X2JJG0_DROME Loading...

EF-hand domain-containing protein

AlphaFold DB , UniProt , Accession X2JJG0, Species DROME (Drosophila melanogaster, Fruit fly), Gene CG11105, Length 363 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	30.4	Very low	31.4	Very low	240 Å²	240	158.4 Å²	158.4	100%	1.182	82%	0.819	S	S	*	*				0	124	0	-92.5	-89.5	-159.6	0	0	107.8
2	P	44.3	Very low	31.7	Very low	115 Å²	115	151.9 Å²	151.9	75%	0.747	81%	0.807	S	S	*	*			cis	-120.8	163.2	-39.1	26	-6.6	0	0	0	111.6
3	E	32	Very low	32.4	Very low	200 Å²	200	148.6 Å²	148.6	94%	0.935	80%	0.799	S	S	*	*			trans	-78.7	148.3	172.2	-83.8	178.3	157.3	0	0	112
4	I	34.6	Very low	32.2	Very low	153 Å²	153	144.5 Å²	144.5	79%	0.785	79%	0.788	S	S	*	*			trans	-101.5	152.9	-175.2	-70.8	170.1	0	0	0	109
5	L	30.6	Very low	32	Very low	149 Å²	149	144.5 Å²	144.5	78%	0.78	79%	0.787	S	S	*	*			trans	-19.1	142.1	164.9	-76	75.1	0	0	0	116.7
6	D	30	Very low	32.1	Very low	173 Å²	173	143.2 Å²	143.2	93%	0.925	78%	0.784	S	S	*	*				-147.4	138.6	126.1	-106.4	-20.9	0	0	0	111.9
7	A	29.7	Very low	32	Very low	71 Å²	71	142.2 Å²	142.2	59%	0.587	78%	0.783	S	S	*	*			trans	-114.6	149	-179.8	0	0	0	0	0	108.6
8	M	26	Very low	31.8	Very low	157 Å²	157	141.6 Å²	141.6	77%	0.773	78%	0.779	S	S	*	*			trans	66	144.4	151	-63.2	168.3	74.3	0	0	115
9	E	29.2	Very low	32.1	Very low	146 Å²	146	141.5 Å²	141.5	68%	0.682	78%	0.775	S	S	*	*			cis	-171.2	158.9	19.7	-130	169.6	-176	0	0	108.9
10	M	31	Very low	32	Very low	153 Å²	153	139.9 Å²	139.9	75%	0.754	78%	0.775	S	S	*	*			trans	49.9	125.5	145	-79.9	-177.6	61.3	0	0	122.5
11	E	27	Very low	32	Very low	185 Å²	185	137.1 Å²	137.1	86%	0.864	77%	0.77	S	S	*	*				-156.3	133.9	100.4	-83.7	-136.2	146.2	0	0	111.5
12	A	36	Very low	32.3	Very low	81 Å²	81	137 Å²	137	67%	0.669	76%	0.756	S	S	*	*			trans	-96.6	163.4	157.2	0	0	0	0	0	107.3
13	P	39.8	Very low	31.7	Very low	109 Å²	109	140.6 Å²	140.6	71%	0.708	76%	0.763	S	S	*	*				-159.4	172.9	82.8	37.3	-15.1	0	0	0	117.5
14	S	29.9	Very low	31.6	Very low	91 Å²	91	137.5 Å²	137.5	64%	0.636	76%	0.758	S	S	*	*			trans	61.9	139.7	143.4	42.2	0	0	0	0	119.7
15	D	29.1	Very low	31.3	Very low	144 Å²	144	134.6 Å²	134.6	77%	0.77	76%	0.757	S	S	*	*			cis	-166.3	144.3	12.6	-97.5	-27.5	0	0	0	110.7
16	V	34.2	Very low	31.3	Very low	124 Å²	124	132.3 Å²	132.3	75%	0.752	75%	0.749	S	S	*	*			trans	34.7	137.3	137.5	-148.3	0	0	0	0	123
17	V	31	Very low	31.1	Very low	126 Å²	126	131.6 Å²	131.6	76%	0.764	75%	0.745	S	S	*	*			trans	120.3	99.7	136.5	-160.1	0	0	0	0	116.6
18	D	28.1	Very low	31.2	Very low	132 Å²	132	133.3 Å²	133.3	71%	0.706	75%	0.748	S	S	*	*			trans	35.5	127.9	131.4	-124.7	17.6	0	0	0	124.3
19	I	37.7	Very low	31.3	Very low	139 Å²	139	133.1 Å²	133.1	71%	0.713	75%	0.749	S	S	*	*			trans	40	111.1	142.7	-56	159.7	0	0	0	118.5
20	S	30	Very low	31.4	Very low	110 Å²	110	131 Å²	131	77%	0.769	75%	0.746	S	S	*	*				172.5	158	100.6	75	0	0	0	0	112
21	A	32.1	Very low	31.4	Very low	81 Å²	81	131.3 Å²	131.3	67%	0.669	75%	0.749	S	S	*	*			trans	76.2	106.2	153.7	0	0	0	0	0	119.3
22	R	37	Very low	31.6	Very low	237 Å²	237	128.8 Å²	128.8	89%	0.894	74%	0.74	S	S	*	*				49	109.4	125	-67.9	175.7	164.1	172.7	-5.3	117.4
23	E	30.2	Very low	31.2	Very low	191 Å²	191	132.3 Å²	132.3	89%	0.893	75%	0.748	S	S	*	*				-177.6	106.9	106	-98.7	171.8	179.7	0	0	108.9	A25	E23-A25 PolarHBondContact O-N 3.15Å; E23-A25 VanDerWaalsContact O-N 3.16Å
24	T	30.5	Very low	30.8	Very low	136 Å²	136	130.9 Å²	130.9	83%	0.834	75%	0.745	S	S	*	*			trans	-71.9	101	164.1	36.6	0	0	0	0	107.8	V26	T24-V26 PolarHBondContact O-N 3.3Å
25	A	28.6	Very low	30.8	Very low	92 Å²	92	131.2 Å²	131.2	76%	0.76	75%	0.748	S	S	*	*			trans	-65.3	110.3	165.5	0	0	0	0	0	108.7	E23	E23-A25 PolarHBondContact O-N 3.15Å; E23-A25 VanDerWaalsContact O-N 3.16Å
26	V	31.2	Very low	30.9	Very low	101 Å²	101	130.5 Å²	130.5	61%	0.612	75%	0.754	S	S	*	*			trans	-83.9	109.6	167.7	-177.9	0	0	0	0	106.4	T24 V28	T24-V26 PolarHBondContact O-N 3.3Å; V26-V28 HydrophobicContact CB-CG2 4.48Å; V26-V28 HydrophobicContact CG1-CG2 3.78Å; V26-V28 PolarHBondContact O-N 2.85Å
27	N	25.9	Very low	30.9	Very low	157 Å²	157	131.6 Å²	131.6	84%	0.84	75%	0.754	S	S	*	*			trans	-71.8	95.4	168.9	-77.9	-16.9	0	0	0	108.4
28	V	30.1	Very low	30.8	Very low	107 Å²	107	133 Å²	133	65%	0.648	76%	0.757	S	S	*	*			trans	-86.3	114.3	168.1	-178.9	0	0	0	0	107.4	V26	V26-V28 HydrophobicContact CB-CG2 4.48Å; V26-V28 HydrophobicContact CG1-CG2 3.78Å; V26-V28 PolarHBondContact O-N 2.85Å
29	I	28.9	Very low	30.9	Very low	154 Å²	154	133.1 Å²	133.1	79%	0.79	76%	0.758	S	S	*	*			trans	-89.7	106.8	167.1	-60.9	176.6	0	0	0	107	I31	I29-I31 HydrophobicContact CG2-CG1 4.44Å
30	T	31.6	Very low	30.6	Very low	102 Å²	102	132.8 Å²	132.8	63%	0.626	76%	0.757	S	S	*	*			trans	-90	113.6	171.7	-34.5	0	0	0	0	108.2	I32	T30-I32 HydrophobicContact CG2-CG1 3.98Å
31	I	30.5	Very low	30.6	Very low	158 Å²	158	134 Å²	134	81%	0.81	76%	0.755	S	S	*	*			trans	-90	105.7	162.4	-58	-178.4	0	0	0	106.3	I29	I29-I31 HydrophobicContact CG2-CG1 4.44Å
32	I	32.4	Very low	30.4	Very low	133 Å²	133	136.7 Å²	136.7	68%	0.682	76%	0.758	S	S	*	*			trans	-85.7	123.6	173	-56	166.2	0	0	0	106.5	T30 A34	T30-I32 HydrophobicContact CG2-CG1 3.98Å; I32-A34 HydrophobicContact CG2-CB 4.05Å
33	D	27	Very low	30.1	Very low	155 Å²	155	131.8 Å²	131.8	83%	0.829	75%	0.75	S	S	*	*			trans	-98.4	119.1	156.2	-162.8	-7.7	0	0	0	108.2
34	A	31.3	Very low	30	Very low	78 Å²	78	128.7 Å²	128.7	65%	0.645	74%	0.74	S	S	*	*			trans	-120.5	84.6	-173.5	0	0	0	0	0	109.1	I32	I32-A34 HydrophobicContact CG2-CB 4.05Å
35	S	29.4	Very low	30	Very low	99 Å²	99	128.4 Å²	128.4	69%	0.692	73%	0.733	S	S	*	*			trans	-178.6	100.4	144.7	44	0	0	0	0	111.8
36	S	32.3	Very low	30.1	Very low	129 Å²	129	129.6 Å²	129.6	90%	0.902	73%	0.727	S	S	*	*			trans	-96.7	92.3	142.9	-163.2	0	0	0	0	106.5
37	I	33.6	Very low	30.1	Very low	147 Å²	147	130.7 Å²	130.7	75%	0.754	73%	0.729	S	S	*	*			trans	-143.9	96.6	166.5	-57.3	-179.5	0	0	0	107
38	N	28.3	Very low	30.3	Very low	154 Å²	154	128.9 Å²	128.9	82%	0.824	72%	0.719	S	S	*	*				159.2	146	105.5	-144.2	-1.9	0	0	0	113.1
39	N	31.4	Very low	30.4	Very low	135 Å²	135	129.9 Å²	129.9	72%	0.722	72%	0.721	S	S	*	*			trans	-88	161.1	178.4	-97.6	-26.8	0	0	0	113.3
40	N	29.9	Very low	30.4	Very low	132 Å²	132	129.5 Å²	129.5	71%	0.706	72%	0.72	S	S	*	*			trans	94.7	119.5	142.4	-72.9	-11.9	0	0	0	123.3
41	N	30.3	Very low	30.6	Very low	136 Å²	136	128.2 Å²	128.2	73%	0.727	72%	0.716	S	S	*	*				51.3	122.4	128.6	-66.9	-10.9	0	0	0	121.7
42	N	28.8	Very low	30.6	Very low	138 Å²	138	128 Å²	128	74%	0.738	72%	0.716	S	S	*	*				166.6	143.2	88.6	-109	-17.1	0	0	0	113.3
43	N	30.1	Very low	30.4	Very low	133 Å²	133	126.2 Å²	126.2	71%	0.711	72%	0.715	S	S	*	*			trans	19.2	140.8	144.2	-67.1	-12.2	0	0	0	120.3
44	N	28.7	Very low	30.5	Very low	127 Å²	127	124.3 Å²	124.3	68%	0.679	71%	0.71	S	S	*	*				179.8	150.1	51.5	-128.2	-6.3	0	0	0	110.5
45	N	30	Very low	30.5	Very low	129 Å²	129	125.9 Å²	125.9	69%	0.69	71%	0.711	S	S	*	*			trans	51.8	143.4	144.9	-72	-8.2	0	0	0	120.8
46	N	29.9	Very low	30.5	Very low	118 Å²	118	127.4 Å²	127.4	63%	0.631	71%	0.712	S	S	*	*			cis	-173.1	151.7	27.9	-127.4	-1.9	0	0	0	110.6
47	N	31.4	Very low	30.5	Very low	124 Å²	124	127.7 Å²	127.7	66%	0.663	70%	0.703	S	S	*	*			trans	63.5	143.8	144.6	-68.1	-6.8	0	0	0	119.9
48	N	29.8	Very low	30.7	Very low	119 Å²	119	126.9 Å²	126.9	64%	0.636	70%	0.7	S	S	*	*			cis	-166.8	146.9	18.3	-124.1	-3.9	0	0	0	112
49	N	32.1	Very low	31	Very low	127 Å²	127	126.8 Å²	126.8	68%	0.679	69%	0.694	S	S	*	*			trans	78.4	127.6	134.9	-70.4	-12.5	0	0	0	126.3
50	N	30.4	Very low	31.2	Very low	146 Å²	146	128.6 Å²	128.6	78%	0.781	70%	0.698	S	S	*	*			trans	80.8	137.9	133.1	-92.7	-5.5	0	0	0	119.4
51	S	34.6	Very low	31.3	Very low	75 Å²	75	129.3 Å²	129.3	52%	0.524	70%	0.702	S	S	.	*			cis	-170.3	155.8	7.1	-80	0	0	0	0	110.6
52	N	31	Very low	31.3	Very low	155 Å²	155	128.6 Å²	128.6	83%	0.829	71%	0.708	S	S	*	*			trans	70	143.9	147	-61.3	-9.4	0	0	0	118.4
53	S	28.9	Very low	31.3	Very low	94 Å²	94	125.9 Å²	125.9	66%	0.657	71%	0.713	S	S	*	*			cis	-169.9	143	14.6	126.6	0	0	0	0	110.4
54	T	29.1	Very low	31.5	Very low	116 Å²	116	128.7 Å²	128.7	71%	0.712	72%	0.721	S	S	*	*				44.3	130	124.3	-21.3	0	0	0	0	118.1
55	T	30.5	Very low	32.3	Very low	111 Å²	111	128.2 Å²	128.2	68%	0.681	73%	0.725	S	S	*	*			cis	177	162	45.8	-11.6	0	0	0	0	112.6
56	N	29.6	Very low	32.5	Very low	131 Å²	131	130.7 Å²	130.7	70%	0.701	73%	0.732	S	S	*	*			trans	96.7	97	143.5	-72.1	-19.8	0	0	0	123.1
57	N	32.8	Very low	33.1	Very low	134 Å²	134	131.4 Å²	131.4	72%	0.717	74%	0.741	S	S	*	*				43.3	122	109.2	-66.7	-7.8	0	0	0	120.6
58	N	36.1	Very low	33.6	Very low	130 Å²	130	133.8 Å²	133.8	70%	0.695	75%	0.749	S	S	*	*				158.2	144.9	77.4	-112.8	-18.8	0	0	0	114.8
59	H	35.8	Very low	34.3	Very low	152 Å²	152	135.8 Å²	135.8	70%	0.704	76%	0.757	S	S	*	*			trans	72	141.7	151.1	-77.5	42.4	0	0	0	118.9
60	H	36.1	Very low	34.8	Very low	174 Å²	174	131.9 Å²	131.9	81%	0.806	75%	0.748	S	S	*	*			cis	-157.2	167.2	18.7	-147.1	55.1	0	0	0	110.6
61	N	30.9	Very low	35.4	Very low	147 Å²	147	128.4 Å²	128.4	79%	0.786	74%	0.739	S	S	*	*			trans	-112.6	137.7	-166.7	-165.8	16.1	0	0	0	111.6
62	S	30.4	Very low	36	Very low	121 Å²	121	129.8 Å²	129.8	85%	0.846	74%	0.744	S	S	*	*			trans	169.7	127.2	143.2	54.8	0	0	0	0	114
63	G	29.5	Very low	36.8	Very low	81 Å²	81	129 Å²	129	84%	0.835	74%	0.735	S	S	*	*			trans	118	96.8	147.8	0	0	0	0	0	118.4
64	E	34.9	Very low	37.7	Very low	192 Å²	192	129.6 Å²	129.6	90%	0.897	73%	0.73	S	S	*	*			trans	-77.3	169.6	157.1	-73.1	-179.9	159.9	0	0	110.8
65	P	44.1	Very low	38.7	Very low	116 Å²	116	130.8 Å²	130.8	75%	0.753	73%	0.728	S	S	*	*			cis	-134.1	173.1	12.2	34.9	-12.8	0	0	0	116.5
66	E	35.1	Very low	39.8	Very low	181 Å²	181	131.7 Å²	131.7	85%	0.846	72%	0.724	S	S	*	*			trans	-9.5	127.4	159.6	-53.6	-178.9	152.5	0	0	116.1
67	T	41.2	Very low	40.8	Very low	134 Å²	134	131.4 Å²	131.4	82%	0.822	72%	0.719	S	S	*	*				-175.7	153.4	84.7	-40.1	0	0	0	0	107.7
68	E	43	Very low	41.7	Very low	174 Å²	174	130.4 Å²	130.4	81%	0.813	71%	0.71	S	S	*	*			trans	99.7	44	177.1	-55.8	-169.3	152.6	0	0	118.2	G70	E68-G70 PolarHBondContact O-N 3.09Å
69	I	44.1	Very low	42.5	Very low	160 Å²	160	130.9 Å²	130.9	82%	0.821	71%	0.708	S	S	*	*			trans	-99.4	64.9	164.3	-50.2	-177.7	0	0	0	109.9
70	G	42	Very low	43.2	Very low	46 Å²	46	130.7 Å²	130.7	47%	0.474	71%	0.707	S	S	.	*	S	Bend	trans	-139	-27.7	175.8	0	0	0	0	0	114.4	E68	E68-G70 PolarHBondContact O-N 3.09Å
71	A	43.8	Very low	43.8	Very low	72 Å²	72	128.7 Å²	128.7	60%	0.595	70%	0.699	S	S	*	*	H	α-helix	trans	-93.6	-30.2	-175.8	0	0	0	0	0	113.6	Q75	A71-Q75 PolarHBondContact O-N 3.41Å
72	V	46.2	Very low	44.4	Very low	104 Å²	104	128.8 Å²	128.8	63%	0.63	69%	0.694	S	S	*	*	H	α-helix	trans	-80.8	-27.6	-175.3	-171.5	0	0	0	0	112.3	Q75 Q76	V72-Q75 PolarHBondContact O-N 2.8Å; V72-Q76 PolarHBondContact O-N 3.15Å; V72-Q76 VanDerWaalsContact O-N 3.09Å
