A0A3Q0KJL8_SCHMA Loading...

Putative bone morphogenetic protein antagonist noggin

AlphaFold DB , UniProt , Accession A0A3Q0KJL8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 470 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	48.1	Very low	38.6	Very low	252 Å²	252	172.1 Å²	172.1	100%	1.241	86%	0.86	S	S	*	*				0	119.6	0	-79.6	166.9	149.5	0	0	108
2	K	34.6	Very low	38.7	Very low	214 Å²	214	169.7 Å²	169.7	93%	0.93	85%	0.85	S	S	*	*			trans	-88.1	149.8	-172.4	-73.9	168.5	170.2	172.3	0	110.9
3	S	36.9	Very low	38.5	Very low	101 Å²	101	170.2 Å²	170.2	71%	0.706	85%	0.848	S	S	*	*			trans	159.6	109.7	133.6	-162.3	0	0	0	0	107.4
4	K	37.1	Very low	38.2	Very low	196 Å²	196	164.4 Å²	164.4	85%	0.852	83%	0.832	S	S	*	*				52.8	128.5	62.3	-76.7	-162	176.9	-171.1	0	114.5
5	Y	41.8	Very low	38.1	Very low	211 Å²	211	162.6 Å²	162.6	83%	0.827	83%	0.825	S	S	*	*			trans	160.5	93	144	-97.3	-82.6	0	0	0	107.2
6	T	41.1	Very low	38.1	Very low	120 Å²	120	164.5 Å²	164.5	74%	0.736	83%	0.826	S	S	*	*				79.7	121.5	83.1	63.3	0	0	0	0	115.3
7	D	34.5	Very low	37.9	Very low	166 Å²	166	160.6 Å²	160.6	89%	0.888	82%	0.818	S	S	*	*			trans	-63.9	149.5	170.1	-70.2	-52.3	0	0	0	113.7
8	Q	47.8	Very low	37.8	Very low	181 Å²	181	160.5 Å²	160.5	85%	0.846	82%	0.818	S	S	*	*			trans	-132.3	115.7	156.7	-89.3	-176.4	-9.4	0	0	110.3
9	S	33.9	Very low	37.6	Very low	115 Å²	115	158.2 Å²	158.2	80%	0.804	81%	0.813	S	S	*	*			trans	-76.3	137.9	163.8	49.2	0	0	0	0	111
10	F	38.5	Very low	37.8	Very low	178 Å²	178	156.5 Å²	156.5	78%	0.781	81%	0.809	S	S	*	*			trans	-124.7	127.7	160.1	-101.7	-87.4	0	0	0	109.5	I12	F10-I12 HydrophobicContact CD1-CD1 4.38Å
11	N	30.1	Very low	37.9	Very low	159 Å²	159	155.3 Å²	155.3	85%	0.85	81%	0.805	S	S	*	*			trans	-130.2	125.6	173.8	-158.6	6.4	0	0	0	106.1
12	I	39.9	Very low	37.5	Very low	143 Å²	143	150.1 Å²	150.1	73%	0.733	78%	0.782	S	S	*	*			trans	-136.9	112.9	173.1	-67.6	-178.7	0	0	0	108.6	F10	F10-I12 HydrophobicContact CD1-CD1 4.38Å
13	Q	35.9	Very low	37.6	Very low	176 Å²	176	147.2 Å²	147.2	82%	0.822	78%	0.776	S	S	*	*			trans	-42.9	162.9	155.1	-90	156.9	-55.9	0	0	112.7
14	S	34.3	Very low	37.8	Very low	90 Å²	90	148 Å²	148	63%	0.629	78%	0.779	S	S	*	*			cis	175.8	151.1	5.9	41.3	0	0	0	0	105.6
15	D	36.7	Very low	37.6	Very low	137 Å²	137	145.7 Å²	145.7	73%	0.733	78%	0.776	S	S	*	*			trans	170.6	111.7	136.8	-87.2	-21.3	0	0	0	109.2
16	K	37.6	Very low	37.3	Very low	193 Å²	193	145.9 Å²	145.9	84%	0.839	78%	0.777	S	S	*	*				52.5	132.7	99.2	-76.1	-178.9	178.4	174.8	0	113.1
17	S	34.8	Very low	37.1	Very low	98 Å²	98	145.8 Å²	145.8	69%	0.685	77%	0.772	S	S	*	*			cis	-176.5	149.4	5.7	39.5	0	0	0	0	104.9
18	I	36	Very low	37.1	Very low	159 Å²	159	141.9 Å²	141.9	82%	0.815	76%	0.758	S	S	*	*				176.8	138.5	103.2	-83	155.7	0	0	0	108.7
19	T	35.6	Very low	36.6	Very low	117 Å²	117	139.8 Å²	139.8	72%	0.718	75%	0.752	S	S	*	*			trans	-67.5	163.1	179.1	42.6	0	0	0	0	114.8
20	V	40.9	Very low	36.7	Very low	124 Å²	124	140.7 Å²	140.7	75%	0.752	75%	0.748	S	S	*	*				-177.6	115.4	99.1	160.2	0	0	0	0	106
21	N	38.9	Very low	36.8	Very low	132 Å²	132	138.7 Å²	138.7	71%	0.706	75%	0.746	S	S	*	*				61.1	131.2	94.5	-79	15.9	0	0	0	113.3
22	D	40.9	Very low	37.2	Very low	143 Å²	143	137.6 Å²	137.6	77%	0.765	74%	0.74	S	S	*	*			cis	-161	152.6	29.9	-76	-51.8	0	0	0	112.3
23	D	36.4	Very low	37.1	Very low	152 Å²	152	137.5 Å²	137.5	81%	0.813	74%	0.741	S	S	*	*			trans	-78.8	171.3	160.4	-101	-33.5	0	0	0	110.2
24	P	40.6	Very low	37.1	Very low	119 Å²	119	135.8 Å²	135.8	77%	0.773	74%	0.736	S	S	*	*				-158.8	153.1	51.7	39.3	-14.3	0	0	0	121
25	N	33.7	Very low	37.3	Very low	147 Å²	147	139.1 Å²	139.1	79%	0.786	74%	0.741	S	S	*	*			trans	10.5	129.9	132.7	-148.8	7.5	0	0	0	122.4
26	Y	35.9	Very low	37.3	Very low	214 Å²	214	138.2 Å²	138.2	84%	0.839	74%	0.741	S	S	*	*			trans	-162.9	117.9	136.7	-140.6	-101.2	0	0	0	115.4
27	N	36.8	Very low	37.2	Very low	118 Å²	118	136.8 Å²	136.8	63%	0.631	74%	0.739	S	S	*	*			trans	19.8	126	139.4	-91.6	-22.5	0	0	0	120.8
28	S	33.6	Very low	37.2	Very low	84 Å²	84	136.2 Å²	136.2	59%	0.587	74%	0.735	S	S	*	*				93.7	113.8	76.9	-173.9	0	0	0	0	114.4
29	N	37.4	Very low	37.1	Very low	137 Å²	137	137.7 Å²	137.7	73%	0.733	74%	0.736	S	S	*	*				155.2	119.9	121.6	-88.6	-42.5	0	0	0	114.4
30	N	36.5	Very low	36.9	Very low	135 Å²	135	137.3 Å²	137.3	72%	0.722	74%	0.738	S	S	*	*				25.4	123.7	129.5	-79.2	-17	0	0	0	120.8
31	N	39.3	Very low	36.6	Very low	136 Å²	136	136.9 Å²	136.9	73%	0.727	74%	0.741	S	S	*	*				168.8	123.4	98.5	-89.4	-38.2	0	0	0	114.3
32	N	39.3	Very low	36.3	Very low	136 Å²	136	138.1 Å²	138.1	73%	0.727	75%	0.746	S	S	*	*			trans	12.9	129.3	139.2	-51.6	-34.8	0	0	0	121.4
33	N	37.2	Very low	36.1	Very low	140 Å²	140	141.3 Å²	141.3	75%	0.749	75%	0.753	S	S	*	*				166.4	111.5	115.7	-86.8	-22.5	0	0	0	109.4
34	I	36.4	Very low	35.9	Very low	140 Å²	140	141.7 Å²	141.7	72%	0.718	76%	0.756	S	S	*	*				75.8	133.4	87.6	-70.4	177.2	0	0	0	114.1
35	Q	37.9	Very low	35.6	Very low	160 Å²	160	145.9 Å²	145.9	75%	0.748	76%	0.761	S	S	*	*			trans	98.3	103.3	157.5	-87.9	164.3	52.5	0	0	118.1
36	T	36.8	Very low	35.5	Very low	119 Å²	119	143.2 Å²	143.2	73%	0.73	76%	0.755	S	S	*	*				88.2	145.2	105	54.2	0	0	0	0	112.8
37	M	36.9	Very low	35.6	Very low	162 Å²	162	142.2 Å²	142.2	80%	0.798	76%	0.757	S	S	*	*			cis	-164.8	140.2	4.2	-99.9	-100.2	-98.6	0	0	107.1
38	S	33.3	Very low	35.4	Very low	86 Å²	86	141.7 Å²	141.7	60%	0.601	76%	0.762	S	S	*	*			trans	21.3	128.6	143.7	64.5	0	0	0	0	122.2
39	K	34.8	Very low	35.5	Very low	190 Å²	190	143.2 Å²	143.2	83%	0.826	77%	0.77	S	S	*	*				154.2	125.3	107.3	-98.6	168.5	-179.1	176.2	0	113.2
40	S	31.1	Very low	35.2	Very low	109 Å²	109	143 Å²	143	76%	0.762	77%	0.774	S	S	*	*			trans	25	127.6	140.5	59.5	0	0	0	0	120.2
41	S	34.7	Very low	35.1	Very low	116 Å²	116	141.5 Å²	141.5	81%	0.811	78%	0.78	S	S	*	*				-178.7	147.9	103.5	-159.1	0	0	0	0	112
42	L	32.4	Very low	34.7	Very low	158 Å²	158	141.3 Å²	141.3	83%	0.827	78%	0.784	S	S	*	*			trans	-55.5	147	176.6	-71	74	0	0	0	113.1
43	K	38	Very low	34.5	Very low	209 Å²	209	140.1 Å²	140.1	91%	0.909	79%	0.787	S	S	*	*				-170.1	124.6	123	-106.1	168	-176.2	-179.3	0	112.4
44	N	30.9	Very low	34.3	Very low	161 Å²	161	139.2 Å²	139.2	86%	0.861	79%	0.786	S	S	*	*			trans	-56.4	137.6	165.4	-69.1	-25.9	0	0	0	111.4
45	K	35.4	Very low	34.1	Very low	206 Å²	206	139.9 Å²	139.9	90%	0.896	79%	0.791	S	S	*	*				-160.2	132.9	129.6	-123.5	171.2	179.8	179.9	0	112.2
46	S	31.3	Very low	33.9	Very low	92 Å²	92	141 Å²	141	64%	0.643	79%	0.794	S	S	*	*			trans	-54.9	144.1	176.7	48.7	0	0	0	0	115
47	H	37.6	Very low	33.7	Very low	193 Å²	193	142.9 Å²	142.9	89%	0.894	80%	0.798	S	S	*	*				-159.9	121.4	129.9	-89.5	-61.3	0	0	0	109.9
48	S	32	Very low	33.6	Very low	106 Å²	106	144.7 Å²	144.7	74%	0.741	80%	0.798	S	S	*	*			trans	-76.3	161.9	167.6	57.4	0	0	0	0	110.3
49	P	37.4	Very low	33.3	Very low	116 Å²	116	147.6 Å²	147.6	75%	0.753	81%	0.807	S	S	*	*				-150.9	155.7	72.9	30.7	-6.9	0	0	0	118.1
50	V	31.1	Very low	33.4	Very low	134 Å²	134	145.6 Å²	145.6	81%	0.812	80%	0.803	S	S	*	*			trans	56.9	106.9	137.3	-175.7	0	0	0	0	119.2
51	A	34.6	Very low	33.5	Very low	103 Å²	103	145.8 Å²	145.8	85%	0.851	80%	0.8	S	S	*	*			trans	-153.8	120.8	141.8	0	0	0	0	0	110.7
52	T	29.3	Very low	33.1	Very low	132 Å²	132	147.8 Å²	147.8	81%	0.81	80%	0.802	S	S	*	*			trans	-70.9	128.1	179.8	-48.9	0	0	0	0	111
53	S	35.2	Very low	33.1	Very low	111 Å²	111	145.7 Å²	145.7	78%	0.776	80%	0.798	S	S	*	*			trans	-165.5	139.1	146.7	49.1	0	0	0	0	111
54	T	33.1	Very low	32.9	Very low	120 Å²	120	141.2 Å²	141.2	74%	0.736	79%	0.788	S	S	*	*			trans	-72.7	120.9	-165.3	46	0	0	0	0	113
55	N	33.4	Very low	32.7	Very low	154 Å²	154	142.9 Å²	142.9	82%	0.824	79%	0.79	S	S	*	*			trans	-115.3	103.9	162.6	-82.3	-37.4	0	0	0	109	L57	N55-L57 PolarHBondContact O-N 3.41Å
56	F	33.5	Very low	32.6	Very low	185 Å²	185	142.7 Å²	142.7	81%	0.811	78%	0.784	S	S	*	*			trans	-76.4	99.8	166.3	-87.2	-84.5	0	0	0	109
57	L	31.2	Very low	32.4	Very low	157 Å²	157	143.9 Å²	143.9	82%	0.822	79%	0.792	S	S	*	*			trans	-74.3	123.3	162.9	-84.7	155.9	0	0	0	109.1	N55	N55-L57 PolarHBondContact O-N 3.41Å
58	Y	36.3	Very low	32.1	Very low	200 Å²	200	142.6 Å²	142.6	78%	0.784	78%	0.784	S	S	*	*			trans	-100.6	105.4	154.7	-86.6	-78.6	0	0	0	109.3
59	N	25.5	Very low	31.8	Very low	148 Å²	148	147.6 Å²	147.6	79%	0.791	79%	0.793	S	S	*	*			trans	-90	105.2	169.7	-159.6	14.2	0	0	0	106.5
60	I	36.6	Very low	31.6	Very low	147 Å²	147	148.9 Å²	148.9	75%	0.754	79%	0.793	S	S	*	*			trans	-110.5	93.8	170.8	-59.4	-179.8	0	0	0	108.3
61	T	34	Very low	31.5	Very low	113 Å²	113	148.6 Å²	148.6	69%	0.693	79%	0.791	S	S	*	*			trans	-4.6	134.4	145.1	44.1	0	0	0	0	118.7
62	N	26.9	Very low	31.6	Very low	158 Å²	158	150.4 Å²	150.4	85%	0.845	79%	0.786	S	S	*	*			trans	-34.5	151.2	163.2	-72.3	-38.5	0	0	0	114.4
63	P	32.4	Very low	31.8	Very low	115 Å²	115	153.3 Å²	153.3	75%	0.747	79%	0.791	S	S	*	*				-149.2	143.2	106	27.7	-6.3	0	0	0	117.1
64	V	34.1	Very low	32.1	Very low	115 Å²	115	154.6 Å²	154.6	70%	0.697	79%	0.794	S	S	*	*			trans	75.2	108.2	132.4	-178.8	0	0	0	0	118.7	R66	V64-R66 HydrophobicContact CG1-CG 4.35Å; V64-R66 PolarHBondContact O-N 2.82Å
65	E	26.7	Very low	32	Very low	195 Å²	195	152.7 Å²	152.7	91%	0.911	80%	0.798	S	S	*	*			trans	-44.2	119.7	152.8	-84.6	171.7	136.7	0	0	112
66	R	32.8	Very low	32.1	Very low	202 Å²	202	149.1 Å²	149.1	76%	0.762	80%	0.798	S	S	*	*			trans	-132.6	108.1	152.7	-78.5	-172.8	178.4	167.7	-2.4	109.4	V64 F68	V64-R66 HydrophobicContact CG1-CG 4.35Å; V64-R66 PolarHBondContact O-N 2.82Å; R66-F68 HydrophobicContact CB-CD2 4.04Å; R66-F68 HydrophobicContact CB-CE2 3.87Å; R66-F68 HydrophobicContact CG-CE2 4.45Å; R66-F68 PolarHBondContact O-N 2.92Å
67	S	26.1	Very low	32.1	Very low	117 Å²	117	149.5 Å²	149.5	82%	0.818	81%	0.807	S	S	*	*			trans	-60.7	120.1	163.1	42.7	0	0	0	0	109.6
68	F	32.4	Very low	32.3	Very low	167 Å²	167	145.7 Å²	145.7	73%	0.732	81%	0.806	S	S	*	*			trans	-131.9	108.8	164.5	-82.2	-75.9	0	0	0	109.6	R66	R66-F68 HydrophobicContact CB-CD2 4.04Å; R66-F68 HydrophobicContact CB-CE2 3.87Å; R66-F68 HydrophobicContact CG-CE2 4.45Å; R66-F68 PolarHBondContact O-N 2.92Å
69	K	25.7	Very low	32.3	Very low	211 Å²	211	144.2 Å²	144.2	92%	0.917	81%	0.811	S	S	*	*			trans	-66.1	125.2	158.3	-77.7	177.2	174.5	178.5	0	107.4
70	L	33.3	Very low	32.7	Very low	143 Å²	143	143.6 Å²	143.6	75%	0.749	81%	0.812	S	S	*	*			trans	-129.7	98.8	164.2	-104.6	143.6	0	0	0	108.2
71	T	28.4	Very low	32.5	Very low	127 Å²	127	142 Å²	142	78%	0.779	81%	0.813	S	S	*	*			trans	-62.6	131.6	155.9	51.1	0	0	0	0	108
72	N	35.9	Very low	32.5	Very low	141 Å²	141	141.4 Å²	141.4	75%	0.754	81%	0.814	S	S	*	*			trans	-151.1	109.3	154.7	-90.3	-24.8	0	0	0	108.9
73	Q	33.7	Very low	32.9	Very low	194 Å²	194	140.1 Å²	140.1	91%	0.907	81%	0.812	S	S	*	*			trans	-71.5	125.1	161.9	-71.9	172	-17.8	0	0	108.1
74	V	41.8	Very low	33.3	Very low	137 Å²	137	143 Å²	143	83%	0.83	82%	0.816	S	S	*	*			trans	-143.1	120	154.6	-166.4	0	0	0	0	107.6
75	G	31.8	Very low	33.3	Very low	81 Å²	81	145.6 Å²	145.6	84%	0.835	83%	0.825	S	S	*	*			trans	-72.4	148.5	178	0	0	0	0	0	112.6
76	G	35.8	Very low	33.8	Very low	79 Å²	79	145.7 Å²	145.7	81%	0.814	82%	0.817	S	S	*	*			trans	-158.2	109.4	170.8	0	0	0	0	0	109
77	L	33.4	Very low	33.9	Very low	192 Å²	192	143.6 Å²	143.6	100%	1.005	82%	0.82	S	S	*	*			trans	-64.5	130.1	176.4	-73.7	152.3	0	0	0	110.3
78	G	35.3	Very low	34.2	Very low	77 Å²	77	142.8 Å²	142.8	79%	0.794	81%	0.814	S	S	*	*			trans	-158.7	113.7	173.2	0	0	0	0	0	110.2
79	L	36.9	Very low	34.3	Very low	170 Å²	170	142.2 Å²	142.2	89%	0.89	82%	0.818	S	S	*	*			trans	-71.2	130	-167.6	-67.6	160.9	0	0	0	113.7
80	V	32.3	Very low	34.6	Very low	134 Å²	134	139.2 Å²	139.2	81%	0.812	81%	0.812	S	S	*	*			trans	40.5	117.2	135	-166	0	0	0	0	119.2
81	S	32.4	Very low	34.7	Very low	113 Å²	113	137.8 Å²	137.8	79%	0.79	81%	0.814	S	S	*	*				172.2	137.5	117.3	179.4	0	0	0	0	112.9
82	S	34.5	Very low	34.9	Very low	102 Å²	102	140.6 Å²	140.6	71%	0.713	82%	0.823	S	S	*	*			trans	93	82	154.4	-160.7	0	0	0	0	119.6
83	V	36	Very low	34.9	Very low	131 Å²	131	139 Å²	139	79%	0.794	82%	0.822	S	S	*	*			trans	38.2	97.5	131.4	-165.5	0	0	0	0	117.7
84	Q	39.6	Very low	35	Very low	176 Å²	176	138.6 Å²	138.6	82%	0.822	82%	0.82	S	S	*	*			trans	-151.1	116.6	148.2	-103.2	158.5	21.7	0	0	109.3	R86	Q84-R86 PolarHBondContact O-N 3.01Å
85	N	35	Very low	34.6	Very low	169 Å²	169	138.2 Å²	138.2	90%	0.904	82%	0.818	S	S	*	*			trans	-57.8	104.6	170.6	-78.4	-11.5	0	0	0	109.4
86	R	37.4	Very low	34.7	Very low	197 Å²	197	140.7 Å²	140.7	74%	0.743	82%	0.818	S	S	*	*			trans	-121.4	117.4	156.4	-74.4	-163.5	178.4	-166.4	0	107.7	Q84 S88	Q84-R86 PolarHBondContact O-N 3.01Å; R86-S88 PolarHBondContact O-N 2.98Å; R86-S88 VanDerWaalsContact O-N 3.16Å
87	I	34.7	Very low	34.9	Very low	158 Å²	158	144.3 Å²	144.3	81%	0.81	82%	0.818	S	S	*	*			trans	-70.4	103.5	167	-64.5	165.4	0	0	0	105.5	L89	I87-L89 HydrophobicContact CG2-CD1 4.1Å; I87-L89 PolarHBondContact O-N 3.17Å
88	S	33.3	Very low	34.8	Very low	100 Å²	100	140.5 Å²	140.5	70%	0.699	81%	0.808	S	S	*	*			trans	-79.9	100.3	170.3	-46.9	0	0	0	0	107.9	R86 D90	R86-S88 PolarHBondContact O-N 2.98Å; R86-S88 VanDerWaalsContact O-N 3.16Å; S88-D90 VanDerWaalsContact C-N 3.27Å; S88-D90 PolarHBondContact O-N 3.4Å; S88-D90 VanDerWaalsContact O-N 3.15Å
89	L	33	Very low	35	Very low	154 Å²	154	143 Å²	143	81%	0.806	81%	0.81	S	S	*	*			trans	-76.5	85.7	160.5	-83.9	114.2	0	0	0	107.7	I87	I87-L89 HydrophobicContact CG2-CD1 4.1Å; I87-L89 PolarHBondContact O-N 3.17Å
90	D	33.2	Very low	34.8	Very low	149 Å²	149	142.9 Å²	142.9	80%	0.797	81%	0.809	S	S	*	*			trans	-153.6	74	169.5	-91.8	-32.2	0	0	0	108.5	S88	S88-D90 VanDerWaalsContact C-N 3.27Å; S88-D90 PolarHBondContact O-N 3.4Å; S88-D90 VanDerWaalsContact O-N 3.15Å
91	S	35	Very low	35.1	Very low	112 Å²	112	144 Å²	144	78%	0.783	81%	0.811	S	S	*	*			trans	176.8	65.7	157.5	25.5	0	0	0	0	111.5
92	L	31.5	Very low	35.2	Very low	187 Å²	187	146.3 Å²	146.3	98%	0.979	81%	0.811	S	S	*	*			trans	-128.8	77.2	152.9	-85.5	119.7	0	0	0	107.5
93	S	36.5	Very low	35.4	Very low	106 Å²	106	149.7 Å²	149.7	74%	0.741	82%	0.82	S	S	*	*			trans	-125.7	125.8	155.6	59.1	0	0	0	0	107.1	T95	S93-T95 PolarHBondContact O-N 3.05Å
94	H	34.8	Very low	35.4	Very low	187 Å²	187	151.6 Å²	151.6	87%	0.866	82%	0.817	S	S	*	*			trans	-40.7	129.4	178.6	-59.6	-89.4	0	0	0	113
95	T	35	Very low	35.5	Very low	128 Å²	128	150.6 Å²	150.6	79%	0.785	81%	0.812	S	S	*	*			trans	-153.7	113.2	135.4	42.6	0	0	0	0	108.8	S93	S93-T95 PolarHBondContact O-N 3.05Å
96	T	33.9	Very low	35.7	Very low	134 Å²	134	149.7 Å²	149.7	82%	0.822	81%	0.807	S	S	*	*			trans	-65.2	124.9	161.6	47.1	0	0	0	0	108.5
97	N	38.5	Very low	35.6	Very low	154 Å²	154	145.6 Å²	145.6	82%	0.824	81%	0.809	S	S	*	*			trans	-144.6	103.6	158.1	-89.4	-27.5	0	0	0	108.2
98	S	32.7	Very low	36	Very low	113 Å²	113	143.3 Å²	143.3	79%	0.79	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-66.1	144.4	171	34.7	0	0	0	0	111.6
99	P	39.1	Very low	36.2	Very low	130 Å²	130	144.6 Å²	144.6	84%	0.844	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-82.2	146.8	175	32.9	-30.9	0	0	0	112
100	L	33.5	Very low	36.4	Very low	166 Å²	166	144.1 Å²	144.1	87%	0.869	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-48.3	138.5	177	-68.4	148.9	0	0	0	114.3
101	N	38.2	Very low	36.6	Very low	157 Å²	157	142.1 Å²	142.1	84%	0.84	80%	0.798	S	S	*	*			trans	-150.3	110	143.6	-105.1	-17.5	0	0	0	110.6
102	M	34.2	Very low	36.7	Very low	162 Å²	162	143.6 Å²	143.6	80%	0.798	80%	0.798	S	S	*	*			trans	25.5	121	138.4	-62.8	-80.3	-79.7	0	0	118.2
103	I	38.6	Very low	37.1	Very low	174 Å²	174	139.8 Å²	139.8	89%	0.892	79%	0.787	S	S	*	*				-179.2	139.8	119.3	-85	149.7	0	0	0	109.3
104	K	35.7	Very low	37.2	Very low	170 Å²	170	142 Å²	142	74%	0.739	79%	0.789	S	S	*	*			trans	-71.3	148	-174.2	-66.1	166.5	171.1	175.6	0	113.6
105	H	42.2	Very low	37.5	Very low	156 Å²	156	139.9 Å²	139.9	72%	0.722	78%	0.783	S	S	*	*				148.5	116.7	119.1	-82.7	-70.2	0	0	0	113.9
106	N	38.7	Very low	37.6	Very low	149 Å²	149	139 Å²	139	80%	0.797	78%	0.782	S	S	*	*			trans	34.8	119.3	142	-59.6	-1.1	0	0	0	121.7
107	S	35	Very low	37.9	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	78%	0.777	S	S	*	*			trans	-54	165.3	150.5	41.7	0	0	0	0	112.5
108	P	42.7	Very low	38.3	Very low	109 Å²	109	138.1 Å²	138.1	71%	0.708	78%	0.777	S	S	*	*			cis	-150.4	158.8	38.1	41.1	-18.8	0	0	0	119.3
109	V	37.8	Very low	39	Very low	128 Å²	128	139.5 Å²	139.5	78%	0.776	78%	0.775	S	S	*	*				61.9	131.8	129.7	178.5	0	0	0	0	121.3
110	L	38.2	Very low	39.4	Very low	144 Å²	144	140 Å²	140	75%	0.754	77%	0.771	S	S	*	*			trans	94.8	108.8	158.3	-72.8	155.6	0	0	0	120.5
111	T	36.5	Very low	40.1	Very low	106 Å²	106	138.7 Å²	138.7	65%	0.65	76%	0.763	S	S	*	*				75.3	121.8	129.8	55.2	0	0	0	0	122.3
112	N	37	Very low	40.5	Very low	144 Å²	144	141 Å²	141	77%	0.77	77%	0.766	S	S	*	*			trans	80.8	133.3	133	-71.2	-5.8	0	0	0	120.2
113	S	39.9	Very low	40.8	Very low	107 Å²	107	144.3 Å²	144.3	75%	0.748	77%	0.77	S	S	*	*			trans	75.8	140.8	153.2	77.5	0	0	0	0	115.1
114	L	39.7	Very low	40.9	Very low	151 Å²	151	145.5 Å²	145.5	79%	0.791	76%	0.764	S	S	*	*			cis	-176.9	167.2	-5.1	-111.9	168.8	0	0	0	103.1
115	I	41.4	Very low	41.4	Very low	143 Å²	143	146.4 Å²	146.4	73%	0.733	77%	0.768	S	S	*	*			trans	88.1	94.6	155.5	-60	143.6	0	0	0	118
116	S	36.2	Very low	41.6	Very low	109 Å²	109	146.2 Å²	146.2	76%	0.762	77%	0.773	S	S	*	*				47.7	124.7	126.4	75.3	0	0	0	0	122.3
117	S	39.7	Very low	41.9	Very low	103 Å²	103	145.9 Å²	145.9	72%	0.72	77%	0.771	S	S	*	*				-155	149.7	111.1	79	0	0	0	0	110.5
118	M	47.9	Very low	42.3	Very low	167 Å²	167	149 Å²	149	82%	0.823	77%	0.773	S	S	*	*			trans	-104.8	18.5	-160.5	-107	-165.5	84	0	0	114.7
119	D	46.8	Very low	42.4	Very low	142 Å²	142	148.4 Å²	148.4	76%	0.759	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-93.6	-3.1	-167.1	-73.3	-41.9	0	0	0	116.5	I121	D119-I121 PolarHBondContact O-N 2.73Å
120	D	46.7	Very low	43	Very low	140 Å²	140	148.8 Å²	148.8	75%	0.749	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-85.8	-3.8	-173.5	-80.2	-39.7	0	0	0	116.3
121	I	48.3	Very low	43.8	Very low	140 Å²	140	147.7 Å²	147.7	72%	0.718	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-89.1	-18.8	-171	-64.3	174.3	0	0	0	113.6	D119	D119-I121 PolarHBondContact O-N 2.73Å
122	K	46.3	Very low	44.9	Very low	206 Å²	206	150.8 Å²	150.8	90%	0.896	77%	0.772	S	S	*	*	S	Bend	trans	-90.9	-15.3	-175.5	-81.1	-178.6	178.9	174.3	0	115.7
123	R	41.6	Very low	45.9	Very low	231 Å²	231	153.8 Å²	153.8	87%	0.872	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-83.3	-9.6	178.9	-110.3	177.4	178.5	-173.5	-0.4	114.7	K125	R123-K125 PolarHBondContact O-N 3.27Å
124	Y	41.4	Very low	46.5	Very low	199 Å²	199	149.4 Å²	149.4	78%	0.78	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-83.7	-4.3	-175.6	-106.7	-87.1	0	0	0	115.9
125	K	46.3	Very low	47.3	Very low	189 Å²	189	150.9 Å²	150.9	82%	0.822	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-86.5	-12.7	-179.2	-95	-172.8	175.1	-177.5	0	116	R123	R123-K125 PolarHBondContact O-N 3.27Å
126	N	45.9	Very low	47.9	Very low	152 Å²	152	147 Å²	147	81%	0.813	74%	0.735	S	S	*	*	S	Bend	trans	-101	2.6	-175.2	-79.1	5.4	0	0	0	115.4
127	N	44.6	Very low	48.8	Very low	141 Å²	141	149.4 Å²	149.4	75%	0.754	74%	0.739	S	S	*	*			trans	-121.2	54.9	-179	-73.1	-7.2	0	0	0	112	P129	N127-P129 WeakPolarHBondContact O-CD 3.45Å
128	Q	43.3	Very low	49.5	Very low	177 Å²	177	149 Å²	149	83%	0.827	74%	0.741	S	S	*	*			trans	-86.9	116.7	159.4	-79	-140.7	-16.8	0	0	109.3	I130	Q128-I130 PolarHBondContact O-N 3.34Å
129	P	45.8	Very low	49.7	Very low	98 Å²	98	142.8 Å²	142.8	64%	0.636	71%	0.714	S	S	*	*			trans	-64.5	125.7	166.5	26.6	-29.4	0	0	0	108.1	N127 T131	N127-P129 WeakPolarHBondContact O-CD 3.45Å; P129-T131 PolarHBondContact O-N 3.13Å; P129-T131 PolarHBondContact O-OG1 2.94Å
130	I	50.4	Low	50.4	Low	136 Å²	136	144.4 Å²	144.4	70%	0.697	72%	0.717	S	S	*	*			trans	-59.7	101.8	169.8	-61.5	165.4	0	0	0	106.1	Q128	Q128-I130 PolarHBondContact O-N 3.34Å
131	T	54	Low	50.9	Low	120 Å²	120	142.7 Å²	142.7	74%	0.736	71%	0.705	S	S	*	*			trans	-117.2	28	-174.4	-29.4	0	0	0	0	111.6	P129	P129-T131 PolarHBondContact O-N 3.13Å; P129-T131 PolarHBondContact O-OG1 2.94Å
132	E	60	Low	51.3	Low	172 Å²	172	139.9 Å²	139.9	80%	0.804	69%	0.685	S	S	*	*			trans	-115.5	119.4	166.9	-91.7	179.9	156	0	0	109.1
133	W	56.7	Low	51.7	Low	206 Å²	206	134.4 Å²	134.4	78%	0.78	67%	0.673	S	S	*	*			trans	-67.4	129.1	167.5	-79.3	93.9	0	0	0	108.2	L135 I145	W133-L135 PolarHBondContact O-N 3.09Å; W133-I145 HydrophobicContact CE3-CD1 4.47Å; W133-I145 HydrophobicContact CZ3-CD1 4.35Å
134	P	52.9	Low	52.6	Low	16 Å²	16	130.6 Å²	130.6	10%	0.104	66%	0.663	C	S	.	*			trans	-63.4	124.8	-178.7	22.9	-30.7	0	0	0	109.8	S136 Y142 I145	P134-S136 PolarHBondContact O-N 3.37Å; P134-Y142 HydrophobicContact CB-CD2 3.9Å; P134-Y142 HydrophobicContact CB-CE2 3.46Å; P134-Y142 VanDerWaalsContact CB-CE2 3.46Å; P134-Y142 HydrophobicContact CG-CD1 4.27Å; P134-Y142 HydrophobicContact CG-CD2 3.75Å; P134-Y142 HydrophobicContact CG-CE1 4.09Å; P134-Y142 HydrophobicContact CG-CE2 3.43Å; P134-Y142 VanDerWaalsContact CG-CE2 3.43Å; P134-Y142 HydrophobicContact CG-CG 4.15Å; P134-Y142 WeakPolarHBondContact O-CE2 3.38Å; P134-Y142 VanDerWaalsContact O-CZ 3.22Å; P134-Y142 PolarHBondContact O-OH 3.23Å; P134-I145 HydrophobicContact CG-CD1 3.77Å
135	L	58.2	Low	53.5	Low	181 Å²	181	124.3 Å²	124.3	95%	0.948	64%	0.642	S	S	*	*	S	Bend	trans	-80.2	3.7	-171.2	-69.6	164.7	0	0	0	114.1	W133	W133-L135 PolarHBondContact O-N 3.09Å
136	S	53.6	Low	54.1	Low	62 Å²	62	120.4 Å²	120.4	43%	0.434	63%	0.63	S	S	.	*			trans	-143.7	112.8	-169.6	162.6	0	0	0	0	111.6	P134 A138 S139 Y142	P134-S136 PolarHBondContact O-N 3.37Å; S136-A138 PolarHBondContact O-N 3.5Å; S136-A138 PolarHBondContact OG-N 3.39Å; S136-S139 PolarHBondContact O-N 3.21Å; S136-S139 PolarHBondContact O-OG 2.99Å; S136-S139 VanDerWaalsContact O-OG 3.1Å; S136-Y142 VanDerWaalsContact O-CD2 3.24Å; S136-Y142 WeakPolarHBondContact O-CD2 3.27Å; S136-Y142 WeakPolarHBondContact O-CE2 3.27Å
137	L	55.4	Low	55.1	Low	160 Å²	160	119.2 Å²	119.2	84%	0.838	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.8	-12.7	176.8	-105.1	81.5	0	0	0	114.9
138	A	53.6	Low	56.2	Low	93 Å²	93	119.8 Å²	119.8	77%	0.769	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-4.4	-177.7	0	0	0	0	0	114.5	S136	S136-A138 PolarHBondContact O-N 3.5Å; S136-A138 PolarHBondContact OG-N 3.39Å
