 3.52Å; W403-W483 HydrophobicContact CZ2-CZ2 3.52Å; G481-W483 PolarHBondContact O-N 3.29Å; W483-R485 HydrophobicContact CH2-CB 4.31Å; W483-R485 HydrophobicContact CH2-CG 4.44Å; W483-R485 HydrophobicContact CZ3-CB 3.96Å; W483-V497 HydrophobicContact CB-CG2 4.1Å; W483-L509 PolarHBondContact NE1-O 3.47Å; W483-K510 PolarHBondContact NE1-O 3.15Å
484	Y	97.7	Very high	95.8	Very high	62 Å²	62	67.1 Å²	67.1	24%	0.243	30%	0.302	C	S	.	.			trans	-106.5	127.3	176.8	-69.7	-79.9	0	0	0	111.9	W403 V482 G486 Y489 D495 S508	W403-Y484 WeakPolarHBondContact CZ2-O 3.32Å; V482-Y484 HydrophobicContact CB-CD2 4.16Å; V482-Y484 HydrophobicContact CB-CE2 3.6Å; V482-Y484 HydrophobicContact CG1-CD1 4.46Å; V482-Y484 HydrophobicContact CG1-CD2 4.08Å; V482-Y484 HydrophobicContact CG1-CE1 4.03Å; V482-Y484 HydrophobicContact CG1-CE2 3.63Å; V482-Y484 HydrophobicContact CG1-CG 4.48Å; V482-Y484 HydrophobicContact CG2-CE2 4.47Å; V482-Y484 PolarHBondContact O-N 3.5Å; Y484-G486 PolarHBondContact O-N 3.14Å; Y484-Y489 HydrophobicContact CD1-CG 4.35Å; Y484-Y489 AromaticContact CD2-CD1 3.75Å; Y484-Y489 HydrophobicContact CD2-CD1 3.75Å; Y484-Y489 AromaticContact CD2-CD2 3.65Å; Y484-Y489 HydrophobicContact CD2-CD2 3.65Å; Y484-Y489 HydrophobicContact CD2-CE1 4.27Å; Y484-Y489 HydrophobicContact CD2-CE2 4.18Å; Y484-Y489 AromaticContact CD2-CG 3.42Å; Y484-Y489 HydrophobicContact CD2-CG 3.42Å; Y484-Y489 VanDerWaalsContact CD2-CG 3.42Å; Y484-Y489 HydrophobicContact CE1-CD2 4.49Å; Y484-Y489 HydrophobicContact CE2-CD1 4.32Å; Y484-Y489 AromaticContact CE2-CD2 3.39Å; Y484-Y489 HydrophobicContact CE2-CD2 3.39Å; Y484-Y489 AromaticContact CE2-CE2 3.78Å; Y484-Y489 HydrophobicContact CE2-CE2 3.78Å; Y484-Y489 AromaticContact CE2-CG 3.71Å; Y484-Y489 HydrophobicContact CE2-CG 3.71Å; Y484-Y489 VanDerWaalsContact CG-CB 3.48Å; Y484-Y489 HydrophobicContact CG-CD1 4.23Å; Y484-Y489 HydrophobicContact CG-CD2 4.29Å; Y484-Y489 AromaticContact CG-CG 3.77Å; Y484-Y489 HydrophobicContact CG-CG 3.77Å; Y484-Y489 AromaticContact CZ-CD2 3.87Å; Y484-D495 WeakPolarHBondContact CE2-OD1 3.49Å; Y484-D495 PolarHBondContact OH-OD1 3.23Å; Y484-S508 PolarHBondContact N-OG 2.89Å
485	R	95.9	Very high	95.9	Very high	212 Å²	212	66.1 Å²	66.1	80%	0.8	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	129.2	175.4	-168.3	-179.9	-175.7	-165	1.3	110.8	W403 W483	W403-R485 HydrophobicContact CH2-CB 4.21Å; W403-R485 HydrophobicContact CH2-CG 3.75Å; W403-R485 HydrophobicContact CZ3-CG 4.04Å; W483-R485 HydrophobicContact CH2-CB 4.31Å; W483-R485 HydrophobicContact CH2-CG 4.44Å; W483-R485 HydrophobicContact CZ3-CB 3.96Å
486	G	93.3	Very high	95.9	Very high	43 Å²	43	65.3 Å²	65.3	44%	0.443	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	4	174.8	0	0	0	0	0	116	W403 Y484 H488	W403-G486 VanDerWaalsContact CE2-N 3.28Å; W403-G486 VanDerWaalsContact CZ2-N 3.3Å; Y484-G486 PolarHBondContact O-N 3.14Å; G486-H488 PolarHBondContact O-N 2.93Å; G486-H488 VanDerWaalsContact O-N 3.11Å
487	G	94.2	Very high	96	Very high	0 Å²	0	62 Å²	62	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	88.4	-74.5	170.8	0	0	0	0	0	113.1	W403 Y507 S508	W403-G487 VanDerWaalsContact NE1-N 3.15Å; G487-Y507 WeakPolarHBondContact O-CA 3.49Å; G487-S508 WeakPolarHBondContact CA-O 3.32Å; G487-S508 PolarHBondContact O-N 3.2Å
488	H	95.1	Very high	96	Very high	147 Å²	147	62.4 Å²	62.4	68%	0.681	27%	0.274	S	S	*	.	B	Isolated β-bridge	trans	-72.7	133	177.9	-59.6	103.4	0	0	0	110.5	G486 Y507	G486-H488 PolarHBondContact O-N 2.93Å; G486-H488 VanDerWaalsContact O-N 3.11Å; H488-Y507 AromaticContact CD2-CD2 3.89Å; H488-Y507 AromaticContact CE1-CD2 3.95Å; H488-Y507 AromaticContact CE1-CE2 3.92Å; H488-Y507 AromaticContact NE2-CD2 3.7Å