73	Q	47.8	Very low	45.3	Very low	139 Å²	139	131.5 Å²	131.5	65%	0.65	69%	0.693	S	S	*	*	H	α-helix	trans	-71.1	-34.1	175.8	-154.3	112.3	8.7	0	0	112	Q77	Q73-Q77 VanDerWaalsContact O-CB 3.25Å; Q73-Q77 WeakPolarHBondContact O-CB 3.35Å; Q73-Q77 PolarHBondContact O-N 2.73Å; Q73-Q77 VanDerWaalsContact O-N 3.07Å
74	L	48.1	Very low	46	Very low	106 Å²	106	136 Å²	136	56%	0.555	69%	0.693	S	S	*	*	H	α-helix	trans	-73.9	-30.6	176	-85.9	161.3	0	0	0	112.5	Q78	L74-Q78 WeakPolarHBondContact O-CB 3.32Å; L74-Q78 PolarHBondContact O-N 2.77Å
75	Q	51	Low	46.1	Very low	141 Å²	141	133.6 Å²	133.6	66%	0.659	69%	0.685	S	S	*	*	H	α-helix	trans	-77.9	-36.1	177.6	-159	130.7	29.9	0	0	112.2	A71 V72 Q78 Q79	A71-Q75 PolarHBondContact O-N 3.41Å; V72-Q75 PolarHBondContact O-N 2.8Å; Q75-Q78 PolarHBondContact O-N 3.16Å; Q75-Q79 PolarHBondContact O-N 3.17Å; Q75-Q79 VanDerWaalsContact O-N 3.08Å
76	Q	52.3	Low	45.8	Very low	130 Å²	130	136.7 Å²	136.7	61%	0.607	69%	0.689	S	S	*	*	H	α-helix	trans	-74.2	-30.5	175	-157.8	164.1	75.4	0	0	112.2	V72 Q80	V72-Q76 PolarHBondContact O-N 3.15Å; V72-Q76 VanDerWaalsContact O-N 3.09Å; Q76-Q80 PolarHBondContact O-N 3Å
77	Q	51.3	Low	46.3	Very low	126 Å²	126	136 Å²	136	59%	0.589	69%	0.691	S	S	*	*	H	α-helix	trans	-73.4	-34.8	172.1	-162.9	169.2	52.9	0	0	112.6	Q73 Q81	Q73-Q77 VanDerWaalsContact O-CB 3.25Å; Q73-Q77 WeakPolarHBondContact O-CB 3.35Å; Q73-Q77 PolarHBondContact O-N 2.73Å; Q73-Q77 VanDerWaalsContact O-N 3.07Å; Q77-Q81 WeakPolarHBondContact O-CB 3.31Å; Q77-Q81 PolarHBondContact O-N 2.77Å; Q77-Q81 VanDerWaalsContact O-N 3.1Å
78	Q	52.6	Low	45.9	Very low	113 Å²	113	138.6 Å²	138.6	53%	0.528	69%	0.693	S	S	.	*	H	α-helix	trans	-68.8	-32.3	171.5	-93.2	-179.9	30.7	0	0	113.2	L74 Q75 Q81 Q82	L74-Q78 WeakPolarHBondContact O-CB 3.32Å; L74-Q78 PolarHBondContact O-N 2.77Å; Q75-Q78 PolarHBondContact O-N 3.16Å; Q78-Q81 PolarHBondContact O-N 3.36Å; Q78-Q82 PolarHBondContact O-N 2.83Å
79	Q	52.5	Low	45.4	Very low	139 Å²	139	136.6 Å²	136.6	65%	0.65	70%	0.695	S	S	*	*	H	α-helix	trans	-74.5	-29.8	178.8	-142.5	166.3	35.5	0	0	112.6	Q75	Q75-Q79 PolarHBondContact O-N 3.17Å; Q75-Q79 VanDerWaalsContact O-N 3.08Å
80	Q	50.8	Low	44.8	Very low	148 Å²	148	133.2 Å²	133.2	69%	0.692	69%	0.692	S	S	*	*	H	α-helix	trans	-75.4	-29.8	169.1	-77	-177.9	6.8	0	0	112.8	Q76	Q76-Q80 PolarHBondContact O-N 3Å
81	Q	47	Very low	44.3	Very low	133 Å²	133	135.8 Å²	135.8	62%	0.621	70%	0.702	S	S	*	*	H	α-helix	trans	-78.4	-23.5	177.6	-144.3	169.2	70.7	0	0	113.3	Q77 Q78 Q84	Q77-Q81 WeakPolarHBondContact O-CB 3.31Å; Q77-Q81 PolarHBondContact O-N 2.77Å; Q77-Q81 VanDerWaalsContact O-N 3.1Å; Q78-Q81 PolarHBondContact O-N 3.36Å; Q81-Q84 PolarHBondContact O-N 2.82Å
82	Q	45.6	Very low	43.7	Very low	149 Å²	149	139.7 Å²	139.7	70%	0.696	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-14	172.6	-80.3	-178.8	21.7	0	0	114.5	Q78	Q78-Q82 PolarHBondContact O-N 2.83Å
83	Q	47.9	Very low	42.8	Very low	177 Å²	177	144.2 Å²	144.2	83%	0.827	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-0.9	171.4	-79.4	-177.4	18.8	0	0	114.2
84	Q	45	Very low	41.7	Very low	176 Å²	176	144 Å²	144	82%	0.822	73%	0.733	S	S	*	*	S	Bend	trans	-113	4.1	175.9	-93.5	-178.9	26.3	0	0	115.3	Q81	Q81-Q84 PolarHBondContact O-N 2.82Å
85	L	37.6	Very low	41	Very low	141 Å²	141	143.8 Å²	143.8	74%	0.738	75%	0.746	S	S	*	*			trans	-103.6	28.9	-176.2	-109.9	161.1	0	0	0	115
86	H	37.2	Very low	39.8	Very low	181 Å²	181	144.2 Å²	144.2	84%	0.838	75%	0.751	S	S	*	*			trans	-113.3	37.5	172.6	-129.4	70.7	0	0	0	114.6
87	L	45.1	Very low	38.7	Very low	167 Å²	167	143.6 Å²	143.6	87%	0.874	76%	0.758	S	S	*	*			trans	-147.3	81.4	165.9	-90.4	105.1	0	0	0	111.2
88	Q	33	Very low	37.6	Very low	189 Å²	189	146 Å²	146	88%	0.883	78%	0.775	S	S	*	*			trans	-158.1	125.8	144.1	-67.8	-156.4	15.6	0	0	109
89	P	33.4	Very low	36.4	Very low	131 Å²	131	148.9 Å²	148.9	85%	0.851	79%	0.792	S	S	*	*			trans	-81.7	126.2	175.1	31	-29.5	0	0	0	110.7	S91	P89-S91 PolarHBondContact O-N 3.44Å
90	A	30.2	Very low	35.3	Very low	90 Å²	90	150 Å²	150	74%	0.744	80%	0.798	S	S	*	*			trans	-65.3	124.2	168.4	0	0	0	0	0	110.3	N92	A90-N92 PolarHBondContact O-N 2.87Å
91	S	32.8	Very low	34.1	Very low	100 Å²	100	154.7 Å²	154.7	70%	0.699	81%	0.809	S	S	*	*			trans	-73.1	103.8	172.9	41.8	0	0	0	0	111.1	P89	P89-S91 PolarHBondContact O-N 3.44Å
92	N	30	Very low	33.5	Very low	153 Å²	153	157.5 Å²	157.5	82%	0.818	81%	0.814	S	S	*	*			trans	-122.6	121.4	165.7	-81.1	-32.4	0	0	0	109.1	A90	A90-N92 PolarHBondContact O-N 2.87Å
93	F	27.7	Very low	32.8	Very low	199 Å²	199	161.4 Å²	161.4	87%	0.873	82%	0.822	S	S	*	*			trans	-93.4	135.3	-179.2	-73.1	-94.3	0	0	0	111.1
94	V	25.5	Very low	32.2	Very low	136 Å²	136	164 Å²	164	82%	0.824	82%	0.824	S	S	*	*			trans	-136.5	124.1	159.9	179.6	0	0	0	0	108.4	I96	V94-I96 HydrophobicContact CG1-CG1 4.34Å
95	A	31.7	Very low	31.7	Very low	100 Å²	100	160.2 Å²	160.2	83%	0.826	82%	0.817	S	S	*	*			trans	-98.7	136.5	174.3	0	0	0	0	0	110.2
96	I	26.2	Very low	31.5	Very low	151 Å²	151	162 Å²	162	77%	0.774	82%	0.822	S	S	*	*			trans	-136.2	133.7	166.2	-56.3	-177.3	0	0	0	109.4	V94	V94-I96 HydrophobicContact CG1-CG1 4.34Å
97	P	28.6	Very low	31.1	Very low	117 Å²	117	158.8 Å²	158.8	76%	0.76	82%	0.819	S	S	*	*			trans	-84.3	152.4	-169.9	-1.1	20.6	0	0	0	113.9
98	L	30.3	Very low	30.5	Very low	177 Å²	177	162.8 Å²	162.8	93%	0.927	82%	0.822	S	S	*	*			trans	-61.6	126	167.5	-75.4	159.7	0	0	0	111.3
99	L	26	Very low	30.4	Very low	172 Å²	172	161.8 Å²	161.8	90%	0.901	82%	0.821	S	S	*	*			trans	-114	105.4	161.1	-81.2	169.8	0	0	0	109.7
100	E	30.6	Very low	30	Very low	163 Å²	163	159.7 Å²	159.7	76%	0.762	82%	0.815	S	S	*	*			trans	-74.4	130	160.3	-173.1	104	-160.9	0	0	108.6	R102	E100-R102 HydrophobicContact CG-CB 4.47Å
101	R	25.4	Very low	30.2	Very low	247 Å²	247	161.3 Å²	161.3	93%	0.932	82%	0.818	S	S	*	*			trans	-119.4	91.1	162	-154.5	177.7	-167	172.9	3.9	109.5
102	R	33.7	Very low	30.1	Very low	192 Å²	192	164.7 Å²	164.7	73%	0.725	83%	0.827	S	S	*	*			trans	-99	135.6	165.1	-138.1	179.8	-173.2	-168.9	3.1	109.4	E100	E100-R102 HydrophobicContact CG-CB 4.47Å
103	R	32.1	Very low	30.1	Very low	231 Å²	231	161 Å²	161	87%	0.872	82%	0.818	S	S	*	*			trans	-123	105.7	153.2	-91.1	-166.4	173.7	-177.5	-0.1	109.8
104	R	34.7	Very low	30.3	Very low	230 Å²	230	157 Å²	157	87%	0.868	81%	0.812	S	S	*	*			trans	56.4	133.6	147.1	-63.9	-179.3	175.2	173.5	-3.3	118.8
105	S	33.8	Very low	30.6	Very low	97 Å²	97	157.4 Å²	157.4	68%	0.678	81%	0.808	S	S	*	*			cis	-158.4	140	18.2	14.2	0	0	0	0	113.4
106	H	34.2	Very low	30.7	Very low	178 Å²	178	158.3 Å²	158.3	82%	0.824	80%	0.798	S	S	*	*			trans	74.8	102.7	160.7	-55.2	-47.5	0	0	0	121
107	C	29.3	Very low	30.8	Very low	115 Å²	115	157.2 Å²	157.2	78%	0.777	80%	0.802	S	S	*	*				-169.3	143.9	128.3	-93.7	0	0	0	0	110.5
108	R	32.4	Very low	31.2	Very low	251 Å²	251	156.5 Å²	156.5	95%	0.947	79%	0.791	S	S	*	*			trans	-68.8	132.6	178.5	-68.7	176.1	174.2	179.7	-2.4	111
109	I	29.4	Very low	31.1	Very low	167 Å²	167	156.6 Å²	156.6	86%	0.856	79%	0.786	S	S	*	*			trans	-144.4	128.8	158.4	-57.7	179.8	0	0	0	108.4
110	A	26.4	Very low	31.5	Very low	88 Å²	88	155.6 Å²	155.6	73%	0.727	78%	0.782	S	S	*	*			trans	-129.1	160.7	157.5	0	0	0	0	0	107.3
111	P	33.6	Very low	32.1	Very low	123 Å²	123	151.4 Å²	151.4	80%	0.799	78%	0.783	S	S	*	*			cis	-127	165.2	0.1	38.3	-21.4	0	0	0	114.9
112	L	31	Very low	32.6	Very low	171 Å²	171	144.2 Å²	144.2	90%	0.895	77%	0.77	S	S	*	*			trans	-68	159.6	156.3	-68.1	154.2	0	0	0	108.9
113	A	29.5	Very low	32.8	Very low	77 Å²	77	140.8 Å²	140.8	64%	0.636	76%	0.762	S	S	*	*			cis	-158.4	157.9	20.4	0	0	0	0	0	109.7
114	P	32.5	Very low	33	Very low	113 Å²	113	132.7 Å²	132.7	73%	0.734	74%	0.739	S	S	*	*			trans	-85.7	122.5	157.6	30.8	-23.3	0	0	0	109.6
115	I	30.3	Very low	33.4	Very low	146 Å²	146	126.5 Å²	126.5	75%	0.749	72%	0.72	S	S	*	*			trans	-106.8	113.3	155	-62	177.7	0	0	0	105.8
116	I	34.8	Very low	33.5	Very low	119 Å²	119	128 Å²	128	61%	0.61	72%	0.716	S	S	*	*			trans	-109.5	113.9	172.6	-56.9	176.8	0	0	0	106.2	I118	I116-I118 HydrophobicContact CG2-CD1 4.15Å; I116-I118 HydrophobicContact CG2-CG1 3.57Å
117	C	28.8	Very low	33.5	Very low	128 Å²	128	126 Å²	126	87%	0.865	71%	0.711	S	S	*	*			trans	-94.1	122.9	158.4	-89.7	0	0	0	0	107.7
118	I	36.3	Very low	33.9	Very low	101 Å²	101	125.1 Å²	125.1	52%	0.518	70%	0.702	S	S	.	*			trans	-107.4	124.7	171.8	-50	179.9	0	0	0	106.9	I116 P124	I116-I118 HydrophobicContact CG2-CD1 4.15Å; I116-I118 HydrophobicContact CG2-CG1 3.57Å; I118-P124 HydrophobicContact CD1-CG 4.46Å
119	Q	28.5	Very low	34.1	Very low	180 Å²	180	121.4 Å²	121.4	84%	0.841	69%	0.688	S	S	*	*			trans	-128.8	119.9	145.4	-148.9	163.7	4.9	0	0	109.2
120	N	34.7	Very low	34.2	Very low	151 Å²	151	119.9 Å²	119.9	81%	0.807	68%	0.681	S	S	*	*	S	Bend	trans	67.4	101.9	171.7	-64.8	1.2	0	0	0	118.5
121	G	43.1	Very low	34.5	Very low	75 Å²	75	120.2 Å²	120.2	77%	0.773	68%	0.678	S	S	*	*	S	Bend	trans	117.5	5	132.4	0	0	0	0	0	118.6
122	S	34.5	Very low	34.7	Very low	95 Å²	95	123.7 Å²	123.7	66%	0.664	68%	0.675	S	S	*	*			trans	-145.9	133.3	176.2	-48.1	0	0	0	0	112.8
123	H	37.8	Very low	35	Very low	120 Å²	120	120.2 Å²	120.2	56%	0.556	67%	0.665	S	S	*	*			trans	-77.1	131.4	-173.5	-170	-102.1	0	0	0	110.9	E125 E126	H123-E125 VanDerWaalsContact CE1-CG 3.43Å; H123-E125 WeakPolarHBondContact CE1-CG 3.5Å; H123-E125 IonicContact CE1-OE2 2.71Å; H123-E125 WeakPolarHBondContact ND1-CB 3.23Å; H123-E125 PolarHBondContact ND1-N 2.8Å; H123-E125 PolarHBondContact O-N 3.3Å; H123-E125 VanDerWaalsContact O-N 3.13Å; H123-E126 PolarHBondContact O-N 3.24Å; H123-E126 VanDerWaalsContact O-N 3.12Å
124	P	38	Very low	35.5	Very low	61 Å²	61	125 Å²	125	40%	0.396	67%	0.667	S	S	.	*	H	α-helix	trans	-67.4	-12.8	-176.4	23.6	-31.1	0	0	0	114.5	I118 E126 V128	I118-P124 HydrophobicContact CD1-CG 4.46Å; P124-E126 VanDerWaalsContact C-N 3.29Å; P124-E126 PolarHBondContact O-N 2.94Å; P124-V128 WeakPolarHBondContact O-CG2 3.46Å; P124-V128 PolarHBondContact O-N 3.44Å
125	E	41.8	Very low	35.9	Very low	101 Å²	101	121.7 Å²	121.7	47%	0.472	65%	0.647	S	S	.	*	H	α-helix	trans	-71.7	-18.8	171.5	-66.8	-162.9	159	0	0	113.9	H123 R129	H123-E125 VanDerWaalsContact CE1-CG 3.43Å; H123-E125 WeakPolarHBondContact CE1-CG 3.5Å; H123-E125 IonicContact CE1-OE2 2.71Å; H123-E125 WeakPolarHBondContact ND1-CB 3.23Å; H123-E125 PolarHBondContact ND1-N 2.8Å; H123-E125 PolarHBondContact O-N 3.3Å; H123-E125 VanDerWaalsContact O-N 3.13Å; E125-R129 WeakPolarHBondContact O-CB 3.26Å; E125-R129 VanDerWaalsContact O-CG 3.23Å; E125-R129 WeakPolarHBondContact O-CG 3.32Å; E125-R129 PolarHBondContact O-N 2.93Å; E125-R129 IonicContact OE2-CZ 2.79Å; E125-R129 IonicContact OE2-NH1 2.71Å; E125-R129 PolarHBondContact OE2-NH1 2.92Å