139	S	51.8	Low	57.3	Low	37 Å²	37	116.8 Å²	116.8	26%	0.259	60%	0.601	S	S	.	*	S	Bend	trans	-79.3	132.1	177.2	57.4	0	0	0	0	111.3	S136 E141 Y142	S136-S139 PolarHBondContact O-N 3.21Å; S136-S139 PolarHBondContact O-OG 2.99Å; S136-S139 VanDerWaalsContact O-OG 3.1Å; S139-E141 PolarHBondContact O-N 2.88Å; S139-Y142 PolarHBondContact O-N 2.72Å; S139-Y142 WeakPolarHBondContact OG-CD2 3.33Å
140	E	61.3	Low	57.9	Low	177 Å²	177	120.9 Å²	120.9	83%	0.827	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-51.2	-16.5	171.7	-66.3	-179.6	166.5	0	0	113.2	Y142 S143	E140-Y142 VanDerWaalsContact C-N 3.3Å; E140-Y142 PolarHBondContact O-N 3.39Å; E140-S143 WeakPolarHBondContact O-CB 3.49Å; E140-S143 PolarHBondContact O-N 2.82Å; E140-S143 PolarHBondContact O-OG 3.35Å
141	E	58.6	Low	58.7	Low	104 Å²	104	116.6 Å²	116.6	49%	0.486	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-64.8	-26.5	174.2	-156.9	159	-147.7	0	0	113.9	S139 S143 K144	S139-E141 PolarHBondContact O-N 2.88Å; E141-S143 VanDerWaalsContact C-N 3.28Å; E141-S143 PolarHBondContact O-N 3.4Å; E141-K144 VanDerWaalsContact O-CB 3.29Å; E141-K144 WeakPolarHBondContact O-CB 3.49Å; E141-K144 PolarHBondContact O-N 3.28Å
142	Y	55.8	Low	59.2	Low	80 Å²	80	118 Å²	118	31%	0.314	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-64.5	-34	173.6	-87.9	-90.1	0	0	0	112.4	P134 S136 S139 E140 K144 I145	P134-Y142 HydrophobicContact CB-CD2 3.9Å; P134-Y142 HydrophobicContact CB-CE2 3.46Å; P134-Y142 VanDerWaalsContact CB-CE2 3.46Å; P134-Y142 HydrophobicContact CG-CD1 4.27Å; P134-Y142 HydrophobicContact CG-CD2 3.75Å; P134-Y142 HydrophobicContact CG-CE1 4.09Å; P134-Y142 HydrophobicContact CG-CE2 3.43Å; P134-Y142 VanDerWaalsContact CG-CE2 3.43Å; P134-Y142 HydrophobicContact CG-CG 4.15Å; P134-Y142 WeakPolarHBondContact O-CE2 3.38Å; P134-Y142 VanDerWaalsContact O-CZ 3.22Å; P134-Y142 PolarHBondContact O-OH 3.23Å; S136-Y142 VanDerWaalsContact O-CD2 3.24Å; S136-Y142 WeakPolarHBondContact O-CD2 3.27Å; S136-Y142 WeakPolarHBondContact O-CE2 3.27Å; S139-Y142 PolarHBondContact O-N 2.72Å; S139-Y142 WeakPolarHBondContact OG-CD2 3.33Å; E140-Y142 VanDerWaalsContact C-N 3.3Å; E140-Y142 PolarHBondContact O-N 3.39Å; Y142-K144 PolarHBondContact O-N 3.38Å; Y142-I145 HydrophobicContact CD1-CD1 4.33Å; Y142-I145 PolarHBondContact O-N 3.49Å
143	S	55.4	Low	59.5	Low	91 Å²	91	113.5 Å²	113.5	64%	0.636	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-64.2	-20.4	173.3	0.5	0	0	0	0	112.9	E140 E141	E140-S143 WeakPolarHBondContact O-CB 3.49Å; E140-S143 PolarHBondContact O-N 2.82Å; E140-S143 PolarHBondContact O-OG 3.35Å; E141-S143 VanDerWaalsContact C-N 3.28Å; E141-S143 PolarHBondContact O-N 3.4Å
144	K	59.5	Low	59.9	Low	152 Å²	152	106.7 Å²	106.7	66%	0.661	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-83.1	-17.6	178.1	-159.9	172.5	-178.9	-178.2	0	112.5	E141 Y142 N146	E141-K144 VanDerWaalsContact O-CB 3.29Å; E141-K144 WeakPolarHBondContact O-CB 3.49Å; E141-K144 PolarHBondContact O-N 3.28Å; Y142-K144 PolarHBondContact O-N 3.38Å; K144-N146 VanDerWaalsContact C-N 3.32Å; K144-N146 PolarHBondContact O-N 3.43Å
145	I	59.9	Low	60.6	Low	67 Å²	67	110.2 Å²	110.2	34%	0.344	58%	0.584	S	S	.	*			trans	-75.5	88.2	173.8	-56.2	174.4	0	0	0	108.1	W133 P134 Y142 M147	W133-I145 HydrophobicContact CE3-CD1 4.47Å; W133-I145 HydrophobicContact CZ3-CD1 4.35Å; P134-I145 HydrophobicContact CG-CD1 3.77Å; Y142-I145 HydrophobicContact CD1-CD1 4.33Å; Y142-I145 PolarHBondContact O-N 3.49Å; I145-M147 HydrophobicContact CG2-CG 4.07Å; I145-M147 PolarHBondContact O-N 3.43Å
146	N	58.9	Low	61.2	Low	107 Å²	107	105.7 Å²	105.7	57%	0.572	57%	0.565	S	S	*	*			trans	-69.6	77.5	172.9	-81.5	-42	0	0	0	110.4	K144 R148	K144-N146 VanDerWaalsContact C-N 3.32Å; K144-N146 PolarHBondContact O-N 3.43Å; N146-R148 PolarHBondContact O-N 2.92Å
147	M	67.1	Low	61.9	Low	126 Å²	126	105.1 Å²	105.1	62%	0.621	56%	0.561	S	S	*	*			trans	-66.7	114.9	164.5	-72.7	-137.6	-55.7	0	0	108.8	I145 I154	I145-M147 HydrophobicContact CG2-CG 4.07Å; I145-M147 PolarHBondContact O-N 3.43Å; M147-I154 PolarHBondContact O-N 3.34Å
148	R	68.5	Low	62.5	Low	154 Å²	154	99.8 Å²	99.8	58%	0.581	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	117.4	175.3	-65.1	176.5	-177.7	-116.2	4.3	108.4	N146 G151 Q152	N146-R148 PolarHBondContact O-N 2.92Å; R148-G151 PolarHBondContact NH1-O 2.93Å; R148-Q152 VanDerWaalsContact CA-O 3.29Å; R148-Q152 WeakPolarHBondContact CA-O 3.43Å
149	I	65.1	Low	63.3	Low	114 Å²	114	97.9 Å²	97.9	59%	0.585	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	124.8	167	-68.8	175.8	0	0	0	106.3	G151 Q152 I154	I149-G151 PolarHBondContact O-N 3.44Å; I149-Q152 PolarHBondContact N-O 3.49Å; I149-Q152 PolarHBondContact O-N 2.91Å; I149-I154 HydrophobicContact CB-CD1 4.21Å; I149-I154 HydrophobicContact CD1-CD1 3.45Å; I149-I154 VanDerWaalsContact CD1-CD1 3.45Å; I149-I154 HydrophobicContact CG1-CD1 3.75Å
150	M	59.1	Low	64.3	Low	184 Å²	184	101.4 Å²	101.4	91%	0.906	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	31	-175.1	-53.5	-62.6	-75.4	0	0	114	Q152	M150-Q152 VanDerWaalsContact C-N 3.29Å; M150-Q152 PolarHBondContact O-N 3.49Å
151	G	67	Low	64.8	Low	45 Å²	45	98 Å²	98	46%	0.464	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-11	177.3	0	0	0	0	0	115.7	R148 I149	R148-G151 PolarHBondContact NH1-O 2.93Å; I149-G151 PolarHBondContact O-N 3.44Å
152	Q	65.2	Low	65.7	Low	149 Å²	149	95.3 Å²	95.3	70%	0.696	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	131.4	177.4	-68.8	-176.6	-19.9	0	0	111.1	R148 I149 M150	R148-Q152 VanDerWaalsContact CA-O 3.29Å; R148-Q152 WeakPolarHBondContact CA-O 3.43Å; I149-Q152 PolarHBondContact N-O 3.49Å; I149-Q152 PolarHBondContact O-N 2.91Å; M150-Q152 VanDerWaalsContact C-N 3.29Å; M150-Q152 PolarHBondContact O-N 3.49Å
153	P	65.3	Low	67.1	Low	79 Å²	79	95.9 Å²	95.9	51%	0.513	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	135.8	172.5	29.2	-33	0	0	0	109.4
154	I	65.1	Low	68.6	Low	62 Å²	62	92.1 Å²	92.1	32%	0.318	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-85.4	119	175.7	-55.5	171	0	0	0	107.7	M147 I149 P156 V159	M147-I154 PolarHBondContact O-N 3.34Å; I149-I154 HydrophobicContact CB-CD1 4.21Å; I149-I154 HydrophobicContact CD1-CD1 3.45Å; I149-I154 VanDerWaalsContact CD1-CD1 3.45Å; I149-I154 HydrophobicContact CG1-CD1 3.75Å; I154-P156 WeakPolarHBondContact O-CD 3.22Å; I154-V159 HydrophobicContact CG2-CG2 3.26Å
155	D	68.3	Low	69.8	Low	91 Å²	91	88.8 Å²	88.8	49%	0.487	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-64.7	117	168.2	-177.3	-14.2	0	0	0	108.4	S157 V158	D155-S157 PolarHBondContact O-N 2.98Å; D155-S157 VanDerWaalsContact O-N 3.1Å; D155-S157 VanDerWaalsContact OD1-CB 3.31Å; D155-S157 WeakPolarHBondContact OD1-CB 3.32Å; D155-S157 PolarHBondContact OD1-N 3.07Å; D155-S157 PolarHBondContact OD1-OG 3.08Å; D155-S157 PolarHBondContact OD2-OG 3.2Å; D155-V158 HydrophobicContact CB-CG2 3.97Å; D155-V158 WeakPolarHBondContact O-CB 3.5Å; D155-V158 PolarHBondContact O-N 3.46Å
156	P	69.8	Low	71	Confident	85 Å²	85	88.8 Å²	88.8	55%	0.552	47%	0.473	S	S	*	.	H	α-helix	trans	-59	-24.6	-178	24.3	-34.4	0	0	0	112.5	I154 V158 V159 N160	I154-P156 WeakPolarHBondContact O-CD 3.22Å; P156-V158 VanDerWaalsContact C-N 3.31Å; P156-V158 PolarHBondContact O-N 3.36Å; P156-V159 PolarHBondContact O-N 3.06Å; P156-N160 PolarHBondContact O-N 3.21Å; P156-N160 PolarHBondContact O-ND2 2.02Å
157	S	68.6	Low	72.3	Confident	50 Å²	50	85.4 Å²	85.4	35%	0.35	46%	0.458	S	S	.	.	H	α-helix	trans	-62.4	-39	174.8	73.3	0	0	0	0	111.8	D155 V159 N160 H161	D155-S157 PolarHBondContact O-N 2.98Å; D155-S157 VanDerWaalsContact O-N 3.1Å; D155-S157 VanDerWaalsContact OD1-CB 3.31Å; D155-S157 WeakPolarHBondContact OD1-CB 3.32Å; D155-S157 PolarHBondContact OD1-N 3.07Å; D155-S157 PolarHBondContact OD1-OG 3.08Å; D155-S157 PolarHBondContact OD2-OG 3.2Å; S157-V159 VanDerWaalsContact C-N 3.33Å; S157-V159 PolarHBondContact O-N 3.31Å; S157-N160 PolarHBondContact O-N 2.92Å; S157-H161 PolarHBondContact O-CD2 2.96Å; S157-H161 PolarHBondContact O-NE2 3.28Å
158	V	67.6	Low	73.3	Confident	48 Å²	48	83.9 Å²	83.9	29%	0.291	46%	0.457	S	S	.	.	H	α-helix	trans	-66.2	-37.5	179.6	-179.9	0	0	0	0	110.9	D155 P156 H161	D155-V158 HydrophobicContact CB-CG2 3.97Å; D155-V158 WeakPolarHBondContact O-CB 3.5Å; D155-V158 PolarHBondContact O-N 3.46Å; P156-V158 VanDerWaalsContact C-N 3.31Å; P156-V158 PolarHBondContact O-N 3.36Å; V158-H161 PolarHBondContact O-N 2.93Å
159	V	71	Confident	74.2	Confident	53 Å²	53	83.2 Å²	83.2	32%	0.321	46%	0.461	S	S	.	.	H	α-helix	trans	-68.1	-39.4	179.7	-174.6	0	0	0	0	111.6	I154 P156 S157 H161 L162	I154-V159 HydrophobicContact CG2-CG2 3.26Å; P156-V159 PolarHBondContact O-N 3.06Å; S157-V159 VanDerWaalsContact C-N 3.33Å; S157-V159 PolarHBondContact O-N 3.31Å; V159-H161 PolarHBondContact O-N 2.99Å; V159-L162 WeakPolarHBondContact O-CB 3.37Å; V159-L162 PolarHBondContact O-N 3.02Å
160	N	72.2	Confident	75.4	Confident	111 Å²	111	80.7 Å²	80.7	59%	0.594	45%	0.445	S	S	*	.	H	α-helix	trans	-61.3	-34	179.7	-72.2	-22.7	0	0	0	112.3	P156 S157 L162 H163	P156-N160 PolarHBondContact O-N 3.21Å; P156-N160 PolarHBondContact O-ND2 2.02Å; S157-N160 PolarHBondContact O-N 2.92Å; N160-L162 VanDerWaalsContact C-N 3.25Å; N160-L162 PolarHBondContact O-N 3.31Å; N160-H163 PolarHBondContact O-N 3.46Å
161	H	73	Confident	76.9	Confident	105 Å²	105	72.2 Å²	72.2	49%	0.486	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-16.5	176.2	-61	-52.5	0	0	0	113.9	S157 V158 V159 N448	S157-H161 PolarHBondContact O-CD2 2.96Å; S157-H161 PolarHBondContact O-NE2 3.28Å; V158-H161 PolarHBondContact O-N 2.93Å; V159-H161 PolarHBondContact O-N 2.99Å; H161-N448 PolarHBondContact CD2-ND2 3.31Å
162	L	77.6	Confident	78	Confident	48 Å²	48	76.8 Å²	76.8	25%	0.251	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-11.3	178.2	-63.7	170.9	0	0	0	112.6	V159 N160 W310 C312 Y450	V159-L162 WeakPolarHBondContact O-CB 3.37Å; V159-L162 PolarHBondContact O-N 3.02Å; N160-L162 VanDerWaalsContact C-N 3.25Å; N160-L162 PolarHBondContact O-N 3.31Å; L162-W310 PolarHBondContact O-NE1 2.98Å; L162-C312 HydrophobicContact CD2-CB 4.13Å; L162-Y450 HydrophobicContact CD2-CD2 4.11Å; L162-Y450 HydrophobicContact CD2-CG 4.03Å
163	H	84	Confident	79.2	Confident	93 Å²	93	73.5 Å²	73.5	43%	0.431	40%	0.395	S	S	.	.	S	Bend	trans	-81.3	140.4	175.5	-75.6	-178.9	0	0	0	112.2	N160 D165	N160-H163 PolarHBondContact O-N 3.46Å; H163-D165 PolarHBondContact O-N 3.24Å
164	P	87.9	Confident	80.5	Confident	12 Å²	12	69.8 Å²	69.8	8%	0.078	37%	0.37	C	S	.	.			trans	-71	132.8	177.5	26.4	-30	0	0	0	111.1	V166 P269 W310 W454	P164-V166 PolarHBondContact O-N 2.67Å; P164-P269 WeakPolarHBondContact CG-O 3.42Å; P164-W310 HydrophobicContact CB-CB 4.23Å; P164-W310 HydrophobicContact CB-CD2 3.67Å; P164-W310 HydrophobicContact CB-CE3 4.08Å; P164-W310 HydrophobicContact CB-CG 3.76Å; P164-W310 HydrophobicContact CB-CZ2 4.48Å; P164-W310 HydrophobicContact CG-CB 3.96Å; P164-W310 HydrophobicContact CG-CD2 4.3Å; P164-W310 HydrophobicContact CG-CG 3.85Å; P164-W454 HydrophobicContact CB-CH2 3.57Å; P164-W454 HydrophobicContact CB-CZ2 3.34Å; P164-W454 HydrophobicContact CG-CH2 3.72Å; P164-W454 HydrophobicContact CG-CZ2 4.05Å
165	D	84.6	Confident	81.7	Confident	82 Å²	82	73.3 Å²	73.3	44%	0.439	38%	0.38	S	S	.	.			trans	-76.6	113.1	165.3	167.5	19.9	0	0	0	110	H163 S167 K170	H163-D165 PolarHBondContact O-N 3.24Å; D165-S167 VanDerWaalsContact OD1-CB 3.25Å; D165-S167 WeakPolarHBondContact OD1-CB 3.3Å; D165-S167 PolarHBondContact OD1-N 3.42Å; D165-S167 PolarHBondContact OD1-OG 2.69Å; D165-S167 PolarHBondContact OD2-OG 2.86Å; D165-K170 HydrophobicContact CB-CD 4.22Å; D165-K170 WeakPolarHBondContact O-CD 3.07Å; D165-K170 WeakPolarHBondContact OD2-CD 3.3Å; D165-K170 VanDerWaalsContact OD2-CE 3.25Å; D165-K170 WeakPolarHBondContact OD2-CE 3.26Å; D165-K170 IonicContact OD2-NZ 2.68Å; D165-K170 PolarHBondContact OD2-NZ 3.4Å
166	V	85	Confident	82.8	Confident	66 Å²	66	74.2 Å²	74.2	40%	0.4	38%	0.379	S	S	.	.			trans	-104.7	36.7	179	-87.5	0	0	0	0	112.5	P164 T171 L174 W454	P164-V166 PolarHBondContact O-N 2.67Å; V166-T171 PolarHBondContact O-OG1 2.8Å; V166-L174 HydrophobicContact CG1-CD1 4.12Å; V166-W454 HydrophobicContact CG1-CH2 4.35Å; V166-W454 HydrophobicContact CG1-CZ2 4.18Å
167	S	87.4	Confident	83.7	Confident	36 Å²	36	71 Å²	71	25%	0.252	36%	0.357	S	S	.	.			trans	-54.3	149.7	168.9	55.2	0	0	0	0	112.6	D165 H169 K170 T171	D165-S167 VanDerWaalsContact OD1-CB 3.25Å; D165-S167 WeakPolarHBondContact OD1-CB 3.3Å; D165-S167 PolarHBondContact OD1-N 3.42Å; D165-S167 PolarHBondContact OD1-OG 2.69Å; D165-S167 PolarHBondContact OD2-OG 2.86Å; S167-H169 PolarHBondContact O-N 3.25Å; S167-K170 WeakPolarHBondContact O-CA 3.48Å; S167-K170 WeakPolarHBondContact O-CB 3.37Å; S167-K170 PolarHBondContact O-N 3.47Å; S167-T171 PolarHBondContact O-N 3.35Å; S167-T171 PolarHBondContact O-OG1 3.06Å
168	P	87.5	Confident	84.7	Confident	94 Å²	94	68.7 Å²	68.7	61%	0.61	34%	0.341	S	S	*	.	H	α-helix	trans	-57.2	-28.8	-172.5	20.7	-34.2	0	0	0	114	K172	P168-K172 WeakPolarHBondContact O-CG 2.97Å; P168-K172 PolarHBondContact O-N 2.89Å; P168-K172 VanDerWaalsContact O-N 3.11Å
169	H	87	Confident	85.1	Confident	140 Å²	140	69.5 Å²	69.5	65%	0.648	35%	0.349	S	S	*	.	H	α-helix	trans	-68.7	-38.8	174.5	-64	-74.8	0	0	0	112.7	S167	S167-H169 PolarHBondContact O-N 3.25Å
170	K	90.5	Very high	85.2	Confident	61 Å²	61	70 Å²	70	27%	0.265	36%	0.364	S	S	.	.	H	α-helix	trans	-73	-41.9	174.4	-70	-179.3	175.7	173.6	0	110.2	D165 S167 K172 K173 L174 L443	D165-K170 HydrophobicContact CB-CD 4.22Å; D165-K170 WeakPolarHBondContact O-CD 3.07Å; D165-K170 WeakPolarHBondContact OD2-CD 3.3Å; D165-K170 VanDerWaalsContact OD2-CE 3.25Å; D165-K170 WeakPolarHBondContact OD2-CE 3.26Å; D165-K170 IonicContact OD2-NZ 2.68Å; D165-K170 PolarHBondContact OD2-NZ 3.4Å; S167-K170 WeakPolarHBondContact O-CA 3.48Å; S167-K170 WeakPolarHBondContact O-CB 3.37Å; S167-K170 PolarHBondContact O-N 3.47Å; K170-K172 VanDerWaalsContact C-N 3.29Å; K170-K172 PolarHBondContact O-N 3.06Å; K170-K173 CarbonylContact O-C 3.58Å; K170-K173 WeakPolarHBondContact O-CA 3.01Å; K170-K173 WeakPolarHBondContact O-CB 3.41Å; K170-K173 PolarHBondContact O-N 2.8Å; K170-L174 WeakPolarHBondContact O-CG 3.42Å; K170-L174 PolarHBondContact O-N 3.47Å; K170-L443 HydrophobicContact CB-CD2 4.2Å; K170-L443 HydrophobicContact CD-CD2 4.41Å; K170-L443 HydrophobicContact CG-CD2 3.9Å
171	T	90.1	Very high	85.6	Confident	7 Å²	7	68.3 Å²	68.3	4%	0.043	36%	0.355	C	S	.	.	H	α-helix	trans	-52.3	-43.3	173.4	-55.4	0	0	0	0	112.7	V166 S167 K173 L174 R175 E189 W272	V166-T171 PolarHBondContact O-OG1 2.8Å; S167-T171 PolarHBondContact O-N 3.35Å; S167-T171 PolarHBondContact O-OG1 3.06Å; T171-K173 VanDerWaalsContact C-N 3.26Å; T171-K173 PolarHBondContact O-N 3.44Å; T171-L174 PolarHBondContact O-N 2.88Å; T171-R175 PolarHBondContact O-N 2.04Å; T171-E189 WeakPolarHBondContact CG2-OE1 3.46Å; T171-E189 WeakPolarHBondContact CG2-OE2 3.42Å; T171-E189 PolarHBondContact OG1-OE1 3.43Å; T171-W272 HydrophobicContact CG2-CZ2 3.49Å; T171-W272 VanDerWaalsContact CG2-CZ2 3.49Å
172	K	89.9	Confident	86.1	Confident	140 Å²	140	66 Å²	66	61%	0.609	35%	0.346	S	S	*	.	H	α-helix	trans	-59.7	-34.5	174.1	-75.3	176.7	-177.1	178.8	0	112.9	P168 K170 K176	P168-K172 WeakPolarHBondContact O-CG 2.97Å; P168-K172 PolarHBondContact O-N 2.89Å; P168-K172 VanDerWaalsContact O-N 3.11Å; K170-K172 VanDerWaalsContact C-N 3.29Å; K170-K172 PolarHBondContact O-N 3.06Å; K172-K176 WeakPolarHBondContact O-CG 3.35Å; K172-K176 PolarHBondContact O-N 2.86Å
173	K	90.8	Very high	86.5	Confident	81 Å²	81	65.5 Å²	65.5	35%	0.352	34%	0.344	S	S	.	.	H	α-helix	trans	-76.3	-38.5	175.5	-65.9	171.6	178.2	172.1	0	111.4	K170 T171 K176 I177 L443	K170-K173 CarbonylContact O-C 3.58Å; K170-K173 WeakPolarHBondContact O-CA 3.01Å; K170-K173 WeakPolarHBondContact O-CB 3.41Å; K170-K173 PolarHBondContact O-N 2.8Å; T171-K173 VanDerWaalsContact C-N 3.26Å; T171-K173 PolarHBondContact O-N 3.44Å; K173-K176 WeakPolarHBondContact O-CA 3.21Å; K173-K176 WeakPolarHBondContact O-CB 3.22Å; K173-K176 PolarHBondContact O-N 3.27Å; K173-K176 VanDerWaalsContact O-N 3.11Å; K173-I177 WeakPolarHBondContact O-CG1 3.33Å; K173-I177 PolarHBondContact O-N 3.47Å; K173-L443 HydrophobicContact CB-CD1 3.91Å; K173-L443 HydrophobicContact CB-CD2 4.37Å; K173-L443 HydrophobicContact CD-CD2 3.8Å; K173-L443 HydrophobicContact CD-CG 4.39Å
174	L	92	Very high	86.6	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-61.4	-43.9	174.5	-62.1	175.1	0	0	0	111.4	V166 K170 T171 K176 I177 L178 W272 L308 L443 W454	V166-L174 HydrophobicContact CG1-CD1 4.12Å; K170-L174 WeakPolarHBondContact O-CG 3.42Å; K170-L174 PolarHBondContact O-N 3.47Å; T171-L174 PolarHBondContact O-N 2.88Å; L174-K176 PolarHBondContact O-N 3.17Å; L174-I177 HydrophobicContact CD2-CD1 4.27Å; L174-I177 WeakPolarHBondContact O-CA 3.41Å; L174-I177 WeakPolarHBondContact O-CB 3.42Å; L174-I177 PolarHBondContact O-N 3.41Å; L174-L178 PolarHBondContact O-N 2.92Å; L174-L178 VanDerWaalsContact O-N 3.1Å; L174-W272 VanDerWaalsContact C-CZ3 3.44Å; L174-W272 HydrophobicContact CB-CD2 3.75Å; L174-W272 HydrophobicContact CB-CE3 3.53Å; L174-W272 HydrophobicContact CB-CH2 3.78Å; L174-W272 HydrophobicContact CB-CZ2 3.98Å; L174-W272 HydrophobicContact CB-CZ3 3.51Å; L174-W272 HydrophobicContact CD1-CB 4.32Å; L174-W272 HydrophobicContact CD1-CD2 3.7Å; L174-W272 HydrophobicContact CD1-CE3 4.28Å; L174-W272 HydrophobicContact CD1-CG 3.68Å; L174-W272 HydrophobicContact CG-CD2 4.33Å; L174-W272 HydrophobicContact CG-CE3 4.45Å; L174-L308 HydrophobicContact CB-CD1 3.87Å; L174-L308 HydrophobicContact CD2-CD1 3.55Å; L174-L308 HydrophobicContact CG-CD1 4.24Å; L174-L443 HydrophobicContact CD2-CD1 3.65Å; L174-L443 HydrophobicContact CG-CD1 4.29Å; L174-W454 HydrophobicContact CD1-CZ2 3.98Å; L174-W454 HydrophobicContact CD2-CD2 3.89Å; L174-W454 HydrophobicContact CD2-CG 3.81Å; L174-W454 HydrophobicContact CD2-CZ2 4.28Å
175	R	91.5	Very high	86.6	Confident	137 Å²	137	75 Å²	75	52%	0.517	38%	0.384	S	S	.	.	H	α-helix	trans	-59.3	-36.6	173.1	-163.9	178.5	-62.5	-159.9	0.5	112.1	T171 I177 L178 S179 L182 W272	T171-R175 PolarHBondContact O-N 2.04Å; R175-I177 VanDerWaalsContact C-N 3.32Å; R175-L178 CarbonylContact O-C 3.55Å; R175-L178 PolarHBondContact O-N 3.09Å; R175-S179 WeakPolarHBondContact O-CA 3.5Å; R175-S179 WeakPolarHBondContact O-CB 3.43Å; R175-S179 PolarHBondContact O-N 2.77Å; R175-S179 PolarHBondContact O-OG 2.82Å; R175-L182 HydrophobicContact CG-CD2 4.09Å; R175-W272 HydrophobicContact CB-CH2 3.86Å; R175-W272 VanDerWaalsContact N-CH2 3.3Å
176	K	90	Very high	86.9	Confident	110 Å²	110	71.3 Å²	71.3	48%	0.478	36%	0.364	S	S	.	.	H	α-helix	trans	-68.4	-28.5	174.7	-74	173.1	-177.2	178.7	0	113.2	K172 K173 L174 S179 L439	K172-K176 WeakPolarHBondContact O-CG 3.35Å; K172-K176 PolarHBondContact O-N 2.86Å; K173-K176 WeakPolarHBondContact O-CA 3.21Å; K173-K176 WeakPolarHBondContact O-CB 3.22Å; K173-K176 PolarHBondContact O-N 3.27Å; K173-K176 VanDerWaalsContact O-N 3.11Å; L174-K176 PolarHBondContact O-N 3.17Å; K176-S179 VanDerWaalsContact CA-OG 3.31Å; K176-S179 WeakPolarHBondContact CA-OG 3.49Å; K176-L439 HydrophobicContact CB-CD1 3.75Å
177	I	89.8	Confident	87.3	Confident	17 Å²	17	68.7 Å²	68.7	9%	0.087	35%	0.348	C	S	.	.	H	α-helix	trans	-71	-43.6	174.7	-68	162.7	0	0	0	110.1	K173 L174 R175 S179 L308 A436 L439 I440 L443 V456	K173-I177 WeakPolarHBondContact O-CG1 3.33Å; K173-I177 PolarHBondContact O-N 3.47Å; L174-I177 HydrophobicContact CD2-CD1 4.27Å; L174-I177 WeakPolarHBondContact O-CA 3.41Å; L174-I177 WeakPolarHBondContact O-CB 3.42Å; L174-I177 PolarHBondContact O-N 3.41Å; R175-I177 VanDerWaalsContact C-N 3.32Å; I177-S179 VanDerWaalsContact C-N 3.35Å; I177-L308 HydrophobicContact CB-CD1 4.43Å; I177-L308 HydrophobicContact CG2-CD1 4.36Å; I177-L308 HydrophobicContact CG2-CD2 3.81Å; I177-A436 HydrophobicContact CG2-CB 4.17Å; I177-L439 HydrophobicContact CD1-CB 3.84Å; I177-L439 HydrophobicContact CG1-CB 3.61Å; I177-L439 HydrophobicContact CG1-CD1 3.97Å; I177-L439 HydrophobicContact CG1-CG 4.46Å; I177-I440 HydrophobicContact CD1-CG1 3.73Å; I177-I440 HydrophobicContact CG1-CG1 4.32Å; I177-I440 HydrophobicContact CG2-CD1 4.19Å; I177-I440 HydrophobicContact CG2-CG1 4.24Å; I177-L443 HydrophobicContact CD1-CD1 3.79Å; I177-V456 HydrophobicContact CG2-CG2 4.2Å
178	L	89.3	Confident	87.5	Confident	2 Å²	2	68.3 Å²	68.3	1%	0.01	35%	0.346	C	S	.	.	S	Bend	trans	-84.5	-2.9	177.3	-63.4	-175.6	0	0	0	114.2	L174 R175 G180 N181 L182 W272 Q306 L308	L174-L178 PolarHBondContact O-N 2.92Å; L174-L178 VanDerWaalsContact O-N 3.1Å; R175-L178 CarbonylContact O-C 3.55Å; R175-L178 PolarHBondContact O-N 3.09Å; L178-G180 PolarHBondContact O-N 2.97Å; L178-N181 PolarHBondContact O-N 2.93Å; L178-L182 HydrophobicContact CB-CB 4.24Å; L178-L182 HydrophobicContact CD1-CD1 4.07Å; L178-L182 PolarHBondContact O-N 3.47Å; L178-W272 HydrophobicContact CD1-CE3 3.92Å; L178-W272 HydrophobicContact CD1-CZ3 3.65Å; L178-W272 HydrophobicContact CG-CZ3 4.26Å; L178-Q306 HydrophobicContact CD2-CB 4.28Å; L178-L308 HydrophobicContact CD1-CD1 4.46Å; L178-L308 HydrophobicContact CD1-CG 4.1Å; L178-L308 HydrophobicContact CD2-CD2 3.72Å; L178-L308 HydrophobicContact CD2-CG 3.9Å; L178-L308 HydrophobicContact CG-CD1 4.18Å; L178-L308 HydrophobicContact CG-CD2 4.2Å; L178-L308 HydrophobicContact CG-CG 3.93Å
179	S	75.2	Confident	87.6	Confident	65 Å²	65	67.6 Å²	67.6	46%	0.455	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	113.6	-174.5	-75.7	0	0	0	0	111.1	R175 K176 I177	R175-S179 WeakPolarHBondContact O-CA 3.5Å; R175-S179 WeakPolarHBondContact O-CB 3.43Å; R175-S179 PolarHBondContact O-N 2.77Å; R175-S179 PolarHBondContact O-OG 2.82Å; K176-S179 VanDerWaalsContact CA-OG 3.31Å; K176-S179 WeakPolarHBondContact CA-OG 3.49Å; I177-S179 VanDerWaalsContact C-N 3.35Å
180	G	74.1	Confident	87.8	Confident	62 Å²	62	65.4 Å²	65.4	64%	0.639	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.2	-25.5	-173.9	0	0	0	0	0	113.6	L178	L178-G180 PolarHBondContact O-N 2.97Å
181	N	79.7	Confident	87.8	Confident	77 Å²	77	66.4 Å²	66.4	41%	0.412	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131	6.6	-172.7	-66.4	73.5	0	0	0	113.4	L178 D183 Q306	L178-N181 PolarHBondContact O-N 2.93Å; N181-D183 PolarHBondContact O-N 3.2Å; N181-Q306 HydrophobicContact CB-CB 4.18Å; N181-Q306 HydrophobicContact CB-CG 4.16Å; N181-Q306 VanDerWaalsContact CG-OE1 3.31Å; N181-Q306 PolarHBondContact ND2-NE2 2.98Å