489	Y	94.2	Very high	96	Very high	35 Å²	35	62.4 Å²	62.4	14%	0.137	27%	0.274	C	S	.	.			trans	-133.1	166.4	179.3	64.7	-84	0	0	0	111	Y484 Q494 D495 G496 G505 A506	Y484-Y489 HydrophobicContact CD1-CG 4.35Å; Y484-Y489 AromaticContact CD2-CD1 3.75Å; Y484-Y489 HydrophobicContact CD2-CD1 3.75Å; Y484-Y489 AromaticContact CD2-CD2 3.65Å; Y484-Y489 HydrophobicContact CD2-CD2 3.65Å; Y484-Y489 HydrophobicContact CD2-CE1 4.27Å; Y484-Y489 HydrophobicContact CD2-CE2 4.18Å; Y484-Y489 AromaticContact CD2-CG 3.42Å; Y484-Y489 HydrophobicContact CD2-CG 3.42Å; Y484-Y489 VanDerWaalsContact CD2-CG 3.42Å; Y484-Y489 HydrophobicContact CE1-CD2 4.49Å; Y484-Y489 HydrophobicContact CE2-CD1 4.32Å; Y484-Y489 AromaticContact CE2-CD2 3.39Å; Y484-Y489 HydrophobicContact CE2-CD2 3.39Å; Y484-Y489 AromaticContact CE2-CE2 3.78Å; Y484-Y489 HydrophobicContact CE2-CE2 3.78Å; Y484-Y489 AromaticContact CE2-CG 3.71Å; Y484-Y489 HydrophobicContact CE2-CG 3.71Å; Y484-Y489 VanDerWaalsContact CG-CB 3.48Å; Y484-Y489 HydrophobicContact CG-CD1 4.23Å; Y484-Y489 HydrophobicContact CG-CD2 4.29Å; Y484-Y489 AromaticContact CG-CG 3.77Å; Y484-Y489 HydrophobicContact CG-CG 3.77Å; Y484-Y489 AromaticContact CZ-CD2 3.87Å; Y489-Q494 VanDerWaalsContact OH-CA 3.27Å; Y489-Q494 WeakPolarHBondContact OH-CA 3.48Å; Y489-D495 WeakPolarHBondContact CE2-OD1 3.49Å; Y489-D495 PolarHBondContact OH-N 2.97Å; Y489-G496 PolarHBondContact OH-N 3.4Å; Y489-G505 PolarHBondContact OH-O 3.03Å; Y489-A506 VanDerWaalsContact CE1-C 3.46Å
490	R	90.8	Very high	96	Very high	256 Å²	256	64.1 Å²	64.1	97%	0.966	29%	0.288	S	S	*	.			trans	-123.3	102.6	173.9	-67.6	179.9	-178.8	148.2	-0.5	108.2
491	S	92.4	Very high	95.9	Very high	50 Å²	50	70.1 Å²	70.1	35%	0.35	32%	0.317	S	S	.	.			trans	-126.8	164.7	168.4	-177.6	0	0	0	0	108.8	Y493 D495	S491-Y493 WeakPolarHBondContact CB-O 3.29Å; S491-Y493 PolarHBondContact O-N 3.46Å; S491-D495 WeakPolarHBondContact CB-OD1 3.24Å; S491-D495 WeakPolarHBondContact CB-OD2 3.33Å; S491-D495 VanDerWaalsContact OG-CG 3.31Å; S491-D495 PolarHBondContact OG-OD1 3.18Å; S491-D495 PolarHBondContact OG-OD2 3.03Å
492	R	92.1	Very high	95.9	Very high	213 Å²	213	71.4 Å²	71.4	80%	0.804	32%	0.322	S	S	*	.	S	Bend	trans	-67.8	-24.2	173.4	-177.2	176.9	178.4	-167.9	-0.9	111.8
493	Y	93.9	Very high	95.8	Very high	79 Å²	79	73 Å²	73	31%	0.31	32%	0.323	S	S	.	.	S	Bend	trans	-127.8	164.2	-177.5	-55.8	-69.2	0	0	0	110	Y464 S491 D495	Y464-Y493 AromaticContact CD1-CD1 3.85Å; Y464-Y493 HydrophobicContact CD1-CD1 3.85Å; Y464-Y493 HydrophobicContact CD1-CD2 4.09Å; Y464-Y493 AromaticContact CD1-CE1 3.51Å; Y464-Y493 HydrophobicContact CD1-CE1 3.51Å; Y464-Y493 AromaticContact CD1-CE2 3.79Å; Y464-Y493 HydrophobicContact CD1-CE2 3.79Å; Y464-Y493 HydrophobicContact CD1-CG 4.12Å; Y464-Y493 AromaticContact CD1-CZ 3.48Å; Y464-Y493 VanDerWaalsContact CD1-CZ 3.48Å; Y464-Y493 AromaticContact CE1-CE1 3.96Å; Y464-Y493 HydrophobicContact CE1-CE1 3.96Å; Y464-Y493 HydrophobicContact CE1-CE2 4.35Å; Y464-Y493 AromaticContact CE1-CZ 3.76Å; Y464-Y493 HydrophobicContact CG-CD1 4.48Å; Y464-Y493 HydrophobicContact CG-CE1 4.5Å; S491-Y493 WeakPolarHBondContact CB-O 3.29Å; S491-Y493 PolarHBondContact O-N 3.46Å; Y493-D495 VanDerWaalsContact C-N 3.33Å; Y493-D495 PolarHBondContact O-N 2.94Å; Y493-D495 VanDerWaalsContact O-N 3.13Å