126	E	36	Very low	36.4	Very low	128 Å²	128	115.6 Å²	115.6	60%	0.598	62%	0.617	S	S	*	*	H	α-helix	trans	-72.3	-40	174.5	-79.4	-164	143.6	0	0	111.4	H123 P124 R129 L130	H123-E126 PolarHBondContact O-N 3.24Å; H123-E126 VanDerWaalsContact O-N 3.12Å; P124-E126 VanDerWaalsContact C-N 3.29Å; P124-E126 PolarHBondContact O-N 2.94Å; E126-R129 PolarHBondContact O-N 3.44Å; E126-L130 WeakPolarHBondContact O-CB 3.17Å; E126-L130 VanDerWaalsContact O-CD1 3.31Å; E126-L130 WeakPolarHBondContact O-CD1 3.07Å; E126-L130 PolarHBondContact O-N 2.88Å
127	L	34.5	Very low	36.4	Very low	137 Å²	137	111.1 Å²	111.1	72%	0.717	59%	0.593	S	S	*	*	H	α-helix	trans	-74.8	-28.6	177.6	-70.4	171.9	0	0	0	112.9	S131	L127-S131 PolarHBondContact O-N 3.48Å
128	V	37.7	Very low	36.8	Very low	96 Å²	96	107.9 Å²	107.9	58%	0.582	57%	0.567	S	S	*	*	H	α-helix	trans	-76.7	-27.5	171.8	178	0	0	0	0	111.8	P124	P124-V128 WeakPolarHBondContact O-CG2 3.46Å; P124-V128 PolarHBondContact O-N 3.44Å
129	R	36.2	Very low	37	Very low	172 Å²	172	109.5 Å²	109.5	65%	0.649	57%	0.566	S	S	*	*	H	α-helix	trans	-77.5	-33.9	171.8	-79.3	-174.7	160.7	107.6	0.8	113	E125 E126 S131 R132	E125-R129 WeakPolarHBondContact O-CB 3.26Å; E125-R129 VanDerWaalsContact O-CG 3.23Å; E125-R129 WeakPolarHBondContact O-CG 3.32Å; E125-R129 PolarHBondContact O-N 2.93Å; E125-R129 IonicContact OE2-CZ 2.79Å; E125-R129 IonicContact OE2-NH1 2.71Å; E125-R129 PolarHBondContact OE2-NH1 2.92Å; E126-R129 PolarHBondContact O-N 3.44Å; R129-S131 VanDerWaalsContact C-N 3.25Å; R129-S131 PolarHBondContact O-N 3.31Å; R129-R132 PolarHBondContact O-N 2.72Å; R129-R132 VanDerWaalsContact O-N 3.14Å
130	L	32.5	Very low	37.6	Very low	135 Å²	135	101.7 Å²	101.7	71%	0.707	53%	0.53	S	S	*	.	H	α-helix	trans	-64.9	-26.6	171.9	-96.4	125.1	0	0	0	112.9	E126	E126-L130 WeakPolarHBondContact O-CB 3.17Å; E126-L130 VanDerWaalsContact O-CD1 3.31Å; E126-L130 WeakPolarHBondContact O-CD1 3.07Å; E126-L130 PolarHBondContact O-N 2.88Å
131	S	33.2	Very low	38.1	Very low	95 Å²	95	97.5 Å²	97.5	66%	0.664	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-5.1	174.1	-174.1	0	0	0	0	114.7	L127 R129	L127-S131 PolarHBondContact O-N 3.48Å; R129-S131 VanDerWaalsContact C-N 3.25Å; R129-S131 PolarHBondContact O-N 3.31Å
132	R	36.6	Very low	38.1	Very low	196 Å²	196	101.9 Å²	101.9	74%	0.74	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-1.1	-179.7	-80.8	-173.7	169.1	-171.4	-0.5	115.2	R129 R134	R129-R132 PolarHBondContact O-N 2.72Å; R129-R132 VanDerWaalsContact O-N 3.14Å; R132-R134 PolarHBondContact O-N 2.94Å
133	S	38.1	Very low	38.6	Very low	99 Å²	99	97.9 Å²	97.9	69%	0.692	47%	0.468	S	S	*	.			trans	-83	71	165.4	-158.9	0	0	0	0	110.1
134	R	39.3	Very low	39.2	Very low	176 Å²	176	94 Å²	94	66%	0.664	45%	0.449	S	S	*	.			trans	-92.2	120.9	154.9	-73.6	-167.5	171	-163.8	-2.6	105.3	R132 L138	R132-R134 PolarHBondContact O-N 2.94Å; R134-L138 HydrophobicContact CB-CB 4.33Å; R134-L138 HydrophobicContact CB-CD1 4.14Å; R134-L138 HydrophobicContact CB-CD2 4.12Å; R134-L138 HydrophobicContact CB-CG 4.43Å
135	S	41.2	Very low	39.6	Very low	45 Å²	45	95 Å²	95	32%	0.315	45%	0.45	S	S	.	.			trans	-33.8	146.8	-167.6	-53.7	0	0	0	0	114.4	F137 L138 R139	S135-F137 PolarHBondContact O-N 3.08Å; S135-L138 WeakPolarHBondContact O-CA 3.36Å; S135-L138 WeakPolarHBondContact O-CB 3.25Å; S135-L138 PolarHBondContact O-N 2.96Å; S135-R139 PolarHBondContact O-N 3.47Å
136	C	40.2	Very low	40	Very low	18 Å²	18	96.5 Å²	96.5	12%	0.122	46%	0.455	C	S	.	.	H	α-helix	trans	-44.9	-34.6	171.6	53.4	0	0	0	0	113.8	L138 R139 I140 M305	C136-L138 PolarHBondContact O-N 3.02Å; C136-R139 WeakPolarHBondContact O-CA 3.39Å; C136-R139 WeakPolarHBondContact O-CB 2.84Å; C136-R139 PolarHBondContact O-N 3.2Å; C136-I140 WeakPolarHBondContact O-CG1 3.21Å; C136-I140 PolarHBondContact O-N 2.79Å; C136-M305 HydrophobicContact CB-CE 4.04Å; C136-M305 HydrophobicContact CB-CG 3.26Å; C136-M305 HydrophobicContact CB-SD 3.5Å; C136-M305 VanDerWaalsContact CB-SD 3.5Å; C136-M305 VanDerWaalsContact SG-SD 3.61Å
137	F	35.7	Very low	40.7	Very low	25 Å²	25	90.9 Å²	90.9	11%	0.11	43%	0.429	C	S	.	.	H	α-helix	trans	-61.5	-33.6	171.2	-61.9	-74	0	0	0	114.6	S135 R139 I140 R141 I301 V358 F359	S135-F137 PolarHBondContact O-N 3.08Å; F137-R139 VanDerWaalsContact C-N 3.29Å; F137-R139 PolarHBondContact O-N 3.42Å; F137-I140 HydrophobicContact CD1-CD1 3.9Å; F137-I140 HydrophobicContact CE1-CD1 4.22Å; F137-I140 PolarHBondContact O-N 3.49Å; F137-R141 WeakPolarHBondContact O-CA 3.08Å; F137-R141 WeakPolarHBondContact O-CB 3.31Å; F137-R141 PolarHBondContact O-N 3.06Å; F137-I301 HydrophobicContact CE1-CD1 4.23Å; F137-I301 HydrophobicContact CE1-CG1 4.34Å; F137-I301 HydrophobicContact CE2-CG2 4.25Å; F137-I301 HydrophobicContact CZ-CD1 3.6Å; F137-I301 HydrophobicContact CZ-CG1 3.97Å; F137-I301 HydrophobicContact CZ-CG2 3.97Å; F137-V358 HydrophobicContact CB-CG1 3.82Å; F137-V358 HydrophobicContact CD2-CG1 3.34Å; F137-V358 HydrophobicContact CE2-CG1 4.2Å; F137-V358 HydrophobicContact CG-CG1 3.85Å; F137-F359 AromaticContact CD1-CD1 3.78Å; F137-F359 HydrophobicContact CD1-CD1 3.78Å; F137-F359 AromaticContact CD1-CE1 3.93Å; F137-F359 HydrophobicContact CD1-CE1 3.93Å; F137-F359 HydrophobicContact CD1-CG 4.41Å; F137-F359 AromaticContact CE1-CD1 3.38Å; F137-F359 HydrophobicContact CE1-CD1 3.38Å; F137-F359 AromaticContact CE1-CE1 3.06Å; F137-F359 HydrophobicContact CE1-CE1 3.06Å; F137-F359 HydrophobicContact CE1-CG 4.3Å; F137-F359 AromaticContact CE1-CZ 3.79Å; F137-F359 HydrophobicContact CE1-CZ 3.79Å; F137-F359 HydrophobicContact CE2-CE1 4.08Å; F137-F359 HydrophobicContact CE2-CE2 4.37Å; F137-F359 AromaticContact CE2-CZ 3.95Å; F137-F359 HydrophobicContact CE2-CZ 3.95Å; F137-F359 AromaticContact CZ-CD1 3.83Å; F137-F359 HydrophobicContact CZ-CD1 3.83Å; F137-F359 AromaticContact CZ-CE1 3.13Å; F137-F359 HydrophobicContact CZ-CE1 3.13Å; F137-F359 HydrophobicContact CZ-CE2 4.13Å; F137-F359 AromaticContact CZ-CZ 3.32Å; F137-F359 HydrophobicContact CZ-CZ 3.32Å
138	L	37	Very low	41.6	Very low	60 Å²	60	87.3 Å²	87.3	31%	0.314	41%	0.408	S	S	.	.	H	α-helix	trans	-68.9	-26.6	169.5	-78.5	102.5	0	0	0	112.7	R134 S135 C136 R142	R134-L138 HydrophobicContact CB-CB 4.33Å; R134-L138 HydrophobicContact CB-CD1 4.14Å; R134-L138 HydrophobicContact CB-CD2 4.12Å; R134-L138 HydrophobicContact CB-CG 4.43Å; S135-L138 WeakPolarHBondContact O-CA 3.36Å; S135-L138 WeakPolarHBondContact O-CB 3.25Å; S135-L138 PolarHBondContact O-N 2.96Å; C136-L138 PolarHBondContact O-N 3.02Å; L138-R142 VanDerWaalsContact O-CB 3.3Å; L138-R142 WeakPolarHBondContact O-CB 3.11Å; L138-R142 WeakPolarHBondContact O-CG 3.13Å; L138-R142 PolarHBondContact O-N 3.15Å
139	R	41.3	Very low	42.2	Very low	135 Å²	135	83.7 Å²	83.7	51%	0.509	39%	0.39	S	S	.	.	H	α-helix	trans	-73.5	-51.2	171.3	-65.5	-176.4	-176.5	170.4	2.5	109.6	S135 C136 F137 R141 R142 T143	S135-R139 PolarHBondContact O-N 3.47Å; C136-R139 WeakPolarHBondContact O-CA 3.39Å; C136-R139 WeakPolarHBondContact O-CB 2.84Å; C136-R139 PolarHBondContact O-N 3.2Å; F137-R139 VanDerWaalsContact C-N 3.29Å; F137-R139 PolarHBondContact O-N 3.42Å; R139-R141 VanDerWaalsContact C-N 3.29Å; R139-R141 PolarHBondContact O-N 2.88Å; R139-R142 PolarHBondContact O-N 3.13Å; R139-T143 WeakPolarHBondContact O-CB 3.32Å; R139-T143 PolarHBondContact O-N 3.4Å; R139-T143 PolarHBondContact O-OG1 3.43Å
140	I	40.6	Very low	43	Very low	15 Å²	15	81.6 Å²	81.6	8%	0.077	39%	0.386	C	S	.	.	H	α-helix	trans	-52.4	-47.5	172.9	-60.9	167.4	0	0	0	110.8	C136 F137 T143 F144 Y224 F228 Y237 L304	C136-I140 WeakPolarHBondContact O-CG1 3.21Å; C136-I140 PolarHBondContact O-N 2.79Å; F137-I140 HydrophobicContact CD1-CD1 3.9Å; F137-I140 HydrophobicContact CE1-CD1 4.22Å; F137-I140 PolarHBondContact O-N 3.49Å; I140-T143 CarbonylContact O-C 3.49Å; I140-T143 WeakPolarHBondContact O-CB 3.17Å; I140-T143 PolarHBondContact O-N 3.03Å; I140-F144 VanDerWaalsContact O-CB 3.28Å; I140-F144 WeakPolarHBondContact O-CB 3.08Å; I140-F144 PolarHBondContact O-N 3.36Å; I140-Y224 VanDerWaalsContact CG2-OH 3.25Å; I140-Y224 WeakPolarHBondContact CG2-OH 3.33Å; I140-F228 HydrophobicContact CB-CZ 4.49Å; I140-F228 HydrophobicContact CG1-CE1 3.94Å; I140-F228 HydrophobicContact CG1-CZ 3.93Å; I140-Y237 HydrophobicContact CD1-CE1 3.97Å; I140-Y237 HydrophobicContact CG2-CE1 4.35Å; I140-L304 HydrophobicContact CD1-CD2 3.27Å; I140-L304 HydrophobicContact CD1-CG 4.5Å; I140-L304 HydrophobicContact CG1-CD2 3.57Å; I140-L304 HydrophobicContact CG1-CG 4.49Å
141	R	44.2	Very low	43.8	Very low	64 Å²	64	76.1 Å²	76.1	24%	0.242	36%	0.357	C	S	.	.	H	α-helix	trans	-62.7	-49.9	176.6	-173.5	-151.6	175.7	148.3	-1.3	112.2	F137 R139 T143 F144 I145 T361 A362 F363	F137-R141 WeakPolarHBondContact O-CA 3.08Å; F137-R141 WeakPolarHBondContact O-CB 3.31Å; F137-R141 PolarHBondContact O-N 3.06Å; R139-R141 VanDerWaalsContact C-N 3.29Å; R139-R141 PolarHBondContact O-N 2.88Å; R141-T143 PolarHBondContact O-N 2.58Å; R141-F144 PolarHBondContact O-N 2.59Å; R141-I145 HydrophobicContact CG-CD1 3.74Å; R141-I145 HydrophobicContact CG-CG1 4.37Å; R141-I145 WeakPolarHBondContact O-CA 3.2Å; R141-I145 WeakPolarHBondContact O-CB 3.28Å; R141-I145 WeakPolarHBondContact O-CG1 3.38Å; R141-I145 PolarHBondContact O-N 2.7Å; R141-T361 PolarHBondContact NH1-O 3.25Å; R141-A362 HydrophobicContact CB-CB 4.29Å; R141-A362 WeakPolarHBondContact CD-O 3.45Å; R141-A362 HydrophobicContact CG-CB 3.95Å; R141-A362 WeakPolarHBondContact CG-O 3.23Å; R141-A362 VanDerWaalsContact NE-C 3.31Å; R141-A362 PolarHBondContact NE-O 3.13Å; R141-A362 VanDerWaalsContact NH1-CA 3.29Å; R141-A362 PolarHBondContact NH2-O 3.21Å; R141-F363 VanDerWaalsContact NH2-CA 3.35Å; R141-F363 PolarHBondContact NH2-OXT 3.2Å
142	R	43.3	Very low	44.2	Very low	167 Å²	167	72.6 Å²	72.6	63%	0.63	33%	0.33	S	S	*	.	H	α-helix	trans	-59.6	-32.4	175.2	-89.9	-178.2	173.7	168.2	-0.8	111.7	L138 R139 K146	L138-R142 VanDerWaalsContact O-CB 3.3Å; L138-R142 WeakPolarHBondContact O-CB 3.11Å; L138-R142 WeakPolarHBondContact O-CG 3.13Å; L138-R142 PolarHBondContact O-N 3.15Å; R139-R142 PolarHBondContact O-N 3.13Å; R142-K146 VanDerWaalsContact O-CB 3.25Å; R142-K146 WeakPolarHBondContact O-CB 3.36Å; R142-K146 WeakPolarHBondContact O-CD 3.49Å; R142-K146 WeakPolarHBondContact O-CG 3.25Å; R142-K146 PolarHBondContact O-N 2.71Å
143	T	46.3	Very low	44.5	Very low	11 Å²	11	66 Å²	66	7%	0.067	32%	0.324	C	S	.	.	H	α-helix	trans	-79.3	-41.4	-176.6	-76.1	0	0	0	0	111.4	R139 I140 R141 K146 L147 F227 F228	R139-T143 WeakPolarHBondContact O-CB 3.32Å; R139-T143 PolarHBondContact O-N 3.4Å; R139-T143 PolarHBondContact O-OG1 3.43Å; I140-T143 CarbonylContact O-C 3.49Å; I140-T143 WeakPolarHBondContact O-CB 3.17Å; I140-T143 PolarHBondContact O-N 3.03Å; R141-T143 PolarHBondContact O-N 2.58Å; T143-K146 CarbonylContact O-C 3.47Å; T143-K146 WeakPolarHBondContact O-CB 3.26Å; T143-K146 PolarHBondContact O-N 3.26Å; T143-L147 WeakPolarHBondContact O-CB 3.42Å; T143-L147 PolarHBondContact O-N 2.8Å; T143-F227 HydrophobicContact CG2-CB 2.99Å; T143-F227 HydrophobicContact CG2-CD1 3.7Å; T143-F227 HydrophobicContact CG2-CD2 4.43Å; T143-F227 HydrophobicContact CG2-CG 3.39Å; T143-F227 WeakPolarHBondContact CG2-O 3.48Å; T143-F227 WeakPolarHBondContact O-CD1 3.22Å; T143-F227 PolarHBondContact OG1-O 2.8Å; T143-F228 HydrophobicContact CG2-CD2 4.47Å; T143-F228 HydrophobicContact CG2-CE2 4.03Å; T143-F228 HydrophobicContact CG2-CZ 4.12Å