182	L	83.3	Confident	87.8	Confident	56 Å²	56	67.4 Å²	67.4	29%	0.293	35%	0.35	S	S	.	.			trans	-82.5	105.4	178.5	-178.7	65.3	0	0	0	110.5	R175 L178 K184 T187 P273	R175-L182 HydrophobicContact CG-CD2 4.09Å; L178-L182 HydrophobicContact CB-CB 4.24Å; L178-L182 HydrophobicContact CD1-CD1 4.07Å; L178-L182 PolarHBondContact O-N 3.47Å; L182-K184 PolarHBondContact O-N 2.88Å; L182-T187 WeakPolarHBondContact CD1-OG1 3.3Å; L182-P273 HydrophobicContact CD1-CG 3.73Å
183	D	86.1	Confident	87.7	Confident	38 Å²	38	73.1 Å²	73.1	20%	0.203	37%	0.368	C	S	.	.			trans	-82	96.8	175.9	-71.6	-34.2	0	0	0	110.7	N181 E185 W186 T187 R303 L305	N181-D183 PolarHBondContact O-N 3.2Å; D183-E185 PolarHBondContact O-N 2.97Å; D183-W186 HydrophobicContact CB-CB 4.06Å; D183-W186 PolarHBondContact O-N 3.35Å; D183-W186 VanDerWaalsContact O-N 3.16Å; D183-T187 PolarHBondContact O-N 3.45Å; D183-T187 PolarHBondContact O-OG1 3.31Å; D183-R303 IonicContact OD1-CZ 3.83Å; D183-R303 IonicContact OD1-NE 2.93Å; D183-R303 IonicContact OD1-NH2 2.66Å; D183-R303 PolarHBondContact OD1-NH2 3.39Å; D183-R303 IonicContact OD2-CZ 3.32Å; D183-R303 IonicContact OD2-NE 2.72Å; D183-R303 PolarHBondContact OD2-NE 3.42Å; D183-R303 IonicContact OD2-NH2 2.72Å; D183-R303 PolarHBondContact OD2-NH2 3.24Å; D183-R303 VanDerWaalsContact OD2-NH2 3.09Å; D183-L305 HydrophobicContact CB-CD2 3.94Å; D183-L305 WeakPolarHBondContact OD2-CD2 3.44Å
184	K	87.8	Confident	87.6	Confident	189 Å²	189	74.1 Å²	74.1	82%	0.822	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.7	-177.8	-174.8	-179	175.1	-167.6	0	113.6	L182 W186 T187	L182-K184 PolarHBondContact O-N 2.88Å; K184-W186 VanDerWaalsContact C-N 3.33Å; K184-T187 VanDerWaalsContact O-O 3.07Å
185	E	86.8	Confident	87.3	Confident	115 Å²	115	78.1 Å²	78.1	54%	0.537	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-19.1	-177.4	-54.7	167.7	158.2	0	0	112.9	D183 L204	D183-E185 PolarHBondContact O-N 2.97Å; E185-L204 HydrophobicContact CB-CD2 3.33Å; E185-L204 HydrophobicContact CG-CD2 3.84Å; E185-L204 WeakPolarHBondContact OE2-CD2 2.96Å
186	W	90.7	Very high	87.2	Confident	5 Å²	5	79.1 Å²	79.1	2%	0.019	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-9.9	-176.2	-68.1	93.8	0	0	0	113.3	D183 K184 L204 F262 I276 R277 L305 I461 D463	D183-W186 HydrophobicContact CB-CB 4.06Å; D183-W186 PolarHBondContact O-N 3.35Å; D183-W186 VanDerWaalsContact O-N 3.16Å; K184-W186 VanDerWaalsContact C-N 3.33Å; W186-L204 HydrophobicContact CH2-CD1 4.24Å; W186-L204 HydrophobicContact CZ2-CD1 3.52Å; W186-F262 HydrophobicContact CH2-CD1 4.23Å; W186-F262 AromaticContact CH2-CE1 3.76Å; W186-F262 HydrophobicContact CH2-CE1 3.76Å; W186-F262 HydrophobicContact CZ3-CD1 4.27Å; W186-F262 HydrophobicContact CZ3-CE1 4.25Å; W186-I276 CarbonylContact O-C 3.53Å; W186-I276 WeakPolarHBondContact O-CA 3.32Å; W186-R277 HydrophobicContact CE3-CB 3.9Å; W186-R277 HydrophobicContact CE3-CG 4.13Å; W186-R277 VanDerWaalsContact CE3-O 3.23Å; W186-R277 HydrophobicContact CZ3-CB 4.5Å; W186-R277 HydrophobicContact CZ3-CG 4.29Å; W186-R277 PolarHBondContact O-N 3.1Å; W186-L305 HydrophobicContact CB-CD1 4.18Å; W186-L305 HydrophobicContact CB-CD2 3.7Å; W186-L305 HydrophobicContact CG-CD2 4.29Å; W186-I461 HydrophobicContact CB-CD1 4.47Å; W186-I461 HydrophobicContact CD2-CD1 3.71Å; W186-I461 HydrophobicContact CE3-CD1 3.15Å; W186-I461 HydrophobicContact CG-CD1 4.29Å; W186-I461 HydrophobicContact CH2-CD1 4.37Å; W186-I461 HydrophobicContact CZ3-CD1 3.54Å; W186-D463 HydrophobicContact CH2-CB 3.47Å; W186-D463 VanDerWaalsContact CH2-CB 3.47Å; W186-D463 HydrophobicContact CZ2-CB 3.64Å; W186-D463 HydrophobicContact CZ3-CB 4.37Å
187	T	92.8	Very high	87	Confident	10 Å²	10	77 Å²	77	6%	0.061	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	140.7	-178	63.1	0	0	0	0	110.9	L182 D183 K184 W275 I276 L305 L307	L182-T187 WeakPolarHBondContact CD1-OG1 3.3Å; D183-T187 PolarHBondContact O-N 3.45Å; D183-T187 PolarHBondContact O-OG1 3.31Å; K184-T187 VanDerWaalsContact O-O 3.07Å; T187-W275 CarbonylContact C-O 3.51Å; T187-W275 WeakPolarHBondContact CA-O 3.47Å; T187-I276 HydrophobicContact CG2-CG2 4.45Å; T187-L305 HydrophobicContact CG2-CD1 3.98Å; T187-L305 HydrophobicContact CG2-CD2 4.48Å; T187-L307 HydrophobicContact CG2-CD2 3.91Å
188	S	92.3	Very high	86.8	Confident	28 Å²	28	83 Å²	83	20%	0.196	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	144.5	177.9	-174.8	0	0	0	0	111.1	T190 P273 W275	S188-T190 WeakPolarHBondContact CB-O 3.46Å; S188-T190 PolarHBondContact OG-N 2.7Å; S188-T190 PolarHBondContact OG-O 3.24Å; S188-P273 WeakPolarHBondContact O-CB 3.48Å; S188-W275 PolarHBondContact N-O 2.94Å; S188-W275 WeakPolarHBondContact O-CB 2.98Å; S188-W275 PolarHBondContact O-N 3.43Å
189	E	89.8	Confident	86.3	Confident	80 Å²	80	83.6 Å²	83.6	37%	0.374	42%	0.42	S	S	.	.	S	Bend	trans	-77.9	-42.4	173.8	-179.1	170.3	-169.5	0	0	110.8	T171	T171-E189 WeakPolarHBondContact CG2-OE1 3.46Å; T171-E189 WeakPolarHBondContact CG2-OE2 3.42Å; T171-E189 PolarHBondContact OG1-OE1 3.43Å
190	T	90.8	Very high	86.1	Confident	94 Å²	94	82.9 Å²	82.9	58%	0.577	41%	0.411	S	S	*	.	S	Bend	trans	-99.4	151.4	178.1	55.4	0	0	0	0	111.2	S188	S188-T190 WeakPolarHBondContact CB-O 3.46Å; S188-T190 PolarHBondContact OG-N 2.7Å; S188-T190 PolarHBondContact OG-O 3.24Å
191	P	90.8	Very high	85.7	Confident	81 Å²	81	80.2 Å²	80.2	53%	0.526	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-54.9	126.3	172.3	20.7	-30.8	0	0	0	110	W275	P191-W275 HydrophobicContact CB-CD2 4.23Å; P191-W275 HydrophobicContact CB-CH2 4.03Å; P191-W275 HydrophobicContact CB-CZ2 3.55Å; P191-W275 HydrophobicContact CG-CZ2 4.32Å
192	P	90.3	Very high	84.8	Confident	28 Å²	28	77.6 Å²	77.6	18%	0.182	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-69.1	149	173.8	23.4	-23.6	0	0	0	110	I194 L195 W264	P192-I194 PolarHBondContact O-N 2.99Å; P192-L195 HydrophobicContact CG-CD2 4.35Å; P192-W264 HydrophobicContact CB-CD2 4.28Å; P192-W264 HydrophobicContact CB-CG 4.28Å; P192-W264 HydrophobicContact CG-CB 3.64Å; P192-W264 VanDerWaalsContact CG-CD1 3.46Å; P192-W264 HydrophobicContact CG-CD2 3.34Å; P192-W264 HydrophobicContact CG-CE3 3.9Å; P192-W264 HydrophobicContact CG-CG 3.2Å; P192-W264 HydrophobicContact CG-CZ2 4.42Å
193	R	88.9	Confident	83.6	Confident	260 Å²	260	75.8 Å²	75.8	98%	0.981	37%	0.366	S	S	*	.	S	Bend	trans	-61.3	-33.3	-179.7	-66.2	-177.2	-179.8	-178.7	-1	112.8
194	I	87	Confident	82.1	Confident	102 Å²	102	75.8 Å²	75.8	52%	0.523	37%	0.366	S	S	.	.			trans	-111.3	107.1	-179.9	-57.3	171	0	0	0	107	P192 R196 Q197	P192-I194 PolarHBondContact O-N 2.99Å; I194-R196 WeakPolarHBondContact CG2-O 2.99Å; I194-Q197 HydrophobicContact CG2-CB 4.24Å
195	L	86.3	Confident	80.4	Confident	84 Å²	84	69.8 Å²	69.8	44%	0.44	34%	0.342	S	S	.	.	S	Bend	trans	-78.9	-28.5	-179.6	-67.1	177.9	0	0	0	112.7	P192 I263 W264 W275	P192-L195 HydrophobicContact CG-CD2 4.35Å; L195-I263 CarbonylContact O-C 3.58Å; L195-I263 WeakPolarHBondContact O-CA 2.97Å; L195-W264 HydrophobicContact CD2-CB 4.14Å; L195-W264 PolarHBondContact O-N 2.92Å; L195-W275 HydrophobicContact CD2-CE3 4.32Å; L195-W275 HydrophobicContact CD2-CH2 4.39Å; L195-W275 HydrophobicContact CD2-CZ3 3.72Å
196	R	89	Confident	78.2	Confident	158 Å²	158	69.3 Å²	69.3	60%	0.596	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.1	127.4	179.4	-64.1	-174.4	66.7	171.9	-1.7	109.5	I194 D261 F262 I263	I194-R196 WeakPolarHBondContact CG2-O 2.99Å; R196-D261 IonicContact CZ-OD2 3.84Å; R196-D261 IonicContact NH2-OD2 3.23Å; R196-D261 PolarHBondContact NH2-OD2 3.14Å; R196-F262 CarbonylContact C-O 3.45Å; R196-F262 WeakPolarHBondContact CA-O 3.46Å; R196-I263 HydrophobicContact CG-CG1 4.17Å; R196-I263 HydrophobicContact CG-CG2 4.17Å
197	Q	86	Confident	75.6	Confident	65 Å²	65	76.1 Å²	76.1	30%	0.304	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	120.5	177	-175.8	168.7	13.4	0	0	109.7	I194 N205 F262	I194-Q197 HydrophobicContact CG2-CB 4.24Å; Q197-N205 VanDerWaalsContact CD-CG 3.48Å; Q197-N205 PolarHBondContact NE2-ND2 2.82Å; Q197-N205 PolarHBondContact NE2-OD1 3.49Å; Q197-N205 PolarHBondContact OE1-ND2 2.87Å; Q197-F262 PolarHBondContact N-O 2.82Å; Q197-F262 WeakPolarHBondContact O-CB 3Å; Q197-F262 PolarHBondContact O-N 3.08Å
198	R	85.2	Confident	72.9	Confident	144 Å²	144	82 Å²	82	54%	0.543	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	137.4	171.5	-163.3	176.1	-160.8	141.5	1.3	109.4	E259 L282	R198-E259 IonicContact CZ-OE2 2.65Å; R198-E259 VanDerWaalsContact CZ-OE2 3.23Å; R198-E259 IonicContact NE-OE2 3.69Å; R198-E259 PolarHBondContact NE-OE2 2.86Å; R198-E259 IonicContact NH2-OE2 2.75Å; R198-E259 PolarHBondContact NH2-OE2 2.99Å; R198-L282 HydrophobicContact CG-CD1 4.13Å
199	G	78.8	Confident	70.2	Confident	14 Å²	14	89.9 Å²	89.9	14%	0.144	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	179.8	176.6	0	0	0	0	0	111.8	M260	G199-M260 PolarHBondContact N-O 3.22Å; G199-M260 PolarHBondContact O-N 3.16Å
200	I	72.4	Confident	67.8	Low	50 Å²	50	93.6 Å²	93.6	26%	0.256	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	144.5	173.4	-57.8	171.6	0	0	0	107.8	G202 S203 Y212	I200-G202 PolarHBondContact O-N 3.15Å; I200-S203 WeakPolarHBondContact O-CB 3.01Å; I200-S203 PolarHBondContact O-N 2.83Å; I200-S203 VanDerWaalsContact O-N 3.07Å; I200-Y212 HydrophobicContact CD1-CD1 4.34Å; I200-Y212 HydrophobicContact CD1-CE1 3.52Å
201	S	65.4	Low	65.5	Low	6 Å²	6	90.4 Å²	90.4	4%	0.042	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.9	126.2	171.9	-173.4	0	0	0	0	110.5	S203 I215 C258 R464 C465	S201-S203 PolarHBondContact O-N 2.72Å; S201-I215 WeakPolarHBondContact O-CD1 3.09Å; S201-I215 WeakPolarHBondContact OG-CD1 3.31Å; S201-C258 WeakPolarHBondContact CB-O 3.38Å; S201-C258 PolarHBondContact N-O 2.84Å; S201-R464 WeakPolarHBondContact OG-CA 3.49Å; S201-C465 PolarHBondContact OG-N 2.81Å; S201-C465 PolarHBondContact OG-O 3.04Å
202	G	60.6	Low	63.2	Low	22 Å²	22	93.4 Å²	93.4	23%	0.227	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	-8.2	176.5	0	0	0	0	0	116.9	I200 L204 I215	I200-G202 PolarHBondContact O-N 3.15Å; G202-L204 PolarHBondContact O-N 2.93Å; G202-I215 VanDerWaalsContact N-CD1 3.34Å
203	S	57.7	Low	61.3	Low	19 Å²	19	96.8 Å²	96.8	13%	0.133	47%	0.471	C	S	.	.			trans	-85.8	99.7	172.2	167.1	0	0	0	0	109.5	I200 S201 S211	I200-S203 WeakPolarHBondContact O-CB 3.01Å; I200-S203 PolarHBondContact O-N 2.83Å; I200-S203 VanDerWaalsContact O-N 3.07Å; S201-S203 PolarHBondContact O-N 2.72Å; S203-S211 WeakPolarHBondContact CA-O 3.39Å; S203-S211 WeakPolarHBondContact CB-O 3.28Å; S203-S211 WeakPolarHBondContact OG-CB 3.38Å
204	L	55.6	Low	59.7	Low	37 Å²	37	87.1 Å²	87.1	19%	0.194	44%	0.443	C	S	.	.			trans	-81.5	128.2	165.4	-120.5	74.1	0	0	0	109.1	E185 W186 G202 T206	E185-L204 HydrophobicContact CB-CD2 3.33Å; E185-L204 HydrophobicContact CG-CD2 3.84Å; E185-L204 WeakPolarHBondContact OE2-CD2 2.96Å; W186-L204 HydrophobicContact CH2-CD1 4.24Å; W186-L204 HydrophobicContact CZ2-CD1 3.52Å; G202-L204 PolarHBondContact O-N 2.93Å; L204-T206 PolarHBondContact O-N 3.05Å
205	N	50.6	Low	58.3	Low	63 Å²	63	84.1 Å²	84.1	34%	0.337	43%	0.427	S	S	.	.			trans	-62.2	90.7	-174.8	-59.7	-57	0	0	0	112.6	Q197 R277	Q197-N205 VanDerWaalsContact CD-CG 3.48Å; Q197-N205 PolarHBondContact NE2-ND2 2.82Å; Q197-N205 PolarHBondContact NE2-OD1 3.49Å; Q197-N205 PolarHBondContact OE1-ND2 2.87Å; N205-R277 PolarHBondContact ND2-NH2 3.29Å; N205-R277 VanDerWaalsContact ND2-NH2 3.11Å
206	T	40.4	Very low	57.5	Low	105 Å²	105	80.8 Å²	80.8	64%	0.644	41%	0.41	S	S	*	.			trans	-100.6	120.8	148.5	2.7	0	0	0	0	106.1	L204 N208	L204-T206 PolarHBondContact O-N 3.05Å; T206-N208 PolarHBondContact O-N 2.02Å
207	N	37.7	Very low	57	Low	148 Å²	148	75.7 Å²	75.7	79%	0.791	40%	0.402	S	S	*	.	S	Bend	trans	-51.1	126.9	163.1	-61.9	-21.9	0	0	0	107
208	N	34.3	Very low	56.8	Low	135 Å²	135	79.6 Å²	79.6	72%	0.722	42%	0.418	S	S	*	.	S	Bend	trans	103.5	95.8	178.4	-51.1	-13.8	0	0	0	115.2	T206 E210	T206-N208 PolarHBondContact O-N 2.02Å; N208-E210 VanDerWaalsContact C-N 3.34Å; N208-E210 PolarHBondContact O-N 2.84Å
209	Q	36.9	Very low	56.8	Low	193 Å²	193	74.4 Å²	74.4	90%	0.902	40%	0.4	S	S	*	.	S	Bend	trans	57.6	-5.6	139.1	-74.2	174.8	-29	0	0	122.6
210	E	39.9	Very low	57.2	Low	157 Å²	157	76.3 Å²	76.3	73%	0.734	41%	0.407	S	S	*	.			trans	-119.7	9.4	-171.9	-66.4	-172.6	168.9	0	0	116.5	N208 Y212 T213	N208-E210 VanDerWaalsContact C-N 3.34Å; N208-E210 PolarHBondContact O-N 2.84Å; E210-Y212 PolarHBondContact O-N 2.77Å; E210-T213 WeakPolarHBondContact O-CG2 3.47Å; E210-T213 PolarHBondContact O-OG1 2.89Å
211	S	42.2	Very low	57.9	Low	28 Å²	28	79.7 Å²	79.7	20%	0.196	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-1.8	-167.8	-45.3	0	0	0	0	116.5	S203 T213	S203-S211 WeakPolarHBondContact CA-O 3.39Å; S203-S211 WeakPolarHBondContact CB-O 3.28Å; S203-S211 WeakPolarHBondContact OG-CB 3.38Å; S211-T213 VanDerWaalsContact C-N 3.34Å
212	Y	42.9	Very low	59	Low	144 Å²	144	83.9 Å²	83.9	57%	0.565	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-12.5	177.7	-66.2	-79.7	0	0	0	113.5	I200 E210 S214 D216	I200-Y212 HydrophobicContact CD1-CD1 4.34Å; I200-Y212 HydrophobicContact CD1-CE1 3.52Å; E210-Y212 PolarHBondContact O-N 2.77Å; Y212-S214 PolarHBondContact O-N 3.28Å; Y212-D216 WeakPolarHBondContact CB-OD2 3.39Å; Y212-D216 VanDerWaalsContact CD1-OD2 3.28Å; Y212-D216 WeakPolarHBondContact CD1-OD2 3.35Å; Y212-D216 WeakPolarHBondContact O-CB 2.85Å; Y212-D216 PolarHBondContact O-N 3.29Å
213	T	50.2	Low	60.4	Low	99 Å²	99	83.3 Å²	83.3	61%	0.607	43%	0.43	S	S	*	.	H	α-helix	trans	-71.5	-33.9	-155	55.1	0	0	0	0	115.8	E210 S211 A217	E210-T213 WeakPolarHBondContact O-CG2 3.47Å; E210-T213 PolarHBondContact O-OG1 2.89Å; S211-T213 VanDerWaalsContact C-N 3.34Å; T213-A217 WeakPolarHBondContact O-CB 3.03Å; T213-A217 PolarHBondContact O-N 3.23Å
214	S	54.1	Low	61.7	Low	57 Å²	57	90.3 Å²	90.3	40%	0.399	45%	0.454	S	S	.	.	H	α-helix	trans	-91.9	-28.8	-165.3	79.2	0	0	0	0	116.1	Y212 R464	Y212-S214 PolarHBondContact O-N 3.28Å; S214-R464 PolarHBondContact OG-NH2 2.82Å
215	I	58.9	Low	63.3	Low	39 Å²	39	94.4 Å²	94.4	20%	0.2	47%	0.472	C	S	.	.	H	α-helix	trans	-98.1	-38.6	176.8	-62.8	-172.2	0	0	0	110.1	S201 G202 A217 K218 R464	S201-I215 WeakPolarHBondContact O-CD1 3.09Å; S201-I215 WeakPolarHBondContact OG-CD1 3.31Å; G202-I215 VanDerWaalsContact N-CD1 3.34Å; I215-A217 PolarHBondContact O-N 2.86Å; I215-K218 PolarHBondContact O-N 3.42Å; I215-R464 HydrophobicContact CD1-CB 3.7Å; I215-R464 HydrophobicContact CD1-CG 3.44Å; I215-R464 VanDerWaalsContact CD1-CG 3.44Å; I215-R464 HydrophobicContact CG1-CG 4.45Å
216	D	69.3	Low	65.1	Low	14 Å²	14	95.2 Å²	95.2	8%	0.075	48%	0.476	C	S	.	.	H	α-helix	trans	-70.2	-21	174.6	-56.3	-38.7	0	0	0	111.4	Y212 K218 L219 L220	Y212-D216 WeakPolarHBondContact CB-OD2 3.39Å; Y212-D216 VanDerWaalsContact CD1-OD2 3.28Å; Y212-D216 WeakPolarHBondContact CD1-OD2 3.35Å; Y212-D216 WeakPolarHBondContact O-CB 2.85Å; Y212-D216 PolarHBondContact O-N 3.29Å; D216-K218 VanDerWaalsContact C-N 3.28Å; D216-K218 PolarHBondContact O-N 2.68Å; D216-L219 PolarHBondContact O-N 3.33Å; D216-L220 HydrophobicContact CB-CD1 3.74Å; D216-L220 HydrophobicContact CB-CG 4.02Å; D216-L220 WeakPolarHBondContact O-CA 3.43Å; D216-L220 WeakPolarHBondContact O-CB 3.25Å; D216-L220 VanDerWaalsContact O-CD1 3.32Å; D216-L220 WeakPolarHBondContact O-CD1 3.39Å; D216-L220 WeakPolarHBondContact O-CG 3.33Å; D216-L220 PolarHBondContact O-N 3.25Å
217	A	77.7	Confident	67.3	Low	51 Å²	51	97.4 Å²	97.4	42%	0.421	48%	0.484	S	S	.	.	H	α-helix	trans	-56.3	-41.1	175.6	0	0	0	0	0	113.2	T213 I215 K221	T213-A217 WeakPolarHBondContact O-CB 3.03Å; T213-A217 PolarHBondContact O-N 3.23Å; I215-A217 PolarHBondContact O-N 2.86Å; A217-K221 VanDerWaalsContact O-CB 3.25Å; A217-K221 WeakPolarHBondContact O-CB 3.41Å; A217-K221 PolarHBondContact O-N 3.33Å
218	K	83	Confident	69.6	Low	147 Å²	147	92.2 Å²	92.2	64%	0.639	45%	0.454	S	S	*	.	H	α-helix	trans	-70.7	-47.1	178.6	-175	179.2	170.8	-174.6	0	110.8	I215 D216 K221 E222	I215-K218 PolarHBondContact O-N 3.42Å; D216-K218 VanDerWaalsContact C-N 3.28Å; D216-K218 PolarHBondContact O-N 2.68Å; K218-K221 WeakPolarHBondContact O-CB 2.96Å; K218-K221 PolarHBondContact O-N 2.74Å; K218-E222 WeakPolarHBondContact CE-OE1 3.41Å; K218-E222 IonicContact NZ-OE1 3.25Å; K218-E222 WeakPolarHBondContact O-CG 3.18Å; K218-E222 PolarHBondContact O-N 2.89Å
219	L	84.3	Confident	72	Confident	34 Å²	34	90.2 Å²	90.2	18%	0.178	45%	0.447	C	S	.	.	H	α-helix	trans	-65	-43.3	-179.9	-177.2	62.5	0	0	0	112	D216 K221 E222 I223 I253 A256 T257	D216-L219 PolarHBondContact O-N 3.33Å; L219-K221 VanDerWaalsContact C-N 3.31Å; L219-K221 PolarHBondContact O-N 3.02Å; L219-E222 PolarHBondContact O-N 3.25Å; L219-I223 HydrophobicContact CD1-CD1 3.76Å; L219-I223 HydrophobicContact CD1-CG1 4.35Å; L219-I223 HydrophobicContact CG-CD1 3.8Å; L219-I223 WeakPolarHBondContact O-CB 3.32Å; L219-I223 VanDerWaalsContact O-CG1 3.28Å; L219-I223 WeakPolarHBondContact O-CG1 3.01Å; L219-I223 PolarHBondContact O-N 3.35Å; L219-I253 HydrophobicContact CD2-CG2 4.25Å; L219-A256 HydrophobicContact CD1-CB 3.86Å; L219-A256 HydrophobicContact CD2-CB 3.93Å; L219-T257 HydrophobicContact CD2-CG2 4.03Å
220	L	86.5	Confident	74.4	Confident	54 Å²	54	83.1 Å²	83.1	28%	0.283	41%	0.413	S	S	.	.	H	α-helix	trans	-62	-38.2	174.3	-71	165.3	0	0	0	111.3	D216 R224 I253	D216-L220 HydrophobicContact CB-CD1 3.74Å; D216-L220 HydrophobicContact CB-CG 4.02Å; D216-L220 WeakPolarHBondContact O-CA 3.43Å; D216-L220 WeakPolarHBondContact O-CB 3.25Å; D216-L220 VanDerWaalsContact O-CD1 3.32Å; D216-L220 WeakPolarHBondContact O-CD1 3.39Å; D216-L220 WeakPolarHBondContact O-CG 3.33Å; D216-L220 PolarHBondContact O-N 3.25Å; L220-R224 WeakPolarHBondContact O-CB 3.29Å; L220-R224 WeakPolarHBondContact O-CG 3.22Å; L220-R224 PolarHBondContact O-N 2.65Å; L220-R224 PolarHBondContact O-NE 3.49Å; L220-I253 HydrophobicContact CD2-CD1 3.56Å; L220-I253 HydrophobicContact CD2-CG1 4.42Å
221	K	88.8	Confident	76.7	Confident	121 Å²	121	83.7 Å²	83.7	53%	0.526	41%	0.409	S	S	.	.	H	α-helix	trans	-63.9	-51.2	174.7	-179.3	179.8	173.5	-178	0	110.5	A217 K218 L219 I223 R224 E225	A217-K221 VanDerWaalsContact O-CB 3.25Å; A217-K221 WeakPolarHBondContact O-CB 3.41Å; A217-K221 PolarHBondContact O-N 3.33Å; K218-K221 WeakPolarHBondContact O-CB 2.96Å; K218-K221 PolarHBondContact O-N 2.74Å; L219-K221 VanDerWaalsContact C-N 3.31Å; L219-K221 PolarHBondContact O-N 3.02Å; K221-I223 VanDerWaalsContact C-N 3.3Å; K221-I223 PolarHBondContact O-N 3.16Å; K221-R224 PolarHBondContact O-N 3.25Å; K221-E225 WeakPolarHBondContact CE-OE1 3.42Å; K221-E225 WeakPolarHBondContact CG-OE1 3.17Å; K221-E225 IonicContact NZ-OE1 3.04Å; K221-E225 WeakPolarHBondContact O-CG 3.02Å; K221-E225 PolarHBondContact O-N 2.89Å; K221-E225 VanDerWaalsContact O-N 3.08Å
222	E	88.5	Confident	78.9	Confident	94 Å²	94	85.1 Å²	85.1	44%	0.439	41%	0.414	S	S	.	.	H	α-helix	trans	-59	-41.5	178.8	-71.8	174.3	-174.4	0	0	111.4	K218 L219 E225 L226	K218-E222 WeakPolarHBondContact CE-OE1 3.41Å; K218-E222 IonicContact NZ-OE1 3.25Å; K218-E222 WeakPolarHBondContact O-CG 3.18Å; K218-E222 PolarHBondContact O-N 2.89Å; L219-E222 PolarHBondContact O-N 3.25Å; E222-E225 PolarHBondContact O-N 2.82Å; E222-L226 WeakPolarHBondContact O-CG 3.34Å; E222-L226 PolarHBondContact O-N 2.8Å
223	I	88.1	Confident	81.2	Confident	10 Å²	10	83.7 Å²	83.7	5%	0.051	43%	0.425	C	S	.	.	H	α-helix	trans	-74.4	-29.4	-179	-69.5	172.4	0	0	0	112.9	L219 K221 E225 L226 R249 L252 I253	L219-I223 HydrophobicContact CD1-CD1 3.76Å; L219-I223 HydrophobicContact CD1-CG1 4.35Å; L219-I223 HydrophobicContact CG-CD1 3.8Å; L219-I223 WeakPolarHBondContact O-CB 3.32Å; L219-I223 VanDerWaalsContact O-CG1 3.28Å; L219-I223 WeakPolarHBondContact O-CG1 3.01Å; L219-I223 PolarHBondContact O-N 3.35Å; K221-I223 VanDerWaalsContact C-N 3.3Å; K221-I223 PolarHBondContact O-N 3.16Å; I223-E225 VanDerWaalsContact C-N 3.3Å; I223-L226 HydrophobicContact CG1-CD1 4.21Å; I223-L226 PolarHBondContact O-N 2.66Å; I223-R249 HydrophobicContact CG2-CB 3.72Å; I223-R249 HydrophobicContact CG2-CG 3.75Å; I223-L252 HydrophobicContact CD1-CB 4.2Å; I223-I253 HydrophobicContact CD1-CB 4.21Å; I223-I253 HydrophobicContact CD1-CD1 4.42Å; I223-I253 HydrophobicContact CD1-CG1 3.31Å; I223-I253 HydrophobicContact CG2-CD1 4.49Å; I223-I253 HydrophobicContact CG2-CG1 4.35Å
224	R	86.5	Confident	83	Confident	167 Å²	167	88.4 Å²	88.4	63%	0.63	43%	0.433	S	S	*	.	H	α-helix	trans	-68.9	-31.2	170.1	-77.2	-179.7	-129.5	145.5	-3.3	112.2	L220 K221 L226	L220-R224 WeakPolarHBondContact O-CB 3.29Å; L220-R224 WeakPolarHBondContact O-CG 3.22Å; L220-R224 PolarHBondContact O-N 2.65Å; L220-R224 PolarHBondContact O-NE 3.49Å; K221-R224 PolarHBondContact O-N 3.25Å; R224-L226 VanDerWaalsContact C-N 3.31Å
225	E	89.2	Confident	84.6	Confident	122 Å²	122	87.9 Å²	87.9	57%	0.57	44%	0.437	S	S	*	.	S	Bend	trans	-79.6	-10.2	177.6	-69.5	170	-175.8	0	0	112.9	K221 E222 I223 N227	K221-E225 WeakPolarHBondContact CE-OE1 3.42Å; K221-E225 WeakPolarHBondContact CG-OE1 3.17Å; K221-E225 IonicContact NZ-OE1 3.04Å; K221-E225 WeakPolarHBondContact O-CG 3.02Å; K221-E225 PolarHBondContact O-N 2.89Å; K221-E225 VanDerWaalsContact O-N 3.08Å; E222-E225 PolarHBondContact O-N 2.82Å; I223-E225 VanDerWaalsContact C-N 3.3Å; E225-N227 PolarHBondContact O-N 2.93Å
226	L	88.1	Confident	86	Confident	81 Å²	81	90.2 Å²	90.2	42%	0.424	45%	0.452	S	S	.	.			trans	-73.8	120.7	176.3	-71	175.3	0	0	0	112	E222 I223 R224 F228 L252	E222-L226 WeakPolarHBondContact O-CG 3.34Å; E222-L226 PolarHBondContact O-N 2.8Å; I223-L226 HydrophobicContact CG1-CD1 4.21Å; I223-L226 PolarHBondContact O-N 2.66Å; R224-L226 VanDerWaalsContact C-N 3.31Å; L226-F228 HydrophobicContact CB-CE2 4.09Å; L226-F228 WeakPolarHBondContact O-CD2 3.19Å; L226-L252 HydrophobicContact CD1-CD1 4.15Å
227	N	86.5	Confident	86.9	Confident	150 Å²	150	96 Å²	96	80%	0.802	47%	0.474	S	S	*	.			trans	-87.5	109.5	170	-70.7	-28.1	0	0	0	110.3	E225 T229	E225-N227 PolarHBondContact O-N 2.93Å; N227-T229 PolarHBondContact O-N 2.85Å