494	Q	94.8	Very high	95.7	Very high	107 Å²	107	72.1 Å²	72.1	50%	0.5	33%	0.328	S	S	.	.			trans	-83.6	82.4	170.8	-70.4	179.2	-3.4	0	0	108.7	Q465 Y489 Y498	Q465-Q494 PolarHBondContact OE1-O 3.34Å; Y489-Q494 VanDerWaalsContact OH-CA 3.27Å; Y489-Q494 WeakPolarHBondContact OH-CA 3.48Å; Q494-Y498 HydrophobicContact CB-CE1 4.32Å; Q494-Y498 WeakPolarHBondContact O-CE1 3.47Å
495	D	97.1	Very high	95.4	Very high	5 Å²	5	69.7 Å²	69.7	3%	0.027	32%	0.321	C	S	.	.			trans	-106.4	3.1	-174.1	52.8	8.7	0	0	0	114	Y464 K466 N478 G481 V482 Y484 Y489 S491 Y493	Y464-D495 WeakPolarHBondContact O-CB 3.45Å; K466-D495 HydrophobicContact CB-CB 4.49Å; K466-D495 HydrophobicContact CG-CB 3.88Å; N478-D495 PolarHBondContact ND2-O 3.25Å; G481-D495 CarbonylContact C-O 3.52Å; G481-D495 WeakPolarHBondContact CA-O 3.44Å; V482-D495 HydrophobicContact CG2-CB 4.29Å; V482-D495 PolarHBondContact N-O 3.03Å; Y484-D495 WeakPolarHBondContact CE2-OD1 3.49Å; Y484-D495 PolarHBondContact OH-OD1 3.23Å; Y489-D495 WeakPolarHBondContact CE2-OD1 3.49Å; Y489-D495 PolarHBondContact OH-N 2.97Å; S491-D495 WeakPolarHBondContact CB-OD1 3.24Å; S491-D495 WeakPolarHBondContact CB-OD2 3.33Å; S491-D495 VanDerWaalsContact OG-CG 3.31Å; S491-D495 PolarHBondContact OG-OD1 3.18Å; S491-D495 PolarHBondContact OG-OD2 3.03Å; Y493-D495 VanDerWaalsContact C-N 3.33Å; Y493-D495 PolarHBondContact O-N 2.94Å; Y493-D495 VanDerWaalsContact O-N 3.13Å
496	G	97.6	Very high	95.4	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-68.4	171.6	-180	0	0	0	0	0	115.2	N478 V482 Y489 Y498	N478-G496 PolarHBondContact ND2-O 2.89Å; N478-G496 VanDerWaalsContact ND2-O 3.1Å; V482-G496 CarbonylContact O-C 3.37Å; V482-G496 VanDerWaalsContact O-CA 3.24Å; V482-G496 WeakPolarHBondContact O-CA 2.95Å; Y489-G496 PolarHBondContact OH-N 3.4Å; G496-Y498 VanDerWaalsContact O-CD1 3.24Å; G496-Y498 WeakPolarHBondContact O-CD1 3.43Å; G496-Y498 PolarHBondContact O-N 2.96Å; G496-Y498 VanDerWaalsContact O-N 3.08Å
497	V	98.6	Very high	95.6	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.286	C	S	.	.	S	Bend	trans	-77.7	81.7	167.8	179.9	0	0	0	0	109.5	R353 N478 G481 V482 W483 S508 L509 V512	R353-V497 HydrophobicContact CG-CG1 4.32Å; R353-V497 VanDerWaalsContact NH1-CG2 3.31Å; N478-V497 WeakPolarHBondContact O-CA 3.35Å; G481-V497 WeakPolarHBondContact O-CG2 3.45Å; V482-V497 PolarHBondContact O-N 2.92Å; V482-V497 VanDerWaalsContact O-N 3.09Å; W483-V497 HydrophobicContact CB-CG2 4.1Å; V497-S508 PolarHBondContact N-OG 3.24Å; V497-S508 CarbonylContact O-C 3.58Å; V497-S508 WeakPolarHBondContact O-CA 2.89Å; V497-L509 HydrophobicContact CG1-CB 4.43Å; V497-L509 WeakPolarHBondContact O-CB 3.44Å; V497-L509 WeakPolarHBondContact O-CG 3.45Å; V497-L509 PolarHBondContact O-N 2.91Å; V497-V512 HydrophobicContact CG1-CG2 3.61Å
498	Y	98.4	Very high	95.8	Very high	7 Å²	7	60.6 Å²	60.6	3%	0.027	29%	0.286	C	S	.	.			trans	-117.3	161.6	-170.2	73.6	-99.5	0	0	0	115	Q465 A475 H476 S477 N478 Q494 G496 Y507	Q465-Y498 PolarHBondContact OE1-OH 2.85Å; A475-Y498 WeakPolarHBondContact CB-OH 3.38Å; A475-Y498 PolarHBondContact O-OH 2.69Å; H476-Y498 WeakPolarHBondContact O-CE2 3.43Å; S477-Y498 WeakPolarHBondContact CA-O 3.29Å; N478-Y498 HydrophobicContact CB-CD1 3.75Å; N478-Y498 HydrophobicContact CB-CE1 3.37Å; N478-Y498 HydrophobicContact CB-CG 4.44Å; N478-Y498 PolarHBondContact N-O 3.4Å; Q494-Y498 HydrophobicContact CB-CE1 4.32Å; Q494-Y498 WeakPolarHBondContact O-CE1 3.47Å; G496-Y498 VanDerWaalsContact O-CD1 3.24Å; G496-Y498 WeakPolarHBondContact O-CD1 3.43Å; G496-Y498 PolarHBondContact O-N 2.96Å; G496-Y498 VanDerWaalsContact O-N 3.08Å; Y498-Y507 VanDerWaalsContact CB-O 3.3Å; Y498-Y507 WeakPolarHBondContact CB-O 3.35Å