144	F	49.3	Very low	44.6	Very low	38 Å²	38	65.5 Å²	65.5	17%	0.167	32%	0.32	C	S	.	.	H	α-helix	trans	-68.5	-34.8	169.6	-161.6	-92.2	0	0	0	110.9	I140 R141 K146 L147 F148 Y224 L262 L265	I140-F144 VanDerWaalsContact O-CB 3.28Å; I140-F144 WeakPolarHBondContact O-CB 3.08Å; I140-F144 PolarHBondContact O-N 3.36Å; R141-F144 PolarHBondContact O-N 2.59Å; F144-K146 VanDerWaalsContact C-N 3.34Å; F144-L147 HydrophobicContact CD2-CD2 4.43Å; F144-L147 PolarHBondContact O-N 3.3Å; F144-F148 WeakPolarHBondContact O-CA 3.35Å; F144-F148 WeakPolarHBondContact O-CB 3.49Å; F144-F148 PolarHBondContact O-N 2.86Å; F144-Y224 HydrophobicContact CD2-CE2 4.47Å; F144-L262 HydrophobicContact CE1-CD2 3.52Å; F144-L262 HydrophobicContact CZ-CD2 3.59Å; F144-L265 HydrophobicContact CE1-CD1 4.35Å; F144-L265 HydrophobicContact CZ-CD1 4.16Å
145	I	47.7	Very low	44.6	Very low	82 Å²	82	63.9 Å²	63.9	42%	0.421	33%	0.325	S	S	.	.	H	α-helix	trans	-70.6	-28.9	170	-71.2	171.7	0	0	0	111.4	R141 G149	R141-I145 HydrophobicContact CG-CD1 3.74Å; R141-I145 HydrophobicContact CG-CG1 4.37Å; R141-I145 WeakPolarHBondContact O-CA 3.2Å; R141-I145 WeakPolarHBondContact O-CB 3.28Å; R141-I145 WeakPolarHBondContact O-CG1 3.38Å; R141-I145 PolarHBondContact O-N 2.7Å; I145-G149 WeakPolarHBondContact O-CA 3.37Å; I145-G149 PolarHBondContact O-N 3.49Å
146	K	48.9	Very low	44.4	Very low	133 Å²	133	67.8 Å²	67.8	58%	0.578	34%	0.342	S	S	*	.	H	α-helix	trans	-77	-39.8	172.3	-81.7	167	-178.9	-176.8	0	111.3	R142 T143 F144 F148 G149 K150 F227	R142-K146 VanDerWaalsContact O-CB 3.25Å; R142-K146 WeakPolarHBondContact O-CB 3.36Å; R142-K146 WeakPolarHBondContact O-CD 3.49Å; R142-K146 WeakPolarHBondContact O-CG 3.25Å; R142-K146 PolarHBondContact O-N 2.71Å; T143-K146 CarbonylContact O-C 3.47Å; T143-K146 WeakPolarHBondContact O-CB 3.26Å; T143-K146 PolarHBondContact O-N 3.26Å; F144-K146 VanDerWaalsContact C-N 3.34Å; K146-F148 VanDerWaalsContact C-N 3.35Å; K146-G149 PolarHBondContact O-N 3.26Å; K146-K150 WeakPolarHBondContact O-CB 3.38Å; K146-K150 PolarHBondContact O-N 2.93Å; K146-F227 HydrophobicContact CB-CD1 4.36Å; K146-F227 HydrophobicContact CB-CE1 4.2Å
147	L	51.9	Low	44.2	Very low	10 Å²	10	72.3 Å²	72.3	5%	0.052	37%	0.371	C	S	.	.	H	α-helix	trans	-58.1	-51.4	168.6	174.6	48.4	0	0	0	109.1	T143 F144 G149 K150 I151 I223 F227	T143-L147 WeakPolarHBondContact O-CB 3.42Å; T143-L147 PolarHBondContact O-N 2.8Å; F144-L147 HydrophobicContact CD2-CD2 4.43Å; F144-L147 PolarHBondContact O-N 3.3Å; L147-G149 PolarHBondContact O-N 2.81Å; L147-K150 PolarHBondContact O-N 3.44Å; L147-I151 HydrophobicContact CD1-CD1 3.3Å; L147-I151 HydrophobicContact CD1-CG1 3.86Å; L147-I151 HydrophobicContact CG-CD1 3.86Å; L147-I151 VanDerWaalsContact O-CB 3.29Å; L147-I151 WeakPolarHBondContact O-CB 3.27Å; L147-I151 VanDerWaalsContact O-CG1 3.28Å; L147-I151 WeakPolarHBondContact O-CG1 3.49Å; L147-I151 PolarHBondContact O-N 3.3Å; L147-I223 HydrophobicContact CD1-CG2 3.68Å; L147-I223 HydrophobicContact CD2-CG2 4.26Å; L147-F227 VanDerWaalsContact CA-CE1 3.42Å; L147-F227 HydrophobicContact CB-CD1 4.21Å; L147-F227 HydrophobicContact CB-CD2 3.99Å; L147-F227 HydrophobicContact CB-CE1 3.61Å; L147-F227 HydrophobicContact CB-CE2 3.51Å; L147-F227 HydrophobicContact CB-CG 4.42Å; L147-F227 HydrophobicContact CB-CZ 3.29Å; L147-F227 HydrophobicContact CD1-CD2 4.43Å; L147-F227 HydrophobicContact CD1-CE2 3.38Å; L147-F227 HydrophobicContact CD1-CZ 3.46Å; L147-F227 VanDerWaalsContact CD1-CZ 3.46Å; L147-F227 HydrophobicContact CD2-CD2 4.09Å; L147-F227 HydrophobicContact CD2-CE2 3.8Å; L147-F227 HydrophobicContact CD2-CZ 4.41Å; L147-F227 HydrophobicContact CG-CD2 4.36Å; L147-F227 HydrophobicContact CG-CE2 3.7Å; L147-F227 HydrophobicContact CG-CZ 3.83Å; L147-F227 VanDerWaalsContact N-CE1 3.29Å
148	F	52.7	Low	44.4	Very low	61 Å²	61	76.1 Å²	76.1	27%	0.268	40%	0.401	S	S	.	.	H	α-helix	trans	-59.3	-45.1	173.5	-175.5	-102.7	0	0	0	111.5	F144 K146 K150 I151 M152	F144-F148 WeakPolarHBondContact O-CA 3.35Å; F144-F148 WeakPolarHBondContact O-CB 3.49Å; F144-F148 PolarHBondContact O-N 2.86Å; K146-F148 VanDerWaalsContact C-N 3.35Å; F148-K150 VanDerWaalsContact C-N 3.3Å; F148-K150 PolarHBondContact O-N 3.04Å; F148-I151 PolarHBondContact O-N 3.15Å; F148-M152 HydrophobicContact CD1-CG 3.9Å; F148-M152 HydrophobicContact CD2-CG 3.69Å; F148-M152 HydrophobicContact CE1-CE 4.16Å; F148-M152 HydrophobicContact CE1-CG 3.78Å; F148-M152 HydrophobicContact CE2-CE 3.93Å; F148-M152 HydrophobicContact CE2-CG 3.57Å; F148-M152 HydrophobicContact CE2-SD 4.02Å; F148-M152 HydrophobicContact CG-CG 3.86Å; F148-M152 HydrophobicContact CZ-CE 3.48Å; F148-M152 VanDerWaalsContact CZ-CE 3.48Å; F148-M152 HydrophobicContact CZ-CG 3.63Å; F148-M152 HydrophobicContact CZ-SD 4.11Å; F148-M152 WeakPolarHBondContact O-CA 3.49Å; F148-M152 WeakPolarHBondContact O-CB 3.42Å; F148-M152 WeakPolarHBondContact O-CG 3.32Å; F148-M152 PolarHBondContact O-N 3.19Å
149	G	50.3	Low	44.4	Very low	20 Å²	20	80.5 Å²	80.5	21%	0.206	42%	0.42	C	S	.	.	H	α-helix	trans	-69.6	-27	179.1	0	0	0	0	0	113.4	I145 K146 L147 G153 S154	I145-G149 WeakPolarHBondContact O-CA 3.37Å; I145-G149 PolarHBondContact O-N 3.49Å; K146-G149 PolarHBondContact O-N 3.26Å; L147-G149 PolarHBondContact O-N 2.81Å; G149-G153 CarbonylContact O-C 3.55Å; G149-G153 WeakPolarHBondContact O-CA 3.27Å; G149-G153 PolarHBondContact O-N 3.4Å; G149-S154 PolarHBondContact O-N 2.87Å
150	K	53.2	Low	44.2	Very low	129 Å²	129	76.6 Å²	76.6	56%	0.561	42%	0.416	S	S	*	.	H	α-helix	trans	-80.4	-39.1	173.8	-166.1	174.2	178.2	-168.2	0	111.5	K146 L147 F148	K146-K150 WeakPolarHBondContact O-CB 3.38Å; K146-K150 PolarHBondContact O-N 2.93Å; L147-K150 PolarHBondContact O-N 3.44Å; F148-K150 VanDerWaalsContact C-N 3.3Å; F148-K150 PolarHBondContact O-N 3.04Å
151	I	49.2	Very low	44	Very low	19 Å²	19	81.9 Å²	81.9	10%	0.097	45%	0.445	C	S	.	.	H	α-helix	trans	-70.7	-40.6	173.7	-73.3	176	0	0	0	111.4	L147 F148 I202 F258	L147-I151 HydrophobicContact CD1-CD1 3.3Å; L147-I151 HydrophobicContact CD1-CG1 3.86Å; L147-I151 HydrophobicContact CG-CD1 3.86Å; L147-I151 VanDerWaalsContact O-CB 3.29Å; L147-I151 WeakPolarHBondContact O-CB 3.27Å; L147-I151 VanDerWaalsContact O-CG1 3.28Å; L147-I151 WeakPolarHBondContact O-CG1 3.49Å; L147-I151 PolarHBondContact O-N 3.3Å; F148-I151 PolarHBondContact O-N 3.15Å; I151-I202 HydrophobicContact CG2-CG2 4.23Å; I151-F258 HydrophobicContact CD1-CZ 4.16Å
152	M	42.2	Very low	43.6	Very low	22 Å²	22	89.3 Å²	89.3	11%	0.108	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-7.9	-178.1	-65.7	-73.4	-89.7	0	0	113.6	F148 E198 R201 I202	F148-M152 HydrophobicContact CD1-CG 3.9Å; F148-M152 HydrophobicContact CD2-CG 3.69Å; F148-M152 HydrophobicContact CE1-CE 4.16Å; F148-M152 HydrophobicContact CE1-CG 3.78Å; F148-M152 HydrophobicContact CE2-CE 3.93Å; F148-M152 HydrophobicContact CE2-CG 3.57Å; F148-M152 HydrophobicContact CE2-SD 4.02Å; F148-M152 HydrophobicContact CG-CG 3.86Å; F148-M152 HydrophobicContact CZ-CE 3.48Å; F148-M152 VanDerWaalsContact CZ-CE 3.48Å; F148-M152 HydrophobicContact CZ-CG 3.63Å; F148-M152 HydrophobicContact CZ-SD 4.11Å; F148-M152 WeakPolarHBondContact O-CA 3.49Å; F148-M152 WeakPolarHBondContact O-CB 3.42Å; F148-M152 WeakPolarHBondContact O-CG 3.32Å; F148-M152 PolarHBondContact O-N 3.19Å; M152-E198 HydrophobicContact CE-CB 4.47Å; M152-R201 HydrophobicContact SD-CB 4.41Å; M152-I202 HydrophobicContact CE-CG1 4.22Å; M152-I202 HydrophobicContact SD-CB 4.38Å; M152-I202 HydrophobicContact SD-CD1 4.06Å; M152-I202 HydrophobicContact SD-CG1 3.21Å; M152-I202 WeakPolarHBondContact SD-CG1 3.48Å
153	G	43	Very low	43.5	Very low	58 Å²	58	89.4 Å²	89.4	60%	0.598	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	84.5	178.6	0	0	0	0	0	113.7	G149	G149-G153 CarbonylContact O-C 3.55Å; G149-G153 WeakPolarHBondContact O-CA 3.27Å; G149-G153 PolarHBondContact O-N 3.4Å
154	S	39.2	Very low	43	Very low	87 Å²	87	95 Å²	95	61%	0.608	50%	0.504	S	S	*	.			trans	-98.4	98.5	158.5	82.9	0	0	0	0	110	G149	G149-S154 PolarHBondContact O-N 2.87Å
155	N	38.3	Very low	42.6	Very low	143 Å²	143	102.3 Å²	102.3	77%	0.765	53%	0.532	S	S	*	.	S	Bend	trans	178.5	115	130.1	-80.5	-28.9	0	0	0	109.2
156	N	37.7	Very low	42.1	Very low	126 Å²	126	107.3 Å²	107.3	67%	0.674	55%	0.546	S	S	*	.			trans	79.9	110.2	175.6	-62.7	-31.5	0	0	0	118	S158	N156-S158 PolarHBondContact O-N 2.92Å; N156-S158 VanDerWaalsContact O-N 3.17Å
157	P	37.1	Very low	41.7	Very low	113 Å²	113	106.2 Å²	106.2	73%	0.734	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-7.5	170	28	-32.8	0	0	0	113.5	E159	P157-E159 PolarHBondContact O-N 2.9Å
158	S	39.5	Very low	41.4	Very low	105 Å²	105	116 Å²	116	73%	0.734	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-13.2	-177.6	-179.6	0	0	0	0	114.8	N156	N156-S158 PolarHBondContact O-N 2.92Å; N156-S158 VanDerWaalsContact O-N 3.17Å
159	E	36.7	Very low	41	Very low	153 Å²	153	117.9 Å²	117.9	72%	0.715	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-17	179.8	-141	169.9	-168.6	0	0	112.4	P157	P157-E159 PolarHBondContact O-N 2.9Å
160	A	37	Very low	40.5	Very low	53 Å²	53	125.2 Å²	125.2	44%	0.438	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-69.3	-32.7	177.2	0	0	0	0	0	112.6	R162	A160-R162 PolarHBondContact O-N 3.1Å
161	D	35.5	Very low	39.9	Very low	126 Å²	126	127.2 Å²	127.2	67%	0.674	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-77.8	0.6	-178.6	-65.7	-14.4	0	0	0	113.7
162	R	37.4	Very low	39.5	Very low	219 Å²	219	132.3 Å²	132.3	83%	0.826	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-92.4	-5.5	178.9	-147.7	178.7	-152.6	162.9	8.1	114.3	A160	A160-R162 PolarHBondContact O-N 3.1Å
163	Y	39.6	Very low	39.6	Very low	170 Å²	170	140.2 Å²	140.2	67%	0.667	71%	0.71	S	S	*	*			trans	-116.4	19.9	-178.1	-101.9	-86.5	0	0	0	113.6	Y165 Y166	Y163-Y165 VanDerWaalsContact C-N 3.27Å; Y163-Y165 PolarHBondContact O-N 3.01Å; Y163-Y166 HydrophobicContact CE1-CE2 4.45Å
164	D	36.6	Very low	39.2	Very low	128 Å²	128	146.4 Å²	146.4	68%	0.684	72%	0.721	S	S	*	*			trans	-85.3	61.5	168.6	-86.9	-5.3	0	0	0	110.9
165	Y	40.8	Very low	39.6	Very low	192 Å²	192	151.4 Å²	151.4	75%	0.753	73%	0.734	S	S	*	*			trans	-171.1	72.8	158.6	-158.2	-101.1	0	0	0	111.5	Y163	Y163-Y165 VanDerWaalsContact C-N 3.27Å; Y163-Y165 PolarHBondContact O-N 3.01Å
166	Y	37.5	Very low	39.5	Very low	187 Å²	187	148.1 Å²	148.1	73%	0.733	72%	0.72	S	S	*	*			trans	-136.4	94.2	150.6	-76.9	-71.3	0	0	0	108.5	Y163 Y168	Y163-Y166 HydrophobicContact CE1-CE2 4.45Å; Y166-Y168 WeakPolarHBondContact O-CD2 3.1Å; Y166-Y168 PolarHBondContact O-N 3.36Å