228	F	84.9	Confident	87.4	Confident	39 Å²	39	97.9 Å²	97.9	17%	0.171	47%	0.473	C	S	.	.			trans	-78.4	115.5	176.1	-67.6	-95.8	0	0	0	109.8	L226 F230 I245 R249 L252	L226-F228 HydrophobicContact CB-CE2 4.09Å; L226-F228 WeakPolarHBondContact O-CD2 3.19Å; F228-F230 HydrophobicContact CB-CE2 3.71Å; F228-F230 HydrophobicContact CB-CZ 4.04Å; F228-F230 HydrophobicContact CD1-CZ 4.17Å; F228-I245 HydrophobicContact CB-CD1 4.1Å; F228-I245 HydrophobicContact CB-CG1 4.27Å; F228-I245 HydrophobicContact CB-CG2 4.27Å; F228-I245 HydrophobicContact CD1-CG2 4.42Å; F228-I245 HydrophobicContact CD2-CG2 3.27Å; F228-I245 HydrophobicContact CE2-CG2 3.6Å; F228-I245 HydrophobicContact CG-CG2 3.73Å; F228-I245 HydrophobicContact CZ-CG2 4.28Å; F228-R249 HydrophobicContact CE2-CG 3.47Å; F228-R249 VanDerWaalsContact CE2-CG 3.47Å; F228-R249 HydrophobicContact CZ-CG 3.64Å; F228-L252 HydrophobicContact CE1-CD1 3.97Å; F228-L252 HydrophobicContact CZ-CD1 3.88Å
229	T	85.5	Confident	87.6	Confident	94 Å²	94	96.3 Å²	96.3	58%	0.577	48%	0.476	S	S	*	.			trans	-120	127	171.4	55.2	0	0	0	0	108.5	N227	N227-T229 PolarHBondContact O-N 2.85Å
230	F	87.2	Confident	87.7	Confident	44 Å²	44	96.6 Å²	96.6	19%	0.193	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	147.6	-179.2	-59.9	-89.4	0	0	0	109.1	F228 Y237 F238 L240 I245 Y248	F228-F230 HydrophobicContact CB-CE2 3.71Å; F228-F230 HydrophobicContact CB-CZ 4.04Å; F228-F230 HydrophobicContact CD1-CZ 4.17Å; F230-Y237 CarbonylContact O-C 3.58Å; F230-Y237 VanDerWaalsContact O-CA 3.27Å; F230-Y237 WeakPolarHBondContact O-CA 3.48Å; F230-F238 HydrophobicContact CB-CD1 4.21Å; F230-F238 HydrophobicContact CB-CD2 4.16Å; F230-F238 HydrophobicContact CB-CE1 3.73Å; F230-F238 HydrophobicContact CB-CE2 3.66Å; F230-F238 HydrophobicContact CB-CG 4.42Å; F230-F238 HydrophobicContact CB-CZ 3.43Å; F230-F238 VanDerWaalsContact CB-CZ 3.43Å; F230-F238 HydrophobicContact CG-CE2 4.27Å; F230-F238 HydrophobicContact CG-CZ 4.33Å; F230-F238 PolarHBondContact N-O 3.21Å; F230-F238 VanDerWaalsContact N-O 3.13Å; F230-F238 PolarHBondContact O-N 3.27Å; F230-L240 HydrophobicContact CD1-CD1 4.46Å; F230-L240 HydrophobicContact CD2-CB 4.36Å; F230-L240 HydrophobicContact CD2-CD1 3.8Å; F230-L240 HydrophobicContact CD2-CG 3.71Å; F230-L240 HydrophobicContact CE1-CD1 4.09Å; F230-L240 HydrophobicContact CE2-CB 4.03Å; F230-L240 HydrophobicContact CE2-CD1 3.38Å; F230-L240 HydrophobicContact CE2-CG 3.65Å; F230-L240 HydrophobicContact CG-CD1 4.32Å; F230-L240 HydrophobicContact CG-CG 4.44Å; F230-L240 HydrophobicContact CZ-CD1 3.54Å; F230-L240 HydrophobicContact CZ-CG 4.33Å; F230-I245 HydrophobicContact CE2-CG1 4.43Å; F230-Y248 HydrophobicContact CZ-CD2 4.33Å; F230-Y248 HydrophobicContact CZ-CE2 4.28Å
231	R	88.9	Confident	87.8	Confident	169 Å²	169	97.6 Å²	97.6	64%	0.638	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.9	132.6	174.8	-66.8	-177.5	-179.6	174	4.5	108.9	Y237	R231-Y237 HydrophobicContact CG-CD1 3.75Å; R231-Y237 HydrophobicContact CG-CE1 3.7Å; R231-Y237 VanDerWaalsContact CZ-OH 3.27Å; R231-Y237 PolarHBondContact NE-OH 3.37Å; R231-Y237 PolarHBondContact NH2-OH 2.83Å
232	N	87.6	Confident	87.8	Confident	57 Å²	57	96.2 Å²	96.2	31%	0.305	48%	0.484	S	S	.	.			trans	-78.6	176.8	171.8	72.4	3.4	0	0	0	111	Y234 G235 V236 F238	N232-Y234 PolarHBondContact O-N 3.22Å; N232-Y234 VanDerWaalsContact O-N 3.17Å; N232-Y234 VanDerWaalsContact OD1-C 3.24Å; N232-Y234 WeakPolarHBondContact OD1-CA 3.38Å; N232-Y234 WeakPolarHBondContact OD1-CB 3.25Å; N232-Y234 PolarHBondContact OD1-N 3Å; N232-G235 PolarHBondContact O-N 3.44Å; N232-G235 PolarHBondContact OD1-N 3.24Å; N232-V236 PolarHBondContact N-O 3.37Å; N232-V236 PolarHBondContact OD1-N 3.38Å; N232-V236 PolarHBondContact OD1-O 3.07Å; N232-F238 HydrophobicContact CB-CD1 4.24Å; N232-F238 HydrophobicContact CB-CE1 4.02Å
233	S	91	Very high	87.8	Confident	115 Å²	115	99.7 Å²	99.7	80%	0.804	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-24.2	175.3	51	0	0	0	0	113.8
234	Y	89.1	Confident	87.9	Confident	198 Å²	198	103.8 Å²	103.8	78%	0.776	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	2.5	177.9	-53.1	-73.7	0	0	0	113.4	N232 V236	N232-Y234 PolarHBondContact O-N 3.22Å; N232-Y234 VanDerWaalsContact O-N 3.17Å; N232-Y234 VanDerWaalsContact OD1-C 3.24Å; N232-Y234 WeakPolarHBondContact OD1-CA 3.38Å; N232-Y234 WeakPolarHBondContact OD1-CB 3.25Å; N232-Y234 PolarHBondContact OD1-N 3Å; Y234-V236 VanDerWaalsContact C-N 3.29Å; Y234-V236 PolarHBondContact O-N 3.32Å
235	G	87.9	Confident	88.1	Confident	45 Å²	45	96.6 Å²	96.6	46%	0.464	49%	0.493	S	S	.	.	S	Bend	trans	77.9	4.1	-179.7	0	0	0	0	0	115.7	N232	N232-G235 PolarHBondContact O-N 3.44Å; N232-G235 PolarHBondContact OD1-N 3.24Å
236	V	88.4	Confident	88.1	Confident	88 Å²	88	94.8 Å²	94.8	53%	0.533	49%	0.485	S	S	.	.			trans	-77.3	132	175.9	-175.9	0	0	0	0	109.5	N232 Y234	N232-V236 PolarHBondContact N-O 3.37Å; N232-V236 PolarHBondContact OD1-N 3.38Å; N232-V236 PolarHBondContact OD1-O 3.07Å; Y234-V236 VanDerWaalsContact C-N 3.29Å; Y234-V236 PolarHBondContact O-N 3.32Å
237	Y	87.2	Confident	88.2	Confident	137 Å²	137	94.9 Å²	94.9	54%	0.537	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	137.8	175.4	-62.2	-88.9	0	0	0	110.9	F230 R231	F230-Y237 CarbonylContact O-C 3.58Å; F230-Y237 VanDerWaalsContact O-CA 3.27Å; F230-Y237 WeakPolarHBondContact O-CA 3.48Å; R231-Y237 HydrophobicContact CG-CD1 3.75Å; R231-Y237 HydrophobicContact CG-CE1 3.7Å; R231-Y237 VanDerWaalsContact CZ-OH 3.27Å; R231-Y237 PolarHBondContact NE-OH 3.37Å; R231-Y237 PolarHBondContact NH2-OH 2.83Å
238	F	87.5	Confident	88.3	Confident	89 Å²	89	93 Å²	93	39%	0.39	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	152.7	169.5	66.2	-84.7	0	0	0	109.9	F230 N232 L240	F230-F238 HydrophobicContact CB-CD1 4.21Å; F230-F238 HydrophobicContact CB-CD2 4.16Å; F230-F238 HydrophobicContact CB-CE1 3.73Å; F230-F238 HydrophobicContact CB-CE2 3.66Å; F230-F238 HydrophobicContact CB-CG 4.42Å; F230-F238 HydrophobicContact CB-CZ 3.43Å; F230-F238 VanDerWaalsContact CB-CZ 3.43Å; F230-F238 HydrophobicContact CG-CE2 4.27Å; F230-F238 HydrophobicContact CG-CZ 4.33Å; F230-F238 PolarHBondContact N-O 3.21Å; F230-F238 VanDerWaalsContact N-O 3.13Å; F230-F238 PolarHBondContact O-N 3.27Å; N232-F238 HydrophobicContact CB-CD1 4.24Å; N232-F238 HydrophobicContact CB-CE1 4.02Å; F238-L240 HydrophobicContact CD2-CD2 4.22Å; F238-L240 HydrophobicContact CE2-CD2 3.77Å; F238-L240 HydrophobicContact CE2-CG 4.15Å
239	T	88.1	Confident	88.6	Confident	114 Å²	114	93 Å²	93	70%	0.699	47%	0.471	S	S	*	.			trans	-106.8	134.3	175.6	53.9	0	0	0	0	108.7
240	L	86.4	Confident	88.7	Confident	40 Å²	40	96 Å²	96	21%	0.209	47%	0.473	C	S	.	.			trans	-81.4	159.7	170.9	-68.4	178	0	0	0	109.9	F230 F238 Q244 I245 Y248	F230-L240 HydrophobicContact CD1-CD1 4.46Å; F230-L240 HydrophobicContact CD2-CB 4.36Å; F230-L240 HydrophobicContact CD2-CD1 3.8Å; F230-L240 HydrophobicContact CD2-CG 3.71Å; F230-L240 HydrophobicContact CE1-CD1 4.09Å; F230-L240 HydrophobicContact CE2-CB 4.03Å; F230-L240 HydrophobicContact CE2-CD1 3.38Å; F230-L240 HydrophobicContact CE2-CG 3.65Å; F230-L240 HydrophobicContact CG-CD1 4.32Å; F230-L240 HydrophobicContact CG-CG 4.44Å; F230-L240 HydrophobicContact CZ-CD1 3.54Å; F230-L240 HydrophobicContact CZ-CG 4.33Å; F238-L240 HydrophobicContact CD2-CD2 4.22Å; F238-L240 HydrophobicContact CE2-CD2 3.77Å; F238-L240 HydrophobicContact CE2-CG 4.15Å; L240-Q244 HydrophobicContact CB-CB 3.87Å; L240-Q244 HydrophobicContact CD1-CB 4.35Å; L240-Q244 VanDerWaalsContact CD2-OE1 3.3Å; L240-I245 HydrophobicContact CB-CD1 4.27Å; L240-I245 HydrophobicContact CB-CG1 3.84Å; L240-I245 WeakPolarHBondContact O-CD1 3.49Å; L240-Y248 HydrophobicContact CD1-CE2 3.95Å
241	T	89.3	Confident	88.9	Confident	75 Å²	75	99 Å²	99	46%	0.46	48%	0.484	S	S	.	.			trans	-65.6	156.7	172.1	63.2	0	0	0	0	110.2	E243 Q244 I245	T241-E243 PolarHBondContact O-N 3.17Å; T241-Q244 WeakPolarHBondContact O-CB 3.47Å; T241-Q244 PolarHBondContact O-N 2.79Å; T241-Q244 VanDerWaalsContact OG1-CG 3.27Å; T241-Q244 WeakPolarHBondContact OG1-CG 3.36Å; T241-Q244 PolarHBondContact OG1-N 2.86Å; T241-Q244 PolarHBondContact OG1-OE1 2.94Å; T241-I245 WeakPolarHBondContact O-CG1 3.48Å; T241-I245 PolarHBondContact O-N 3.11Å
242	D	87.2	Confident	88.9	Confident	92 Å²	92	92.8 Å²	92.8	49%	0.492	46%	0.463	S	S	.	.	H	α-helix	trans	-58.2	-38.9	-179.4	-166.4	65.1	0	0	0	111.4	Q244 I245 Q246 R249	D242-Q244 VanDerWaalsContact C-N 3.28Å; D242-Q244 PolarHBondContact O-N 2.82Å; D242-I245 WeakPolarHBondContact O-CA 3.38Å; D242-I245 PolarHBondContact O-N 3.27Å; D242-Q246 WeakPolarHBondContact O-CG 3.29Å; D242-Q246 PolarHBondContact O-N 3.2Å; D242-Q246 PolarHBondContact OD1-NE2 3.34Å; D242-Q246 PolarHBondContact OD2-NE2 3.27Å; D242-R249 IonicContact OD1-CZ 3.68Å; D242-R249 IonicContact OD1-NH1 2.7Å; D242-R249 PolarHBondContact OD1-NH1 3.48Å; D242-R249 IonicContact OD1-NH2 3.77Å; D242-R249 IonicContact OD2-NH1 3.96Å
243	E	89.1	Confident	89	Confident	167 Å²	167	91.5 Å²	91.5	78%	0.78	46%	0.456	S	S	*	.	H	α-helix	trans	-56.7	-38.7	173.9	-63	-177.9	175.1	0	0	113	T241 P247	T241-E243 PolarHBondContact O-N 3.17Å; E243-P247 VanDerWaalsContact O-CD 3.26Å; E243-P247 WeakPolarHBondContact O-CD 3.43Å
244	Q	89.8	Confident	88.8	Confident	97 Å²	97	91.7 Å²	91.7	45%	0.453	44%	0.444	S	S	.	.	H	α-helix	trans	-75.9	-25.8	176.5	-71.4	169.2	-18.4	0	0	112.4	L240 T241 D242 P247 Y248	L240-Q244 HydrophobicContact CB-CB 3.87Å; L240-Q244 HydrophobicContact CD1-CB 4.35Å; L240-Q244 VanDerWaalsContact CD2-OE1 3.3Å; T241-Q244 WeakPolarHBondContact O-CB 3.47Å; T241-Q244 PolarHBondContact O-N 2.79Å; T241-Q244 VanDerWaalsContact OG1-CG 3.27Å; T241-Q244 WeakPolarHBondContact OG1-CG 3.36Å; T241-Q244 PolarHBondContact OG1-N 2.86Å; T241-Q244 PolarHBondContact OG1-OE1 2.94Å; D242-Q244 VanDerWaalsContact C-N 3.28Å; D242-Q244 PolarHBondContact O-N 2.82Å; Q244-P247 WeakPolarHBondContact O-CD 3.28Å; Q244-Y248 WeakPolarHBondContact O-CD2 3.42Å; Q244-Y248 WeakPolarHBondContact O-CE2 3.44Å
245	I	90.2	Very high	88.8	Confident	15 Å²	15	87 Å²	87	8%	0.077	43%	0.425	C	S	.	.	H	α-helix	trans	-80.9	-32.2	179	-68.5	168.7	0	0	0	111.6	F228 F230 L240 T241 D242 Y248 R249	F228-I245 HydrophobicContact CB-CD1 4.1Å; F228-I245 HydrophobicContact CB-CG1 4.27Å; F228-I245 HydrophobicContact CB-CG2 4.27Å; F228-I245 HydrophobicContact CD1-CG2 4.42Å; F228-I245 HydrophobicContact CD2-CG2 3.27Å; F228-I245 HydrophobicContact CE2-CG2 3.6Å; F228-I245 HydrophobicContact CG-CG2 3.73Å; F228-I245 HydrophobicContact CZ-CG2 4.28Å; F230-I245 HydrophobicContact CE2-CG1 4.43Å; L240-I245 HydrophobicContact CB-CD1 4.27Å; L240-I245 HydrophobicContact CB-CG1 3.84Å; L240-I245 WeakPolarHBondContact O-CD1 3.49Å; T241-I245 WeakPolarHBondContact O-CG1 3.48Å; T241-I245 PolarHBondContact O-N 3.11Å; D242-I245 WeakPolarHBondContact O-CA 3.38Å; D242-I245 PolarHBondContact O-N 3.27Å; I245-Y248 WeakPolarHBondContact O-CB 3.42Å; I245-Y248 PolarHBondContact O-N 2.8Å; I245-R249 HydrophobicContact CG2-CG 4.06Å; I245-R249 PolarHBondContact O-N 3.38Å; I245-R249 VanDerWaalsContact O-N 3.08Å
246	Q	89.2	Confident	88.9	Confident	85 Å²	85	86.1 Å²	86.1	40%	0.397	41%	0.413	S	S	.	.	H	α-helix	trans	-52.4	-44.1	-177.4	-69.6	-52.2	-32.2	0	0	114.2	D242 Y248 R249 Y250	D242-Q246 WeakPolarHBondContact O-CG 3.29Å; D242-Q246 PolarHBondContact O-N 3.2Å; D242-Q246 PolarHBondContact OD1-NE2 3.34Å; D242-Q246 PolarHBondContact OD2-NE2 3.27Å; Q246-Y248 VanDerWaalsContact C-N 3.3Å; Q246-Y248 PolarHBondContact O-N 2.83Å; Q246-R249 PolarHBondContact O-N 2.85Å; Q246-Y250 PolarHBondContact O-N 2.93Å
247	P	90.5	Very high	88.9	Confident	83 Å²	83	83.9 Å²	83.9	54%	0.539	40%	0.4	S	S	.	.	H	α-helix	trans	-58.7	-38.2	175.2	-25.8	34.9	0	0	0	113.5	E243 Q244 Y250 W251	E243-P247 VanDerWaalsContact O-CD 3.26Å; E243-P247 WeakPolarHBondContact O-CD 3.43Å; Q244-P247 WeakPolarHBondContact O-CD 3.28Å; P247-Y250 PolarHBondContact O-N 2.84Å; P247-W251 VanDerWaalsContact O-CB 3.3Å; P247-W251 WeakPolarHBondContact O-CB 3.25Å; P247-W251 PolarHBondContact O-N 3.23Å
248	Y	89.7	Confident	89.1	Confident	110 Å²	110	77.6 Å²	77.6	43%	0.431	38%	0.376	S	S	.	.	H	α-helix	trans	-68.6	-39.6	177.1	-63.5	-79.7	0	0	0	111.8	F230 L240 Q244 I245 Q246 W251 L252	F230-Y248 HydrophobicContact CZ-CD2 4.33Å; F230-Y248 HydrophobicContact CZ-CE2 4.28Å; L240-Y248 HydrophobicContact CD1-CE2 3.95Å; Q244-Y248 WeakPolarHBondContact O-CD2 3.42Å; Q244-Y248 WeakPolarHBondContact O-CE2 3.44Å; I245-Y248 WeakPolarHBondContact O-CB 3.42Å; I245-Y248 PolarHBondContact O-N 2.8Å; Q246-Y248 VanDerWaalsContact C-N 3.3Å; Q246-Y248 PolarHBondContact O-N 2.83Å; Y248-W251 PolarHBondContact O-N 3.17Å; Y248-L252 WeakPolarHBondContact O-CG 3.18Å; Y248-L252 PolarHBondContact O-N 2.55Å
249	R	89.9	Confident	89.1	Confident	38 Å²	38	75.9 Å²	75.9	14%	0.143	37%	0.369	C	S	.	.	H	α-helix	trans	-61.3	-47.8	173.7	-72.6	-176.5	175.8	130.9	0.8	111.2	I223 F228 D242 I245 Q246 W251 L252 I253	I223-R249 HydrophobicContact CG2-CB 3.72Å; I223-R249 HydrophobicContact CG2-CG 3.75Å; F228-R249 HydrophobicContact CE2-CG 3.47Å; F228-R249 VanDerWaalsContact CE2-CG 3.47Å; F228-R249 HydrophobicContact CZ-CG 3.64Å; D242-R249 IonicContact OD1-CZ 3.68Å; D242-R249 IonicContact OD1-NH1 2.7Å; D242-R249 PolarHBondContact OD1-NH1 3.48Å; D242-R249 IonicContact OD1-NH2 3.77Å; D242-R249 IonicContact OD2-NH1 3.96Å; I245-R249 HydrophobicContact CG2-CG 4.06Å; I245-R249 PolarHBondContact O-N 3.38Å; I245-R249 VanDerWaalsContact O-N 3.08Å; Q246-R249 PolarHBondContact O-N 2.85Å; R249-W251 PolarHBondContact O-N 2.94Å; R249-L252 PolarHBondContact O-N 2.83Å; R249-I253 VanDerWaalsContact O-CG1 3.31Å; R249-I253 WeakPolarHBondContact O-CG1 3.27Å; R249-I253 PolarHBondContact O-N 3.28Å
250	Y	88.5	Confident	89.2	Confident	157 Å²	157	70.4 Å²	70.4	62%	0.616	34%	0.336	S	S	*	.	H	α-helix	trans	-60.9	-45.1	177.6	-175.2	-94.2	0	0	0	111.7	Q246 P247 L252 I253 E254	Q246-Y250 PolarHBondContact O-N 2.93Å; P247-Y250 PolarHBondContact O-N 2.84Å; Y250-L252 VanDerWaalsContact C-N 3.34Å; Y250-L252 PolarHBondContact O-N 2.79Å; Y250-I253 WeakPolarHBondContact O-CB 3.28Å; Y250-I253 PolarHBondContact O-N 3.3Å; Y250-E254 PolarHBondContact O-N 3.36Å
251	W	90.5	Very high	89.5	Confident	108 Å²	108	69.5 Å²	69.5	41%	0.409	33%	0.331	S	S	.	.	H	α-helix	trans	-60.1	-41.3	176.5	176.5	81.4	0	0	0	112.6	P247 Y248 R249 E254 R255 W291	P247-W251 VanDerWaalsContact O-CB 3.3Å; P247-W251 WeakPolarHBondContact O-CB 3.25Å; P247-W251 PolarHBondContact O-N 3.23Å; Y248-W251 PolarHBondContact O-N 3.17Å; R249-W251 PolarHBondContact O-N 2.94Å; W251-E254 PolarHBondContact O-N 3.4Å; W251-R255 VanDerWaalsContact O-CB 3.3Å; W251-R255 WeakPolarHBondContact O-CB 3.39Å; W251-R255 PolarHBondContact O-N 3.03Å; W251-W291 HydrophobicContact CH2-CB 4.04Å; W251-W291 AromaticContact CH2-CD1 3.62Å; W251-W291 HydrophobicContact CH2-CD2 4.38Å; W251-W291 AromaticContact CH2-CG 3.75Å; W251-W291 HydrophobicContact CH2-CG 3.75Å; W251-W291 HydrophobicContact CZ3-CB 4.43Å; W251-W291 HydrophobicContact CZ3-CG 4.27Å
252	L	90.4	Very high	89.6	Confident	39 Å²	39	66 Å²	66	20%	0.204	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-40.6	174.6	-76.4	173.8	0	0	0	112.3	I223 L226 F228 Y248 R249 Y250 R255 A256	I223-L252 HydrophobicContact CD1-CB 4.2Å; L226-L252 HydrophobicContact CD1-CD1 4.15Å; F228-L252 HydrophobicContact CE1-CD1 3.97Å; F228-L252 HydrophobicContact CZ-CD1 3.88Å; Y248-L252 WeakPolarHBondContact O-CG 3.18Å; Y248-L252 PolarHBondContact O-N 2.55Å; R249-L252 PolarHBondContact O-N 2.83Å; Y250-L252 VanDerWaalsContact C-N 3.34Å; Y250-L252 PolarHBondContact O-N 2.79Å; L252-R255 PolarHBondContact O-N 2.65Å; L252-A256 WeakPolarHBondContact O-CB 3.02Å; L252-A256 PolarHBondContact O-N 3.29Å
253	I	88.8	Confident	89.8	Confident	30 Å²	30	63 Å²	63	15%	0.154	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-55.5	174.5	-67.1	161.1	0	0	0	109.2	L219 L220 I223 R249 Y250 R255 A256 T257	L219-I253 HydrophobicContact CD2-CG2 4.25Å; L220-I253 HydrophobicContact CD2-CD1 3.56Å; L220-I253 HydrophobicContact CD2-CG1 4.42Å; I223-I253 HydrophobicContact CD1-CB 4.21Å; I223-I253 HydrophobicContact CD1-CD1 4.42Å; I223-I253 HydrophobicContact CD1-CG1 3.31Å; I223-I253 HydrophobicContact CG2-CD1 4.49Å; I223-I253 HydrophobicContact CG2-CG1 4.35Å; R249-I253 VanDerWaalsContact O-CG1 3.31Å; R249-I253 WeakPolarHBondContact O-CG1 3.27Å; R249-I253 PolarHBondContact O-N 3.28Å; Y250-I253 WeakPolarHBondContact O-CB 3.28Å; Y250-I253 PolarHBondContact O-N 3.3Å; I253-R255 VanDerWaalsContact C-N 3.26Å; I253-R255 PolarHBondContact O-N 2.75Å; I253-A256 CarbonylContact O-C 3.58Å; I253-A256 PolarHBondContact O-N 3.2Å; I253-A256 VanDerWaalsContact O-N 3.09Å; I253-T257 HydrophobicContact CG2-CG2 3.86Å; I253-T257 WeakPolarHBondContact O-CG2 3.29Å; I253-T257 PolarHBondContact O-N 3.28Å; I253-T257 PolarHBondContact O-OG1 3Å
254	E	87.5	Confident	90.1	Very high	118 Å²	118	56.8 Å²	56.8	55%	0.551	26%	0.262	S	S	*	.	H	α-helix	trans	-56.7	-42.7	-178.4	-171	-176.6	174.9	0	0	111.2	Y250 W251 T257	Y250-E254 PolarHBondContact O-N 3.36Å; W251-E254 PolarHBondContact O-N 3.4Å; E254-T257 PolarHBondContact O-N 3.04Å; E254-T257 PolarHBondContact O-OG1 2.97Å
255	R	89	Confident	90.3	Very high	99 Å²	99	54.6 Å²	54.6	37%	0.374	25%	0.252	S	S	.	.	H	α-helix	trans	-65.7	-40.5	177.4	-165.5	68.4	176.5	-159.3	-3.5	112.9	W251 L252 I253 S288 C289	W251-R255 VanDerWaalsContact O-CB 3.3Å; W251-R255 WeakPolarHBondContact O-CB 3.39Å; W251-R255 PolarHBondContact O-N 3.03Å; L252-R255 PolarHBondContact O-N 2.65Å; I253-R255 VanDerWaalsContact C-N 3.26Å; I253-R255 PolarHBondContact O-N 2.75Å; R255-S288 PolarHBondContact NE-O 3.35Å; R255-S288 PolarHBondContact NH2-O 2.84Å; R255-C289 CarbonylContact C-O 3.3Å; R255-C289 CarbonylContact O-C 3.58Å; R255-C289 WeakPolarHBondContact O-CA 3.42Å; R255-C289 VanDerWaalsContact O-O 3.09Å
256	A	89.8	Confident	90.5	Very high	27 Å²	27	56.9 Å²	56.9	22%	0.223	27%	0.265	C	S	.	.	H	α-helix	trans	-79.8	-20.3	-178.8	0	0	0	0	0	113.4	L219 L252 I253 C289	L219-A256 HydrophobicContact CD1-CB 3.86Å; L219-A256 HydrophobicContact CD2-CB 3.93Å; L252-A256 WeakPolarHBondContact O-CB 3.02Å; L252-A256 PolarHBondContact O-N 3.29Å; I253-A256 CarbonylContact O-C 3.58Å; I253-A256 PolarHBondContact O-N 3.2Å; I253-A256 VanDerWaalsContact O-N 3.09Å; A256-C289 WeakPolarHBondContact CA-O 3.17Å
257	T	88.6	Confident	90.6	Very high	41 Å²	41	54.6 Å²	54.6	25%	0.252	26%	0.255	S	S	.	.			trans	-69.8	132.5	177.4	59.7	0	0	0	0	111.7	L219 I253 E254	L219-T257 HydrophobicContact CD2-CG2 4.03Å; I253-T257 HydrophobicContact CG2-CG2 3.86Å; I253-T257 WeakPolarHBondContact O-CG2 3.29Å; I253-T257 PolarHBondContact O-N 3.28Å; I253-T257 PolarHBondContact O-OG1 3Å; E254-T257 PolarHBondContact O-N 3.04Å; E254-T257 PolarHBondContact O-OG1 2.97Å
258	C	90.4	Very high	90.7	Very high	6 Å²	6	51.4 Å²	51.4	4%	0.041	24%	0.237	C	C	.	.			trans	-105.3	122.8	179.4	-73.4	0	0	0	0	110.8	S201 C297 C465	S201-C258 WeakPolarHBondContact CB-O 3.38Å; S201-C258 PolarHBondContact N-O 2.84Å; C258-C297 VanDerWaalsContact CA-SG 3.52Å; C258-C297 HydrophobicContact CB-CB 3.68Å; C258-C297 WeakPolarHBondContact CB-SG 3.44Å; C258-C297 VanDerWaalsContact SG-CA 3.5Å; C258-C297 WeakPolarHBondContact SG-CB 3.27Å; C258-C297 CovalentContact SG-SG 2.04Å; C258-C297 PolarHBondContact SG-SG 3.38Å; C258-C465 HydrophobicContact CB-CB 3.64Å
259	E	89.2	Confident	90.7	Very high	52 Å²	52	49.3 Å²	49.3	24%	0.243	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	148.9	171.5	-61.2	173.8	-151.6	0	0	111.2	R198 L282 R284	R198-E259 IonicContact CZ-OE2 2.65Å; R198-E259 VanDerWaalsContact CZ-OE2 3.23Å; R198-E259 IonicContact NE-OE2 3.69Å; R198-E259 PolarHBondContact NE-OE2 2.86Å; R198-E259 IonicContact NH2-OE2 2.75Å; R198-E259 PolarHBondContact NH2-OE2 2.99Å; E259-L282 HydrophobicContact CB-CB 4.31Å; E259-L282 HydrophobicContact CB-CD1 3.96Å; E259-L282 PolarHBondContact O-N 2.84Å; E259-R284 IonicContact OE1-CZ 3.26Å; E259-R284 VanDerWaalsContact OE1-CZ 3.26Å; E259-R284 IonicContact OE1-NH1 2.8Å; E259-R284 PolarHBondContact OE1-NH1 3.22Å; E259-R284 IonicContact OE1-NH2 2.89Å; E259-R284 PolarHBondContact OE1-NH2 2.98Å; E259-R284 IonicContact OE2-NH1 3.58Å
260	M	89.5	Confident	90.8	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	136.1	-177.8	-166.3	-178.5	-129.3	0	0	111	G199 F262 G279 V280 C465	G199-M260 PolarHBondContact N-O 3.22Å; G199-M260 PolarHBondContact O-N 3.16Å; M260-F262 HydrophobicContact SD-CE1 3.87Å; M260-F262 HydrophobicContact SD-CZ 4.02Å; M260-G279 VanDerWaalsContact SD-CA 3.53Å; M260-V280 CarbonylContact C-O 3.56Å; M260-V280 WeakPolarHBondContact CA-O 2.94Å; M260-V280 WeakPolarHBondContact CG-O 3.42Å; M260-C465 WeakPolarHBondContact CE-SG 3.44Å
261	D	91.8	Very high	91.1	Very high	20 Å²	20	44.9 Å²	44.9	11%	0.107	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	119	168.3	-93.7	3.4	0	0	0	109.3	R196 I263 G279 V280 L282	R196-D261 IonicContact CZ-OD2 3.84Å; R196-D261 IonicContact NH2-OD2 3.23Å; R196-D261 PolarHBondContact NH2-OD2 3.14Å; D261-I263 HydrophobicContact CB-CD1 4.46Å; D261-I263 HydrophobicContact CB-CG1 4.26Å; D261-G279 CarbonylContact O-C 3.58Å; D261-G279 WeakPolarHBondContact O-CA 3.37Å; D261-V280 HydrophobicContact CB-CB 4.5Å; D261-V280 PolarHBondContact N-O 3.02Å; D261-V280 PolarHBondContact O-N 3.32Å; D261-L282 HydrophobicContact CB-CD2 4.2Å
262	F	91.5	Very high	91.3	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.009	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	115.9	168.1	-65.3	-76.2	0	0	0	109.7	W186 R196 Q197 M260 R277 R278	W186-F262 HydrophobicContact CH2-CD1 4.23Å; W186-F262 AromaticContact CH2-CE1 3.76Å; W186-F262 HydrophobicContact CH2-CE1 3.76Å; W186-F262 HydrophobicContact CZ3-CD1 4.27Å; W186-F262 HydrophobicContact CZ3-CE1 4.25Å; R196-F262 CarbonylContact C-O 3.45Å; R196-F262 WeakPolarHBondContact CA-O 3.46Å; Q197-F262 PolarHBondContact N-O 2.82Å; Q197-F262 WeakPolarHBondContact O-CB 3Å; Q197-F262 PolarHBondContact O-N 3.08Å; M260-F262 HydrophobicContact SD-CE1 3.87Å; M260-F262 HydrophobicContact SD-CZ 4.02Å; F262-R277 HydrophobicContact CB-CG 4.2Å; F262-R277 HydrophobicContact CD1-CG 4.37Å; F262-R277 VanDerWaalsContact CD2-NH2 3.26Å; F262-R278 CarbonylContact C-O 3.55Å; F262-R278 WeakPolarHBondContact CA-O 3.36Å