499	W	98.6	Very high	96	Very high	1 Å²	1	53.7 Å²	53.7	0%	0.004	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-136.9	111.7	170.5	-171	-87.4	0	0	0	108	V398 L400 A410 Y412 A435 G436 S438 L439 S477 L479 E501 F502 R503 L509	V398-W499 HydrophobicContact CG1-CZ3 4.26Å; L400-W499 HydrophobicContact CD1-CB 3.73Å; L400-W499 HydrophobicContact CD1-CD2 3.76Å; L400-W499 HydrophobicContact CD1-CE3 4.22Å; L400-W499 HydrophobicContact CD1-CG 3.56Å; A410-W499 HydrophobicContact CB-CH2 3.82Å; A410-W499 HydrophobicContact CB-CZ2 3.53Å; Y412-W499 HydrophobicContact CE2-CH2 4.26Å; Y412-W499 WeakPolarHBondContact OH-CH2 3.35Å; A435-W499 PolarHBondContact O-NE1 3.04Å; G436-W499 WeakPolarHBondContact O-CZ2 3.48Å; G436-W499 PolarHBondContact O-NE1 3.41Å; S438-W499 PolarHBondContact OG-NE1 2.92Å; L439-W499 HydrophobicContact CB-CH2 3.83Å; L439-W499 HydrophobicContact CB-CZ3 4.29Å; S477-W499 VanDerWaalsContact CB-CE3 3.46Å; L479-W499 HydrophobicContact CD1-CE3 4.28Å; L479-W499 HydrophobicContact CD1-CZ3 4.15Å; L479-W499 HydrophobicContact CD2-CE3 4.12Å; L479-W499 HydrophobicContact CG-CE3 4.46Å; W499-E501 PolarHBondContact O-N 2.9Å; W499-F502 HydrophobicContact CB-CB 4.34Å; W499-F502 HydrophobicContact CG-CB 4.39Å; W499-F502 PolarHBondContact O-N 3.44Å; W499-F502 VanDerWaalsContact O-N 3.17Å; W499-R503 PolarHBondContact O-N 2.86Å; W499-L509 HydrophobicContact CB-CD1 4.08Å
500	A	97.7	Very high	96.2	Very high	36 Å²	36	54.7 Å²	54.7	30%	0.298	26%	0.259	S	S	.	.	H	α-helix	trans	-58.3	-48.6	-164.6	0	0	0	0	0	113.2	S438 H476 F502 G504	S438-A500 PolarHBondContact OG-N 2.94Å; H476-A500 HydrophobicContact CB-CB 4.39Å; H476-A500 WeakPolarHBondContact O-CB 3.42Å; H476-A500 PolarHBondContact O-N 3.47Å; A500-F502 PolarHBondContact O-N 2.89Å; A500-G504 VanDerWaalsContact O-CA 3.27Å; A500-G504 WeakPolarHBondContact O-CA 3.32Å; A500-G504 PolarHBondContact O-N 3.46Å
501	E	97.7	Very high	96.5	Very high	126 Å²	126	48 Å²	48	59%	0.589	23%	0.233	S	C	*	.	H	α-helix	trans	-72.3	-12.2	-176.9	-66.2	-164.2	176.2	0	0	114.1	G436 D437 S438 W499	G436-E501 VanDerWaalsContact C-OE2 3.24Å; G436-E501 WeakPolarHBondContact CA-OE2 3.32Å; D437-E501 PolarHBondContact N-OE2 2.84Å; S438-E501 PolarHBondContact OG-N 3.21Å; S438-E501 VanDerWaalsContact OG-N 3.07Å; W499-E501 PolarHBondContact O-N 2.9Å
502	F	97.6	Very high	96.8	Very high	28 Å²	28	45.6 Å²	45.6	12%	0.123	22%	0.217	C	C	.	.	H	α-helix	trans	-93.9	-50.7	179.2	178.9	-140.7	0	0	0	113	L400 D402 R406 V408 W499 A500 L509	L400-F502 HydrophobicContact CB-CD1 4.4Å; L400-F502 HydrophobicContact CB-CE1 4.46Å; L400-F502 HydrophobicContact CD1-CD1 4.31Å; D402-F502 HydrophobicContact CB-CE1 4Å; D402-F502 HydrophobicContact CB-CZ 4.04Å; R406-F502 HydrophobicContact CB-CZ 4.36Å; R406-F502 HydrophobicContact CG-CE2 4.25Å; R406-F502 HydrophobicContact CG-CZ 4.19Å; V408-F502 HydrophobicContact CB-CD2 4.47Å; V408-F502 HydrophobicContact CB-CE2 4.33Å; V408-F502 HydrophobicContact CG1-CD2 3.97Å; V408-F502 HydrophobicContact CG1-CE2 3.56Å; V408-F502 HydrophobicContact CG1-CZ 4.01Å; V408-F502 HydrophobicContact CG2-CB 4.46Å; V408-F502 HydrophobicContact CG2-CD1 3.58Å; V408-F502 HydrophobicContact CG2-CD2 3.71Å; V408-F502 HydrophobicContact CG2-CE1 3.63Å; V408-F502 HydrophobicContact CG2-CE2 3.75Å; V408-F502 HydrophobicContact CG2-CG 3.66Å; V408-F502 HydrophobicContact CG2-CZ 3.72Å; W499-F502 HydrophobicContact CB-CB 4.34Å; W499-F502 HydrophobicContact CG-CB 4.39Å; W499-F502 PolarHBondContact O-N 3.44Å; W499-F502 VanDerWaalsContact O-N 3.17Å; A500-F502 PolarHBondContact O-N 2.89Å; F502-L509 HydrophobicContact CD1-CD2 3.67Å; F502-L509 HydrophobicContact CE1-CD2 3.72Å