167	D	41.4	Very low	39.5	Very low	110 Å²	110	147.8 Å²	147.8	59%	0.588	72%	0.724	S	S	*	*			trans	-48.8	111.5	158.1	-177.2	7.3	0	0	0	109.1	S169	D167-S169 PolarHBondContact O-N 3.4Å; D167-S169 VanDerWaalsContact O-N 3.13Å; D167-S169 VanDerWaalsContact OD1-CB 3.23Å; D167-S169 WeakPolarHBondContact OD1-CB 3.11Å; D167-S169 PolarHBondContact OD1-N 2.9Å; D167-S169 PolarHBondContact OD1-OG 3.12Å
168	Y	43.8	Very low	39.5	Very low	216 Å²	216	147.6 Å²	147.6	85%	0.847	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	22.4	-177.9	-98	-84.8	0	0	0	112.7	Y166	Y166-Y168 WeakPolarHBondContact O-CD2 3.1Å; Y166-Y168 PolarHBondContact O-N 3.36Å
169	S	45.1	Very low	40	Very low	99 Å²	99	149.3 Å²	149.3	69%	0.692	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-10.4	-173.9	-52.9	0	0	0	0	114.6	D167	D167-S169 PolarHBondContact O-N 3.4Å; D167-S169 VanDerWaalsContact O-N 3.13Å; D167-S169 VanDerWaalsContact OD1-CB 3.23Å; D167-S169 WeakPolarHBondContact OD1-CB 3.11Å; D167-S169 PolarHBondContact OD1-N 2.9Å; D167-S169 PolarHBondContact OD1-OG 3.12Å
170	E	39.7	Very low	40.7	Very low	174 Å²	174	145.4 Å²	145.4	81%	0.813	70%	0.702	S	S	*	*	S	Bend	trans	-133.6	14.9	-164.3	-146.4	173.3	-167	0	0	117.5
171	L	40.1	Very low	41.5	Very low	172 Å²	172	152.3 Å²	152.3	90%	0.901	72%	0.717	S	S	*	*			trans	-138.9	75.6	175.8	-69.7	174.8	0	0	0	112.8
172	E	41.9	Very low	42.6	Very low	125 Å²	125	148.1 Å²	148.1	58%	0.584	70%	0.697	S	S	*	*			trans	-148.2	68	161.6	-121.1	172.4	-153.7	0	0	111.4	R179 R181	E172-R179 IonicContact OE1-CZ 2.73Å; E172-R179 IonicContact OE1-NH1 3.77Å; E172-R179 PolarHBondContact OE1-NH1 3.48Å; E172-R181 IonicContact OE2-NH2 3.71Å
173	E	44.3	Very low	43.7	Very low	189 Å²	189	141.9 Å²	141.9	88%	0.883	68%	0.68	S	S	*	*			trans	-128.5	72.3	159.5	-159.8	174.5	-138.8	0	0	108.3
174	F	34.1	Very low	44.9	Very low	188 Å²	188	137 Å²	137	83%	0.825	67%	0.67	S	S	*	*	S	Bend	trans	-162.5	125.9	152	-123.6	-88.4	0	0	0	109.2	T176	F174-T176 PolarHBondContact O-N 2.87Å
175	E	46.8	Very low	46.3	Very low	191 Å²	191	133.9 Å²	133.9	89%	0.893	65%	0.653	S	S	*	*			trans	-46.2	112.6	-175	-63.8	167.3	153.7	0	0	112.6
176	T	37.3	Very low	47.4	Very low	75 Å²	75	128 Å²	128	46%	0.46	64%	0.641	S	S	.	*			trans	-131.9	141.8	166.8	52.1	0	0	0	0	110.1	F174 R179	F174-T176 PolarHBondContact O-N 2.87Å; T176-R179 PolarHBondContact OG1-NE 2.84Å; T176-R179 PolarHBondContact OG1-NH2 3.47Å; T176-R179 VanDerWaalsContact OG1-NH2 3.13Å
177	P	38	Very low	49	Very low	118 Å²	118	120.1 Å²	120.1	77%	0.766	61%	0.614	S	S	*	*			trans	-62.5	150.5	-170.6	25.9	-33.5	0	0	0	111.2	R179	P177-R179 PolarHBondContact O-N 3.28Å
178	A	35.7	Very low	50.5	Low	110 Å²	110	115.2 Å²	115.2	91%	0.909	59%	0.588	S	S	*	*			trans	-33.4	98	-170.2	0	0	0	0	0	113.3	Y180	A178-Y180 PolarHBondContact O-N 2.97Å
179	R	51.3	Low	51.8	Low	141 Å²	141	106.9 Å²	106.9	53%	0.532	56%	0.561	S	S	.	*			trans	-70	122.2	172.4	-68.4	179.1	-174.4	179	-1.4	107.2	E172 T176 P177 R181	E172-R179 IonicContact OE1-CZ 2.73Å; E172-R179 IonicContact OE1-NH1 3.77Å; E172-R179 PolarHBondContact OE1-NH1 3.48Å; T176-R179 PolarHBondContact OG1-NE 2.84Å; T176-R179 PolarHBondContact OG1-NH2 3.47Å; T176-R179 VanDerWaalsContact OG1-NH2 3.13Å; P177-R179 PolarHBondContact O-N 3.28Å; R179-R181 PolarHBondContact O-N 3.44Å
180	Y	51.4	Low	53.2	Low	70 Å²	70	112.5 Å²	112.5	28%	0.275	57%	0.567	S	S	.	*			trans	-58	113.5	169	178.1	-98.4	0	0	0	108.2	A178 P182 G213 V214 S254 F255 E256	A178-Y180 PolarHBondContact O-N 2.97Å; Y180-P182 HydrophobicContact CE1-CB 4.25Å; Y180-P182 WeakPolarHBondContact O-CD 3.33Å; Y180-G213 WeakPolarHBondContact CD1-O 3.47Å; Y180-V214 HydrophobicContact CD2-CG1 4.45Å; Y180-V214 HydrophobicContact CG-CG1 4.08Å; Y180-S254 VanDerWaalsContact OH-CB 3.27Å; Y180-S254 WeakPolarHBondContact OH-CB 3.04Å; Y180-S254 PolarHBondContact OH-OG 2.67Å; Y180-F255 HydrophobicContact CE1-CB 4.24Å; Y180-E256 VanDerWaalsContact OH-CG 3.24Å; Y180-E256 WeakPolarHBondContact OH-CG 3.4Å; Y180-E256 PolarHBondContact OH-OE1 3.26Å
181	R	52.4	Low	54.6	Low	198 Å²	198	107.6 Å²	107.6	75%	0.747	56%	0.556	S	S	*	*			trans	-90.1	112.6	173	-90.3	-170.1	177.7	144.6	3.5	106.8	E172 R179	E172-R181 IonicContact OE2-NH2 3.71Å; R179-R181 PolarHBondContact O-N 3.44Å
182	P	59.5	Low	56.2	Low	39 Å²	39	99.7 Å²	99.7	25%	0.253	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-63.6	152.7	173	28.6	-34.1	0	0	0	109.8	Y180 L188 Y203 F255	Y180-P182 HydrophobicContact CE1-CB 4.25Å; Y180-P182 WeakPolarHBondContact O-CD 3.33Å; P182-L188 HydrophobicContact CB-CD1 4.5Å; P182-Y203 HydrophobicContact CG-CD2 4.49Å; P182-Y203 HydrophobicContact CG-CE2 3.83Å; P182-F255 HydrophobicContact CB-CB 4.49Å; P182-F255 HydrophobicContact CB-CD1 3.88Å
183	D	60.1	Low	57.8	Low	88 Å²	88	99.4 Å²	99.4	47%	0.471	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-48.1	151	168.5	-95.1	-14.4	0	0	0	111.2	L185 A187 L188 E256	D183-L185 PolarHBondContact O-N 3.21Å; D183-A187 HydrophobicContact CB-CB 4.34Å; D183-L188 HydrophobicContact CB-CG 4.28Å; D183-E256 WeakPolarHBondContact CA-OE1 3.22Å; D183-E256 HydrophobicContact CB-CG 4.4Å; D183-E256 WeakPolarHBondContact CB-OE1 3.44Å; D183-E256 VanDerWaalsContact CG-OE1 3.23Å; D183-E256 PolarHBondContact N-OE1 2.97Å
184	S	65.6	Low	59.2	Low	67 Å²	67	90.7 Å²	90.7	47%	0.469	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-49.4	137.2	179.9	64	0	0	0	0	110.7	S186 A187 L188	S184-S186 PolarHBondContact O-N 2.77Å; S184-S186 PolarHBondContact OG-OG 3.11Å; S184-S186 VanDerWaalsContact OG-OG 3.06Å; S184-A187 WeakPolarHBondContact O-CA 3.5Å; S184-A187 WeakPolarHBondContact O-CB 3.43Å; S184-A187 PolarHBondContact O-N 3.44Å; S184-A187 WeakPolarHBondContact OG-CB 3.29Å; S184-A187 PolarHBondContact OG-N 3.07Å; S184-L188 PolarHBondContact O-N 3.33Å; S184-L188 VanDerWaalsContact O-N 3.07Å
185	L	65.9	Low	61.3	Low	62 Å²	62	85 Å²	85	33%	0.325	45%	0.448	S	S	.	.	H	α-helix	trans	-51.6	-31.5	179.5	-68.2	171	0	0	0	112.3	D183 S189 E196 I199 K200	D183-L185 PolarHBondContact O-N 3.21Å; L185-S189 VanDerWaalsContact O-CB 3.26Å; L185-S189 WeakPolarHBondContact O-CB 3.12Å; L185-S189 PolarHBondContact O-N 3.45Å; L185-E196 HydrophobicContact CB-CG 4.48Å; L185-I199 HydrophobicContact CD2-CB 4.46Å; L185-I199 HydrophobicContact CD2-CG2 3.72Å; L185-K200 HydrophobicContact CD1-CD 4.41Å; L185-K200 HydrophobicContact CD1-CG 3.98Å; L185-K200 HydrophobicContact CD2-CG 4.36Å
186	S	62.9	Low	62.7	Low	70 Å²	70	79.9 Å²	79.9	49%	0.49	43%	0.425	S	S	.	.	H	α-helix	trans	-66.7	-37.4	173.1	49.5	0	0	0	0	114	S184 R190	S184-S186 PolarHBondContact O-N 2.77Å; S184-S186 PolarHBondContact OG-OG 3.11Å; S184-S186 VanDerWaalsContact OG-OG 3.06Å; S186-R190 WeakPolarHBondContact O-CB 3.46Å; S186-R190 PolarHBondContact O-N 3.45Å; S186-R190 VanDerWaalsContact O-N 3.12Å
187	A	71.9	Confident	64.3	Low	21 Å²	21	81 Å²	81	17%	0.174	43%	0.428	C	S	.	.	H	α-helix	trans	-69.6	-43.7	174.6	0	0	0	0	0	110.6	D183 S184 R190 A191	D183-A187 HydrophobicContact CB-CB 4.34Å; S184-A187 WeakPolarHBondContact O-CA 3.5Å; S184-A187 WeakPolarHBondContact O-CB 3.43Å; S184-A187 PolarHBondContact O-N 3.44Å; S184-A187 WeakPolarHBondContact OG-CB 3.29Å; S184-A187 PolarHBondContact OG-N 3.07Å; A187-R190 PolarHBondContact O-N 2.85Å; A187-R190 VanDerWaalsContact O-N 3.16Å; A187-A191 WeakPolarHBondContact O-CB 3.31Å; A187-A191 PolarHBondContact O-N 2.68Å
188	L	72.2	Confident	66	Low	7 Å²	7	76.8 Å²	76.8	4%	0.037	40%	0.398	C	S	.	.	H	α-helix	trans	-66	-38.6	176	-73.4	170.9	0	0	0	112.7	P182 D183 S184 R190 A191 T192 I199 F255 E256	P182-L188 HydrophobicContact CB-CD1 4.5Å; D183-L188 HydrophobicContact CB-CG 4.28Å; S184-L188 PolarHBondContact O-N 3.33Å; S184-L188 VanDerWaalsContact O-N 3.07Å; L188-R190 PolarHBondContact O-N 2.63Å; L188-A191 PolarHBondContact O-N 3.26Å; L188-T192 WeakPolarHBondContact O-CA 3.36Å; L188-T192 VanDerWaalsContact O-CB 3.24Å; L188-T192 WeakPolarHBondContact O-CB 3.5Å; L188-T192 WeakPolarHBondContact O-CG2 3.32Å; L188-T192 PolarHBondContact O-N 2.84Å; L188-T192 PolarHBondContact O-OG1 3.12Å; L188-I199 HydrophobicContact CB-CD1 4.02Å; L188-I199 HydrophobicContact CB-CG2 4.43Å; L188-I199 HydrophobicContact CD1-CG2 4.34Å; L188-F255 HydrophobicContact CD1-CD1 4Å; L188-F255 HydrophobicContact CD1-CE1 3.85Å; L188-E256 HydrophobicContact CD2-CB 4.02Å; L188-E256 HydrophobicContact CD2-CG 3.95Å
189	S	71.9	Confident	67.8	Low	40 Å²	40	71.5 Å²	71.5	28%	0.28	35%	0.354	S	S	.	.	H	α-helix	trans	-69.6	-22.7	174.5	-170.9	0	0	0	0	112.9	L185 T192 F194	L185-S189 VanDerWaalsContact O-CB 3.26Å; L185-S189 WeakPolarHBondContact O-CB 3.12Å; L185-S189 PolarHBondContact O-N 3.45Å; S189-T192 CarbonylContact C-O 3.54Å; S189-F194 PolarHBondContact OG-O 2.93Å
190	R	73.6	Confident	68.9	Low	218 Å²	218	68.4 Å²	68.4	82%	0.823	34%	0.344	S	S	*	.	H	α-helix	trans	-84	-36	172.8	-174.6	172.4	60.9	177.8	-1.3	112.5	S186 A187 L188	S186-R190 WeakPolarHBondContact O-CB 3.46Å; S186-R190 PolarHBondContact O-N 3.45Å; S186-R190 VanDerWaalsContact O-N 3.12Å; A187-R190 PolarHBondContact O-N 2.85Å; A187-R190 VanDerWaalsContact O-N 3.16Å; L188-R190 PolarHBondContact O-N 2.63Å
191	A	70.7	Confident	69.7	Low	70 Å²	70	70.2 Å²	70.2	58%	0.579	35%	0.351	S	S	*	.	H	α-helix	trans	-76.9	-29	178	0	0	0	0	0	112.2	A187 L188	A187-A191 WeakPolarHBondContact O-CB 3.31Å; A187-A191 PolarHBondContact O-N 2.68Å; L188-A191 PolarHBondContact O-N 3.26Å
192	T	73.7	Confident	70.7	Confident	6 Å²	6	60.8 Å²	60.8	4%	0.037	32%	0.315	C	S	.	.	S	Bend	trans	-116.2	155.5	-176.5	73.3	0	0	0	0	110.8	L188 S189 F194 V259	L188-T192 WeakPolarHBondContact O-CA 3.36Å; L188-T192 VanDerWaalsContact O-CB 3.24Å; L188-T192 WeakPolarHBondContact O-CB 3.5Å; L188-T192 WeakPolarHBondContact O-CG2 3.32Å; L188-T192 PolarHBondContact O-N 2.84Å; L188-T192 PolarHBondContact O-OG1 3.12Å; S189-T192 CarbonylContact C-O 3.54Å; T192-F194 PolarHBondContact O-N 2.71Å; T192-F194 VanDerWaalsContact O-N 3.13Å; T192-V259 HydrophobicContact CG2-CB 4.48Å; T192-V259 HydrophobicContact CG2-CG1 3.68Å
193	R	74.5	Confident	71.4	Confident	119 Å²	119	62.1 Å²	62.1	45%	0.449	32%	0.316	S	S	.	.	S	Bend	trans	-83.3	21.8	179.3	-61.4	-177.6	-176.4	111.9	9.6	112.3	S263 R267 G268 E272	R193-S263 PolarHBondContact N-OG 3.45Å; R193-R267 HydrophobicContact CB-CB 3.95Å; R193-R267 WeakPolarHBondContact CD-O 3.31Å; R193-R267 PolarHBondContact NH1-O 2.81Å; R193-R267 VanDerWaalsContact O-CD 3.29Å; R193-R267 WeakPolarHBondContact O-CD 3.46Å; R193-R267 PolarHBondContact O-NH1 2.88Å; R193-G268 VanDerWaalsContact NH1-CA 3.34Å; R193-E272 IonicContact CZ-OE1 3.5Å; R193-E272 IonicContact CZ-OE2 2.77Å; R193-E272 IonicContact NH1-OE1 3.7Å; R193-E272 IonicContact NH1-OE2 3.38Å; R193-E272 PolarHBondContact NH1-OE2 3.13Å; R193-E272 IonicContact NH2-OE1 3.36Å; R193-E272 PolarHBondContact NH2-OE1 2.79Å; R193-E272 IonicContact NH2-OE2 2.77Å; R193-E272 PolarHBondContact NH2-OE2 2.88Å; R193-E272 VanDerWaalsContact NH2-OE2 3.13Å