263	I	92.9	Very high	91.4	Very high	29 Å²	29	38.6 Å²	38.6	15%	0.149	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.4	-176.9	-53.7	179.3	0	0	0	108.4	L195 R196 D261 E265 R277 R278 V280	L195-I263 CarbonylContact O-C 3.58Å; L195-I263 WeakPolarHBondContact O-CA 2.97Å; R196-I263 HydrophobicContact CG-CG1 4.17Å; R196-I263 HydrophobicContact CG-CG2 4.17Å; D261-I263 HydrophobicContact CB-CD1 4.46Å; D261-I263 HydrophobicContact CB-CG1 4.26Å; I263-E265 HydrophobicContact CG2-CG 4.38Å; I263-R277 CarbonylContact O-C 3.59Å; I263-R277 WeakPolarHBondContact O-CA 3.47Å; I263-R278 PolarHBondContact N-O 2.66Å; I263-R278 PolarHBondContact O-N 2.98Å; I263-V280 HydrophobicContact CD1-CG2 3.99Å
264	W	94.1	Very high	91.7	Very high	37 Å²	37	42.1 Å²	42.1	14%	0.14	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.1	169.3	-72.6	98.1	0	0	0	109.9	P192 L195 W275 I276 R277	P192-W264 HydrophobicContact CB-CD2 4.28Å; P192-W264 HydrophobicContact CB-CG 4.28Å; P192-W264 HydrophobicContact CG-CB 3.64Å; P192-W264 VanDerWaalsContact CG-CD1 3.46Å; P192-W264 HydrophobicContact CG-CD2 3.34Å; P192-W264 HydrophobicContact CG-CE3 3.9Å; P192-W264 HydrophobicContact CG-CG 3.2Å; P192-W264 HydrophobicContact CG-CZ2 4.42Å; L195-W264 HydrophobicContact CD2-CB 4.14Å; L195-W264 PolarHBondContact O-N 2.92Å; W264-W275 HydrophobicContact CB-CE3 4.44Å; W264-W275 HydrophobicContact CE3-CB 4.14Å; W264-W275 HydrophobicContact CZ3-CB 4.45Å; W264-I276 CarbonylContact C-O 3.54Å; W264-I276 VanDerWaalsContact CA-O 3.27Å; W264-I276 WeakPolarHBondContact CA-O 3.41Å; W264-R277 HydrophobicContact CD2-CB 3.81Å; W264-R277 HydrophobicContact CD2-CG 4.26Å; W264-R277 HydrophobicContact CE3-CB 3.84Å; W264-R277 HydrophobicContact CH2-CB 3.93Å; W264-R277 HydrophobicContact CZ2-CB 3.9Å; W264-R277 HydrophobicContact CZ2-CG 4.28Å; W264-R277 HydrophobicContact CZ3-CB 3.9Å
265	E	93.5	Very high	92	Very high	51 Å²	51	38.2 Å²	38.2	24%	0.238	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	144.3	179.2	-58.9	-163.5	136.7	0	0	111	I263 W275 I276 R278	I263-E265 HydrophobicContact CG2-CG 4.38Å; E265-W275 WeakPolarHBondContact O-CA 3.35Å; E265-I276 HydrophobicContact CB-CG1 4.15Å; E265-I276 PolarHBondContact N-O 2.78Å; E265-I276 PolarHBondContact O-N 2.76Å; E265-R278 VanDerWaalsContact CD-CD 3.49Å; E265-R278 HydrophobicContact CG-CG 4.16Å; E265-R278 IonicContact OE1-CZ 3.8Å; E265-R278 IonicContact OE1-NE 2.76Å; E265-R278 PolarHBondContact OE1-NE 3.09Å; E265-R278 IonicContact OE1-NH2 3.95Å; E265-R278 PolarHBondContact OE1-NH2 3.28Å; E265-R278 VanDerWaalsContact OE2-CD 3.29Å; E265-R278 WeakPolarHBondContact OE2-CD 3.43Å; E265-R278 IonicContact OE2-CZ 2.83Å; E265-R278 IonicContact OE2-NE 3.23Å; E265-R278 PolarHBondContact OE2-NE 3.46Å
266	D	94.5	Very high	92.3	Very high	63 Å²	63	33.5 Å²	33.5	34%	0.337	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116.8	173.1	-173	0.4	0	0	0	109.7	G268 R274 W275	D266-G268 VanDerWaalsContact C-N 3.3Å; D266-G268 WeakPolarHBondContact OD1-CA 3.46Å; D266-G268 PolarHBondContact OD1-N 2.81Å; D266-R274 VanDerWaalsContact CG-NE 3.25Å; D266-R274 WeakPolarHBondContact OD1-CD 3.48Å; D266-R274 WeakPolarHBondContact OD1-CG 3.49Å; D266-R274 IonicContact OD1-CZ 2.81Å; D266-R274 IonicContact OD1-NE 3.8Å; D266-R274 PolarHBondContact OD1-NE 2.63Å; D266-R274 IonicContact OD1-NH2 2.63Å; D266-R274 IonicContact OD2-CZ 3.33Å; D266-R274 VanDerWaalsContact OD2-CZ 3.23Å; D266-R274 IonicContact OD2-NE 3.99Å; D266-R274 PolarHBondContact OD2-NE 2.87Å; D266-R274 IonicContact OD2-NH2 3.09Å; D266-R274 PolarHBondContact OD2-NH2 3.1Å; D266-W275 HydrophobicContact CB-CD2 4.39Å; D266-W275 HydrophobicContact CB-CE3 4.13Å; D266-W275 HydrophobicContact CB-CH2 3.81Å; D266-W275 HydrophobicContact CB-CZ2 4.04Å; D266-W275 HydrophobicContact CB-CZ3 3.85Å
267	L	93.1	Very high	92.5	Very high	37 Å²	37	33 Å²	33	19%	0.194	17%	0.165	C	C	.	.			trans	-83.3	-7.6	175.6	-63.8	179.5	0	0	0	113.1	F271 R274 I276 L307	L267-F271 HydrophobicContact CB-CB 3.71Å; L267-F271 HydrophobicContact CB-CD2 3.78Å; L267-F271 HydrophobicContact CB-CG 3.8Å; L267-F271 HydrophobicContact CD1-CB 4.14Å; L267-F271 HydrophobicContact CD1-CD1 4.2Å; L267-F271 HydrophobicContact CD1-CG 4.1Å; L267-F271 VanDerWaalsContact O-CD2 3.32Å; L267-F271 WeakPolarHBondContact O-CD2 3.29Å; L267-R274 PolarHBondContact N-O 3.27Å; L267-I276 HydrophobicContact CD1-CD1 4.07Å; L267-I276 HydrophobicContact CD1-CG1 4.19Å; L267-I276 HydrophobicContact CD1-CG2 3.61Å; L267-I276 HydrophobicContact CD2-CD1 3.86Å; L267-I276 HydrophobicContact CD2-CG1 4.23Å; L267-I276 HydrophobicContact CG-CD1 4.13Å; L267-I276 HydrophobicContact CG-CG1 4.06Å; L267-I276 HydrophobicContact CG-CG2 4.26Å; L267-L307 HydrophobicContact CD1-CD1 3.53Å
268	G	91.6	Very high	92.6	Very high	15 Å²	15	35.7 Å²	35.7	16%	0.155	17%	0.17	C	C	.	.			trans	90.5	179.3	-178.7	0	0	0	0	0	114.4	D266 L270 F271	D266-G268 VanDerWaalsContact C-N 3.3Å; D266-G268 WeakPolarHBondContact OD1-CA 3.46Å; D266-G268 PolarHBondContact OD1-N 2.81Å; G268-L270 VanDerWaalsContact C-N 3.27Å; G268-L270 PolarHBondContact O-N 3.25Å; G268-F271 PolarHBondContact O-N 3.03Å
269	P	90	Very high	92.7	Very high	66 Å²	66	35.7 Å²	35.7	43%	0.429	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-16.8	-170.2	29.2	-35.8	0	0	0	114.2	P164 F271	P164-P269 WeakPolarHBondContact CG-O 3.42Å; P269-F271 VanDerWaalsContact C-N 3.26Å; P269-F271 PolarHBondContact O-N 3.43Å
270	L	92.4	Very high	92.9	Very high	63 Å²	63	35.5 Å²	35.5	33%	0.33	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-11.3	178.9	-58.5	179.3	0	0	0	112.7	G268 H309 W310	G268-L270 VanDerWaalsContact C-N 3.27Å; G268-L270 PolarHBondContact O-N 3.25Å; L270-H309 CarbonylContact O-C 3.56Å; L270-H309 WeakPolarHBondContact O-CA 2.88Å; L270-W310 HydrophobicContact CB-CB 4.39Å; L270-W310 HydrophobicContact CD2-CB 4.3Å; L270-W310 WeakPolarHBondContact O-CB 3.34Å; L270-W310 PolarHBondContact O-N 3.49Å
271	F	94.4	Very high	93.1	Very high	40 Å²	40	36.5 Å²	36.5	18%	0.175	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	141.8	-179.9	-72.2	-88.9	0	0	0	111.5	L267 G268 P269 L308 H309	L267-F271 HydrophobicContact CB-CB 3.71Å; L267-F271 HydrophobicContact CB-CD2 3.78Å; L267-F271 HydrophobicContact CB-CG 3.8Å; L267-F271 HydrophobicContact CD1-CB 4.14Å; L267-F271 HydrophobicContact CD1-CD1 4.2Å; L267-F271 HydrophobicContact CD1-CG 4.1Å; L267-F271 VanDerWaalsContact O-CD2 3.32Å; L267-F271 WeakPolarHBondContact O-CD2 3.29Å; G268-F271 PolarHBondContact O-N 3.03Å; P269-F271 VanDerWaalsContact C-N 3.26Å; P269-F271 PolarHBondContact O-N 3.43Å; F271-L308 CarbonylContact C-O 3.59Å; F271-L308 WeakPolarHBondContact CA-O 3.08Å; F271-H309 HydrophobicContact CD1-CB 4.08Å; F271-H309 HydrophobicContact CE1-CB 3.73Å; F271-H309 AromaticContact CE1-CD2 3.9Å; F271-H309 AromaticContact CE1-CG 3.8Å; F271-H309 AromaticContact CE2-CD2 3.96Å; F271-H309 HydrophobicContact CZ-CB 4.36Å; F271-H309 AromaticContact CZ-CD2 3.67Å; F271-H309 AromaticContact CZ-CG 3.92Å
272	W	93.6	Very high	93	Very high	9 Å²	9	37.5 Å²	37.5	3%	0.034	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	125.6	174.2	-169.8	93.3	0	0	0	111	T171 L174 R175 L178 L308 W454	T171-W272 HydrophobicContact CG2-CZ2 3.49Å; T171-W272 VanDerWaalsContact CG2-CZ2 3.49Å; L174-W272 VanDerWaalsContact C-CZ3 3.44Å; L174-W272 HydrophobicContact CB-CD2 3.75Å; L174-W272 HydrophobicContact CB-CE3 3.53Å; L174-W272 HydrophobicContact CB-CH2 3.78Å; L174-W272 HydrophobicContact CB-CZ2 3.98Å; L174-W272 HydrophobicContact CB-CZ3 3.51Å; L174-W272 HydrophobicContact CD1-CB 4.32Å; L174-W272 HydrophobicContact CD1-CD2 3.7Å; L174-W272 HydrophobicContact CD1-CE3 4.28Å; L174-W272 HydrophobicContact CD1-CG 3.68Å; L174-W272 HydrophobicContact CG-CD2 4.33Å; L174-W272 HydrophobicContact CG-CE3 4.45Å; R175-W272 HydrophobicContact CB-CH2 3.86Å; R175-W272 VanDerWaalsContact N-CH2 3.3Å; L178-W272 HydrophobicContact CD1-CE3 3.92Å; L178-W272 HydrophobicContact CD1-CZ3 3.65Å; L178-W272 HydrophobicContact CG-CZ3 4.26Å; W272-L308 HydrophobicContact CB-CB 4.36Å; W272-L308 HydrophobicContact CE3-CD1 3.77Å; W272-L308 HydrophobicContact CE3-CG 4.34Å; W272-L308 HydrophobicContact CZ3-CD1 4.29Å; W272-L308 PolarHBondContact N-O 3.33Å; W272-L308 WeakPolarHBondContact O-CB 3.42Å; W272-L308 PolarHBondContact O-N 2.6Å; W272-W454 HydrophobicContact CB-CH2 3.87Å; W272-W454 HydrophobicContact CB-CZ3 3.91Å
273	P	94.3	Very high	93	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.032	21%	0.208	C	C	.	.	S	Bend	cis	-60.4	149	-10.2	-19.9	32.5	0	0	0	112.9	L182 S188	L182-P273 HydrophobicContact CD1-CG 3.73Å; S188-P273 WeakPolarHBondContact O-CB 3.48Å
274	R	93.6	Very high	92.7	Very high	105 Å²	105	45.6 Å²	45.6	40%	0.396	22%	0.221	S	C	.	.			trans	-72.6	-38.7	-173.1	174.6	172.5	174.8	177.3	0.1	113.1	D266 L267	D266-R274 VanDerWaalsContact CG-NE 3.25Å; D266-R274 WeakPolarHBondContact OD1-CD 3.48Å; D266-R274 WeakPolarHBondContact OD1-CG 3.49Å; D266-R274 IonicContact OD1-CZ 2.81Å; D266-R274 IonicContact OD1-NE 3.8Å; D266-R274 PolarHBondContact OD1-NE 2.63Å; D266-R274 IonicContact OD1-NH2 2.63Å; D266-R274 IonicContact OD2-CZ 3.33Å; D266-R274 VanDerWaalsContact OD2-CZ 3.23Å; D266-R274 IonicContact OD2-NE 3.99Å; D266-R274 PolarHBondContact OD2-NE 2.87Å; D266-R274 IonicContact OD2-NH2 3.09Å; D266-R274 PolarHBondContact OD2-NH2 3.1Å; L267-R274 PolarHBondContact N-O 3.27Å
275	W	94.9	Very high	92.3	Very high	35 Å²	35	50 Å²	50	13%	0.133	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	130.2	-175	-63.5	83.2	0	0	0	110.9	T187 S188 P191 L195 W264 E265 D266	T187-W275 CarbonylContact C-O 3.51Å; T187-W275 WeakPolarHBondContact CA-O 3.47Å; S188-W275 PolarHBondContact N-O 2.94Å; S188-W275 WeakPolarHBondContact O-CB 2.98Å; S188-W275 PolarHBondContact O-N 3.43Å; P191-W275 HydrophobicContact CB-CD2 4.23Å; P191-W275 HydrophobicContact CB-CH2 4.03Å; P191-W275 HydrophobicContact CB-CZ2 3.55Å; P191-W275 HydrophobicContact CG-CZ2 4.32Å; L195-W275 HydrophobicContact CD2-CE3 4.32Å; L195-W275 HydrophobicContact CD2-CH2 4.39Å; L195-W275 HydrophobicContact CD2-CZ3 3.72Å; W264-W275 HydrophobicContact CB-CE3 4.44Å; W264-W275 HydrophobicContact CE3-CB 4.14Å; W264-W275 HydrophobicContact CZ3-CB 4.45Å; E265-W275 WeakPolarHBondContact O-CA 3.35Å; D266-W275 HydrophobicContact CB-CD2 4.39Å; D266-W275 HydrophobicContact CB-CE3 4.13Å; D266-W275 HydrophobicContact CB-CH2 3.81Å; D266-W275 HydrophobicContact CB-CZ2 4.04Å; D266-W275 HydrophobicContact CB-CZ3 3.85Å
276	I	94.9	Very high	91.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	147	174.9	63.9	163.9	0	0	0	110.4	W186 T187 W264 E265 L267 L305 L307 Y459 I461	W186-I276 CarbonylContact O-C 3.53Å; W186-I276 WeakPolarHBondContact O-CA 3.32Å; T187-I276 HydrophobicContact CG2-CG2 4.45Å; W264-I276 CarbonylContact C-O 3.54Å; W264-I276 VanDerWaalsContact CA-O 3.27Å; W264-I276 WeakPolarHBondContact CA-O 3.41Å; E265-I276 HydrophobicContact CB-CG1 4.15Å; E265-I276 PolarHBondContact N-O 2.78Å; E265-I276 PolarHBondContact O-N 2.76Å; L267-I276 HydrophobicContact CD1-CD1 4.07Å; L267-I276 HydrophobicContact CD1-CG1 4.19Å; L267-I276 HydrophobicContact CD1-CG2 3.61Å; L267-I276 HydrophobicContact CD2-CD1 3.86Å; L267-I276 HydrophobicContact CD2-CG1 4.23Å; L267-I276 HydrophobicContact CG-CD1 4.13Å; L267-I276 HydrophobicContact CG-CG1 4.06Å; L267-I276 HydrophobicContact CG-CG2 4.26Å; I276-L305 HydrophobicContact CG2-CD1 4.49Å; I276-L307 HydrophobicContact CG2-CD1 3.92Å; I276-L307 HydrophobicContact CG2-CD2 4.11Å; I276-Y459 HydrophobicContact CD1-CD1 3.91Å; I276-Y459 HydrophobicContact CD1-CE1 3.42Å; I276-Y459 VanDerWaalsContact CD1-CE1 3.42Å; I276-I461 HydrophobicContact CD1-CG2 4.39Å
277	R	93.3	Very high	91.5	Very high	17 Å²	17	53.6 Å²	53.6	6%	0.064	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	132	171.4	-171.4	178	170.4	171	1.3	108.1	W186 N205 F262 I263 W264 I461	W186-R277 HydrophobicContact CE3-CB 3.9Å; W186-R277 HydrophobicContact CE3-CG 4.13Å; W186-R277 VanDerWaalsContact CE3-O 3.23Å; W186-R277 HydrophobicContact CZ3-CB 4.5Å; W186-R277 HydrophobicContact CZ3-CG 4.29Å; W186-R277 PolarHBondContact O-N 3.1Å; N205-R277 PolarHBondContact ND2-NH2 3.29Å; N205-R277 VanDerWaalsContact ND2-NH2 3.11Å; F262-R277 HydrophobicContact CB-CG 4.2Å; F262-R277 HydrophobicContact CD1-CG 4.37Å; F262-R277 VanDerWaalsContact CD2-NH2 3.26Å; I263-R277 CarbonylContact O-C 3.59Å; I263-R277 WeakPolarHBondContact O-CA 3.47Å; W264-R277 HydrophobicContact CD2-CB 3.81Å; W264-R277 HydrophobicContact CD2-CG 4.26Å; W264-R277 HydrophobicContact CE3-CB 3.84Å; W264-R277 HydrophobicContact CH2-CB 3.93Å; W264-R277 HydrophobicContact CZ2-CB 3.9Å; W264-R277 HydrophobicContact CZ2-CG 4.28Å; W264-R277 HydrophobicContact CZ3-CB 3.9Å; R277-I461 WeakPolarHBondContact O-CD1 3.3Å
278	R	92.1	Very high	91.5	Very high	97 Å²	97	52.5 Å²	52.5	37%	0.366	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	148	169.9	67	164.9	-177.7	149	-15.1	110.7	F262 I263 E265 I461	F262-R278 CarbonylContact C-O 3.55Å; F262-R278 WeakPolarHBondContact CA-O 3.36Å; I263-R278 PolarHBondContact N-O 2.66Å; I263-R278 PolarHBondContact O-N 2.98Å; E265-R278 VanDerWaalsContact CD-CD 3.49Å; E265-R278 HydrophobicContact CG-CG 4.16Å; E265-R278 IonicContact OE1-CZ 3.8Å; E265-R278 IonicContact OE1-NE 2.76Å; E265-R278 PolarHBondContact OE1-NE 3.09Å; E265-R278 IonicContact OE1-NH2 3.95Å; E265-R278 PolarHBondContact OE1-NH2 3.28Å; E265-R278 VanDerWaalsContact OE2-CD 3.29Å; E265-R278 WeakPolarHBondContact OE2-CD 3.43Å; E265-R278 IonicContact OE2-CZ 2.83Å; E265-R278 IonicContact OE2-NE 3.23Å; E265-R278 PolarHBondContact OE2-NE 3.46Å; R278-I461 HydrophobicContact CB-CG2 4.44Å
279	G	92	Very high	91.5	Very high	6 Å²	6	52.3 Å²	52.3	6%	0.062	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	134.2	172	0	0	0	0	0	111.5	M260 D261 S462	M260-G279 VanDerWaalsContact SD-CA 3.53Å; D261-G279 CarbonylContact O-C 3.58Å; D261-G279 WeakPolarHBondContact O-CA 3.37Å; G279-S462 WeakPolarHBondContact CA-O 3.41Å; G279-S462 PolarHBondContact N-O 3.47Å
280	V	93.1	Very high	91.6	Very high	49 Å²	49	50 Å²	50	30%	0.297	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.8	174	-179.5	0	0	0	0	108.6	M260 D261 I263	M260-V280 CarbonylContact C-O 3.56Å; M260-V280 WeakPolarHBondContact CA-O 2.94Å; M260-V280 WeakPolarHBondContact CG-O 3.42Å; D261-V280 HydrophobicContact CB-CB 4.5Å; D261-V280 PolarHBondContact N-O 3.02Å; D261-V280 PolarHBondContact O-N 3.32Å; I263-V280 HydrophobicContact CD1-CG2 3.99Å
281	C	93	Very high	91.4	Very high	21 Å²	21	56 Å²	56	14%	0.142	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	132.7	179.9	-57	0	0	0	0	111.3	R298 P299 C465	C281-R298 VanDerWaalsContact SG-C 3.54Å; C281-P299 VanDerWaalsContact SG-N 3.43Å; C281-C465 WeakPolarHBondContact CA-SG 3.35Å; C281-C465 HydrophobicContact CB-CB 3.96Å; C281-C465 WeakPolarHBondContact CB-SG 3.13Å; C281-C465 WeakPolarHBondContact SG-CB 3.43Å; C281-C465 CovalentContact SG-SG 2.02Å; C281-C465 PolarHBondContact SG-SG 2.76Å
282	L	90.8	Very high	91.2	Very high	40 Å²	40	59.1 Å²	59.1	21%	0.209	31%	0.312	C	S	.	.			trans	-87.3	118.3	177.9	-65.2	177.4	0	0	0	110	R198 E259 D261	R198-L282 HydrophobicContact CG-CD1 4.13Å; E259-L282 HydrophobicContact CB-CB 4.31Å; E259-L282 HydrophobicContact CB-CD1 3.96Å; E259-L282 PolarHBondContact O-N 2.84Å; D261-L282 HydrophobicContact CB-CD2 4.2Å
283	N	90.6	Very high	91.1	Very high	90 Å²	90	63.3 Å²	63.3	48%	0.481	34%	0.343	S	S	.	.			trans	-113.5	97.8	171.9	-74.4	-52.7	0	0	0	108.6	C297	N283-C297 PolarHBondContact ND2-O 2.85Å; N283-C297 WeakPolarHBondContact OD1-CB 3.44Å; N283-C297 PolarHBondContact OD1-N 2.73Å; N283-C297 PolarHBondContact OD1-O 3.26Å; N283-C297 VanDerWaalsContact OD1-O 3.06Å
284	R	86.4	Confident	90.9	Very high	112 Å²	112	65.5 Å²	65.5	42%	0.423	37%	0.366	S	S	.	.			trans	-70.7	134.4	173.8	-65.6	179.2	-82.8	-124.4	-10	109.1	E259 G286 H287	E259-R284 IonicContact OE1-CZ 3.26Å; E259-R284 VanDerWaalsContact OE1-CZ 3.26Å; E259-R284 IonicContact OE1-NH1 2.8Å; E259-R284 PolarHBondContact OE1-NH1 3.22Å; E259-R284 IonicContact OE1-NH2 2.89Å; E259-R284 PolarHBondContact OE1-NH2 2.98Å; E259-R284 IonicContact OE2-NH1 3.58Å; R284-G286 PolarHBondContact O-N 2.94Å; R284-H287 HydrophobicContact CB-CB 3.97Å; R284-H287 WeakPolarHBondContact CB-CD2 3.24Å; R284-H287 PolarHBondContact O-N 3.36Å; R284-H287 VanDerWaalsContact O-N 3.09Å
285	P	86.7	Confident	90.9	Very high	129 Å²	129	63.1 Å²	63.1	84%	0.838	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	132.6	178.9	25.9	-33.7	0	0	0	110.3	H287	P285-H287 VanDerWaalsContact C-N 3.26Å; P285-H287 PolarHBondContact O-CD2 2.87Å; P285-H287 PolarHBondContact O-N 2.84Å
286	G	84	Confident	90.8	Very high	89 Å²	89	66.9 Å²	66.9	92%	0.918	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-6.2	-177.3	0	0	0	0	0	115.7	R284	R284-G286 PolarHBondContact O-N 2.94Å
287	H	87.3	Confident	90.7	Very high	100 Å²	100	67.4 Å²	67.4	46%	0.463	38%	0.381	S	S	.	.			trans	-90.7	129.6	175	-65.4	-99.3	0	0	0	110.9	R284 P285	R284-H287 HydrophobicContact CB-CB 3.97Å; R284-H287 WeakPolarHBondContact CB-CD2 3.24Å; R284-H287 PolarHBondContact O-N 3.36Å; R284-H287 VanDerWaalsContact O-N 3.09Å; P285-H287 VanDerWaalsContact C-N 3.26Å; P285-H287 PolarHBondContact O-CD2 2.87Å; P285-H287 PolarHBondContact O-N 2.84Å
288	S	91.7	Very high	90.7	Very high	15 Å²	15	71.3 Å²	71.3	11%	0.105	40%	0.396	C	S	.	.			trans	-114.2	135.4	169.2	-179.5	0	0	0	0	109.3	R255 S290 G294 M295	R255-S288 PolarHBondContact NE-O 3.35Å; R255-S288 PolarHBondContact NH2-O 2.84Å; S288-S290 PolarHBondContact O-N 2.8Å; S288-S290 PolarHBondContact OG-N 2.83Å; S288-S290 PolarHBondContact OG-OG 3.35Å; S288-G294 PolarHBondContact OG-N 3.29Å; S288-M295 WeakPolarHBondContact CA-O 3.33Å; S288-M295 WeakPolarHBondContact CB-O 3.44Å; S288-M295 PolarHBondContact OG-N 2.96Å; S288-M295 PolarHBondContact OG-O 3.33Å
289	C	92.2	Very high	90.7	Very high	10 Å²	10	70.5 Å²	70.5	7%	0.068	40%	0.403	C	S	.	.	S	Bend	trans	-81.1	1.3	177.5	57.4	0	0	0	0	113	R255 A256 M295 K296 C467	R255-C289 CarbonylContact C-O 3.3Å; R255-C289 CarbonylContact O-C 3.58Å; R255-C289 WeakPolarHBondContact O-CA 3.42Å; R255-C289 VanDerWaalsContact O-O 3.09Å; A256-C289 WeakPolarHBondContact CA-O 3.17Å; C289-M295 PolarHBondContact N-O 2.97Å; C289-M295 VanDerWaalsContact SG-C 3.54Å; C289-K296 VanDerWaalsContact SG-CA 3.59Å; C289-C467 HydrophobicContact CB-CB 3.7Å; C289-C467 WeakPolarHBondContact CB-SG 3.37Å; C289-C467 PolarHBondContact O-SG 3.03Å; C289-C467 WeakPolarHBondContact SG-CA 3.38Å; C289-C467 WeakPolarHBondContact SG-CB 3.41Å; C289-C467 CovalentContact SG-SG 2.02Å; C289-C467 PolarHBondContact SG-SG 2.72Å
290	S	92.1	Very high	90.5	Very high	19 Å²	19	74.1 Å²	74.1	13%	0.133	43%	0.428	C	S	.	.	S	Bend	trans	-115.6	161.4	176.2	64.3	0	0	0	0	112.2	S288 P292 G294 M295	S288-S290 PolarHBondContact O-N 2.8Å; S288-S290 PolarHBondContact OG-N 2.83Å; S288-S290 PolarHBondContact OG-OG 3.35Å; S290-P292 CarbonylContact C-O 3.59Å; S290-P292 VanDerWaalsContact C-O 3.3Å; S290-P292 CarbonylContact O-C 3.57Å; S290-P292 PolarHBondContact OG-O 3.06Å; S290-G294 PolarHBondContact OG-N 3.1Å; S290-M295 WeakPolarHBondContact CB-SD 3.33Å; S290-M295 WeakPolarHBondContact OG-CB 3.5Å; S290-M295 WeakPolarHBondContact OG-CG 3.45Å; S290-M295 PolarHBondContact OG-N 2.78Å
291	W	88.2	Confident	90.1	Very high	189 Å²	189	72.5 Å²	72.5	72%	0.716	42%	0.421	S	S	*	.	S	Bend	trans	-126.9	122.1	165.3	-177.2	84.8	0	0	0	109.1	W251	W251-W291 HydrophobicContact CH2-CB 4.04Å; W251-W291 AromaticContact CH2-CD1 3.62Å; W251-W291 HydrophobicContact CH2-CD2 4.38Å; W251-W291 AromaticContact CH2-CG 3.75Å; W251-W291 HydrophobicContact CH2-CG 3.75Å; W251-W291 HydrophobicContact CZ3-CB 4.43Å; W251-W291 HydrophobicContact CZ3-CG 4.27Å
292	P	90.1	Very high	89.9	Confident	105 Å²	105	75.7 Å²	75.7	68%	0.682	44%	0.444	S	S	*	.	S	Bend	cis	-62.7	163.1	-4.5	28.8	-35.4	0	0	0	112.5	S290 G294	S290-P292 CarbonylContact C-O 3.59Å; S290-P292 VanDerWaalsContact C-O 3.3Å; S290-P292 CarbonylContact O-C 3.57Å; S290-P292 PolarHBondContact OG-O 3.06Å; P292-G294 PolarHBondContact O-N 2.8Å
293	S	91.6	Very high	89.9	Confident	96 Å²	96	77.6 Å²	77.6	67%	0.671	45%	0.448	S	S	*	.	S	Bend	trans	-63.9	129.8	-177.1	55.1	0	0	0	0	111.7
294	G	90.8	Very high	90	Very high	51 Å²	51	76 Å²	76	53%	0.526	45%	0.448	S	S	.	.			trans	179.1	-32.2	175.3	0	0	0	0	0	114.3	S288 S290 P292	S288-G294 PolarHBondContact OG-N 3.29Å; S290-G294 PolarHBondContact OG-N 3.1Å; P292-G294 PolarHBondContact O-N 2.8Å
295	M	92.7	Very high	90.3	Very high	56 Å²	56	70.8 Å²	70.8	28%	0.276	43%	0.428	S	S	.	.			trans	-88.3	155.4	-179.1	-57.6	168.2	69.2	0	0	112	S288 C289 S290 C467 S468	S288-M295 WeakPolarHBondContact CA-O 3.33Å; S288-M295 WeakPolarHBondContact CB-O 3.44Å; S288-M295 PolarHBondContact OG-N 2.96Å; S288-M295 PolarHBondContact OG-O 3.33Å; C289-M295 PolarHBondContact N-O 2.97Å; C289-M295 VanDerWaalsContact SG-C 3.54Å; S290-M295 WeakPolarHBondContact CB-SD 3.33Å; S290-M295 WeakPolarHBondContact OG-CB 3.5Å; S290-M295 WeakPolarHBondContact OG-CG 3.45Å; S290-M295 PolarHBondContact OG-N 2.78Å; M295-C467 WeakPolarHBondContact CB-SG 3.04Å; M295-C467 HydrophobicContact CE-CB 4.44Å; M295-C467 VanDerWaalsContact CE-O 3.3Å; M295-C467 WeakPolarHBondContact CE-O 3.35Å; M295-S468 WeakPolarHBondContact CB-O 3.06Å
296	K	93.8	Very high	90.6	Very high	114 Å²	114	67 Å²	67	50%	0.496	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	158.4	180	-65.6	-178.6	-178	175.1	0	111.2	C289 R298 S468	C289-K296 VanDerWaalsContact SG-CA 3.59Å; K296-R298 PolarHBondContact O-N 2.96Å; K296-S468 PolarHBondContact N-O 3.47Å; K296-S468 PolarHBondContact O-N 3.44Å; K296-S468 VanDerWaalsContact O-N 3.07Å; K296-S468 VanDerWaalsContact O-O 3.13Å
297	C	92.9	Very high	91.1	Very high	11 Å²	11	62.8 Å²	62.8	7%	0.074	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	119.1	177.8	-70.1	0	0	0	0	110.1	C258 N283	C258-C297 VanDerWaalsContact CA-SG 3.52Å; C258-C297 HydrophobicContact CB-CB 3.68Å; C258-C297 WeakPolarHBondContact CB-SG 3.44Å; C258-C297 VanDerWaalsContact SG-CA 3.5Å; C258-C297 WeakPolarHBondContact SG-CB 3.27Å; C258-C297 CovalentContact SG-SG 2.04Å; C258-C297 PolarHBondContact SG-SG 3.38Å; N283-C297 PolarHBondContact ND2-O 2.85Å; N283-C297 WeakPolarHBondContact OD1-CB 3.44Å; N283-C297 PolarHBondContact OD1-N 2.73Å; N283-C297 PolarHBondContact OD1-O 3.26Å; N283-C297 VanDerWaalsContact OD1-O 3.06Å