503	R	96.2	Very high	97.1	Very high	81 Å²	81	36.5 Å²	36.5	31%	0.306	19%	0.186	S	C	.	.	H	α-helix	trans	-138.3	5.1	-176.9	-58.3	-62.5	-77.3	-136	-9.5	114.5	D402 W499 Y507 L509	D402-R503 IonicContact OD2-CZ 3.17Å; D402-R503 IonicContact OD2-NE 3.91Å; D402-R503 IonicContact OD2-NH1 2.84Å; D402-R503 PolarHBondContact OD2-NH1 3.49Å; D402-R503 IonicContact OD2-NH2 2.68Å; W499-R503 PolarHBondContact O-N 2.86Å; R503-Y507 HydrophobicContact CB-CD1 3.56Å; R503-Y507 HydrophobicContact CB-CE1 4.29Å; R503-Y507 HydrophobicContact CB-CG 3.68Å; R503-Y507 HydrophobicContact CG-CD1 3.8Å; R503-Y507 HydrophobicContact CG-CE1 4.03Å; R503-Y507 HydrophobicContact CG-CG 4.29Å; R503-Y507 WeakPolarHBondContact O-CB 3.48Å; R503-L509 HydrophobicContact CG-CD2 4.23Å
504	G	95.1	Very high	97.3	Very high	27 Å²	27	32.8 Å²	32.8	28%	0.278	17%	0.171	S	C	.	.			trans	74.1	167.5	-174.6	0	0	0	0	0	114.1	A500 A506 Y507	A500-G504 VanDerWaalsContact O-CA 3.27Å; A500-G504 WeakPolarHBondContact O-CA 3.32Å; A500-G504 PolarHBondContact O-N 3.46Å; G504-A506 VanDerWaalsContact C-N 3.28Å; G504-A506 PolarHBondContact O-N 3.49Å; G504-Y507 PolarHBondContact O-N 2.97Å
505	G	93.1	Very high	97.5	Very high	10 Å²	10	27.9 Å²	27.9	10%	0.103	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-17.4	-176.8	0	0	0	0	0	115.6	Y489 Y507	Y489-G505 PolarHBondContact OH-O 3.03Å; G505-Y507 VanDerWaalsContact C-N 3.3Å; G505-Y507 PolarHBondContact O-N 3.35Å
506	A	95.4	Very high	97.6	Very high	56 Å²	56	27.7 Å²	27.7	46%	0.463	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	13.8	179.6	0	0	0	0	0	114.1	Y489 G504	Y489-A506 VanDerWaalsContact CE1-C 3.46Å; G504-A506 VanDerWaalsContact C-N 3.28Å; G504-A506 PolarHBondContact O-N 3.49Å
507	Y	97.7	Very high	97.5	Very high	9 Å²	9	29.8 Å²	29.8	4%	0.035	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-130.4	117.8	-177.7	-169	-83.6	0	0	0	111.6	D402 W403 G487 H488 Y498 R503 G504 G505 L509	D402-Y507 HydrophobicContact CB-CE1 3.95Å; W403-Y507 WeakPolarHBondContact CB-OH 3.35Å; W403-Y507 AromaticContact CD1-CE1 3.96Å; W403-Y507 AromaticContact CD1-CZ 3.83Å; W403-Y507 PolarHBondContact N-OH 2.95Å; G487-Y507 WeakPolarHBondContact O-CA 3.49Å; H488-Y507 AromaticContact CD2-CD2 3.89Å; H488-Y507 AromaticContact CE1-CD2 3.95Å; H488-Y507 AromaticContact CE1-CE2 3.92Å; H488-Y507 AromaticContact NE2-CD2 3.7Å; Y498-Y507 VanDerWaalsContact CB-O 3.3Å; Y498-Y507 WeakPolarHBondContact CB-O 3.35Å; R503-Y507 HydrophobicContact CB-CD1 3.56Å; R503-Y507 HydrophobicContact CB-CE1 4.29Å; R503-Y507 HydrophobicContact CB-CG 3.68Å; R503-Y507 HydrophobicContact CG-CD1 3.8Å; R503-Y507 HydrophobicContact CG-CE1 4.03Å; R503-Y507 HydrophobicContact CG-CG 4.29Å; R503-Y507 WeakPolarHBondContact O-CB 3.48Å; G504-Y507 PolarHBondContact O-N 2.97Å; G505-Y507 VanDerWaalsContact C-N 3.3Å; G505-Y507 PolarHBondContact O-N 3.35Å; Y507-L509 HydrophobicContact CD1-CD2 4.15Å; Y507-L509 HydrophobicContact CE1-CD2 4.19Å
508	S	98.3	Very high	97.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.			trans	-87.6	118.8	175.6	-169.4	0	0	0	0	110.9	W403 V482 Y484 G487 V497	W403-S508 PolarHBondContact NE1-O 3Å; V482-S508 PolarHBondContact O-OG 3.42Å; Y484-S508 PolarHBondContact N-OG 2.89Å; G487-S508 WeakPolarHBondContact CA-O 3.32Å; G487-S508 PolarHBondContact O-N 3.2Å; V497-S508 PolarHBondContact N-OG 3.24Å; V497-S508 CarbonylContact O-C 3.58Å; V497-S508 WeakPolarHBondContact O-CA 2.89Å