194	F	74.7	Confident	71.8	Confident	6 Å²	6	64.4 Å²	64.4	3%	0.026	32%	0.318	C	S	.	.	S	Bend	trans	-101.7	150	-179.1	-68.4	-63.6	0	0	0	112.1	S189 T192 E198 I199 I202 V259 L262 S263 S266	S189-F194 PolarHBondContact OG-O 2.93Å; T192-F194 PolarHBondContact O-N 2.71Å; T192-F194 VanDerWaalsContact O-N 3.13Å; F194-E198 WeakPolarHBondContact CA-OE2 3.46Å; F194-E198 HydrophobicContact CB-CB 4.16Å; F194-E198 HydrophobicContact CD1-CB 4.27Å; F194-I199 HydrophobicContact CB-CD1 4.2Å; F194-I199 HydrophobicContact CB-CG1 3.75Å; F194-I202 HydrophobicContact CD2-CD1 4.24Å; F194-I202 HydrophobicContact CE2-CD1 4.2Å; F194-I202 HydrophobicContact CG-CD1 4.46Å; F194-I202 HydrophobicContact CZ-CD1 4.39Å; F194-V259 HydrophobicContact CD2-CG1 3.99Å; F194-V259 HydrophobicContact CE2-CG1 4.44Å; F194-L262 HydrophobicContact CE2-CB 4.06Å; F194-L262 HydrophobicContact CZ-CB 4.33Å; F194-S263 VanDerWaalsContact CE2-CA 3.5Å; F194-S266 WeakPolarHBondContact CZ-OG 3.14Å
195	T	77.2	Confident	71.9	Confident	69 Å²	69	61.7 Å²	61.7	42%	0.423	30%	0.3	S	S	.	.			trans	-76.3	157	171.3	68.9	0	0	0	0	110.7	D197 E198 I199	T195-D197 PolarHBondContact O-N 3.41Å; T195-E198 PolarHBondContact N-OE2 3.38Å; T195-E198 WeakPolarHBondContact O-CB 3.32Å; T195-E198 PolarHBondContact O-N 3.03Å; T195-E198 VanDerWaalsContact OG1-CG 3.31Å; T195-E198 WeakPolarHBondContact OG1-CG 3.26Å; T195-E198 PolarHBondContact OG1-N 3.49Å; T195-E198 PolarHBondContact OG1-OE2 2.75Å; T195-I199 WeakPolarHBondContact O-CG1 3.32Å; T195-I199 PolarHBondContact O-N 3.28Å
196	E	75.4	Confident	72.2	Confident	84 Å²	84	59 Å²	59	39%	0.393	29%	0.286	S	S	.	.	H	α-helix	trans	-55.5	-35.3	177.3	-66.2	-172.1	174.2	0	0	112.7	L185 I199 K200	L185-E196 HydrophobicContact CB-CG 4.48Å; E196-I199 PolarHBondContact O-N 3.29Å; E196-K200 WeakPolarHBondContact O-CB 3.32Å; E196-K200 VanDerWaalsContact O-CG 3.23Å; E196-K200 WeakPolarHBondContact O-CG 3.39Å; E196-K200 PolarHBondContact O-N 2.86Å
197	D	71.3	Confident	72.5	Confident	98 Å²	98	60 Å²	60	52%	0.524	28%	0.281	S	S	.	.	H	α-helix	trans	-74.6	-27.4	178.2	-61.5	-33.2	0	0	0	113.2	T195 K200 R201	T195-D197 PolarHBondContact O-N 3.41Å; D197-K200 IonicContact OD1-NZ 3.68Å; D197-K200 PolarHBondContact OD1-NZ 3.16Å; D197-R201 WeakPolarHBondContact O-CG 3.36Å; D197-R201 PolarHBondContact O-N 2.93Å; D197-R201 PolarHBondContact O-NE 3.19Å; D197-R201 VanDerWaalsContact O-NE 3.14Å
198	E	73.4	Confident	72.2	Confident	29 Å²	29	62.8 Å²	62.8	14%	0.136	31%	0.305	C	S	.	.	H	α-helix	trans	-69.5	-47.4	168.2	-71.6	171.8	149.3	0	0	110.2	M152 F194 T195 K200 R201 I202 R267	M152-E198 HydrophobicContact CE-CB 4.47Å; F194-E198 WeakPolarHBondContact CA-OE2 3.46Å; F194-E198 HydrophobicContact CB-CB 4.16Å; F194-E198 HydrophobicContact CD1-CB 4.27Å; T195-E198 PolarHBondContact N-OE2 3.38Å; T195-E198 WeakPolarHBondContact O-CB 3.32Å; T195-E198 PolarHBondContact O-N 3.03Å; T195-E198 VanDerWaalsContact OG1-CG 3.31Å; T195-E198 WeakPolarHBondContact OG1-CG 3.26Å; T195-E198 PolarHBondContact OG1-N 3.49Å; T195-E198 PolarHBondContact OG1-OE2 2.75Å; E198-K200 VanDerWaalsContact C-N 3.33Å; E198-K200 PolarHBondContact O-N 2.81Å; E198-R201 VanDerWaalsContact CG-NH2 3.27Å; E198-R201 WeakPolarHBondContact O-CB 3.25Å; E198-R201 PolarHBondContact O-N 3.18Å; E198-I202 WeakPolarHBondContact O-CG1 3.48Å; E198-I202 PolarHBondContact O-N 2.94Å; E198-R267 VanDerWaalsContact CD-NH2 3.32Å; E198-R267 IonicContact OE1-CZ 2.59Å; E198-R267 IonicContact OE1-NH1 3.57Å; E198-R267 IonicContact OE1-NH2 3.82Å; E198-R267 PolarHBondContact OE1-NH2 2.91Å; E198-R267 IonicContact OE2-CZ 3.97Å; E198-R267 IonicContact OE2-NH1 3.58Å; E198-R267 PolarHBondContact OE2-NH1 2.84Å; E198-R267 IonicContact OE2-NH2 2.92Å; E198-R267 PolarHBondContact OE2-NH2 2.8Å
199	I	75.1	Confident	71.8	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-42.9	178.7	-63.4	165.9	0	0	0	110.7	L185 L188 F194 T195 E196 R201 I202 Y203 F255 V259	L185-I199 HydrophobicContact CD2-CB 4.46Å; L185-I199 HydrophobicContact CD2-CG2 3.72Å; L188-I199 HydrophobicContact CB-CD1 4.02Å; L188-I199 HydrophobicContact CB-CG2 4.43Å; L188-I199 HydrophobicContact CD1-CG2 4.34Å; F194-I199 HydrophobicContact CB-CD1 4.2Å; F194-I199 HydrophobicContact CB-CG1 3.75Å; T195-I199 WeakPolarHBondContact O-CG1 3.32Å; T195-I199 PolarHBondContact O-N 3.28Å; E196-I199 PolarHBondContact O-N 3.29Å; I199-R201 VanDerWaalsContact C-N 3.31Å; I199-R201 PolarHBondContact O-N 3.25Å; I199-I202 PolarHBondContact O-N 3.43Å; I199-Y203 WeakPolarHBondContact O-CB 3.47Å; I199-Y203 PolarHBondContact O-N 2.65Å; I199-F255 HydrophobicContact CG2-CE1 3.89Å; I199-F255 HydrophobicContact CG2-CZ 4Å; I199-V259 HydrophobicContact CG1-CG1 4.35Å
200	K	73.1	Confident	71.5	Confident	75 Å²	75	64.2 Å²	64.2	33%	0.326	31%	0.307	S	S	.	.	H	α-helix	trans	-59.5	-39.6	174.1	-74.4	169.7	-165.8	163.4	0	112.4	L185 E196 D197 E198 Y203 R204	L185-K200 HydrophobicContact CD1-CD 4.41Å; L185-K200 HydrophobicContact CD1-CG 3.98Å; L185-K200 HydrophobicContact CD2-CG 4.36Å; E196-K200 WeakPolarHBondContact O-CB 3.32Å; E196-K200 VanDerWaalsContact O-CG 3.23Å; E196-K200 WeakPolarHBondContact O-CG 3.39Å; E196-K200 PolarHBondContact O-N 2.86Å; D197-K200 IonicContact OD1-NZ 3.68Å; D197-K200 PolarHBondContact OD1-NZ 3.16Å; E198-K200 VanDerWaalsContact C-N 3.33Å; E198-K200 PolarHBondContact O-N 2.81Å; K200-Y203 PolarHBondContact O-N 3.5Å; K200-R204 VanDerWaalsContact O-CG 3.26Å; K200-R204 WeakPolarHBondContact O-CG 3.47Å; K200-R204 PolarHBondContact O-N 3.08Å
201	R	69.4	Low	71.1	Confident	109 Å²	109	58.8 Å²	58.8	41%	0.411	30%	0.301	S	S	.	.	H	α-helix	trans	-67.2	-45.9	176.4	-78	-179.3	-73.6	166.8	-4.5	111.5	M152 D197 E198 I199 Y203 R204 G205	M152-R201 HydrophobicContact SD-CB 4.41Å; D197-R201 WeakPolarHBondContact O-CG 3.36Å; D197-R201 PolarHBondContact O-N 2.93Å; D197-R201 PolarHBondContact O-NE 3.19Å; D197-R201 VanDerWaalsContact O-NE 3.14Å; E198-R201 VanDerWaalsContact CG-NH2 3.27Å; E198-R201 WeakPolarHBondContact O-CB 3.25Å; E198-R201 PolarHBondContact O-N 3.18Å; I199-R201 VanDerWaalsContact C-N 3.31Å; I199-R201 PolarHBondContact O-N 3.25Å; R201-Y203 VanDerWaalsContact C-N 3.29Å; R201-Y203 PolarHBondContact O-N 3.41Å; R201-R204 PolarHBondContact O-N 3.05Å; R201-G205 PolarHBondContact O-N 3.38Å
202	I	73.1	Confident	70.9	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58.4	-45	175	-57.7	165.4	0	0	0	109.8	I151 M152 F194 E198 I199 R204 G205 F206 F255 F258 V259 L262	I151-I202 HydrophobicContact CG2-CG2 4.23Å; M152-I202 HydrophobicContact CE-CG1 4.22Å; M152-I202 HydrophobicContact SD-CB 4.38Å; M152-I202 HydrophobicContact SD-CD1 4.06Å; M152-I202 HydrophobicContact SD-CG1 3.21Å; M152-I202 WeakPolarHBondContact SD-CG1 3.48Å; F194-I202 HydrophobicContact CD2-CD1 4.24Å; F194-I202 HydrophobicContact CE2-CD1 4.2Å; F194-I202 HydrophobicContact CG-CD1 4.46Å; F194-I202 HydrophobicContact CZ-CD1 4.39Å; E198-I202 WeakPolarHBondContact O-CG1 3.48Å; E198-I202 PolarHBondContact O-N 2.94Å; I199-I202 PolarHBondContact O-N 3.43Å; I202-R204 PolarHBondContact O-N 2.76Å; I202-G205 PolarHBondContact O-N 2.97Å; I202-F206 VanDerWaalsContact O-CB 3.27Å; I202-F206 WeakPolarHBondContact O-CB 3.43Å; I202-F206 PolarHBondContact O-N 2.99Å; I202-F255 HydrophobicContact CB-CE2 4.36Å; I202-F255 HydrophobicContact CB-CZ 4.45Å; I202-F255 HydrophobicContact CG2-CE2 3.95Å; I202-F255 HydrophobicContact CG2-CZ 4.45Å; I202-F258 HydrophobicContact CG2-CD1 4.09Å; I202-F258 HydrophobicContact CG2-CE1 3.86Å; I202-V259 HydrophobicContact CG2-CG2 4.06Å; I202-L262 HydrophobicContact CD1-CD1 4.47Å; I202-L262 HydrophobicContact CG2-CD1 3.91Å
203	Y	73.3	Confident	70.6	Confident	66 Å²	66	60.1 Å²	60.1	26%	0.259	30%	0.303	S	S	.	.	H	α-helix	trans	-60.7	-43.6	178.2	-171.9	-108.6	0	0	0	112.4	P182 I199 K200 R201 F206 K207 F255	P182-Y203 HydrophobicContact CG-CD2 4.49Å; P182-Y203 HydrophobicContact CG-CE2 3.83Å; I199-Y203 WeakPolarHBondContact O-CB 3.47Å; I199-Y203 PolarHBondContact O-N 2.65Å; K200-Y203 PolarHBondContact O-N 3.5Å; R201-Y203 VanDerWaalsContact C-N 3.29Å; R201-Y203 PolarHBondContact O-N 3.41Å; Y203-F206 PolarHBondContact O-N 2.86Å; Y203-K207 WeakPolarHBondContact O-CB 3.33Å; Y203-K207 PolarHBondContact O-N 2.66Å; Y203-F255 VanDerWaalsContact CB-CZ 3.43Å; Y203-F255 AromaticContact CD2-CD1 3.71Å; Y203-F255 HydrophobicContact CD2-CD1 3.71Å; Y203-F255 AromaticContact CD2-CD2 3.75Å; Y203-F255 HydrophobicContact CD2-CD2 3.75Å; Y203-F255 AromaticContact CD2-CE1 3.68Å; Y203-F255 HydrophobicContact CD2-CE1 3.68Å; Y203-F255 AromaticContact CD2-CE2 3.75Å; Y203-F255 HydrophobicContact CD2-CE2 3.75Å; Y203-F255 AromaticContact CD2-CG 3.73Å; Y203-F255 HydrophobicContact CD2-CG 3.73Å; Y203-F255 AromaticContact CD2-CZ 3.7Å; Y203-F255 HydrophobicContact CD2-CZ 3.7Å; Y203-F255 HydrophobicContact CE2-CD1 4.3Å; Y203-F255 HydrophobicContact CE2-CG 4.23Å; Y203-F255 HydrophobicContact CG-CE1 4.27Å; Y203-F255 HydrophobicContact CG-CE2 4.27Å; Y203-F255 HydrophobicContact CG-CZ 4.05Å
204	R	69	Low	70.8	Confident	137 Å²	137	55.8 Å²	55.8	52%	0.517	29%	0.289	S	S	.	.	H	α-helix	trans	-60.8	-45.7	176.5	-74.5	171.9	-176.3	-174.8	1.6	111.6	K200 R201 I202 A208	K200-R204 VanDerWaalsContact O-CG 3.26Å; K200-R204 WeakPolarHBondContact O-CG 3.47Å; K200-R204 PolarHBondContact O-N 3.08Å; R201-R204 PolarHBondContact O-N 3.05Å; I202-R204 PolarHBondContact O-N 2.76Å; R204-A208 WeakPolarHBondContact O-CB 3.39Å; R204-A208 PolarHBondContact O-N 3.33Å
205	G	68.5	Low	71	Confident	10 Å²	10	55.9 Å²	55.9	10%	0.103	29%	0.29	C	S	.	.	H	α-helix	trans	-65.6	-41.8	176.2	0	0	0	0	0	112.7	R201 I202 A208 E209	R201-G205 PolarHBondContact O-N 3.38Å; I202-G205 PolarHBondContact O-N 2.97Å; G205-A208 PolarHBondContact O-N 3.38Å; G205-E209 PolarHBondContact O-N 2.85Å