298	R	92.2	Very high	91.4	Very high	98 Å²	98	58 Å²	58	37%	0.37	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	153.9	-179.5	-73.8	-174.5	161.1	-179.4	-5.4	111.1	C281 K296 S300 C465 S466 S468 C469 S470	C281-R298 VanDerWaalsContact SG-C 3.54Å; K296-R298 PolarHBondContact O-N 2.96Å; R298-S300 PolarHBondContact O-N 3.47Å; R298-C465 CarbonylContact O-C 3.59Å; R298-C465 VanDerWaalsContact O-CA 3.22Å; R298-C465 WeakPolarHBondContact O-CA 3.25Å; R298-S466 PolarHBondContact N-O 3.33Å; R298-S466 PolarHBondContact O-N 3.45Å; R298-S468 WeakPolarHBondContact CB-OG 3.46Å; R298-S468 WeakPolarHBondContact CD-OG 3.37Å; R298-C469 PolarHBondContact NH1-O 3.26Å; R298-S470 VanDerWaalsContact CZ-CA 3.43Å; R298-S470 PolarHBondContact NH1-OXT 3.34Å; R298-S470 VanDerWaalsContact NH2-CA 3.31Å; R298-S470 PolarHBondContact NH2-OXT 3.19Å
299	P	92.1	Very high	91.6	Very high	80 Å²	80	59.4 Å²	59.4	52%	0.519	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	125.6	173.8	27.5	-33.9	0	0	0	109.5	C281 R464	C281-P299 VanDerWaalsContact SG-N 3.43Å; P299-R464 WeakPolarHBondContact CA-O 3.32Å
300	S	88.1	Confident	91.7	Very high	83 Å²	83	59.6 Å²	59.6	58%	0.58	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	-18.1	-178.1	-179.6	0	0	0	0	113.2	R298 R464 S466	R298-S300 PolarHBondContact O-N 3.47Å; S300-R464 PolarHBondContact N-O 3.24Å; S300-S466 WeakPolarHBondContact CB-OG 3.43Å; S300-S466 PolarHBondContact OG-OG 3.17Å
301	G	84.8	Confident	91.8	Very high	15 Å²	15	62.1 Å²	62.1	16%	0.155	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	142.3	173.4	0	0	0	0	0	110.7	S462 D463 R464	G301-S462 WeakPolarHBondContact O-CA 3.44Å; G301-D463 VanDerWaalsContact CA-OD1 3.28Å; G301-D463 WeakPolarHBondContact CA-OD1 3.38Å; G301-D463 PolarHBondContact O-N 3.13Å; G301-R464 PolarHBondContact N-O 3.43Å
302	S	89	Confident	92	Very high	88 Å²	88	55.2 Å²	55.2	62%	0.615	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.6	127.8	168.1	65.6	0	0	0	0	110	I461 D463	S302-I461 CarbonylContact C-O 3.56Å; S302-I461 VanDerWaalsContact CA-O 3.25Å; S302-I461 WeakPolarHBondContact CA-O 3.44Å; S302-D463 PolarHBondContact N-OD1 3.26Å
303	R	90.7	Very high	92.1	Very high	80 Å²	80	51.5 Å²	51.5	30%	0.302	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	133.8	172	-173.5	178.2	-169.8	122.7	-1.5	109.6	D183 L305 L460 I461 D463	D183-R303 IonicContact OD1-CZ 3.83Å; D183-R303 IonicContact OD1-NE 2.93Å; D183-R303 IonicContact OD1-NH2 2.66Å; D183-R303 PolarHBondContact OD1-NH2 3.39Å; D183-R303 IonicContact OD2-CZ 3.32Å; D183-R303 IonicContact OD2-NE 2.72Å; D183-R303 PolarHBondContact OD2-NE 3.42Å; D183-R303 IonicContact OD2-NH2 2.72Å; D183-R303 PolarHBondContact OD2-NH2 3.24Å; D183-R303 VanDerWaalsContact OD2-NH2 3.09Å; R303-L305 HydrophobicContact CG-CD2 4.39Å; R303-L460 WeakPolarHBondContact O-CA 3.34Å; R303-I461 HydrophobicContact CB-CD1 4.29Å; R303-I461 HydrophobicContact CB-CG1 3.94Å; R303-I461 PolarHBondContact N-O 3.17Å; R303-I461 WeakPolarHBondContact O-CG1 2.9Å; R303-I461 PolarHBondContact O-N 2.82Å; R303-D463 HydrophobicContact CB-CB 4.21Å
304	A	92.6	Very high	92.1	Very high	57 Å²	57	50 Å²	50	47%	0.471	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	104.3	176	0	0	0	0	0	110.3	Y459 L460	A304-Y459 CarbonylContact C-O 3.57Å; A304-Y459 WeakPolarHBondContact CA-O 3.43Å; A304-L460 HydrophobicContact CB-CD2 3.84Å
305	L	93.1	Very high	92	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	142.2	171.5	-58.7	-179.6	0	0	0	110.1	D183 W186 T187 I276 R303 K458 Y459 I461	D183-L305 HydrophobicContact CB-CD2 3.94Å; D183-L305 WeakPolarHBondContact OD2-CD2 3.44Å; W186-L305 HydrophobicContact CB-CD1 4.18Å; W186-L305 HydrophobicContact CB-CD2 3.7Å; W186-L305 HydrophobicContact CG-CD2 4.29Å; T187-L305 HydrophobicContact CG2-CD1 3.98Å; T187-L305 HydrophobicContact CG2-CD2 4.48Å; I276-L305 HydrophobicContact CG2-CD1 4.49Å; R303-L305 HydrophobicContact CG-CD2 4.39Å; L305-K458 CarbonylContact O-C 3.48Å; L305-K458 WeakPolarHBondContact O-CA 3.31Å; L305-Y459 PolarHBondContact N-O 3.06Å; L305-Y459 PolarHBondContact O-N 2.76Å; L305-I461 HydrophobicContact CD1-CD1 3.67Å; L305-I461 HydrophobicContact CD1-CG1 4.09Å; L305-I461 HydrophobicContact CD1-CG2 4.07Å; L305-I461 HydrophobicContact CD2-CD1 4.2Å; L305-I461 HydrophobicContact CG-CD1 3.89Å; L305-I461 HydrophobicContact CG-CG1 4.03Å
306	Q	93.4	Very high	91.9	Very high	49 Å²	49	48.2 Å²	48.2	23%	0.229	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	117.4	169.3	-69.1	-172.9	6.1	0	0	109.6	L178 N181	L178-Q306 HydrophobicContact CD2-CB 4.28Å; N181-Q306 HydrophobicContact CB-CB 4.18Å; N181-Q306 HydrophobicContact CB-CG 4.16Å; N181-Q306 VanDerWaalsContact CG-OE1 3.31Å; N181-Q306 PolarHBondContact ND2-NE2 2.98Å
307	L	93.8	Very high	91.8	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	160.9	179.5	-57.1	173.1	0	0	0	109.5	T187 L267 I276 Q457 Y459	T187-L307 HydrophobicContact CG2-CD2 3.91Å; L267-L307 HydrophobicContact CD1-CD1 3.53Å; I276-L307 HydrophobicContact CG2-CD1 3.92Å; I276-L307 HydrophobicContact CG2-CD2 4.11Å; L307-Q457 PolarHBondContact N-O 3.11Å; L307-Q457 PolarHBondContact O-N 3.27Å; L307-Y459 HydrophobicContact CD1-CD2 4.45Å; L307-Y459 HydrophobicContact CD1-CG 4.05Å
308	L	94.3	Very high	91.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	127.9	169.5	-58.1	178.3	0	0	0	108.8	L174 I177 L178 F271 W272 W454 Q455 V456	L174-L308 HydrophobicContact CB-CD1 3.87Å; L174-L308 HydrophobicContact CD2-CD1 3.55Å; L174-L308 HydrophobicContact CG-CD1 4.24Å; I177-L308 HydrophobicContact CB-CD1 4.43Å; I177-L308 HydrophobicContact CG2-CD1 4.36Å; I177-L308 HydrophobicContact CG2-CD2 3.81Å; L178-L308 HydrophobicContact CD1-CD1 4.46Å; L178-L308 HydrophobicContact CD1-CG 4.1Å; L178-L308 HydrophobicContact CD2-CD2 3.72Å; L178-L308 HydrophobicContact CD2-CG 3.9Å; L178-L308 HydrophobicContact CG-CD1 4.18Å; L178-L308 HydrophobicContact CG-CD2 4.2Å; L178-L308 HydrophobicContact CG-CG 3.93Å; F271-L308 CarbonylContact C-O 3.59Å; F271-L308 WeakPolarHBondContact CA-O 3.08Å; W272-L308 HydrophobicContact CB-CB 4.36Å; W272-L308 HydrophobicContact CE3-CD1 3.77Å; W272-L308 HydrophobicContact CE3-CG 4.34Å; W272-L308 HydrophobicContact CZ3-CD1 4.29Å; W272-L308 PolarHBondContact N-O 3.33Å; W272-L308 WeakPolarHBondContact O-CB 3.42Å; W272-L308 PolarHBondContact O-N 2.6Å; L308-W454 HydrophobicContact CB-CD2 4.28Å; L308-W454 HydrophobicContact CB-CE3 3.6Å; L308-W454 HydrophobicContact CB-CZ3 4.14Å; L308-Q455 WeakPolarHBondContact CA-O 3.37Å; L308-V456 HydrophobicContact CD2-CB 4.41Å; L308-V456 HydrophobicContact CD2-CG2 3.72Å
309	H	95.2	Very high	91.5	Very high	45 Å²	45	50.9 Å²	50.9	21%	0.208	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.7	174.7	176.1	-150.9	0	0	0	109	L270 F271 K311 Q455 Q457	L270-H309 CarbonylContact O-C 3.56Å; L270-H309 WeakPolarHBondContact O-CA 2.88Å; F271-H309 HydrophobicContact CD1-CB 4.08Å; F271-H309 HydrophobicContact CE1-CB 3.73Å; F271-H309 AromaticContact CE1-CD2 3.9Å; F271-H309 AromaticContact CE1-CG 3.8Å; F271-H309 AromaticContact CE2-CD2 3.96Å; F271-H309 HydrophobicContact CZ-CB 4.36Å; F271-H309 AromaticContact CZ-CD2 3.67Å; F271-H309 AromaticContact CZ-CG 3.92Å; H309-K311 PolarHBondContact O-N 3.41Å; H309-Q455 PolarHBondContact N-O 2.68Å; H309-Q455 PolarHBondContact O-N 3.45Å; H309-Q457 HydrophobicContact CB-CB 4.37Å; H309-Q457 PolarHBondContact ND1-OE1 3.2Å; H309-Q457 VanDerWaalsContact ND1-OE1 3.14Å
310	W	94.8	Very high	91.6	Very high	13 Å²	13	51.8 Å²	51.8	5%	0.049	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	108.2	176.5	-172.8	-111.1	0	0	0	109.6	L162 P164 L270 V445 C452 W454	L162-W310 PolarHBondContact O-NE1 2.98Å; P164-W310 HydrophobicContact CB-CB 4.23Å; P164-W310 HydrophobicContact CB-CD2 3.67Å; P164-W310 HydrophobicContact CB-CE3 4.08Å; P164-W310 HydrophobicContact CB-CG 3.76Å; P164-W310 HydrophobicContact CB-CZ2 4.48Å; P164-W310 HydrophobicContact CG-CB 3.96Å; P164-W310 HydrophobicContact CG-CD2 4.3Å; P164-W310 HydrophobicContact CG-CG 3.85Å; L270-W310 HydrophobicContact CB-CB 4.39Å; L270-W310 HydrophobicContact CD2-CB 4.3Å; L270-W310 WeakPolarHBondContact O-CB 3.34Å; L270-W310 PolarHBondContact O-N 3.49Å; W310-V445 HydrophobicContact CH2-CB 4.49Å; W310-V445 HydrophobicContact CH2-CG2 4.27Å; W310-C452 HydrophobicContact CD2-CB 4.38Å; W310-C452 VanDerWaalsContact CE2-CB 3.47Å; W310-C452 HydrophobicContact CH2-CB 3.96Å; W310-C452 HydrophobicContact CZ2-CB 3.24Å; W310-W454 HydrophobicContact CB-CE3 4.03Å; W310-W454 HydrophobicContact CB-CH2 4.12Å; W310-W454 HydrophobicContact CB-CZ3 3.73Å; W310-W454 AromaticContact CE3-CD1 3.74Å; W310-W454 AromaticContact CE3-CD2 3.51Å; W310-W454 HydrophobicContact CE3-CD2 3.51Å; W310-W454 AromaticContact CE3-CE2 3.44Å; W310-W454 VanDerWaalsContact CE3-CE2 3.44Å; W310-W454 HydrophobicContact CE3-CE3 4.04Å; W310-W454 AromaticContact CE3-CG 3.76Å; W310-W454 HydrophobicContact CE3-CG 3.76Å; W310-W454 HydrophobicContact CE3-CH2 4.48Å; W310-W454 AromaticContact CE3-CZ2 3.99Å; W310-W454 HydrophobicContact CE3-CZ2 3.99Å; W310-W454 HydrophobicContact CE3-CZ3 4.48Å; W310-W454 AromaticContact CE3-NE1 3.51Å; W310-W454 AromaticContact CZ3-CD1 3.47Å; W310-W454 VanDerWaalsContact CZ3-CD1 3.47Å; W310-W454 HydrophobicContact CZ3-CD2 4.09Å; W310-W454 AromaticContact CZ3-CE2 3.8Å; W310-W454 AromaticContact CZ3-CG 3.94Å; W310-W454 HydrophobicContact CZ3-CG 3.94Å; W310-W454 AromaticContact CZ3-NE1 3.33Å; W310-W454 VanDerWaalsContact CZ3-NE1 3.33Å
311	K	93.5	Very high	91.7	Very high	73 Å²	73	53.9 Å²	53.9	32%	0.317	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	128.7	-178.6	-170.3	-179.5	-175.9	-167.2	0	109.6	H309 E313 C452 Y453 Q455	H309-K311 PolarHBondContact O-N 3.41Å; K311-E313 HydrophobicContact CD-CG 4.29Å; K311-E313 WeakPolarHBondContact CE-OE1 3.06Å; K311-E313 HydrophobicContact CG-CG 4.33Å; K311-E313 IonicContact NZ-OE1 2.96Å; K311-E313 PolarHBondContact NZ-OE1 3.14Å; K311-C452 CarbonylContact O-C 3.5Å; K311-C452 VanDerWaalsContact O-CA 3.27Å; K311-C452 WeakPolarHBondContact O-CA 3.28Å; K311-Y453 PolarHBondContact N-O 3.36Å; K311-Y453 PolarHBondContact O-N 2.89Å; K311-Q455 VanDerWaalsContact CD-OE1 3.29Å
312	C	92.5	Very high	92	Very high	44 Å²	44	58.2 Å²	58.2	30%	0.297	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	128	170.3	-62.3	0	0	0	0	109.5	L162 C452	L162-C312 HydrophobicContact CD2-CB 4.13Å; C312-C452 HydrophobicContact CB-CB 4.1Å; C312-C452 WeakPolarHBondContact CB-SG 3.31Å; C312-C452 WeakPolarHBondContact SG-CB 3.06Å; C312-C452 CovalentContact SG-SG 2.04Å; C312-C452 PolarHBondContact SG-SG 3.49Å
313	E	91.4	Very high	92.2	Very high	27 Å²	27	59.3 Å²	59.3	13%	0.126	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	157.7	173.2	-63.3	-174.5	165.1	0	0	109.1	K311 A315 V318 R321 Y450 H451 Y453	K311-E313 HydrophobicContact CD-CG 4.29Å; K311-E313 WeakPolarHBondContact CE-OE1 3.06Å; K311-E313 HydrophobicContact CG-CG 4.33Å; K311-E313 IonicContact NZ-OE1 2.96Å; K311-E313 PolarHBondContact NZ-OE1 3.14Å; E313-A315 PolarHBondContact O-N 2.82Å; E313-V318 HydrophobicContact CB-CG2 3.82Å; E313-R321 IonicContact OE1-NH1 2.79Å; E313-R321 IonicContact OE2-CZ 3.06Å; E313-R321 VanDerWaalsContact OE2-CZ 3.32Å; E313-R321 IonicContact OE2-NH1 3.4Å; E313-R321 PolarHBondContact OE2-NH1 2.79Å; E313-R321 IonicContact OE2-NH2 3.66Å; E313-R321 PolarHBondContact OE2-NH2 3.31Å; E313-Y450 CarbonylContact O-C 3.58Å; E313-Y450 WeakPolarHBondContact O-CA 3.37Å; E313-H451 PolarHBondContact N-O 2.04Å; E313-H451 PolarHBondContact O-N 3.43Å; E313-Y453 HydrophobicContact CG-CE1 4.27Å; E313-Y453 PolarHBondContact OE1-OH 2.76Å
314	D	91.7	Very high	92.3	Very high	63 Å²	63	57 Å²	57	34%	0.337	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	125.6	172.8	-176.6	-19.2	0	0	0	109.8	A316 Q317 V318	D314-A316 PolarHBondContact O-N 2.98Å; D314-A316 WeakPolarHBondContact OD1-CB 3.18Å; D314-A316 PolarHBondContact OD1-N 2.8Å; D314-Q317 HydrophobicContact CB-CB 4.28Å; D314-Q317 HydrophobicContact CB-CG 3.9Å; D314-Q317 WeakPolarHBondContact O-CB 3.29Å; D314-Q317 PolarHBondContact O-N 3.28Å; D314-Q317 VanDerWaalsContact O-N 3.09Å; D314-V318 WeakPolarHBondContact O-CG2 3.26Å; D314-V318 PolarHBondContact O-N 3.1Å
315	A	90	Very high	92.3	Very high	16 Å²	16	56 Å²	56	13%	0.132	29%	0.292	C	S	.	.	H	α-helix	trans	-60.9	-32.9	-176.9	0	0	0	0	0	111.9	E313 V318 Q319 G449 H451	E313-A315 PolarHBondContact O-N 2.82Å; A315-V318 PolarHBondContact O-N 2.88Å; A315-Q319 VanDerWaalsContact O-CG 3.32Å; A315-Q319 WeakPolarHBondContact O-CG 3.35Å; A315-Q319 PolarHBondContact O-N 2.86Å; A315-G449 WeakPolarHBondContact CB-O 3.43Å; A315-G449 PolarHBondContact N-O 2.88Å; A315-H451 HydrophobicContact CB-CB 4.37Å
316	A	90.2	Very high	92.3	Very high	55 Å²	55	59.2 Å²	59.2	46%	0.455	31%	0.31	S	S	.	.	H	α-helix	trans	-63	-45.1	175.4	0	0	0	0	0	110.7	D314 V318 Q319 T320	D314-A316 PolarHBondContact O-N 2.98Å; D314-A316 WeakPolarHBondContact OD1-CB 3.18Å; D314-A316 PolarHBondContact OD1-N 2.8Å; A316-V318 PolarHBondContact O-N 2.94Å; A316-Q319 PolarHBondContact O-N 3.43Å; A316-T320 PolarHBondContact O-N 3.05Å; A316-T320 PolarHBondContact O-OG1 3.09Å; A316-T320 VanDerWaalsContact O-OG1 3.04Å
317	Q	91.5	Very high	92.3	Very high	126 Å²	126	60.9 Å²	60.9	59%	0.589	32%	0.318	S	S	*	.	H	α-helix	trans	-64.1	-40.2	178.1	-62.8	-178.7	18.8	0	0	112.1	D314 T320 R321	D314-Q317 HydrophobicContact CB-CB 4.28Å; D314-Q317 HydrophobicContact CB-CG 3.9Å; D314-Q317 WeakPolarHBondContact O-CB 3.29Å; D314-Q317 PolarHBondContact O-N 3.28Å; D314-Q317 VanDerWaalsContact O-N 3.09Å; Q317-T320 PolarHBondContact O-N 3.45Å; Q317-R321 WeakPolarHBondContact O-CB 3.49Å; Q317-R321 PolarHBondContact O-N 3.28Å
318	V	89.9	Confident	92.2	Very high	19 Å²	19	68.8 Å²	68.8	12%	0.115	35%	0.347	C	S	.	.	H	α-helix	trans	-62.3	-45.4	177.1	175.5	0	0	0	0	110.8	E313 D314 A315 A316 R321 E322 H451	E313-V318 HydrophobicContact CB-CG2 3.82Å; D314-V318 WeakPolarHBondContact O-CG2 3.26Å; D314-V318 PolarHBondContact O-N 3.1Å; A315-V318 PolarHBondContact O-N 2.88Å; A316-V318 PolarHBondContact O-N 2.94Å; V318-R321 PolarHBondContact O-N 3.04Å; V318-E322 WeakPolarHBondContact O-CB 3.15Å; V318-E322 PolarHBondContact O-N 3.04Å; V318-H451 HydrophobicContact CG2-CB 4.14Å
319	Q	89.7	Confident	92	Very high	133 Å²	133	73.2 Å²	73.2	62%	0.621	37%	0.37	S	S	*	.	H	α-helix	trans	-64	-44.5	178.3	-71.4	177.3	26	0	0	112.2	A315 A316 R321 E322 H323	A315-Q319 VanDerWaalsContact O-CG 3.32Å; A315-Q319 WeakPolarHBondContact O-CG 3.35Å; A315-Q319 PolarHBondContact O-N 2.86Å; A316-Q319 PolarHBondContact O-N 3.43Å; Q319-R321 VanDerWaalsContact C-N 3.3Å; Q319-R321 PolarHBondContact O-N 3.04Å; Q319-E322 PolarHBondContact O-N 2.95Å; Q319-H323 WeakPolarHBondContact O-CB 3.36Å; Q319-H323 PolarHBondContact O-N 3.4Å
320	T	92.8	Very high	91.7	Very high	99 Å²	99	79.7 Å²	79.7	61%	0.607	39%	0.393	S	S	*	.	H	α-helix	trans	-60	-41.9	176	-55.8	0	0	0	0	111.3	A316 Q317 H323 A324	A316-T320 PolarHBondContact O-N 3.05Å; A316-T320 PolarHBondContact O-OG1 3.09Å; A316-T320 VanDerWaalsContact O-OG1 3.04Å; Q317-T320 PolarHBondContact O-N 3.45Å; T320-H323 PolarHBondContact O-N 3.31Å; T320-A324 WeakPolarHBondContact O-CB 3.43Å; T320-A324 PolarHBondContact O-N 2.86Å
321	R	91.9	Very high	91.5	Very high	127 Å²	127	87 Å²	87	48%	0.479	42%	0.42	S	S	.	.	H	α-helix	trans	-67.1	-40.8	177.9	-172.4	174.5	65.3	-156.4	-5.1	112.1	E313 Q317 V318 Q319 A324 A325	E313-R321 IonicContact OE1-NH1 2.79Å; E313-R321 IonicContact OE2-CZ 3.06Å; E313-R321 VanDerWaalsContact OE2-CZ 3.32Å; E313-R321 IonicContact OE2-NH1 3.4Å; E313-R321 PolarHBondContact OE2-NH1 2.79Å; E313-R321 IonicContact OE2-NH2 3.66Å; E313-R321 PolarHBondContact OE2-NH2 3.31Å; Q317-R321 WeakPolarHBondContact O-CB 3.49Å; Q317-R321 PolarHBondContact O-N 3.28Å; V318-R321 PolarHBondContact O-N 3.04Å; Q319-R321 VanDerWaalsContact C-N 3.3Å; Q319-R321 PolarHBondContact O-N 3.04Å; R321-A324 PolarHBondContact O-N 3.29Å; R321-A325 WeakPolarHBondContact O-CB 3.44Å; R321-A325 PolarHBondContact O-N 2.88Å
322	E	90.1	Very high	91.2	Very high	106 Å²	106	92 Å²	92	50%	0.495	44%	0.437	S	S	.	.	H	α-helix	trans	-63.7	-45.6	175	-171.2	169.7	-167.1	0	0	110.7	V318 Q319 A324 A325 D326	V318-E322 WeakPolarHBondContact O-CB 3.15Å; V318-E322 PolarHBondContact O-N 3.04Å; Q319-E322 PolarHBondContact O-N 2.95Å; E322-A324 PolarHBondContact O-N 3.31Å; E322-A325 WeakPolarHBondContact O-CB 3.32Å; E322-A325 PolarHBondContact O-N 3.25Å; E322-D326 PolarHBondContact O-N 3.4Å
323	H	93	Very high	90.9	Very high	111 Å²	111	93.8 Å²	93.8	51%	0.514	45%	0.446	S	S	.	.	H	α-helix	trans	-61.5	-44.7	176	-169.7	73.8	0	0	0	112.3	Q319 T320 A325 D326 Q327	Q319-H323 WeakPolarHBondContact O-CB 3.36Å; Q319-H323 PolarHBondContact O-N 3.4Å; T320-H323 PolarHBondContact O-N 3.31Å; H323-A325 VanDerWaalsContact C-N 3.32Å; H323-A325 PolarHBondContact O-N 3.4Å; H323-D326 PolarHBondContact O-N 2.99Å; H323-Q327 PolarHBondContact CD2-NE2 2.99Å; H323-Q327 VanDerWaalsContact CD2-NE2 3.3Å; H323-Q327 PolarHBondContact NE2-NE2 3.45Å; H323-Q327 WeakPolarHBondContact O-CG 3.34Å; H323-Q327 PolarHBondContact O-N 3.47Å
324	A	93.4	Very high	90.5	Very high	31 Å²	31	95.7 Å²	95.7	26%	0.256	46%	0.463	S	S	.	.	H	α-helix	trans	-63.7	-37.1	175.7	0	0	0	0	0	112.2	T320 R321 E322 R328	T320-A324 WeakPolarHBondContact O-CB 3.43Å; T320-A324 PolarHBondContact O-N 2.86Å; R321-A324 PolarHBondContact O-N 3.29Å; E322-A324 PolarHBondContact O-N 3.31Å; A324-R328 WeakPolarHBondContact O-CG 3.47Å; A324-R328 PolarHBondContact O-N 2.9Å; A324-R328 VanDerWaalsContact O-N 3.1Å
325	A	91.5	Very high	89.9	Confident	36 Å²	36	99 Å²	99	30%	0.298	48%	0.478	S	S	.	.	H	α-helix	trans	-65.9	-45.1	174.6	0	0	0	0	0	111.5	R321 E322 H323 Q327 R328 I329	R321-A325 WeakPolarHBondContact O-CB 3.44Å; R321-A325 PolarHBondContact O-N 2.88Å; E322-A325 WeakPolarHBondContact O-CB 3.32Å; E322-A325 PolarHBondContact O-N 3.25Å; H323-A325 VanDerWaalsContact C-N 3.32Å; H323-A325 PolarHBondContact O-N 3.4Å; A325-Q327 PolarHBondContact O-N 2.9Å; A325-R328 PolarHBondContact O-N 2.87Å; A325-I329 WeakPolarHBondContact O-CG1 3.49Å; A325-I329 PolarHBondContact O-N 3.46Å
326	D	93.1	Very high	89.2	Confident	70 Å²	70	103.1 Å²	103.1	37%	0.374	50%	0.498	S	S	.	.	H	α-helix	trans	-60.8	-42.3	176	-83	-2.4	0	0	0	112	E322 H323 R328 I329 R330	E322-D326 PolarHBondContact O-N 3.4Å; H323-D326 PolarHBondContact O-N 2.99Å; D326-R328 PolarHBondContact O-N 3.46Å; D326-I329 PolarHBondContact O-N 3.49Å; D326-R330 WeakPolarHBondContact O-CG 3.18Å; D326-R330 PolarHBondContact O-N 3.45Å
327	Q	93.5	Very high	88.5	Confident	84 Å²	84	104.6 Å²	104.6	39%	0.393	50%	0.501	S	S	.	.	H	α-helix	trans	-61.5	-42.2	174.7	-74.1	-173.3	2.9	0	0	112.1	H323 A325 R330 R331	H323-Q327 PolarHBondContact CD2-NE2 2.99Å; H323-Q327 VanDerWaalsContact CD2-NE2 3.3Å; H323-Q327 PolarHBondContact NE2-NE2 3.45Å; H323-Q327 WeakPolarHBondContact O-CG 3.34Å; H323-Q327 PolarHBondContact O-N 3.47Å; A325-Q327 PolarHBondContact O-N 2.9Å; Q327-R330 PolarHBondContact O-N 3.19Å; Q327-R331 WeakPolarHBondContact O-CG 3.33Å; Q327-R331 PolarHBondContact O-N 2.91Å
328	R	92.3	Very high	87	Confident	166 Å²	166	105.7 Å²	105.7	63%	0.626	50%	0.504	S	S	*	.	H	α-helix	trans	-64.5	-41.1	175.6	-71.6	173.8	-169.2	142.4	0.7	111.9	A324 A325 D326 R331 R332	A324-R328 WeakPolarHBondContact O-CG 3.47Å; A324-R328 PolarHBondContact O-N 2.9Å; A324-R328 VanDerWaalsContact O-N 3.1Å; A325-R328 PolarHBondContact O-N 2.87Å; D326-R328 PolarHBondContact O-N 3.46Å; R328-R331 PolarHBondContact O-N 2.96Å; R328-R332 WeakPolarHBondContact O-CB 3.41Å; R328-R332 PolarHBondContact O-N 2.88Å
329	I	89.9	Confident	85.6	Confident	94 Å²	94	110 Å²	110	48%	0.482	52%	0.523	S	S	.	.	H	α-helix	trans	-62.5	-46.4	176.3	-68.5	164.9	0	0	0	109.8	A325 D326 R331 R332 V333	A325-I329 WeakPolarHBondContact O-CG1 3.49Å; A325-I329 PolarHBondContact O-N 3.46Å; D326-I329 PolarHBondContact O-N 3.49Å; I329-R331 PolarHBondContact O-N 3.04Å; I329-R332 PolarHBondContact O-N 3.1Å; I329-V333 HydrophobicContact CG2-CG2 4.29Å; I329-V333 WeakPolarHBondContact O-CG2 3.39Å; I329-V333 PolarHBondContact O-N 2.94Å
330	R	89.9	Confident	84.2	Confident	180 Å²	180	106.8 Å²	106.8	68%	0.679	52%	0.515	S	S	*	.	H	α-helix	trans	-58.8	-45.1	176.4	-74	177.9	-173.4	-126.4	3.9	112.6	D326 Q327 R332 V333 S334	D326-R330 WeakPolarHBondContact O-CG 3.18Å; D326-R330 PolarHBondContact O-N 3.45Å; Q327-R330 PolarHBondContact O-N 3.19Å; R330-R332 VanDerWaalsContact C-N 3.33Å; R330-R332 PolarHBondContact O-N 2.92Å; R330-V333 PolarHBondContact O-N 3.45Å; R330-S334 WeakPolarHBondContact O-CB 3.31Å; R330-S334 PolarHBondContact O-N 3.26Å; R330-S334 PolarHBondContact O-OG 3.37Å
331	R	89.5	Confident	82.6	Confident	167 Å²	167	103.6 Å²	103.6	63%	0.63	50%	0.502	S	S	*	.	H	α-helix	trans	-61.7	-40.7	175.6	-73.4	-180	-177.3	159.4	3.5	112.1	Q327 R328 I329 S334 M335	Q327-R331 WeakPolarHBondContact O-CG 3.33Å; Q327-R331 PolarHBondContact O-N 2.91Å; R328-R331 PolarHBondContact O-N 2.96Å; I329-R331 PolarHBondContact O-N 3.04Å; R331-S334 WeakPolarHBondContact CA-OG 3.47Å; R331-S334 PolarHBondContact O-OG 3.07Å; R331-M335 WeakPolarHBondContact O-CB 3.35Å; R331-M335 WeakPolarHBondContact O-CG 3.47Å; R331-M335 PolarHBondContact O-N 3.35Å
332	R	87.7	Confident	80.8	Confident	177 Å²	177	103.1 Å²	103.1	67%	0.668	50%	0.503	S	S	*	.	H	α-helix	trans	-65.8	-44.8	176.7	-171.6	-175.2	-66.6	170.5	-3.2	111.4	R328 I329 R330 M335 N336	R328-R332 WeakPolarHBondContact O-CB 3.41Å; R328-R332 PolarHBondContact O-N 2.88Å; I329-R332 PolarHBondContact O-N 3.1Å; R330-R332 VanDerWaalsContact C-N 3.33Å; R330-R332 PolarHBondContact O-N 2.92Å; R332-M335 PolarHBondContact O-N 3.32Å; R332-N336 WeakPolarHBondContact O-CB 3.48Å; R332-N336 VanDerWaalsContact O-CG 3.3Å; R332-N336 PolarHBondContact O-N 3.21Å; R332-N336 PolarHBondContact O-OD1 2.95Å
333	V	85.3	Confident	79	Confident	82 Å²	82	106.3 Å²	106.3	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-63.6	-45.1	177.2	174.9	0	0	0	0	110.2	I329 R330 M335 N336 T337	I329-V333 HydrophobicContact CG2-CG2 4.29Å; I329-V333 WeakPolarHBondContact O-CG2 3.39Å; I329-V333 PolarHBondContact O-N 2.94Å; R330-V333 PolarHBondContact O-N 3.45Å; V333-M335 PolarHBondContact O-N 3.44Å; V333-N336 PolarHBondContact O-N 3.49Å; V333-T337 WeakPolarHBondContact O-CB 3.34Å; V333-T337 PolarHBondContact O-N 2.92Å; V333-T337 PolarHBondContact O-OG1 3.46Å