509	L	98.4	Very high	97.1	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	17%	0.168	C	C	.	.			trans	-64.7	150.2	179.5	-61.7	170.8	0	0	0	111.7	L400 D402 W483 V497 W499 F502 R503 Y507 V512	L400-L509 HydrophobicContact CB-CD1 4.13Å; L400-L509 HydrophobicContact CD1-CD1 4.14Å; L400-L509 HydrophobicContact CD2-CD1 3.81Å; L400-L509 HydrophobicContact CG-CD1 4.25Å; D402-L509 HydrophobicContact CB-CD2 4.48Å; W483-L509 PolarHBondContact NE1-O 3.47Å; V497-L509 HydrophobicContact CG1-CB 4.43Å; V497-L509 WeakPolarHBondContact O-CB 3.44Å; V497-L509 WeakPolarHBondContact O-CG 3.45Å; V497-L509 PolarHBondContact O-N 2.91Å; W499-L509 HydrophobicContact CB-CD1 4.08Å; F502-L509 HydrophobicContact CD1-CD2 3.67Å; F502-L509 HydrophobicContact CE1-CD2 3.72Å; R503-L509 HydrophobicContact CG-CD2 4.23Å; Y507-L509 HydrophobicContact CD1-CD2 4.15Å; Y507-L509 HydrophobicContact CE1-CD2 4.19Å; L509-V512 HydrophobicContact CB-CG2 4.01Å; L509-V512 HydrophobicContact CD1-CG2 4.05Å
510	K	98.3	Very high	95.7	Very high	56 Å²	56	36.6 Å²	36.6	24%	0.243	20%	0.199	C	C	.	.	S	Bend	trans	-79.5	-47.7	-176.1	-178.9	-173	163.4	-155.5	0	110.7	Q354 E401 W403 W483	Q354-K510 CarbonylContact C-O 3.54Å; Q354-K510 WeakPolarHBondContact CA-O 3.41Å; E401-K510 WeakPolarHBondContact O-CB 3.26Å; E401-K510 PolarHBondContact O-N 2.91Å; E401-K510 WeakPolarHBondContact OE1-CE 3.44Å; E401-K510 IonicContact OE1-NZ 3.44Å; E401-K510 PolarHBondContact OE1-NZ 2.88Å; W403-K510 HydrophobicContact CD2-CB 3.82Å; W403-K510 HydrophobicContact CD2-CD 4.26Å; W403-K510 HydrophobicContact CD2-CG 3.98Å; W403-K510 HydrophobicContact CE3-CB 4.42Å; W403-K510 HydrophobicContact CE3-CD 4.12Å; W403-K510 HydrophobicContact CE3-CG 4.06Å; W403-K510 HydrophobicContact CG-CB 4.03Å; W403-K510 HydrophobicContact CH2-CG 4.11Å; W403-K510 HydrophobicContact CZ2-CB 4.06Å; W403-K510 HydrophobicContact CZ2-CG 4.04Å; W403-K510 HydrophobicContact CZ3-CD 4.45Å; W403-K510 HydrophobicContact CZ3-CG 4.13Å; W483-K510 PolarHBondContact NE1-O 3.15Å
511	R	98.3	Very high	93.8	Very high	115 Å²	115	41 Å²	41	43%	0.434	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	146.3	172.8	-54.6	-177.4	165.6	146.8	-16.2	111.2	R353 Q354 E401	R353-R511 CarbonylContact O-C 3.58Å; R353-R511 VanDerWaalsContact O-CA 3.26Å; R353-R511 WeakPolarHBondContact O-CA 3.3Å; Q354-R511 HydrophobicContact CB-CG 4.13Å; E401-R511 HydrophobicContact CB-CB 3.88Å; E401-R511 HydrophobicContact CB-CG 4.4Å; E401-R511 PolarHBondContact N-O 3.16Å; E401-R511 PolarHBondContact O-N 2.76Å; E401-R511 IonicContact OE1-NH1 2.68Å; E401-R511 IonicContact OE2-NH1 3.75Å; E401-R511 PolarHBondContact OE2-NH1 3.42Å
512	V	98.3	Very high	91.5	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	141	174	175	0	0	0	0	107.9	R352 R353 T399 L400 L479 V497 L509	R352-V512 WeakPolarHBondContact CA-O 3.36Å; R353-V512 HydrophobicContact CB-CB 4.11Å; R353-V512 HydrophobicContact CG-CB 4.19Å; R353-V512 PolarHBondContact N-O 2.85Å; R353-V512 PolarHBondContact O-N 3.3Å; R353-V512 VanDerWaalsContact O-O 3.1Å; T399-V512 CarbonylContact O-C 3.34Å; T399-V512 WeakPolarHBondContact O-CA 3.43Å; L400-V512 HydrophobicContact CD2-CB 4.36Å; L400-V512 HydrophobicContact CD2-CG1 3.95Å; L400-V512 HydrophobicContact CD2-CG2 3.85Å; L479-V512 HydrophobicContact CB-CG1 4.18Å; L479-V512 HydrophobicContact CD1-CG1 3.88Å; L479-V512 HydrophobicContact CD2-CG1 3.99Å; L479-V512 HydrophobicContact CD2-CG2 4.19Å; L479-V512 HydrophobicContact CG-CG1 4.23Å; V497-V512 HydrophobicContact CG1-CG2 3.61Å; L509-V512 HydrophobicContact CB-CG2 4.01Å; L509-V512 HydrophobicContact CD1-CG2 4.05Å