206	F	70.4	Confident	71.3	Confident	6 Å²	6	58.3 Å²	58.3	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-46.2	176	-174.9	-87.6	0	0	0	111.7	I202 Y203 A208 E209 C210 G213 V215 F255 F258	I202-F206 VanDerWaalsContact O-CB 3.27Å; I202-F206 WeakPolarHBondContact O-CB 3.43Å; I202-F206 PolarHBondContact O-N 2.99Å; Y203-F206 PolarHBondContact O-N 2.86Å; F206-A208 VanDerWaalsContact C-N 3.31Å; F206-A208 PolarHBondContact O-N 3.43Å; F206-E209 PolarHBondContact O-N 3.12Å; F206-C210 WeakPolarHBondContact O-CA 3.02Å; F206-C210 WeakPolarHBondContact O-CB 3.44Å; F206-C210 PolarHBondContact O-N 3.04Å; F206-G213 WeakPolarHBondContact CE1-O 3.37Å; F206-V215 HydrophobicContact CD2-CG2 4.05Å; F206-V215 HydrophobicContact CE1-CG2 4.35Å; F206-V215 HydrophobicContact CE2-CB 4.33Å; F206-V215 HydrophobicContact CE2-CG2 3.22Å; F206-V215 HydrophobicContact CZ-CB 4.34Å; F206-V215 HydrophobicContact CZ-CG2 3.41Å; F206-V215 VanDerWaalsContact CZ-CG2 3.41Å; F206-F255 HydrophobicContact CB-CD2 4.06Å; F206-F255 HydrophobicContact CB-CE2 4.18Å; F206-F255 HydrophobicContact CD1-CB 4.5Å; F206-F255 AromaticContact CD1-CD2 3.98Å; F206-F255 HydrophobicContact CD1-CD2 3.98Å; F206-F255 HydrophobicContact CD2-CD2 4.11Å; F206-F255 HydrophobicContact CE1-CB 4.16Å; F206-F255 HydrophobicContact CE1-CD2 4.4Å; F206-F255 HydrophobicContact CE2-CD2 4.49Å; F206-F255 AromaticContact CG-CD2 3.81Å; F206-F255 HydrophobicContact CG-CD2 3.81Å; F206-F255 HydrophobicContact CG-CE2 4.41Å; F206-F255 HydrophobicContact CZ-CB 4.31Å; F206-F258 HydrophobicContact CD2-CB 4.44Å; F206-F258 AromaticContact CD2-CD1 3.68Å; F206-F258 HydrophobicContact CD2-CD1 3.68Å; F206-F258 HydrophobicContact CD2-CE1 4.05Å; F206-F258 HydrophobicContact CD2-CG 4.05Å; F206-F258 HydrophobicContact CE2-CB 4Å; F206-F258 HydrophobicContact CE2-CD1 4.08Å; F206-F258 AromaticContact CE2-CG 3.98Å; F206-F258 HydrophobicContact CE2-CG 3.98Å
207	K	69.6	Low	71.7	Confident	89 Å²	89	56.8 Å²	56.8	39%	0.387	29%	0.288	S	S	.	.	H	α-helix	trans	-71.2	-25.9	179.7	-139.3	-140.3	-168.6	-169.9	0	113.4	Y203 C210	Y203-K207 WeakPolarHBondContact O-CB 3.33Å; Y203-K207 PolarHBondContact O-N 2.66Å; K207-C210 CarbonylContact O-C 3.46Å
208	A	66.4	Low	72.2	Confident	81 Å²	81	57.7 Å²	57.7	67%	0.669	29%	0.293	S	S	*	.	H	α-helix	trans	-70.4	-39.5	175.4	0	0	0	0	0	111.8	R204 G205 F206	R204-A208 WeakPolarHBondContact O-CB 3.39Å; R204-A208 PolarHBondContact O-N 3.33Å; G205-A208 PolarHBondContact O-N 3.38Å; F206-A208 VanDerWaalsContact C-N 3.31Å; F206-A208 PolarHBondContact O-N 3.43Å
209	E	63.5	Low	72.5	Confident	71 Å²	71	58.9 Å²	58.9	33%	0.332	30%	0.302	S	S	.	.	H	α-helix	trans	-85.1	-28.3	177.5	-61.2	-68.4	161.1	0	0	112	G205 F206 I223	G205-E209 PolarHBondContact O-N 2.85Å; F206-E209 PolarHBondContact O-N 3.12Å; E209-I223 HydrophobicContact CB-CD1 3.96Å
210	C	66.6	Low	72.8	Confident	5 Å²	5	59.4 Å²	59.4	3%	0.034	30%	0.304	C	S	.	.			trans	-132	86.7	-177.8	-68.1	0	0	0	0	111.1	F206 K207 T212 G213 V215	F206-C210 WeakPolarHBondContact O-CA 3.02Å; F206-C210 WeakPolarHBondContact O-CB 3.44Å; F206-C210 PolarHBondContact O-N 3.04Å; K207-C210 CarbonylContact O-C 3.46Å; C210-T212 PolarHBondContact O-N 2.79Å; C210-T212 VanDerWaalsContact O-N 3.13Å; C210-G213 PolarHBondContact O-N 2.92Å; C210-G213 VanDerWaalsContact O-N 3.11Å; C210-V215 HydrophobicContact CB-CG2 4.22Å; C210-V215 VanDerWaalsContact SG-CG2 3.55Å
211	P	65.3	Low	73.1	Confident	105 Å²	105	57.9 Å²	57.9	68%	0.682	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.2	-175.4	24	-32.5	0	0	0	114	G213	P211-G213 VanDerWaalsContact C-N 3.31Å
212	T	64.9	Low	73.3	Confident	98 Å²	98	56.6 Å²	56.6	60%	0.601	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-16.6	175.9	47	0	0	0	0	113.6	C210 V214	C210-T212 PolarHBondContact O-N 2.79Å; C210-T212 VanDerWaalsContact O-N 3.13Å; T212-V214 VanDerWaalsContact C-N 3.27Å; T212-V214 PolarHBondContact O-N 3.36Å; T212-V214 PolarHBondContact OG1-O 2.71Å
213	G	68.8	Low	73.3	Confident	6 Å²	6	57.5 Å²	57.5	6%	0.062	31%	0.306	C	S	.	.	S	Bend	trans	78	8.9	-176.5	0	0	0	0	0	114.7	Y180 F206 C210 P211	Y180-G213 WeakPolarHBondContact CD1-O 3.47Å; F206-G213 WeakPolarHBondContact CE1-O 3.37Å; C210-G213 PolarHBondContact O-N 2.92Å; C210-G213 VanDerWaalsContact O-N 3.11Å; P211-G213 VanDerWaalsContact C-N 3.31Å
214	V	77.1	Confident	73.2	Confident	27 Å²	27	54.6 Å²	54.6	16%	0.164	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	145.8	172.8	-65	0	0	0	0	109.4	Y180 T212	Y180-V214 HydrophobicContact CD2-CG1 4.45Å; Y180-V214 HydrophobicContact CG-CG1 4.08Å; T212-V214 VanDerWaalsContact C-N 3.27Å; T212-V214 PolarHBondContact O-N 3.36Å; T212-V214 PolarHBondContact OG1-O 2.71Å
215	V	80.1	Confident	73.3	Confident	8 Å²	8	50.5 Å²	50.5	5%	0.048	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	120.5	177.5	173.7	0	0	0	0	109.1	F206 C210 F220 F242 V253	F206-V215 HydrophobicContact CD2-CG2 4.05Å; F206-V215 HydrophobicContact CE1-CG2 4.35Å; F206-V215 HydrophobicContact CE2-CB 4.33Å; F206-V215 HydrophobicContact CE2-CG2 3.22Å; F206-V215 HydrophobicContact CZ-CB 4.34Å; F206-V215 HydrophobicContact CZ-CG2 3.41Å; F206-V215 VanDerWaalsContact CZ-CG2 3.41Å; C210-V215 HydrophobicContact CB-CG2 4.22Å; C210-V215 VanDerWaalsContact SG-CG2 3.55Å; V215-F220 HydrophobicContact CG1-CB 3.77Å; V215-F220 HydrophobicContact CG1-CD2 4.15Å; V215-F220 HydrophobicContact CG1-CG 4.46Å; V215-F242 HydrophobicContact CG1-CE2 4.27Å; V215-V253 HydrophobicContact CB-CB 4.28Å; V215-V253 PolarHBondContact N-O 3.45Å; V215-V253 PolarHBondContact O-N 3.33Å
216	K	83.7	Confident	73.2	Confident	121 Å²	121	55.3 Å²	55.3	53%	0.526	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	156	169.4	-64.4	-174.2	177.9	-171.8	0	110.4	D218 T219 F220 I252	K216-D218 VanDerWaalsContact C-N 3.34Å; K216-D218 PolarHBondContact O-N 3.06Å; K216-T219 WeakPolarHBondContact O-CA 3.2Å; K216-T219 WeakPolarHBondContact O-CB 3.04Å; K216-T219 PolarHBondContact O-N 3.14Å; K216-F220 PolarHBondContact O-N 2.87Å; K216-I252 HydrophobicContact CG-CG2 4.19Å
217	E	83.2	Confident	72.8	Confident	52 Å²	52	56.5 Å²	56.5	24%	0.243	31%	0.312	C	S	.	.	H	α-helix	trans	-54.2	-45.9	-179.5	-163.2	-160.9	146.8	0	0	113.2	T219 F220 K221 H239 F242	E217-T219 VanDerWaalsContact C-N 3.3Å; E217-T219 PolarHBondContact O-N 3.36Å; E217-F220 WeakPolarHBondContact O-CB 3.08Å; E217-F220 PolarHBondContact O-N 3.32Å; E217-K221 HydrophobicContact CG-CD 4.41Å; E217-K221 WeakPolarHBondContact O-CG 3.2Å; E217-K221 PolarHBondContact O-N 3.36Å; E217-K221 WeakPolarHBondContact OE1-CE 3.39Å; E217-K221 IonicContact OE1-NZ 2.79Å; E217-K221 PolarHBondContact OE1-NZ 3.13Å; E217-H239 IonicContact OE1-CD2 3.41Å; E217-H239 PolarHBondContact OE1-CD2 3.33Å; E217-H239 IonicContact OE1-CG 3.19Å; E217-H239 IonicContact OE1-NE2 3.69Å; E217-F242 HydrophobicContact CB-CD1 3.93Å; E217-F242 HydrophobicContact CB-CD2 4.35Å; E217-F242 HydrophobicContact CB-CE1 3.8Å; E217-F242 HydrophobicContact CB-CE2 4.21Å; E217-F242 HydrophobicContact CB-CG 4.2Å; E217-F242 HydrophobicContact CB-CZ 3.93Å; E217-F242 HydrophobicContact CG-CB 4.27Å; E217-F242 HydrophobicContact CG-CD1 3.68Å; E217-F242 HydrophobicContact CG-CD2 4.37Å; E217-F242 HydrophobicContact CG-CE1 4.08Å; E217-F242 HydrophobicContact CG-CG 3.84Å
218	D	81.9	Confident	72.4	Confident	116 Å²	116	53.5 Å²	53.5	62%	0.62	30%	0.299	S	S	*	.	H	α-helix	trans	-61.4	-40	177.7	-65.9	-46.2	0	0	0	112.2	K216 K221 V222	K216-D218 VanDerWaalsContact C-N 3.34Å; K216-D218 PolarHBondContact O-N 3.06Å; D218-K221 PolarHBondContact O-N 2.95Å; D218-V222 WeakPolarHBondContact O-CG2 3.44Å; D218-V222 PolarHBondContact O-N 3.47Å
219	T	79.7	Confident	72.2	Confident	55 Å²	55	54.4 Å²	54.4	34%	0.337	30%	0.298	S	S	.	.	H	α-helix	trans	-67.1	-41.9	176.8	-50	0	0	0	0	110.5	K216 E217 V222 I223	K216-T219 WeakPolarHBondContact O-CA 3.2Å; K216-T219 WeakPolarHBondContact O-CB 3.04Å; K216-T219 PolarHBondContact O-N 3.14Å; E217-T219 VanDerWaalsContact C-N 3.3Å; E217-T219 PolarHBondContact O-N 3.36Å; T219-V222 PolarHBondContact O-N 3.12Å; T219-I223 HydrophobicContact CG2-CD1 3.97Å; T219-I223 VanDerWaalsContact O-CG1 3.29Å; T219-I223 WeakPolarHBondContact O-CG1 3.4Å; T219-I223 PolarHBondContact O-N 3.1Å
220	F	80.8	Confident	71.4	Confident	10 Å²	10	61 Å²	61	4%	0.044	33%	0.329	C	S	.	.	H	α-helix	trans	-60.1	-47.3	174.9	-172.4	-99	0	0	0	111.3	V215 K216 E217 V222 I223 Y224 A238 V241 F242 L245	V215-F220 HydrophobicContact CG1-CB 3.77Å; V215-F220 HydrophobicContact CG1-CD2 4.15Å; V215-F220 HydrophobicContact CG1-CG 4.46Å; K216-F220 PolarHBondContact O-N 2.87Å; E217-F220 WeakPolarHBondContact O-CB 3.08Å; E217-F220 PolarHBondContact O-N 3.32Å; F220-V222 VanDerWaalsContact C-N 3.35Å; F220-V222 PolarHBondContact O-N 3.44Å; F220-I223 PolarHBondContact O-N 3.34Å; F220-Y224 HydrophobicContact CE1-CD2 4.06Å; F220-Y224 HydrophobicContact CE1-CG 4.36Å; F220-Y224 HydrophobicContact CZ-CD2 4.05Å; F220-Y224 WeakPolarHBondContact O-CB 3.29Å; F220-Y224 PolarHBondContact O-N 2.81Å; F220-A238 HydrophobicContact CD1-CB 4.31Å; F220-A238 HydrophobicContact CE1-CB 4.34Å; F220-A238 WeakPolarHBondContact CE1-O 3.24Å; F220-V241 HydrophobicContact CE1-CB 4.19Å; F220-V241 HydrophobicContact CE1-CG1 4.08Å; F220-V241 HydrophobicContact CZ-CB 4.42Å; F220-V241 HydrophobicContact CZ-CG1 3.79Å; F220-F242 HydrophobicContact CB-CD2 3.7Å; F220-F242 HydrophobicContact CB-CE2 4.28Å; F220-F242 HydrophobicContact CD1-CB 3.91Å; F220-F242 HydrophobicContact CD1-CD2 4.19Å; F220-F242 HydrophobicContact CD2-CD2 4.43Å; F220-F242 HydrophobicContact CE1-CB 4.28Å; F220-F242 HydrophobicContact CG-CB 4.45Å; F220-F242 AromaticContact CG-CD2 3.87Å; F220-F242 HydrophobicContact CG-CD2 3.87Å; F220-L245 HydrophobicContact CE2-CD1 4.02Å; F220-L245 HydrophobicContact CZ-CD1 4.18Å
221	K	78.9	Confident	70.7	Confident	44 Å²	44	64 Å²	64	19%	0.191	36%	0.362	C	S	.	.	H	α-helix	trans	-56.9	-45.2	175.7	-77.4	165	164.9	172.4	0	112.1	E217 D218 Y224 S225 T235 A238	E217-K221 HydrophobicContact CG-CD 4.41Å; E217-K221 WeakPolarHBondContact O-CG 3.2Å; E217-K221 PolarHBondContact O-N 3.36Å; E217-K221 WeakPolarHBondContact OE1-CE 3.39Å; E217-K221 IonicContact OE1-NZ 2.79Å; E217-K221 PolarHBondContact OE1-NZ 3.13Å; D218-K221 PolarHBondContact O-N 2.95Å; K221-Y224 PolarHBondContact O-N 3.38Å; K221-S225 VanDerWaalsContact O-CB 3.23Å; K221-S225 WeakPolarHBondContact O-CB 3.28Å; K221-S225 PolarHBondContact O-N 3.26Å; K221-S225 PolarHBondContact O-OG 3.41Å; K221-T235 HydrophobicContact CD-CG2 3.8Å; K221-T235 WeakPolarHBondContact CE-O 3.35Å; K221-T235 HydrophobicContact CG-CG2 4.25Å; K221-A238 HydrophobicContact CG-CB 3.91Å
222	V	74.7	Confident	70.5	Confident	82 Å²	82	60.2 Å²	60.2	50%	0.497	34%	0.339	S	S	.	.	H	α-helix	trans	-61.6	-51.8	177.4	170.3	0	0	0	0	110.6	D218 T219 F220 Y224 S225 Q226	D218-V222 WeakPolarHBondContact O-CG2 3.44Å; D218-V222 PolarHBondContact O-N 3.47Å; T219-V222 PolarHBondContact O-N 3.12Å; F220-V222 VanDerWaalsContact C-N 3.35Å; F220-V222 PolarHBondContact O-N 3.44Å; V222-Y224 VanDerWaalsContact C-N 3.34Å; V222-Y224 PolarHBondContact O-N 2.84Å; V222-S225 PolarHBondContact O-N 3.39Å; V222-S225 VanDerWaalsContact O-N 3.16Å; V222-S225 PolarHBondContact O-OG 3.12Å; V222-Q226 WeakPolarHBondContact O-CG 3.34Å; V222-Q226 PolarHBondContact O-N 3.45Å
223	I	73.2	Confident	70.6	Confident	18 Å²	18	59.1 Å²	59.1	9%	0.092	33%	0.329	C	S	.	.	H	α-helix	trans	-57.1	-51.6	178.1	-67	165.9	0	0	0	109.2	L147 E209 T219 F220 S225 Q226 F227	L147-I223 HydrophobicContact CD1-CG2 3.68Å; L147-I223 HydrophobicContact CD2-CG2 4.26Å; E209-I223 HydrophobicContact CB-CD1 3.96Å; T219-I223 HydrophobicContact CG2-CD1 3.97Å; T219-I223 VanDerWaalsContact O-CG1 3.29Å; T219-I223 WeakPolarHBondContact O-CG1 3.4Å; T219-I223 PolarHBondContact O-N 3.1Å; F220-I223 PolarHBondContact O-N 3.34Å; I223-S225 PolarHBondContact O-N 3.16Å; I223-Q226 WeakPolarHBondContact O-CB 3.43Å; I223-Q226 PolarHBondContact O-N 3.31Å; I223-F227 HydrophobicContact CG2-CE2 3.82Å; I223-F227 WeakPolarHBondContact O-CD2 2.94Å; I223-F227 WeakPolarHBondContact O-CE2 3.09Å