334	S	83.8	Confident	77.3	Confident	67 Å²	67	109 Å²	109	47%	0.469	53%	0.525	S	S	.	.	H	α-helix	trans	-63.3	-39.7	177.7	67.8	0	0	0	0	112.7	R330 R331 T337 F338	R330-S334 WeakPolarHBondContact O-CB 3.31Å; R330-S334 PolarHBondContact O-N 3.26Å; R330-S334 PolarHBondContact O-OG 3.37Å; R331-S334 WeakPolarHBondContact CA-OG 3.47Å; R331-S334 PolarHBondContact O-OG 3.07Å; S334-T337 PolarHBondContact O-N 3.15Å; S334-F338 VanDerWaalsContact O-CB 3.3Å; S334-F338 WeakPolarHBondContact O-CB 3.26Å; S334-F338 PolarHBondContact O-N 3.41Å
335	M	78.8	Confident	75.2	Confident	132 Å²	132	113.8 Å²	113.8	65%	0.65	54%	0.543	S	S	*	.	H	α-helix	trans	-66	-41.4	174.9	-71.7	-65.9	-177.4	0	0	111.6	R331 R332 V333 F338 H339	R331-M335 WeakPolarHBondContact O-CB 3.35Å; R331-M335 WeakPolarHBondContact O-CG 3.47Å; R331-M335 PolarHBondContact O-N 3.35Å; R332-M335 PolarHBondContact O-N 3.32Å; V333-M335 PolarHBondContact O-N 3.44Å; M335-F338 PolarHBondContact O-N 3.33Å; M335-H339 WeakPolarHBondContact O-CB 3.38Å; M335-H339 PolarHBondContact O-N 3.38Å
336	N	75.9	Confident	73.6	Confident	104 Å²	104	120.5 Å²	120.5	56%	0.556	57%	0.569	S	S	*	*	H	α-helix	trans	-67.8	-39.1	176.8	-74.2	9.8	0	0	0	112.1	R332 V333 H339 S340	R332-N336 WeakPolarHBondContact O-CB 3.48Å; R332-N336 VanDerWaalsContact O-CG 3.3Å; R332-N336 PolarHBondContact O-N 3.21Å; R332-N336 PolarHBondContact O-OD1 2.95Å; V333-N336 PolarHBondContact O-N 3.49Å; N336-H339 PolarHBondContact O-N 2.94Å; N336-S340 PolarHBondContact O-N 2.99Å; N336-S340 PolarHBondContact O-OG 3.4Å
337	T	73.9	Confident	71.7	Confident	85 Å²	85	122.2 Å²	122.2	52%	0.521	58%	0.584	S	S	.	*	H	α-helix	trans	-67.7	-36.7	174.8	-55.9	0	0	0	0	111.6	V333 S334 S340 G341	V333-T337 WeakPolarHBondContact O-CB 3.34Å; V333-T337 PolarHBondContact O-N 2.92Å; V333-T337 PolarHBondContact O-OG1 3.46Å; S334-T337 PolarHBondContact O-N 3.15Å; T337-S340 WeakPolarHBondContact CA-OG 3.49Å; T337-S340 PolarHBondContact O-OG 3.47Å; T337-S340 VanDerWaalsContact O-OG 3.04Å; T337-G341 PolarHBondContact O-N 3.18Å
338	F	61.7	Low	70.1	Confident	150 Å²	150	125.2 Å²	125.2	66%	0.658	61%	0.607	S	S	*	*	H	α-helix	trans	-65.8	-40.8	173	-172.1	-95.7	0	0	0	111.2	S334 M335 G341 F342	S334-F338 VanDerWaalsContact O-CB 3.3Å; S334-F338 WeakPolarHBondContact O-CB 3.26Å; S334-F338 PolarHBondContact O-N 3.41Å; M335-F338 PolarHBondContact O-N 3.33Å; F338-G341 PolarHBondContact O-N 3.36Å; F338-F342 WeakPolarHBondContact O-CB 3.32Å; F338-F342 PolarHBondContact O-N 2.91Å
339	H	60.1	Low	68.1	Low	108 Å²	108	122.8 Å²	122.8	50%	0.5	61%	0.611	S	S	.	*	H	α-helix	trans	-68.9	-40.5	177.8	-143.4	54.8	0	0	0	112.1	M335 N336 F342 Y343	M335-H339 WeakPolarHBondContact O-CB 3.38Å; M335-H339 PolarHBondContact O-N 3.38Å; N336-H339 PolarHBondContact O-N 2.94Å; H339-F342 PolarHBondContact O-N 3.42Å; H339-Y343 AromaticContact CD2-CE2 3.76Å; H339-Y343 AromaticContact CE1-CE2 3.98Å; H339-Y343 AromaticContact NE2-CE2 3.63Å; H339-Y343 WeakPolarHBondContact O-CD2 3.42Å; H339-Y343 PolarHBondContact O-N 2.94Å
340	S	59.9	Low	66.1	Low	67 Å²	67	124.8 Å²	124.8	47%	0.469	62%	0.623	S	S	.	*	H	α-helix	trans	-66.2	-39.7	175.2	63.3	0	0	0	0	112.3	N336 T337 F342	N336-S340 PolarHBondContact O-N 2.99Å; N336-S340 PolarHBondContact O-OG 3.4Å; T337-S340 WeakPolarHBondContact CA-OG 3.49Å; T337-S340 PolarHBondContact O-OG 3.47Å; T337-S340 VanDerWaalsContact O-OG 3.04Å; S340-F342 VanDerWaalsContact C-N 3.28Å; S340-F342 PolarHBondContact O-N 3.46Å
341	G	59	Low	63.9	Low	31 Å²	31	124.5 Å²	124.5	32%	0.32	63%	0.633	S	S	.	*	H	α-helix	trans	-70.8	-21.5	175.7	0	0	0	0	0	113.9	T337 F338	T337-G341 PolarHBondContact O-N 3.18Å; F338-G341 PolarHBondContact O-N 3.36Å
342	F	53.7	Low	62.1	Low	117 Å²	117	123.2 Å²	123.2	51%	0.513	64%	0.637	S	S	.	*	H	α-helix	trans	-73.4	-36.9	176.7	-172.8	-97.2	0	0	0	112.5	F338 H339 S340 E344 M345	F338-F342 WeakPolarHBondContact O-CB 3.32Å; F338-F342 PolarHBondContact O-N 2.91Å; H339-F342 PolarHBondContact O-N 3.42Å; S340-F342 VanDerWaalsContact C-N 3.28Å; S340-F342 PolarHBondContact O-N 3.46Å; F342-E344 VanDerWaalsContact C-N 3.32Å; F342-M345 HydrophobicContact CD2-CE 3.91Å
343	Y	52.8	Low	59.8	Low	173 Å²	173	124.6 Å²	124.6	68%	0.678	65%	0.648	S	S	*	*	H	α-helix	trans	-79.4	-12.7	177.1	-71	-74.8	0	0	0	113.9	H339	H339-Y343 AromaticContact CD2-CE2 3.76Å; H339-Y343 AromaticContact CE1-CE2 3.98Å; H339-Y343 AromaticContact NE2-CE2 3.63Å; H339-Y343 WeakPolarHBondContact O-CD2 3.42Å; H339-Y343 PolarHBondContact O-N 2.94Å
344	E	56.8	Low	58	Low	168 Å²	168	126.1 Å²	126.1	79%	0.785	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-4.3	174.4	-98.1	175.5	164.9	0	0	113.7	F342 E346	F342-E344 VanDerWaalsContact C-N 3.32Å; E344-E346 PolarHBondContact O-N 2.9Å; E344-E346 VanDerWaalsContact O-N 3.13Å
345	M	50.8	Low	55.9	Low	131 Å²	131	132.3 Å²	132.3	65%	0.645	68%	0.681	S	S	*	*			trans	-80.5	92.5	173.1	-79.9	-173.9	-74.8	0	0	110.4	F342	F342-M345 HydrophobicContact CD2-CE 3.91Å
346	E	56.3	Low	54.2	Low	177 Å²	177	134.7 Å²	134.7	83%	0.827	69%	0.69	S	S	*	*			trans	-61.4	136.4	162	-88.7	-174.1	152.4	0	0	110	E344 V348	E344-E346 PolarHBondContact O-N 2.9Å; E344-E346 VanDerWaalsContact O-N 3.13Å; E346-V348 PolarHBondContact O-N 3.39Å
347	P	54.6	Low	52.6	Low	107 Å²	107	138.4 Å²	138.4	70%	0.695	70%	0.701	S	S	*	*			trans	-63.9	124.5	175	26.8	-32.2	0	0	0	109.1	T349	P347-T349 VanDerWaalsContact C-N 3.29Å; P347-T349 PolarHBondContact O-N 3.49Å
348	V	59.3	Low	50.9	Low	146 Å²	146	145.8 Å²	145.8	89%	0.885	72%	0.719	S	S	*	*			trans	-67.2	90.3	173.9	-176.7	0	0	0	0	108.7	E346	E346-V348 PolarHBondContact O-N 3.39Å
349	T	49.6	Very low	49.9	Very low	115 Å²	115	145 Å²	145	71%	0.706	72%	0.722	S	S	*	*			trans	-96	94.9	162.5	55.8	0	0	0	0	107	P347	P347-T349 VanDerWaalsContact C-N 3.29Å; P347-T349 PolarHBondContact O-N 3.49Å
350	D	49.1	Very low	49.3	Very low	136 Å²	136	146 Å²	146	73%	0.727	74%	0.736	S	S	*	*			trans	-171.3	103.4	142.7	-91.6	-24.3	0	0	0	110.7	I352	D350-I352 VanDerWaalsContact C-N 3.33Å; D350-I352 PolarHBondContact O-N 2.89Å
351	I	43.8	Very low	48.4	Very low	175 Å²	175	153.6 Å²	153.6	90%	0.897	76%	0.756	S	S	*	*			trans	-79.9	82.5	168.3	-60.5	168.6	0	0	0	106.4
352	I	50.4	Low	47.6	Very low	139 Å²	139	157 Å²	157	71%	0.713	78%	0.781	S	S	*	*			trans	-131.6	107	166	-56.2	-178.9	0	0	0	110.2	D350 S354	D350-I352 VanDerWaalsContact C-N 3.33Å; D350-I352 PolarHBondContact O-N 2.89Å; I352-S354 PolarHBondContact O-N 3.16Å
353	K	41	Very low	47.1	Very low	206 Å²	206	162.7 Å²	162.7	90%	0.896	80%	0.799	S	S	*	*			trans	-24.5	106.9	164.2	-63.7	166	179.2	172.8	0	113.1
354	S	46.2	Very low	46.4	Very low	114 Å²	114	162.8 Å²	162.8	80%	0.797	81%	0.81	S	S	*	*			trans	-134.2	111.3	149.7	69.4	0	0	0	0	110.2	I352 H356	I352-S354 PolarHBondContact O-N 3.16Å; S354-H356 PolarHBondContact O-N 3.18Å
355	K	40	Very low	45.4	Very low	197 Å²	197	159.5 Å²	159.5	86%	0.857	81%	0.806	S	S	*	*			trans	-61.4	116.7	161.7	-75.3	171	172.4	175.1	0	106.4
356	H	44.2	Very low	44.9	Very low	183 Å²	183	161.1 Å²	161.1	85%	0.847	82%	0.816	S	S	*	*			trans	176.3	140.2	132.1	-103.5	-80.7	0	0	0	110.6	S354	S354-H356 PolarHBondContact O-N 3.18Å
357	K	42.3	Very low	44	Very low	181 Å²	181	160.8 Å²	160.8	79%	0.787	81%	0.812	S	S	*	*			trans	79.9	99.4	157.6	-130.6	169.7	-178.3	-179	0	116.9	D359	K357-D359 PolarHBondContact O-N 3.21Å
358	R	36.8	Very low	43.1	Very low	240 Å²	240	161.9 Å²	161.9	91%	0.906	81%	0.812	S	S	*	*			trans	-40.1	118.6	151.5	-63.6	169.9	-173.5	152.2	1.1	108.7
359	D	42.2	Very low	42.1	Very low	134 Å²	134	163 Å²	163	72%	0.717	81%	0.813	S	S	*	*			trans	-150.4	107.4	149.7	-82.2	-39.1	0	0	0	108	K357	K357-D359 PolarHBondContact O-N 3.21Å
360	T	46	Very low	41.6	Very low	130 Å²	130	162.4 Å²	162.4	80%	0.798	81%	0.814	S	S	*	*			trans	9.2	110.4	161	49.7	0	0	0	0	118.3	A362	T360-A362 PolarHBondContact O-N 3Å
361	Y	41.2	Very low	41	Very low	226 Å²	226	163.4 Å²	163.4	89%	0.886	82%	0.818	S	S	*	*			trans	-53	109.3	155.2	-60.2	-84.4	0	0	0	109.5	R363	Y361-R363 PolarHBondContact O-N 2.84Å
362	A	42.7	Very low	40.7	Very low	101 Å²	101	163.2 Å²	163.2	84%	0.835	81%	0.813	S	S	*	*			trans	-67.2	83.8	166.2	0	0	0	0	0	108.4	T360 L364	T360-A362 PolarHBondContact O-N 3Å; A362-L364 PolarHBondContact O-N 2.92Å
363	R	43	Very low	40	Very low	237 Å²	237	163 Å²	163	89%	0.894	81%	0.808	S	S	*	*			trans	-56	118	161.9	-100.4	-173.8	161	148.3	-2.9	107.3	Y361 S365	Y361-R363 PolarHBondContact O-N 2.84Å; R363-S365 VanDerWaalsContact C-N 3.28Å; R363-S365 PolarHBondContact O-N 2.99Å
364	L	38.3	Very low	40.1	Very low	176 Å²	176	159.7 Å²	159.7	92%	0.921	80%	0.799	S	S	*	*			trans	-53.4	92.6	164.8	-78.8	149.1	0	0	0	108.9	A362	A362-L364 PolarHBondContact O-N 2.92Å
365	S	36.6	Very low	40	Very low	99 Å²	99	161.8 Å²	161.8	69%	0.692	80%	0.802	S	S	*	*			trans	-88	106.2	173.9	-175.7	0	0	0	0	108.5	R363 K367	R363-S365 VanDerWaalsContact C-N 3.28Å; R363-S365 PolarHBondContact O-N 2.99Å; S365-K367 VanDerWaalsContact C-N 3.33Å; S365-K367 PolarHBondContact O-N 2.89Å
366	L	40	Very low	40.1	Very low	165 Å²	165	155.4 Å²	155.4	86%	0.864	78%	0.782	S	S	*	*			trans	-61.7	96.1	154.9	-95.3	72.6	0	0	0	107.3
367	K	37.6	Very low	39.8	Very low	170 Å²	170	153.9 Å²	153.9	74%	0.739	77%	0.77	S	S	*	*			trans	-163.4	131.7	154.9	-114.8	170.6	175.4	-179	0	112.7	S365	S365-K367 VanDerWaalsContact C-N 3.33Å; S365-K367 PolarHBondContact O-N 2.89Å
368	D	35.1	Very low	40	Very low	129 Å²	129	154.7 Å²	154.7	69%	0.69	77%	0.768	S	S	*	*			trans	63.2	103.4	149.8	-52.9	-28.9	0	0	0	118.3
369	N	38.8	Very low	40.3	Very low	169 Å²	169	151.9 Å²	151.9	90%	0.904	76%	0.762	S	S	*	*			trans	-112	94.9	148.3	-98.8	-14.8	0	0	0	108.9
370	S	37.3	Very low	40.3	Very low	104 Å²	104	152.1 Å²	152.1	73%	0.727	76%	0.763	S	S	*	*			trans	-51.1	144.8	156.1	49.9	0	0	0	0	110.9
371	I	37.4	Very low	40.3	Very low	157 Å²	157	153.9 Å²	153.9	81%	0.805	76%	0.762	S	S	*	*	S	Bend	trans	-52.5	138	172	-61.5	154.4	0	0	0	108.6
372	Q	37	Very low	40.3	Very low	171 Å²	171	147.4 Å²	147.4	80%	0.799	76%	0.755	S	S	*	*			trans	113.1	67.5	170.5	-61.3	170.6	-2.1	0	0	115.6
373	H	36.2	Very low	40.3	Very low	133 Å²	133	153 Å²	153	62%	0.616	76%	0.755	S	S	*	*			trans	-166.2	26.1	145.3	-122.6	-86.3	0	0	0	116.1	N375 Y377	H373-N375 PolarHBondContact O-N 3.2Å; H373-Y377 HydrophobicContact CB-CE2 4.24Å; H373-Y377 WeakPolarHBondContact O-CE2 3.5Å
374	I	42.9	Very low	40.2	Very low	138 Å²	138	148.7 Å²	148.7	71%	0.708	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-1.4	-167.3	-69.6	170.5	0	0	0	115.4
375	N	44.3	Very low	40.3	Very low	158 Å²	158	148 Å²	148	85%	0.845	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-12.4	-169.3	-75.8	-18.7	0	0	0	117	H373	H373-N375 PolarHBondContact O-N 3.2Å
376	S	42.5	Very low	40	Very low	63 Å²	63	146.2 Å²	146.2	44%	0.441	74%	0.743	S	S	.	*	S	Bend	trans	-98.1	-21.2	-175.4	45.5	0	0	0	0	115.1
377	Y	38.7	Very low	39.7	Very low	151 Å²	151	146.5 Å²	146.5	59%	0.592	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-89.6	-7.4	-171.6	-44.2	-73.1	0	0	0	114.9	H373 K379	H373-Y377 HydrophobicContact CB-CE2 4.24Å; H373-Y377 WeakPolarHBondContact O-CE2 3.5Å; Y377-K379 VanDerWaalsContact C-N 3.32Å; Y377-K379 PolarHBondContact O-N 2.85Å
378	R	45.2	Very low	39.5	Very low	197 Å²	197	141.6 Å²	141.6	74%	0.743	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-74.2	-14	-178.1	-101.8	-176.2	-168.9	176.9	3.8	114.9
379	K	44.2	Very low	39.3	Very low	182 Å²	182	143.3 Å²	143.3	79%	0.791	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-98.7	-11.5	-174.1	-94.8	-179.9	176.5	177.2	0	115.4	Y377	Y377-K379 VanDerWaalsContact C-N 3.32Å; Y377-K379 PolarHBondContact O-N 2.85Å
380	L	41.4	Very low	39.2	Very low	139 Å²	139	144.3 Å²	144.3	73%	0.728	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	-19	-171.9	-67.8	172	0	0	0	114.9
381	Q	45.1	Very low	38.9	Very low	166 Å²	166	145.8 Å²	145.8	78%	0.776	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-8	177.9	-72.9	-178.9	-7.4	0	0	114.5
382	A	42	Very low	38.8	Very low	90 Å²	90	144.3 Å²	144.3	74%	0.744	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-1.2	-178.8	0	0	0	0	0	114.4
383	R	42.7	Very low	38.7	Very low	219 Å²	219	145.2 Å²	145.2	83%	0.826	73%	0.728	S	S	*	*	S	Bend	trans	-105	-11.5	-176.5	-87.2	-178.4	170.2	155	-4.3	115.8
384	N	40.6	Very low	38.5	Very low	146 Å²	146	144.7 Å²	144.7	78%	0.781	73%	0.734	S	S	*	*	S	Bend	trans	-117.5	18.7	-174.8	-78.7	-5.4	0	0	0	115.5
385	L	39.9	Very low	37.9	Very low	162 Å²	162	143.4 Å²	143.4	85%	0.848	74%	0.738	S	S	*	*			trans	-113.4	54.2	169.1	-74.4	159.9	0	0	0	109.9
386	G	30.4	Very low	37.3	Very low	61 Å²	61	146.4 Å²	146.4	63%	0.629	74%	0.737	S	S	*	*	S	Bend	trans	-107	128.6	159.1	0	0	0	0	0	106.9
387	N	33.9	Very low	36.9	Very low	172 Å²	172	149 Å²	149	92%	0.92	75%	0.75	S	S	*	*			trans	68.5	79.7	179.5	-62.9	-1	0	0	0	116
388	S	34.3	Very low	36.8	Very low	67 Å²	67	149.6 Å²	149.6	47%	0.469	76%	0.764	S	S	.	*			trans	-147.5	134.2	135.4	73.9	0	0	0	0	112.5	Y390	S388-Y390 WeakPolarHBondContact CB-OH 3.38Å; S388-Y390 WeakPolarHBondContact OG-CE2 3.16Å; S388-Y390 PolarHBondContact OG-OH 3.3Å
389	H	31.3	Very low	36.1	Very low	165 Å²	165	147.9 Å²	147.9	76%	0.764	77%	0.768	S	S	*	*			trans	-99.1	101	-167.5	168.9	-75.5	0	0	0	107.3
390	Y	35.2	Very low	35.8	Very low	189 Å²	189	148.7 Å²	148.7	74%	0.741	77%	0.771	S	S	*	*			trans	-140.1	104.8	166.7	-18.3	-79	0	0	0	109.9	S388 T392	S388-Y390 WeakPolarHBondContact CB-OH 3.38Å; S388-Y390 WeakPolarHBondContact OG-CE2 3.16Å; S388-Y390 PolarHBondContact OG-OH 3.3Å; Y390-T392 PolarHBondContact O-N 3.25Å
391	D	32	Very low	35.7	Very low	135 Å²	135	147.1 Å²	147.1	72%	0.722	77%	0.772	S	S	*	*			trans	-60.7	122.7	163.9	-93.4	-48.8	0	0	0	110
392	T	35.1	Very low	35.2	Very low	127 Å²	127	144.5 Å²	144.5	78%	0.779	77%	0.772	S	S	*	*			trans	-144	83.6	157.9	27.1	0	0	0	0	108.8	Y390	Y390-T392 PolarHBondContact O-N 3.25Å
393	K	35.3	Very low	35	Very low	189 Å²	189	149.4 Å²	149.4	82%	0.822	78%	0.779	S	S	*	*			trans	-85.7	99.8	160.4	-81.4	-179.1	-179.9	172.2	0	108.4
394	T	32	Very low	34.7	Very low	123 Å²	123	144.3 Å²	144.3	76%	0.755	78%	0.775	S	S	*	*			trans	-88.3	95.4	160	38.1	0	0	0	0	108.6
395	S	30.8	Very low	34.5	Very low	111 Å²	111	142.5 Å²	142.5	78%	0.776	77%	0.774	S	S	*	*			trans	-103.7	108.9	159.9	65.6	0	0	0	0	108.6
396	W	30.7	Very low	34.3	Very low	221 Å²	221	140.5 Å²	140.5	84%	0.837	77%	0.768	S	S	*	*			trans	-78.7	156.4	166.2	-81	87.6	0	0	0	110.7
397	T	34.9	Very low	34.5	Very low	117 Å²	117	142.3 Å²	142.3	72%	0.718	77%	0.771	S	S	*	*			trans	86.7	93.3	165.5	78.7	0	0	0	0	118.2
398	N	35.5	Very low	34.6	Very low	163 Å²	163	139.6 Å²	139.6	87%	0.872	76%	0.761	S	S	*	*				-161.2	111	105.7	-97.6	-31.8	0	0	0	110.5
399	I	31.1	Very low	34.8	Very low	161 Å²	161	143.3 Å²	143.3	83%	0.826	78%	0.775	S	S	*	*			trans	-84.9	118.3	168.7	-64.9	168	0	0	0	106.1
400	K	37.6	Very low	35.1	Very low	200 Å²	200	140.1 Å²	140.1	87%	0.87	77%	0.771	S	S	*	*			trans	-148.5	100.1	156.5	-126.5	179.9	-177.2	-174	0	110.4
401	S	38.3	Very low	35.3	Very low	105 Å²	105	136.8 Å²	136.8	73%	0.734	78%	0.775	S	S	*	*			trans	17.7	117.9	142.8	-31.9	0	0	0	0	119.5
402	S	36.4	Very low	35.4	Very low	112 Å²	112	136.5 Å²	136.5	78%	0.783	78%	0.779	S	S	*	*			trans	-16.7	136.5	149.2	51.4	0	0	0	0	120.2
403	E	37.5	Very low	35.6	Very low	192 Å²	192	137.9 Å²	137.9	90%	0.897	78%	0.78	S	S	*	*				-162.1	146.3	122.8	-113	173.8	-175.6	0	0	111.4
404	P	35.8	Very low	35.6	Very low	113 Å²	113	134.1 Å²	134.1	73%	0.734	78%	0.777	S	S	*	*			trans	-115.5	168	-165.4	39.4	-26.7	0	0	0	116.2
405	S	36.4	Very low	35.9	Very low	108 Å²	108	133.9 Å²	133.9	76%	0.755	78%	0.78	S	S	*	*			trans	80.9	140.7	164.3	82	0	0	0	0	115.6
406	T	36.2	Very low	36.5	Very low	120 Å²	120	133.9 Å²	133.9	74%	0.736	78%	0.781	S	S	*	*			cis	-164	146.9	24.3	8.1	0	0	0	0	109.6
407	S	34.6	Very low	37.2	Very low	98 Å²	98	127.9 Å²	127.9	69%	0.685	77%	0.773	S	S	*	*			trans	35	132.9	146.6	61.2	0	0	0	0	119.6
408	T	35.8	Very low	37.8	Very low	115 Å²	115	126.8 Å²	126.8	71%	0.706	77%	0.769	S	S	*	*			cis	177	154.2	46.2	-12.7	0	0	0	0	110.4
409	L	39.1	Very low	38.6	Very low	146 Å²	146	122.9 Å²	122.9	76%	0.764	76%	0.755	S	S	*	*			trans	78.8	101.2	145.4	-78.1	144.1	0	0	0	121.8
410	S	35.9	Very low	39.4	Very low	98 Å²	98	118.9 Å²	118.9	69%	0.685	74%	0.741	S	S	*	*				60.5	107.2	124.8	59.6	0	0	0	0	120.8
411	S	40	Very low	40	Very low	118 Å²	118	115 Å²	115	83%	0.825	73%	0.729	S	S	*	*				-167.3	119.2	114	31.6	0	0	0	0	110.5
412	T	33.8	Very low	40.7	Very low	130 Å²	130	116 Å²	116	80%	0.798	72%	0.722	S	S	*	*			trans	-52.1	139	162.1	18.6	0	0	0	0	110.9
413	I	40.5	Very low	41.6	Very low	156 Å²	156	116.8 Å²	116.8	80%	0.8	72%	0.717	S	S	*	*			trans	161.9	120.8	130.6	-77.7	152.3	0	0	0	109.8
414	S	35.6	Very low	42.9	Very low	109 Å²	109	112.3 Å²	112.3	76%	0.762	70%	0.699	S	S	*	*			trans	61.4	90.6	160.5	62.7	0	0	0	0	120.2
415	S	36.5	Very low	44.6	Very low	118 Å²	118	110.1 Å²	110.1	83%	0.825	68%	0.684	S	S	*	*			trans	-151.1	74.7	154.7	51.9	0	0	0	0	111.8
416	S	43.6	Very low	46.5	Very low	112 Å²	112	108.9 Å²	108.9	78%	0.783	67%	0.669	S	S	*	*			trans	-132.8	11.9	176.7	55.9	0	0	0	0	115.1
417	S	45.1	Very low	48.8	Very low	95 Å²	95	105.7 Å²	105.7	66%	0.664	65%	0.651	S	S	*	*	S	Bend	trans	-107.8	0.7	-176.1	53.2	0	0	0	0	115.9
418	S	49.2	Very low	51.2	Low	93 Å²	93	106.9 Å²	106.9	65%	0.65	64%	0.644	S	S	*	*	S	Bend	trans	-91.4	-15.6	-174.6	58.5	0	0	0	0	115.1
419	S	50.6	Low	53.5	Low	82 Å²	82	104.3 Å²	104.3	57%	0.573	63%	0.626	S	S	*	*	H	α-helix	trans	-78.5	-37.1	-174.9	55.5	0	0	0	0	113.5	H422 L423	S419-H422 PolarHBondContact O-N 2.87Å; S419-L423 WeakPolarHBondContact O-CD1 3.36Å
420	S	49.3	Very low	55.9	Low	77 Å²	77	100.2 Å²	100.2	54%	0.538	60%	0.603	S	S	.	*	H	α-helix	trans	-70.2	-35.4	-178.3	71.5	0	0	0	0	113	H422 L423	S420-H422 VanDerWaalsContact C-N 3.26Å; S420-H422 PolarHBondContact O-N 3.34Å; S420-L423 PolarHBondContact O-N 2.89Å
421	L	50.8	Low	58.4	Low	118 Å²	118	103.9 Å²	103.9	62%	0.618	60%	0.602	S	S	*	*	H	α-helix	trans	-66.7	-27.3	178.2	-65.8	175.3	0	0	0	112.5	T425	L421-T425 VanDerWaalsContact O-CG2 3.26Å; L421-T425 WeakPolarHBondContact O-CG2 3.43Å; L421-T425 PolarHBondContact O-N 2.98Å; L421-T425 PolarHBondContact O-OG1 3.11Å
422	H	52.5	Low	60.6	Low	125 Å²	125	104.9 Å²	104.9	58%	0.579	59%	0.588	S	S	*	*	H	α-helix	trans	-79.6	-25.6	-177.5	-158.8	-109.5	0	0	0	113.3	S419 S420 T425 N426	S419-H422 PolarHBondContact O-N 2.87Å; S420-H422 VanDerWaalsContact C-N 3.26Å; S420-H422 PolarHBondContact O-N 3.34Å; H422-T425 WeakPolarHBondContact CA-OG1 3.4Å; H422-T425 PolarHBondContact O-OG1 3.47Å; H422-T425 VanDerWaalsContact O-OG1 3.07Å; H422-N426 PolarHBondContact O-ND2 3.11Å
423	L	55.8	Low	63.3	Low	129 Å²	129	106 Å²	106	68%	0.675	58%	0.577	S	S	*	*	H	α-helix	trans	-75.9	-40	173.9	-81.2	102.9	0	0	0	112.1	S419 S420 N426 S427	S419-L423 WeakPolarHBondContact O-CD1 3.36Å; S420-L423 PolarHBondContact O-N 2.89Å; L423-N426 PolarHBondContact O-N 3.05Å; L423-S427 PolarHBondContact O-N 2.64Å; L423-S427 VanDerWaalsContact O-N 3.15Å
424	D	64.1	Low	65.7	Low	98 Å²	98	104.9 Å²	104.9	52%	0.524	56%	0.563	S	S	.	*	H	α-helix	trans	-67.7	-37.5	-178.9	-92.5	-6.7	0	0	0	113.3	S427 K428	D424-S427 PolarHBondContact O-N 2.89Å; D424-K428 WeakPolarHBondContact O-CG 3.42Å; D424-K428 PolarHBondContact O-N 3.02Å; D424-K428 VanDerWaalsContact O-N 3.08Å
425	T	72.2	Confident	68.3	Low	68 Å²	68	106.9 Å²	106.9	42%	0.417	55%	0.554	S	S	.	*	H	α-helix	trans	-64	-46.8	176.3	47.6	0	0	0	0	111.2	L421 H422 S427 K428 D429	L421-T425 VanDerWaalsContact O-CG2 3.26Å; L421-T425 WeakPolarHBondContact O-CG2 3.43Å; L421-T425 PolarHBondContact O-N 2.98Å; L421-T425 PolarHBondContact O-OG1 3.11Å; H422-T425 WeakPolarHBondContact CA-OG1 3.4Å; H422-T425 PolarHBondContact O-OG1 3.47Å; H422-T425 VanDerWaalsContact O-OG1 3.07Å; T425-S427 VanDerWaalsContact C-N 3.34Å; T425-S427 PolarHBondContact O-N 3.07Å; T425-K428 PolarHBondContact O-N 3.25Å; T425-D429 WeakPolarHBondContact O-CB 3.19Å; T425-D429 PolarHBondContact O-N 2.88Å
426	N	76	Confident	71	Confident	82 Å²	82	102 Å²	102	44%	0.439	52%	0.521	S	S	.	.	H	α-helix	trans	-60.2	-40.4	177.1	-79.3	-49.3	0	0	0	112.7	H422 L423 E430	H422-N426 PolarHBondContact O-ND2 3.11Å; L423-N426 PolarHBondContact O-N 3.05Å; N426-E430 WeakPolarHBondContact O-CB 3.1Å; N426-E430 PolarHBondContact O-N 3.03Å
427	S	84.2	Confident	73.3	Confident	52 Å²	52	104.9 Å²	104.9	36%	0.364	51%	0.514	S	S	.	.	H	α-helix	trans	-65.5	-44	176.8	-178.1	0	0	0	0	112.4	L423 D424 T425 E430 R431	L423-S427 PolarHBondContact O-N 2.64Å; L423-S427 VanDerWaalsContact O-N 3.15Å; D424-S427 PolarHBondContact O-N 2.89Å; T425-S427 VanDerWaalsContact C-N 3.34Å; T425-S427 PolarHBondContact O-N 3.07Å; S427-E430 PolarHBondContact O-N 3.35Å; S427-R431 VanDerWaalsContact O-CG 3.31Å; S427-R431 WeakPolarHBondContact O-CG 3.44Å; S427-R431 PolarHBondContact O-N 2.86Å
428	K	84.5	Confident	75.6	Confident	123 Å²	123	109 Å²	109	54%	0.535	52%	0.515	S	S	.	.	H	α-helix	trans	-63.5	-42.8	176.6	-74.6	173.2	-179	169.4	0	111.5	D424 T425 R431 R432	D424-K428 WeakPolarHBondContact O-CG 3.42Å; D424-K428 PolarHBondContact O-N 3.02Å; D424-K428 VanDerWaalsContact O-N 3.08Å; T425-K428 PolarHBondContact O-N 3.25Å; K428-R431 PolarHBondContact O-N 3.42Å; K428-R432 WeakPolarHBondContact O-CG 3.47Å; K428-R432 PolarHBondContact O-N 3.31Å
429	D	85.2	Confident	77.7	Confident	62 Å²	62	105.5 Å²	105.5	33%	0.332	49%	0.489	S	S	.	.	H	α-helix	trans	-68.3	-38.5	179.3	-74.5	-20.4	0	0	0	112.4	T425 R432 R433	T425-D429 WeakPolarHBondContact O-CB 3.19Å; T425-D429 PolarHBondContact O-N 2.88Å; D429-R432 WeakPolarHBondContact O-CB 3.25Å; D429-R432 PolarHBondContact O-N 3.48Å; D429-R432 IonicContact OD1-NH1 2.65Å; D429-R432 PolarHBondContact OD1-NH1 3.46Å; D429-R433 VanDerWaalsContact O-CG 3.31Å; D429-R433 WeakPolarHBondContact O-CG 3.44Å; D429-R433 PolarHBondContact O-N 3.1Å
430	E	87.7	Confident	79.7	Confident	60 Å²	60	103 Å²	103	28%	0.28	47%	0.469	S	S	.	.	H	α-helix	trans	-64.1	-41.5	173.6	-179.7	55.4	-157.9	0	0	111.8	N426 S427 R432 R433 R434	N426-E430 WeakPolarHBondContact O-CB 3.1Å; N426-E430 PolarHBondContact O-N 3.03Å; S427-E430 PolarHBondContact O-N 3.35Å; E430-R432 VanDerWaalsContact C-N 3.34Å; E430-R432 PolarHBondContact O-N 3.12Å; E430-R433 PolarHBondContact O-N 2.96Å; E430-R434 WeakPolarHBondContact O-CG 3.36Å; E430-R434 PolarHBondContact O-N 3.18Å; E430-R434 IonicContact OE1-CZ 3.34Å; E430-R434 IonicContact OE1-NE 3.98Å; E430-R434 PolarHBondContact OE1-NE 3.42Å; E430-R434 IonicContact OE1-NH2 3.11Å; E430-R434 PolarHBondContact OE1-NH2 3.35Å; E430-R434 VanDerWaalsContact OE1-NH2 3.11Å