513	S	98.2	Very high	88.5	Confident	22 Å²	22	45.4 Å²	45.4	15%	0.154	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	129.6	164.7	-62.3	0	0	0	0	109.9	Q351 V398 T399	Q351-S513 WeakPolarHBondContact O-CA 3.38Å; V398-S513 WeakPolarHBondContact CA-O 3.29Å; T399-S513 PolarHBondContact N-O 3.16Å; T399-S513 PolarHBondContact O-N 3.25Å
514	M	98.7	Very high	85.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	126.6	168.5	-57.1	177.7	69.2	0	0	107.7	I350 Q351 L396 V398 W469 W470 L479	I350-M514 HydrophobicContact CD1-CB 4.25Å; I350-M514 HydrophobicContact CG1-CB 3.78Å; I350-M514 WeakPolarHBondContact CG1-O 3.38Å; I350-M514 PolarHBondContact N-O 3.26Å; Q351-M514 HydrophobicContact CB-CB 3.95Å; Q351-M514 HydrophobicContact CB-CG 4.09Å; Q351-M514 HydrophobicContact CB-SD 4.01Å; Q351-M514 HydrophobicContact CG-SD 4.4Å; Q351-M514 PolarHBondContact N-O 2.86Å; Q351-M514 PolarHBondContact O-N 3.37Å; L396-M514 HydrophobicContact CD1-CB 4.11Å; L396-M514 HydrophobicContact CD1-CE 4.16Å; L396-M514 HydrophobicContact CD2-CE 4.11Å; V398-M514 HydrophobicContact CG1-CG 4.36Å; V398-M514 HydrophobicContact CG2-CG 4.26Å; W469-M514 HydrophobicContact CH2-CE 3.88Å; W469-M514 HydrophobicContact CH2-SD 3.72Å; W469-M514 HydrophobicContact CZ3-CE 4.38Å; W469-M514 HydrophobicContact CZ3-SD 3.94Å; W470-M514 HydrophobicContact CZ3-CE 4.5Å; L479-M514 HydrophobicContact CD1-CG 4.01Å; L479-M514 HydrophobicContact CD1-SD 3.94Å
515	M	98.4	Very high	85.1	Confident	5 Å²	5	54.6 Å²	54.6	3%	0.025	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	144.8	-177.6	64.9	-173	99.5	0	0	111.1	W347 T348 V349 L397 T399	W347-M515 HydrophobicContact CB-CB 4.16Å; W347-M515 HydrophobicContact CB-CG 4.08Å; W347-M515 HydrophobicContact CB-SD 3.66Å; W347-M515 HydrophobicContact CD2-CG 3.91Å; W347-M515 HydrophobicContact CD2-SD 3.83Å; W347-M515 HydrophobicContact CE3-CB 4.28Å; W347-M515 HydrophobicContact CE3-CG 3.61Å; W347-M515 HydrophobicContact CE3-SD 4.18Å; W347-M515 HydrophobicContact CG-CG 4.15Å; W347-M515 HydrophobicContact CG-SD 3.62Å; W347-M515 HydrophobicContact CZ3-CG 4.28Å; T348-M515 CarbonylContact O-C 3.57Å; T348-M515 VanDerWaalsContact O-CA 3.26Å; T348-M515 WeakPolarHBondContact O-CA 3.38Å; V349-M515 HydrophobicContact CG2-CB 4.06Å; L397-M515 HydrophobicContact CB-CG 3.93Å; L397-M515 HydrophobicContact CD2-CE 4.25Å; L397-M515 HydrophobicContact CD2-CG 4.31Å; L397-M515 HydrophobicContact CD2-SD 4.03Å; L397-M515 HydrophobicContact CG-CG 4.34Å; L397-M515 PolarHBondContact N-O 3.44Å; L397-M515 PolarHBondContact O-N 2.64Å; T399-M515 HydrophobicContact CG2-CE 3.88Å
516	I	98.3	Very high	84.7	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	150	-176.4	66	175.8	0	0	0	111.1	T348 I350 L388 T389 Y394 K395 L396 F415	T348-I516 PolarHBondContact N-O 3.34Å; T348-I516 PolarHBondContact O-N 2.98Å; I350-I516 HydrophobicContact CD1-CG2 3.91Å; I350-I516 HydrophobicContact CG1-CG2 4.45Å; I350-I516 HydrophobicContact CG2-CD1 3.89Å; I350-I516 HydrophobicContact CG2-CG1 3.87Å; I350-I516 HydrophobicContact CG2-CG2 4.33Å; L388-I516 HydrophobicContact CB-CD1 3.97Å; L388-I516 HydrophobicContact CD1-CD1 4.37Å; T389-I516 HydrophobicContact CG2-CD1 3.84Å; Y394-I516 HydrophobicContact CD1-CB 4.05Å; Y394-I516 HydrophobicContact CD1-CD1 3.93Å; Y394-I516 HydrophobicContact CD1-CG1 3.96Å; Y394-I516 HydrophobicContact CE1-CD1 4.36Å; Y394-I516 HydrophobicContact CE1-CG1 4.47Å; K395-I516 VanDerWaalsContact O-CA 3.28Å; K395-I516 WeakPolarHBondContact O-CA 3.37Å; L396-I516 HydrophobicContact CB-CG2 4.45Å; L396-I516 HydrophobicContact CD1-CG2 3.99Å; F415-I516 HydrophobicContact CD1-CG2 3.65Å; F415-I516 HydrophobicContact CE1-CG2 3.84Å