431	R	88.9	Confident	81.7	Confident	174 Å²	174	106.7 Å²	106.7	66%	0.657	48%	0.476	S	S	*	.	H	α-helix	trans	-60.2	-42.1	172.8	-71.8	173.7	-172.5	-169.7	1.8	111.8	S427 K428 R434 R435	S427-R431 VanDerWaalsContact O-CG 3.31Å; S427-R431 WeakPolarHBondContact O-CG 3.44Å; S427-R431 PolarHBondContact O-N 2.86Å; K428-R431 PolarHBondContact O-N 3.42Å; R431-R434 PolarHBondContact O-N 3.04Å; R431-R435 PolarHBondContact O-N 3.46Å
432	R	87.8	Confident	83.7	Confident	140 Å²	140	110.3 Å²	110.3	53%	0.528	48%	0.481	S	S	.	.	H	α-helix	trans	-62.2	-47.3	175.5	-73	172	179	176.3	-6.1	111.3	K428 D429 E430 R434 R435 A436	K428-R432 WeakPolarHBondContact O-CG 3.47Å; K428-R432 PolarHBondContact O-N 3.31Å; D429-R432 WeakPolarHBondContact O-CB 3.25Å; D429-R432 PolarHBondContact O-N 3.48Å; D429-R432 IonicContact OD1-NH1 2.65Å; D429-R432 PolarHBondContact OD1-NH1 3.46Å; E430-R432 VanDerWaalsContact C-N 3.34Å; E430-R432 PolarHBondContact O-N 3.12Å; R432-R434 PolarHBondContact O-N 2.96Å; R432-R435 WeakPolarHBondContact O-CB 3.34Å; R432-R435 PolarHBondContact O-N 3.31Å; R432-A436 WeakPolarHBondContact O-CB 3.36Å; R432-A436 PolarHBondContact O-N 2.98Å
433	R	88.8	Confident	85.6	Confident	154 Å²	154	104.8 Å²	104.8	58%	0.581	46%	0.456	S	S	*	.	H	α-helix	trans	-59.2	-43.2	177.1	-72.2	173.6	-172.7	-175.8	4.2	112.1	D429 E430 A436 R437	D429-R433 VanDerWaalsContact O-CG 3.31Å; D429-R433 WeakPolarHBondContact O-CG 3.44Å; D429-R433 PolarHBondContact O-N 3.1Å; E430-R433 PolarHBondContact O-N 2.96Å; R433-A436 PolarHBondContact O-N 3.34Å; R433-R437 WeakPolarHBondContact O-CG 3.46Å; R433-R437 PolarHBondContact O-N 2.79Å
434	R	90.8	Very high	87.3	Confident	132 Å²	132	100 Å²	100	50%	0.498	43%	0.433	S	S	.	.	H	α-helix	trans	-63	-42.7	175.5	-70.2	175.3	-169.6	170.9	3.1	112.1	E430 R431 R432 R437 R438	E430-R434 WeakPolarHBondContact O-CG 3.36Å; E430-R434 PolarHBondContact O-N 3.18Å; E430-R434 IonicContact OE1-CZ 3.34Å; E430-R434 IonicContact OE1-NE 3.98Å; E430-R434 PolarHBondContact OE1-NE 3.42Å; E430-R434 IonicContact OE1-NH2 3.11Å; E430-R434 PolarHBondContact OE1-NH2 3.35Å; E430-R434 VanDerWaalsContact OE1-NH2 3.11Å; R431-R434 PolarHBondContact O-N 3.04Å; R432-R434 PolarHBondContact O-N 2.96Å; R434-R437 PolarHBondContact O-N 3.11Å; R434-R438 WeakPolarHBondContact O-CG 3.33Å; R434-R438 PolarHBondContact O-N 3.02Å; R434-R438 VanDerWaalsContact O-N 3.12Å
435	R	91.9	Very high	88.6	Confident	151 Å²	151	98.3 Å²	98.3	57%	0.57	43%	0.426	S	S	*	.	H	α-helix	trans	-62.8	-44.4	175.8	-170.6	-177.8	-171.8	179.6	5.8	111.4	R431 R432 R438 L439	R431-R435 PolarHBondContact O-N 3.46Å; R432-R435 WeakPolarHBondContact O-CB 3.34Å; R432-R435 PolarHBondContact O-N 3.31Å; R435-R438 PolarHBondContact O-N 3.44Å; R435-L439 HydrophobicContact CG-CD1 4.39Å; R435-L439 WeakPolarHBondContact O-CG 3.05Å; R435-L439 PolarHBondContact O-N 3.08Å
436	A	92	Very high	89.5	Confident	16 Å²	16	99.8 Å²	99.8	13%	0.132	44%	0.435	C	S	.	.	H	α-helix	trans	-58.7	-49	176.5	0	0	0	0	0	111.5	I177 R432 R433 R438 L439 I440	I177-A436 HydrophobicContact CG2-CB 4.17Å; R432-A436 WeakPolarHBondContact O-CB 3.36Å; R432-A436 PolarHBondContact O-N 2.98Å; R433-A436 PolarHBondContact O-N 3.34Å; A436-R438 VanDerWaalsContact C-N 3.34Å; A436-R438 PolarHBondContact O-N 3.3Å; A436-L439 PolarHBondContact O-N 3.46Å; A436-L439 VanDerWaalsContact O-N 3.1Å; A436-I440 WeakPolarHBondContact O-CG1 3.35Å; A436-I440 PolarHBondContact O-N 3.27Å
437	R	92.3	Very high	89.9	Confident	172 Å²	172	97.5 Å²	97.5	65%	0.649	43%	0.427	S	S	*	.	H	α-helix	trans	-57	-43.1	176.2	-71.9	178	-175.8	177.8	2.8	112.8	R433 R434 L439 I440 K441	R433-R437 WeakPolarHBondContact O-CG 3.46Å; R433-R437 PolarHBondContact O-N 2.79Å; R434-R437 PolarHBondContact O-N 3.11Å; R437-L439 VanDerWaalsContact C-N 3.34Å; R437-L439 PolarHBondContact O-N 2.9Å; R437-I440 PolarHBondContact O-N 2.83Å; R437-K441 PolarHBondContact O-N 2.86Å
438	R	93	Very high	89.9	Confident	180 Å²	180	99.5 Å²	99.5	68%	0.679	43%	0.434	S	S	*	.	H	α-helix	trans	-63.1	-39.4	176.4	-69.8	175.5	-170.5	175.1	2.4	112.2	R434 R435 A436 R442	R434-R438 WeakPolarHBondContact O-CG 3.33Å; R434-R438 PolarHBondContact O-N 3.02Å; R434-R438 VanDerWaalsContact O-N 3.12Å; R435-R438 PolarHBondContact O-N 3.44Å; A436-R438 VanDerWaalsContact C-N 3.34Å; A436-R438 PolarHBondContact O-N 3.3Å; R438-R442 WeakPolarHBondContact O-CG 3.47Å; R438-R442 PolarHBondContact O-N 3.43Å
439	L	92.8	Very high	89.9	Confident	20 Å²	20	96 Å²	96	11%	0.105	43%	0.433	C	S	.	.	H	α-helix	trans	-69.6	-42.9	177.7	-71.9	172.9	0	0	0	111.5	K176 I177 R435 A436 R437 K441 R442 L443	K176-L439 HydrophobicContact CB-CD1 3.75Å; I177-L439 HydrophobicContact CD1-CB 3.84Å; I177-L439 HydrophobicContact CG1-CB 3.61Å; I177-L439 HydrophobicContact CG1-CD1 3.97Å; I177-L439 HydrophobicContact CG1-CG 4.46Å; R435-L439 HydrophobicContact CG-CD1 4.39Å; R435-L439 WeakPolarHBondContact O-CG 3.05Å; R435-L439 PolarHBondContact O-N 3.08Å; A436-L439 PolarHBondContact O-N 3.46Å; A436-L439 VanDerWaalsContact O-N 3.1Å; R437-L439 VanDerWaalsContact C-N 3.34Å; R437-L439 PolarHBondContact O-N 2.9Å; L439-K441 PolarHBondContact O-N 3.3Å; L439-R442 PolarHBondContact O-N 3.44Å; L439-R442 VanDerWaalsContact O-N 3.11Å; L439-L443 WeakPolarHBondContact O-CG 3.31Å; L439-L443 PolarHBondContact O-N 2.94Å
440	I	93.1	Very high	90.1	Very high	30 Å²	30	97.9 Å²	97.9	15%	0.154	44%	0.436	C	S	.	.	H	α-helix	trans	-57.9	-48.4	175.6	-68.9	165.7	0	0	0	110.3	I177 A436 R437 R442 L443 S444 W454 V456	I177-I440 HydrophobicContact CD1-CG1 3.73Å; I177-I440 HydrophobicContact CG1-CG1 4.32Å; I177-I440 HydrophobicContact CG2-CD1 4.19Å; I177-I440 HydrophobicContact CG2-CG1 4.24Å; A436-I440 WeakPolarHBondContact O-CG1 3.35Å; A436-I440 PolarHBondContact O-N 3.27Å; R437-I440 PolarHBondContact O-N 2.83Å; I440-R442 PolarHBondContact O-N 3.34Å; I440-L443 CarbonylContact O-C 3.51Å; I440-L443 PolarHBondContact O-N 2.82Å; I440-S444 PolarHBondContact O-N 3.24Å; I440-W454 HydrophobicContact CG1-CB 4.48Å; I440-W454 WeakPolarHBondContact CG2-O 3.39Å; I440-V456 HydrophobicContact CD1-CG2 4.34Å
441	K	92.2	Very high	90.4	Very high	155 Å²	155	97 Å²	97	67%	0.674	43%	0.432	S	S	*	.	H	α-helix	trans	-62.1	-28	176.8	-174.5	168.4	-177.6	164.6	0	113.7	R437 L439 L443 S444	R437-K441 PolarHBondContact O-N 2.86Å; L439-K441 PolarHBondContact O-N 3.3Å; K441-L443 VanDerWaalsContact C-N 3.34Å; K441-S444 PolarHBondContact O-OG 2.88Å
442	R	92.2	Very high	90.6	Very high	193 Å²	193	88.9 Å²	88.9	73%	0.728	40%	0.402	S	S	*	.	H	α-helix	trans	-79.6	-18.3	174.3	-76.2	179.1	178	-171.8	-1.3	113.3	R438 L439 I440	R438-R442 WeakPolarHBondContact O-CG 3.47Å; R438-R442 PolarHBondContact O-N 3.43Å; L439-R442 PolarHBondContact O-N 3.44Å; L439-R442 VanDerWaalsContact O-N 3.11Å; I440-R442 PolarHBondContact O-N 3.34Å
443	L	92.1	Very high	90.9	Very high	9 Å²	9	84.1 Å²	84.1	5%	0.047	38%	0.384	C	S	.	.	H	α-helix	trans	-102.5	-12	-179.9	-69.1	175	0	0	0	112.5	K170 K173 L174 I177 L439 I440 K441	K170-L443 HydrophobicContact CB-CD2 4.2Å; K170-L443 HydrophobicContact CD-CD2 4.41Å; K170-L443 HydrophobicContact CG-CD2 3.9Å; K173-L443 HydrophobicContact CB-CD1 3.91Å; K173-L443 HydrophobicContact CB-CD2 4.37Å; K173-L443 HydrophobicContact CD-CD2 3.8Å; K173-L443 HydrophobicContact CD-CG 4.39Å; L174-L443 HydrophobicContact CD2-CD1 3.65Å; L174-L443 HydrophobicContact CG-CD1 4.29Å; I177-L443 HydrophobicContact CD1-CD1 3.79Å; L439-L443 WeakPolarHBondContact O-CG 3.31Å; L439-L443 PolarHBondContact O-N 2.94Å; I440-L443 CarbonylContact O-C 3.51Å; I440-L443 PolarHBondContact O-N 2.82Å; K441-L443 VanDerWaalsContact C-N 3.34Å
444	S	92.6	Very high	91.1	Very high	28 Å²	28	77.1 Å²	77.1	20%	0.196	36%	0.358	C	S	.	.			trans	-67.3	145.1	174.9	57.9	0	0	0	0	111.1	I440 K441 C452	I440-S444 PolarHBondContact O-N 3.24Å; K441-S444 PolarHBondContact O-OG 2.88Å; S444-C452 CarbonylContact C-O 3.55Å; S444-C452 WeakPolarHBondContact CA-O 3.35Å; S444-C452 VanDerWaalsContact CB-O 3.29Å; S444-C452 WeakPolarHBondContact CB-O 3.35Å
445	V	90.7	Very high	91.3	Very high	63 Å²	63	74.4 Å²	74.4	38%	0.382	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	138.3	-179.4	179.1	0	0	0	0	108.3	W310 A447 C452	W310-V445 HydrophobicContact CH2-CB 4.49Å; W310-V445 HydrophobicContact CH2-CG2 4.27Å; V445-A447 HydrophobicContact CG1-CB 4.44Å; V445-C452 PolarHBondContact N-O 2.99Å; V445-C452 PolarHBondContact O-N 3.29Å
446	T	90.1	Very high	91.4	Very high	100 Å²	100	70.1 Å²	70.1	61%	0.613	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.9	117.3	169.5	47.7	0	0	0	0	108.8	Y450 H451	T446-Y450 CarbonylContact C-O 3.52Å; T446-Y450 VanDerWaalsContact CA-O 3.26Å; T446-Y450 WeakPolarHBondContact CA-O 3.48Å; T446-H451 HydrophobicContact CG2-CB 4.04Å; T446-H451 WeakPolarHBondContact CG2-ND1 3.45Å
447	A	85.6	Confident	91.5	Very high	33 Å²	33	72.7 Å²	72.7	27%	0.273	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	144.3	178.3	0	0	0	0	0	109.7	V445 G449 Y450	V445-A447 HydrophobicContact CG1-CB 4.44Å; A447-G449 VanDerWaalsContact C-N 3.25Å; A447-G449 PolarHBondContact O-N 3.34Å; A447-G449 VanDerWaalsContact O-N 3.14Å; A447-Y450 PolarHBondContact N-O 3.5Å; A447-Y450 PolarHBondContact O-N 3.04Å
448	N	83.1	Confident	91.5	Very high	94 Å²	94	72.2 Å²	72.2	50%	0.503	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	37.8	173.7	-58.9	-7.7	0	0	0	114.8	H161 Y450	H161-N448 PolarHBondContact CD2-ND2 3.31Å; N448-Y450 VanDerWaalsContact C-N 3.25Å; N448-Y450 VanDerWaalsContact O-CD2 3.28Å; N448-Y450 WeakPolarHBondContact O-CD2 3.46Å; N448-Y450 PolarHBondContact O-N 2.98Å
449	G	85.7	Confident	91.5	Very high	49 Å²	49	66.4 Å²	66.4	51%	0.505	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	1.3	-178.5	0	0	0	0	0	114.9	A315 A447	A315-G449 WeakPolarHBondContact CB-O 3.43Å; A315-G449 PolarHBondContact N-O 2.88Å; A447-G449 VanDerWaalsContact C-N 3.25Å; A447-G449 PolarHBondContact O-N 3.34Å; A447-G449 VanDerWaalsContact O-N 3.14Å
450	Y	89.6	Confident	91.6	Very high	103 Å²	103	71.3 Å²	71.3	40%	0.404	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	142.3	175.1	-65.1	-84.2	0	0	0	111.6	L162 E313 T446 A447 N448	L162-Y450 HydrophobicContact CD2-CD2 4.11Å; L162-Y450 HydrophobicContact CD2-CG 4.03Å; E313-Y450 CarbonylContact O-C 3.58Å; E313-Y450 WeakPolarHBondContact O-CA 3.37Å; T446-Y450 CarbonylContact C-O 3.52Å; T446-Y450 VanDerWaalsContact CA-O 3.26Å; T446-Y450 WeakPolarHBondContact CA-O 3.48Å; A447-Y450 PolarHBondContact N-O 3.5Å; A447-Y450 PolarHBondContact O-N 3.04Å; N448-Y450 VanDerWaalsContact C-N 3.25Å; N448-Y450 VanDerWaalsContact O-CD2 3.28Å; N448-Y450 WeakPolarHBondContact O-CD2 3.46Å; N448-Y450 PolarHBondContact O-N 2.98Å
451	H	92.4	Very high	91.6	Very high	40 Å²	40	70.2 Å²	70.2	19%	0.185	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	108.5	167.8	-177.3	67.4	0	0	0	109.3	E313 A315 V318 T446 Y453	E313-H451 PolarHBondContact N-O 2.04Å; E313-H451 PolarHBondContact O-N 3.43Å; A315-H451 HydrophobicContact CB-CB 4.37Å; V318-H451 HydrophobicContact CG2-CB 4.14Å; T446-H451 HydrophobicContact CG2-CB 4.04Å; T446-H451 WeakPolarHBondContact CG2-ND1 3.45Å; H451-Y453 AromaticContact CD2-CD1 3.68Å
452	C	93.5	Very high	91.5	Very high	5 Å²	5	64.8 Å²	64.8	3%	0.034	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	134.8	179.5	-56.8	0	0	0	0	111.4	W310 K311 C312 S444 V445	W310-C452 HydrophobicContact CD2-CB 4.38Å; W310-C452 VanDerWaalsContact CE2-CB 3.47Å; W310-C452 HydrophobicContact CH2-CB 3.96Å; W310-C452 HydrophobicContact CZ2-CB 3.24Å; K311-C452 CarbonylContact O-C 3.5Å; K311-C452 VanDerWaalsContact O-CA 3.27Å; K311-C452 WeakPolarHBondContact O-CA 3.28Å; C312-C452 HydrophobicContact CB-CB 4.1Å; C312-C452 WeakPolarHBondContact CB-SG 3.31Å; C312-C452 WeakPolarHBondContact SG-CB 3.06Å; C312-C452 CovalentContact SG-SG 2.04Å; C312-C452 PolarHBondContact SG-SG 3.49Å; S444-C452 CarbonylContact C-O 3.55Å; S444-C452 WeakPolarHBondContact CA-O 3.35Å; S444-C452 VanDerWaalsContact CB-O 3.29Å; S444-C452 WeakPolarHBondContact CB-O 3.35Å; V445-C452 PolarHBondContact N-O 2.99Å; V445-C452 PolarHBondContact O-N 3.29Å
453	Y	93.7	Very high	91.4	Very high	40 Å²	40	56.7 Å²	56.7	16%	0.157	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	159.8	-178.7	64	-87.9	0	0	0	112.1	K311 E313 H451 Q455	K311-Y453 PolarHBondContact N-O 3.36Å; K311-Y453 PolarHBondContact O-N 2.89Å; E313-Y453 HydrophobicContact CG-CE1 4.27Å; E313-Y453 PolarHBondContact OE1-OH 2.76Å; H451-Y453 AromaticContact CD2-CD1 3.68Å; Y453-Q455 HydrophobicContact CE2-CB 4.1Å
454	W	94.7	Very high	91.2	Very high	7 Å²	7	60.8 Å²	60.8	3%	0.027	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	120.6	173.8	-68.7	105	0	0	0	111.1	P164 V166 L174 W272 L308 W310 I440	P164-W454 HydrophobicContact CB-CH2 3.57Å; P164-W454 HydrophobicContact CB-CZ2 3.34Å; P164-W454 HydrophobicContact CG-CH2 3.72Å; P164-W454 HydrophobicContact CG-CZ2 4.05Å; V166-W454 HydrophobicContact CG1-CH2 4.35Å; V166-W454 HydrophobicContact CG1-CZ2 4.18Å; L174-W454 HydrophobicContact CD1-CZ2 3.98Å; L174-W454 HydrophobicContact CD2-CD2 3.89Å; L174-W454 HydrophobicContact CD2-CG 3.81Å; L174-W454 HydrophobicContact CD2-CZ2 4.28Å; W272-W454 HydrophobicContact CB-CH2 3.87Å; W272-W454 HydrophobicContact CB-CZ3 3.91Å; L308-W454 HydrophobicContact CB-CD2 4.28Å; L308-W454 HydrophobicContact CB-CE3 3.6Å; L308-W454 HydrophobicContact CB-CZ3 4.14Å; W310-W454 HydrophobicContact CB-CE3 4.03Å; W310-W454 HydrophobicContact CB-CH2 4.12Å; W310-W454 HydrophobicContact CB-CZ3 3.73Å; W310-W454 AromaticContact CE3-CD1 3.74Å; W310-W454 AromaticContact CE3-CD2 3.51Å; W310-W454 HydrophobicContact CE3-CD2 3.51Å; W310-W454 AromaticContact CE3-CE2 3.44Å; W310-W454 VanDerWaalsContact CE3-CE2 3.44Å; W310-W454 HydrophobicContact CE3-CE3 4.04Å; W310-W454 AromaticContact CE3-CG 3.76Å; W310-W454 HydrophobicContact CE3-CG 3.76Å; W310-W454 HydrophobicContact CE3-CH2 4.48Å; W310-W454 AromaticContact CE3-CZ2 3.99Å; W310-W454 HydrophobicContact CE3-CZ2 3.99Å; W310-W454 HydrophobicContact CE3-CZ3 4.48Å; W310-W454 AromaticContact CE3-NE1 3.51Å; W310-W454 AromaticContact CZ3-CD1 3.47Å; W310-W454 VanDerWaalsContact CZ3-CD1 3.47Å; W310-W454 HydrophobicContact CZ3-CD2 4.09Å; W310-W454 AromaticContact CZ3-CE2 3.8Å; W310-W454 AromaticContact CZ3-CG 3.94Å; W310-W454 HydrophobicContact CZ3-CG 3.94Å; W310-W454 AromaticContact CZ3-NE1 3.33Å; W310-W454 VanDerWaalsContact CZ3-NE1 3.33Å; I440-W454 HydrophobicContact CG1-CB 4.48Å; I440-W454 WeakPolarHBondContact CG2-O 3.39Å
455	Q	94.5	Very high	91.2	Very high	75 Å²	75	59.7 Å²	59.7	35%	0.35	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129.6	173.1	-176.4	171.7	-28.1	0	0	110.2	L308 H309 K311 Y453 Q457	L308-Q455 WeakPolarHBondContact CA-O 3.37Å; H309-Q455 PolarHBondContact N-O 2.68Å; H309-Q455 PolarHBondContact O-N 3.45Å; K311-Q455 VanDerWaalsContact CD-OE1 3.29Å; Y453-Q455 HydrophobicContact CE2-CB 4.1Å; Q455-Q457 PolarHBondContact O-N 3.39Å
456	V	93.4	Very high	91.1	Very high	61 Å²	61	58.6 Å²	58.6	37%	0.37	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	119	172.2	-176.1	0	0	0	0	108.5	I177 L308 I440	I177-V456 HydrophobicContact CG2-CG2 4.2Å; L308-V456 HydrophobicContact CD2-CB 4.41Å; L308-V456 HydrophobicContact CD2-CG2 3.72Å; I440-V456 HydrophobicContact CD1-CG2 4.34Å
457	Q	93.2	Very high	91.2	Very high	69 Å²	69	55.2 Å²	55.2	32%	0.322	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	136.8	-179.1	-174.2	164.8	-18.3	0	0	110.1	L307 H309 Q455	L307-Q457 PolarHBondContact N-O 3.11Å; L307-Q457 PolarHBondContact O-N 3.27Å; H309-Q457 HydrophobicContact CB-CB 4.37Å; H309-Q457 PolarHBondContact ND1-OE1 3.2Å; H309-Q457 VanDerWaalsContact ND1-OE1 3.14Å; Q455-Q457 PolarHBondContact O-N 3.39Å
458	K	93.3	Very high	91.4	Very high	162 Å²	162	55.4 Å²	55.4	70%	0.704	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	129.3	172.6	-65.5	-177.6	-179.4	-178.6	0	108.7	L305	L305-K458 CarbonylContact O-C 3.48Å; L305-K458 WeakPolarHBondContact O-CA 3.31Å
459	Y	93	Very high	91.6	Very high	59 Å²	59	55.2 Å²	55.2	23%	0.231	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	124.9	179.1	-160.8	-90.7	0	0	0	109.1	I276 A304 L305 L307 I461	I276-Y459 HydrophobicContact CD1-CD1 3.91Å; I276-Y459 HydrophobicContact CD1-CE1 3.42Å; I276-Y459 VanDerWaalsContact CD1-CE1 3.42Å; A304-Y459 CarbonylContact C-O 3.57Å; A304-Y459 WeakPolarHBondContact CA-O 3.43Å; L305-Y459 PolarHBondContact N-O 3.06Å; L305-Y459 PolarHBondContact O-N 2.76Å; L307-Y459 HydrophobicContact CD1-CD2 4.45Å; L307-Y459 HydrophobicContact CD1-CG 4.05Å; Y459-I461 HydrophobicContact CD1-CG2 3.75Å; Y459-I461 HydrophobicContact CE1-CG2 3.93Å
460	L	94.1	Very high	91.2	Very high	122 Å²	122	58.8 Å²	58.8	64%	0.639	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	125.4	-179	-67.6	170.7	0	0	0	109.4	R303 A304	R303-L460 WeakPolarHBondContact O-CA 3.34Å; A304-L460 HydrophobicContact CB-CD2 3.84Å
461	I	93.2	Very high	91.2	Very high	8 Å²	8	56.6 Å²	56.6	4%	0.041	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	149.7	174.8	55.5	160.2	0	0	0	110.2	W186 I276 R277 R278 S302 R303 L305 Y459	W186-I461 HydrophobicContact CB-CD1 4.47Å; W186-I461 HydrophobicContact CD2-CD1 3.71Å; W186-I461 HydrophobicContact CE3-CD1 3.15Å; W186-I461 HydrophobicContact CG-CD1 4.29Å; W186-I461 HydrophobicContact CH2-CD1 4.37Å; W186-I461 HydrophobicContact CZ3-CD1 3.54Å; I276-I461 HydrophobicContact CD1-CG2 4.39Å; R277-I461 WeakPolarHBondContact O-CD1 3.3Å; R278-I461 HydrophobicContact CB-CG2 4.44Å; S302-I461 CarbonylContact C-O 3.56Å; S302-I461 VanDerWaalsContact CA-O 3.25Å; S302-I461 WeakPolarHBondContact CA-O 3.44Å; R303-I461 HydrophobicContact CB-CD1 4.29Å; R303-I461 HydrophobicContact CB-CG1 3.94Å; R303-I461 PolarHBondContact N-O 3.17Å; R303-I461 WeakPolarHBondContact O-CG1 2.9Å; R303-I461 PolarHBondContact O-N 2.82Å; L305-I461 HydrophobicContact CD1-CD1 3.67Å; L305-I461 HydrophobicContact CD1-CG1 4.09Å; L305-I461 HydrophobicContact CD1-CG2 4.07Å; L305-I461 HydrophobicContact CD2-CD1 4.2Å; L305-I461 HydrophobicContact CG-CD1 3.89Å; L305-I461 HydrophobicContact CG-CG1 4.03Å; Y459-I461 HydrophobicContact CD1-CG2 3.75Å; Y459-I461 HydrophobicContact CE1-CG2 3.93Å
462	S	91.2	Very high	91.2	Very high	40 Å²	40	57.4 Å²	57.4	28%	0.28	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	125.2	168.7	-58.9	0	0	0	0	109.7	G279 G301	G279-S462 WeakPolarHBondContact CA-O 3.41Å; G279-S462 PolarHBondContact N-O 3.47Å; G301-S462 WeakPolarHBondContact O-CA 3.44Å
463	D	89	Confident	91	Very high	23 Å²	23	60.3 Å²	60.3	12%	0.123	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	-14.8	179.5	67.5	-31.4	0	0	0	113.2	W186 G301 S302 R303	W186-D463 HydrophobicContact CH2-CB 3.47Å; W186-D463 VanDerWaalsContact CH2-CB 3.47Å; W186-D463 HydrophobicContact CZ2-CB 3.64Å; W186-D463 HydrophobicContact CZ3-CB 4.37Å; G301-D463 VanDerWaalsContact CA-OD1 3.28Å; G301-D463 WeakPolarHBondContact CA-OD1 3.38Å; G301-D463 PolarHBondContact O-N 3.13Å; S302-D463 PolarHBondContact N-OD1 3.26Å; R303-D463 HydrophobicContact CB-CB 4.21Å
464	R	89.2	Confident	90.9	Very high	96 Å²	96	61.5 Å²	61.5	36%	0.362	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	140.8	-176.9	-52.1	-174.6	172	-161.5	-8.6	112.1	S201 S214 I215 P299 S300 G301	S201-R464 WeakPolarHBondContact OG-CA 3.49Å; S214-R464 PolarHBondContact OG-NH2 2.82Å; I215-R464 HydrophobicContact CD1-CB 3.7Å; I215-R464 HydrophobicContact CD1-CG 3.44Å; I215-R464 VanDerWaalsContact CD1-CG 3.44Å; I215-R464 HydrophobicContact CG1-CG 4.45Å; P299-R464 WeakPolarHBondContact CA-O 3.32Å; S300-R464 PolarHBondContact N-O 3.24Å; G301-R464 PolarHBondContact N-O 3.43Å
465	C	91.2	Very high	90.7	Very high	4 Å²	4	64.9 Å²	64.9	3%	0.027	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	142.4	165.2	-55.7	0	0	0	0	110.5	S201 C258 M260 C281 R298	S201-C465 PolarHBondContact OG-N 2.81Å; S201-C465 PolarHBondContact OG-O 3.04Å; C258-C465 HydrophobicContact CB-CB 3.64Å; M260-C465 WeakPolarHBondContact CE-SG 3.44Å; C281-C465 WeakPolarHBondContact CA-SG 3.35Å; C281-C465 HydrophobicContact CB-CB 3.96Å; C281-C465 WeakPolarHBondContact CB-SG 3.13Å; C281-C465 WeakPolarHBondContact SG-CB 3.43Å; C281-C465 CovalentContact SG-SG 2.02Å; C281-C465 PolarHBondContact SG-SG 2.76Å; R298-C465 CarbonylContact O-C 3.59Å; R298-C465 VanDerWaalsContact O-CA 3.22Å; R298-C465 WeakPolarHBondContact O-CA 3.25Å
466	S	90.5	Very high	90.4	Very high	40 Å²	40	64.3 Å²	64.3	28%	0.28	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	156.3	167.3	74.8	0	0	0	0	110.6	R298 S300 S468	R298-S466 PolarHBondContact N-O 3.33Å; R298-S466 PolarHBondContact O-N 3.45Å; S300-S466 WeakPolarHBondContact CB-OG 3.43Å; S300-S466 PolarHBondContact OG-OG 3.17Å; S466-S468 PolarHBondContact O-N 3.37Å
467	C	91.3	Very high	90.2	Very high	30 Å²	30	64.5 Å²	64.5	20%	0.203	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	117.9	171.3	-168.5	0	0	0	0	109.3	C289 M295	C289-C467 HydrophobicContact CB-CB 3.7Å; C289-C467 WeakPolarHBondContact CB-SG 3.37Å; C289-C467 PolarHBondContact O-SG 3.03Å; C289-C467 WeakPolarHBondContact SG-CA 3.38Å; C289-C467 WeakPolarHBondContact SG-CB 3.41Å; C289-C467 CovalentContact SG-SG 2.02Å; C289-C467 PolarHBondContact SG-SG 2.72Å; M295-C467 WeakPolarHBondContact CB-SG 3.04Å; M295-C467 HydrophobicContact CE-CB 4.44Å; M295-C467 VanDerWaalsContact CE-O 3.3Å; M295-C467 WeakPolarHBondContact CE-O 3.35Å
468	S	90.2	Very high	90	Very high	37 Å²	37	64.2 Å²	64.2	26%	0.259	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	160.7	178.1	53.5	0	0	0	0	111.9	M295 K296 R298 S466	M295-S468 WeakPolarHBondContact CB-O 3.06Å; K296-S468 PolarHBondContact N-O 3.47Å; K296-S468 PolarHBondContact O-N 3.44Å; K296-S468 VanDerWaalsContact O-N 3.07Å; K296-S468 VanDerWaalsContact O-O 3.13Å; R298-S468 WeakPolarHBondContact CB-OG 3.46Å; R298-S468 WeakPolarHBondContact CD-OG 3.37Å; S466-S468 PolarHBondContact O-N 3.37Å
469	C	87.1	Confident	89.7	Confident	90 Å²	90	56 Å²	56	61%	0.608	33%	0.326	S	S	*	.			trans	-64.6	149.4	176.1	-61.3	0	0	0	0	111	R298	R298-C469 PolarHBondContact NH1-O 3.26Å
470	S	76.3	Confident	89.4	Confident	123 Å²	123	55.7 Å²	55.7	86%	0.86	34%	0.335	S	S	*	.			trans	-68.4	0	176.2	59.9	0	0	0	0	112.8	R298	R298-S470 VanDerWaalsContact CZ-CA 3.43Å; R298-S470 PolarHBondContact NH1-OXT 3.34Å; R298-S470 VanDerWaalsContact NH2-CA 3.31Å; R298-S470 PolarHBondContact NH2-OXT 3.19Å

Retrieved 470 of 470 residues in 174.7 ms (Link to these results)

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