517	R	96.8	Very high	84.1	Confident	45 Å²	45	56.9 Å²	56.9	17%	0.17	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	144.4	178.3	-178.3	-177.4	-176.3	-83	9.3	109.7	L310 G345 W347 Y394 K395 N519	L310-R517 HydrophobicContact CD2-CG 4.46Å; G345-R517 WeakPolarHBondContact O-CD 3.35Å; G345-R517 PolarHBondContact O-NE 2.89Å; W347-R517 HydrophobicContact CD2-CB 4.02Å; W347-R517 HydrophobicContact CE3-CB 3.44Å; W347-R517 VanDerWaalsContact CE3-CB 3.44Å; W347-R517 HydrophobicContact CH2-CB 4.29Å; W347-R517 HydrophobicContact CZ3-CB 3.6Å; Y394-R517 CarbonylContact C-O 3.44Å; Y394-R517 WeakPolarHBondContact CA-O 3.44Å; Y394-R517 VanDerWaalsContact CD1-C 3.48Å; K395-R517 HydrophobicContact CG-CB 4.5Å; K395-R517 PolarHBondContact N-O 3.27Å; K395-R517 PolarHBondContact O-N 3.41Å; K395-R517 VanDerWaalsContact O-N 3.08Å; R517-N519 PolarHBondContact O-N 2.97Å
518	P	96.1	Very high	83.3	Confident	21 Å²	21	59.8 Å²	59.8	14%	0.136	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.2	137.7	172.1	-27.5	35.2	0	0	0	112.4	D308 L310 Y394	D308-P518 WeakPolarHBondContact OD2-CG 3.44Å; L310-P518 HydrophobicContact CB-CG 4.32Å; L310-P518 HydrophobicContact CD2-CB 4Å; L310-P518 HydrophobicContact CD2-CG 3.87Å; Y394-P518 HydrophobicContact CD1-CG 4.45Å; Y394-P518 HydrophobicContact CE1-CG 3.81Å; Y394-P518 HydrophobicContact CE2-CG 4.48Å
519	N	91.6	Very high	82.4	Confident	28 Å²	28	63.5 Å²	63.5	15%	0.15	31%	0.311	C	S	.	.			trans	-130.3	83	176.1	-174.8	20.2	0	0	0	110.2	N393 K395 A413 R517 N521	N393-N519 PolarHBondContact ND2-O 3.27Å; N393-N519 PolarHBondContact O-N 2.99Å; K395-N519 HydrophobicContact CB-CB 3.9Å; K395-N519 HydrophobicContact CD-CB 4.45Å; K395-N519 HydrophobicContact CG-CB 4.03Å; A413-N519 PolarHBondContact O-ND2 3.28Å; R517-N519 PolarHBondContact O-N 2.97Å; N519-N521 VanDerWaalsContact C-N 3.25Å; N519-N521 PolarHBondContact O-N 3.15Å
520	P	70.6	Confident	81.3	Confident	101 Å²	101	67.7 Å²	67.7	66%	0.656	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-13.3	-175.9	29.3	-35.5	0	0	0	114.1
521	N	56.3	Low	80.1	Confident	130 Å²	130	68.5 Å²	68.5	70%	0.695	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	6.2	-168.2	-71.4	-6.7	0	0	0	114.9	N519 F523	N519-N521 VanDerWaalsContact C-N 3.25Å; N519-N521 PolarHBondContact O-N 3.15Å; N521-F523 VanDerWaalsContact C-N 3.35Å; N521-F523 PolarHBondContact O-N 3.13Å
522	T	50.3	Low	78.7	Confident	50 Å²	50	64.9 Å²	64.9	31%	0.307	33%	0.33	S	S	.	.			trans	-85.5	80.9	166.9	51.4	0	0	0	0	109.9	N393 A413 H524	N393-T522 PolarHBondContact ND2-OG1 3.26Å; A413-T522 HydrophobicContact CB-CG2 4.26Å; T522-H524 PolarHBondContact O-N 3.36Å
523	F	34	Very low	77.1	Confident	196 Å²	196	70.3 Å²	70.3	86%	0.86	36%	0.357	S	S	*	.			trans	-59.9	126.7	153.3	-68.7	-88.2	0	0	0	107.7	N521	N521-F523 VanDerWaalsContact C-N 3.35Å; N521-F523 PolarHBondContact O-N 3.13Å
524	H	35.5	Very low	75.1	Confident	245 Å²	245	74.6 Å²	74.6	100%	1.134	38%	0.376	S	S	*	.			trans	-84	0	175.6	-98.5	-66.1	0	0	0	111.3	T522	T522-H524 PolarHBondContact O-N 3.36Å

Retrieved 524 of 524 residues in 1758.9 ms (Link to these results)

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