224	Y	71.4	Confident	70.6	Confident	6 Å²	6	59.1 Å²	59.1	2%	0.024	33%	0.328	C	S	.	.	H	α-helix	trans	-61	-27.5	-179.9	-158.6	-97	0	0	0	113.2	I140 F144 F220 K221 V222 F227 F228 P234 Y237 A238	I140-Y224 VanDerWaalsContact CG2-OH 3.25Å; I140-Y224 WeakPolarHBondContact CG2-OH 3.33Å; F144-Y224 HydrophobicContact CD2-CE2 4.47Å; F220-Y224 HydrophobicContact CE1-CD2 4.06Å; F220-Y224 HydrophobicContact CE1-CG 4.36Å; F220-Y224 HydrophobicContact CZ-CD2 4.05Å; F220-Y224 WeakPolarHBondContact O-CB 3.29Å; F220-Y224 PolarHBondContact O-N 2.81Å; K221-Y224 PolarHBondContact O-N 3.38Å; V222-Y224 VanDerWaalsContact C-N 3.34Å; V222-Y224 PolarHBondContact O-N 2.84Å; Y224-F227 WeakPolarHBondContact O-CB 3.13Å; Y224-F228 HydrophobicContact CD1-CD2 4.49Å; Y224-F228 AromaticContact CD1-CE2 3.71Å; Y224-F228 HydrophobicContact CD1-CE2 3.71Å; Y224-F228 AromaticContact CE1-CE2 3.45Å; Y224-F228 HydrophobicContact CE1-CE2 3.45Å; Y224-F228 VanDerWaalsContact CE1-CE2 3.45Å; Y224-F228 AromaticContact CE1-CZ 3.87Å; Y224-F228 HydrophobicContact CE1-CZ 3.87Å; Y224-F228 WeakPolarHBondContact O-CD2 3.21Å; Y224-F228 WeakPolarHBondContact O-CE2 3.32Å; Y224-P234 HydrophobicContact CD1-CB 4.06Å; Y224-P234 HydrophobicContact CE1-CB 4.34Å; Y224-Y237 HydrophobicContact CE1-CD1 4.04Å; Y224-Y237 WeakPolarHBondContact OH-CD1 3.35Å; Y224-Y237 VanDerWaalsContact OH-CE1 3.28Å; Y224-Y237 WeakPolarHBondContact OH-CE1 3.43Å; Y224-A238 HydrophobicContact CD1-CB 3.59Å; Y224-A238 HydrophobicContact CE1-CB 4.24Å; Y224-A238 HydrophobicContact CG-CB 3.93Å
225	S	71	Confident	70.7	Confident	50 Å²	50	60.6 Å²	60.6	35%	0.35	34%	0.338	S	S	.	.	H	α-helix	trans	-78.5	-28.6	178.3	75.4	0	0	0	0	114.6	K221 V222 I223 F227 F228	K221-S225 VanDerWaalsContact O-CB 3.23Å; K221-S225 WeakPolarHBondContact O-CB 3.28Å; K221-S225 PolarHBondContact O-N 3.26Å; K221-S225 PolarHBondContact O-OG 3.41Å; V222-S225 PolarHBondContact O-N 3.39Å; V222-S225 VanDerWaalsContact O-N 3.16Å; V222-S225 PolarHBondContact O-OG 3.12Å; I223-S225 PolarHBondContact O-N 3.16Å; S225-F227 PolarHBondContact O-N 2.78Å; S225-F228 PolarHBondContact O-N 2.8Å
226	Q	66.3	Low	70.7	Confident	111 Å²	111	63.6 Å²	63.6	52%	0.519	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-2.8	179.5	-67.5	176.5	17.7	0	0	114.4	V222 I223	V222-Q226 WeakPolarHBondContact O-CG 3.34Å; V222-Q226 PolarHBondContact O-N 3.45Å; I223-Q226 WeakPolarHBondContact O-CB 3.43Å; I223-Q226 PolarHBondContact O-N 3.31Å
227	F	62.6	Low	70.5	Confident	31 Å²	31	58.4 Å²	58.4	14%	0.136	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-14.1	-158.1	-99.6	-33.5	0	0	0	110.6	T143 K146 L147 I223 Y224 S225	T143-F227 HydrophobicContact CG2-CB 2.99Å; T143-F227 HydrophobicContact CG2-CD1 3.7Å; T143-F227 HydrophobicContact CG2-CD2 4.43Å; T143-F227 HydrophobicContact CG2-CG 3.39Å; T143-F227 WeakPolarHBondContact CG2-O 3.48Å; T143-F227 WeakPolarHBondContact O-CD1 3.22Å; T143-F227 PolarHBondContact OG1-O 2.8Å; K146-F227 HydrophobicContact CB-CD1 4.36Å; K146-F227 HydrophobicContact CB-CE1 4.2Å; L147-F227 VanDerWaalsContact CA-CE1 3.42Å; L147-F227 HydrophobicContact CB-CD1 4.21Å; L147-F227 HydrophobicContact CB-CD2 3.99Å; L147-F227 HydrophobicContact CB-CE1 3.61Å; L147-F227 HydrophobicContact CB-CE2 3.51Å; L147-F227 HydrophobicContact CB-CG 4.42Å; L147-F227 HydrophobicContact CB-CZ 3.29Å; L147-F227 HydrophobicContact CD1-CD2 4.43Å; L147-F227 HydrophobicContact CD1-CE2 3.38Å; L147-F227 HydrophobicContact CD1-CZ 3.46Å; L147-F227 VanDerWaalsContact CD1-CZ 3.46Å; L147-F227 HydrophobicContact CD2-CD2 4.09Å; L147-F227 HydrophobicContact CD2-CE2 3.8Å; L147-F227 HydrophobicContact CD2-CZ 4.41Å; L147-F227 HydrophobicContact CG-CD2 4.36Å; L147-F227 HydrophobicContact CG-CE2 3.7Å; L147-F227 HydrophobicContact CG-CZ 3.83Å; L147-F227 VanDerWaalsContact N-CE1 3.29Å; I223-F227 HydrophobicContact CG2-CE2 3.82Å; I223-F227 WeakPolarHBondContact O-CD2 2.94Å; I223-F227 WeakPolarHBondContact O-CE2 3.09Å; Y224-F227 WeakPolarHBondContact O-CB 3.13Å; S225-F227 PolarHBondContact O-N 2.78Å
228	F	61.3	Low	70.4	Confident	26 Å²	26	56 Å²	56	11%	0.114	32%	0.319	C	S	.	.	S	Bend	trans	-110.4	143.7	172.7	-62.8	-88.4	0	0	0	110	I140 T143 Y224 S225 A232 P234 L304	I140-F228 HydrophobicContact CB-CZ 4.49Å; I140-F228 HydrophobicContact CG1-CE1 3.94Å; I140-F228 HydrophobicContact CG1-CZ 3.93Å; T143-F228 HydrophobicContact CG2-CD2 4.47Å; T143-F228 HydrophobicContact CG2-CE2 4.03Å; T143-F228 HydrophobicContact CG2-CZ 4.12Å; Y224-F228 HydrophobicContact CD1-CD2 4.49Å; Y224-F228 AromaticContact CD1-CE2 3.71Å; Y224-F228 HydrophobicContact CD1-CE2 3.71Å; Y224-F228 AromaticContact CE1-CE2 3.45Å; Y224-F228 HydrophobicContact CE1-CE2 3.45Å; Y224-F228 VanDerWaalsContact CE1-CE2 3.45Å; Y224-F228 AromaticContact CE1-CZ 3.87Å; Y224-F228 HydrophobicContact CE1-CZ 3.87Å; Y224-F228 WeakPolarHBondContact O-CD2 3.21Å; Y224-F228 WeakPolarHBondContact O-CE2 3.32Å; S225-F228 PolarHBondContact O-N 2.8Å; F228-A232 HydrophobicContact CB-CB 4.33Å; F228-P234 HydrophobicContact CD2-CB 3.69Å; F228-P234 HydrophobicContact CD2-CG 4.06Å; F228-P234 HydrophobicContact CE2-CB 4Å; F228-P234 HydrophobicContact CG-CB 4.28Å; F228-L304 HydrophobicContact CD1-CD1 3.71Å; F228-L304 HydrophobicContact CD1-CG 4.28Å; F228-L304 HydrophobicContact CD2-CD1 4.18Å; F228-L304 HydrophobicContact CE1-CD1 3.47Å; F228-L304 VanDerWaalsContact CE1-CD1 3.47Å; F228-L304 HydrophobicContact CE1-CD2 4.18Å; F228-L304 HydrophobicContact CE1-CG 3.82Å; F228-L304 HydrophobicContact CE2-CD1 3.97Å; F228-L304 HydrophobicContact CG-CD1 4.08Å; F228-L304 HydrophobicContact CZ-CD1 3.63Å; F228-L304 HydrophobicContact CZ-CD2 4.26Å; F228-L304 HydrophobicContact CZ-CG 4.24Å
229	P	60.3	Low	70.5	Confident	100 Å²	100	53.6 Å²	53.6	65%	0.649	30%	0.304	S	S	*	.			trans	-63.6	152.6	175.4	26.3	-32.5	0	0	0	111.5	G231	P229-G231 PolarHBondContact O-N 3.24Å; P229-G231 VanDerWaalsContact O-N 3.09Å
230	Q	48.4	Very low	70.6	Confident	209 Å²	209	52 Å²	52	98%	0.977	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	114.5	179.2	-71.5	177.4	7.4	0	0	110.6
231	G	51.6	Low	70.7	Confident	70 Å²	70	51.9 Å²	51.9	72%	0.722	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	130.5	-12.9	177	0	0	0	0	0	116.3	P229	P229-G231 PolarHBondContact O-N 3.24Å; P229-G231 VanDerWaalsContact O-N 3.09Å
232	A	60.7	Low	70.9	Confident	24 Å²	24	50.1 Å²	50.1	20%	0.198	28%	0.284	C	S	.	.			trans	-90.2	147.5	167.3	0	0	0	0	0	110.3	F228 P234 L304	F228-A232 HydrophobicContact CB-CB 4.33Å; A232-P234 WeakPolarHBondContact O-CD 3.38Å; A232-L304 WeakPolarHBondContact CB-O 3.28Å
233	N	66.4	Low	71.3	Confident	75 Å²	75	47.7 Å²	47.7	40%	0.401	27%	0.268	S	S	.	.			trans	-104.5	91.7	171.9	-169.1	-2.3	0	0	0	109.7	T235 E303	N233-T235 PolarHBondContact O-N 2.97Å; N233-T235 VanDerWaalsContact OD1-CB 3.25Å; N233-T235 WeakPolarHBondContact OD1-CB 3.41Å; N233-T235 PolarHBondContact OD1-N 3.14Å; N233-T235 PolarHBondContact OD1-OG1 3.04Å; N233-E303 PolarHBondContact N-O 3.41Å
234	P	70.1	Confident	71.7	Confident	7 Å²	7	47 Å²	47	5%	0.045	27%	0.265	C	S	.	.			trans	-80.7	-0.2	-177.7	33.3	-35.7	0	0	0	113.7	Y224 F228 A232 L236 Y237 A238 L304	Y224-P234 HydrophobicContact CD1-CB 4.06Å; Y224-P234 HydrophobicContact CE1-CB 4.34Å; F228-P234 HydrophobicContact CD2-CB 3.69Å; F228-P234 HydrophobicContact CD2-CG 4.06Å; F228-P234 HydrophobicContact CE2-CB 4Å; F228-P234 HydrophobicContact CG-CB 4.28Å; A232-P234 WeakPolarHBondContact O-CD 3.38Å; P234-L236 PolarHBondContact O-N 2.83Å; P234-Y237 PolarHBondContact O-N 2.95Å; P234-A238 WeakPolarHBondContact O-CB 3.5Å; P234-A238 PolarHBondContact O-N 3.13Å; P234-L304 HydrophobicContact CB-CD1 3.43Å; P234-L304 VanDerWaalsContact CB-CD1 3.43Å
235	T	78.3	Confident	72.1	Confident	58 Å²	58	47 Å²	47	36%	0.356	27%	0.266	S	S	.	.	H	α-helix	trans	-63.2	-43.8	-168.1	-49.3	0	0	0	0	112.9	K221 N233 H239	K221-T235 HydrophobicContact CD-CG2 3.8Å; K221-T235 WeakPolarHBondContact CE-O 3.35Å; K221-T235 HydrophobicContact CG-CG2 4.25Å; N233-T235 PolarHBondContact O-N 2.97Å; N233-T235 VanDerWaalsContact OD1-CB 3.25Å; N233-T235 WeakPolarHBondContact OD1-CB 3.41Å; N233-T235 PolarHBondContact OD1-N 3.14Å; N233-T235 PolarHBondContact OD1-OG1 3.04Å; T235-H239 PolarHBondContact O-N 2.98Å; T235-H239 VanDerWaalsContact O-N 3.07Å
236	L	79.4	Confident	72.7	Confident	71 Å²	71	45 Å²	45	37%	0.372	25%	0.25	S	S	.	.	H	α-helix	trans	-66.9	-47.4	179	-83.1	151.8	0	0	0	111.3	P234 A238 H239 Y240 A300 E303	P234-L236 PolarHBondContact O-N 2.83Å; L236-A238 VanDerWaalsContact C-N 3.32Å; L236-A238 PolarHBondContact O-N 2.69Å; L236-H239 WeakPolarHBondContact O-CB 3.19Å; L236-H239 PolarHBondContact O-N 3.06Å; L236-Y240 WeakPolarHBondContact O-CD2 3.23Å; L236-Y240 PolarHBondContact O-N 3.43Å; L236-A300 HydrophobicContact CB-CB 3.84Å; L236-E303 VanDerWaalsContact CD1-OE2 3.31Å; L236-E303 WeakPolarHBondContact CD1-OE2 3.42Å
237	Y	79.7	Confident	73	Confident	12 Å²	12	45.6 Å²	45.6	5%	0.047	25%	0.253	C	S	.	.	H	α-helix	trans	-66.2	-36.7	178.4	-167.3	-95.7	0	0	0	112.2	I140 Y224 P234 H239 Y240 V241 I301 L304	I140-Y237 HydrophobicContact CD1-CE1 3.97Å; I140-Y237 HydrophobicContact CG2-CE1 4.35Å; Y224-Y237 HydrophobicContact CE1-CD1 4.04Å; Y224-Y237 WeakPolarHBondContact OH-CD1 3.35Å; Y224-Y237 VanDerWaalsContact OH-CE1 3.28Å; Y224-Y237 WeakPolarHBondContact OH-CE1 3.43Å; P234-Y237 PolarHBondContact O-N 2.95Å; Y237-H239 VanDerWaalsContact C-N 3.31Å; Y237-H239 PolarHBondContact O-N 2.97Å; Y237-Y240 PolarHBondContact O-N 3.11Å; Y237-V241 HydrophobicContact CD1-CG2 3.91Å; Y237-V241 HydrophobicContact CE1-CG2 3.58Å; Y237-V241 WeakPolarHBondContact O-CG2 3.44Å; Y237-V241 PolarHBondContact O-N 3.19Å; Y237-I301 HydrophobicContact CD2-CG1 3.98Å; Y237-I301 HydrophobicContact CE2-CD1 4.47Å; Y237-I301 HydrophobicContact CE2-CG1 3.83Å; Y237-L304 HydrophobicContact CD1-CD2 3.84Å; Y237-L304 HydrophobicContact CD2-CD2 4.47Å; Y237-L304 HydrophobicContact CE1-CD2 4.38Å; Y237-L304 HydrophobicContact CG-CD2 3.87Å
238	A	81.3	Confident	73.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.8	-36.6	174.2	0	0	0	0	0	112.3	F220 K221 Y224 P234 L236 F242	F220-A238 HydrophobicContact CD1-CB 4.31Å; F220-A238 HydrophobicContact CE1-CB 4.34Å; F220-A238 WeakPolarHBondContact CE1-O 3.24Å; K221-A238 HydrophobicContact CG-CB 3.91Å; Y224-A238 HydrophobicContact CD1-CB 3.59Å; Y224-A238 HydrophobicContact CE1-CB 4.24Å; Y224-A238 HydrophobicContact CG-CB 3.93Å; P234-A238 WeakPolarHBondContact O-CB 3.5Å; P234-A238 PolarHBondContact O-N 3.13Å; L236-A238 VanDerWaalsContact C-N 3.32Å; L236-A238 PolarHBondContact O-N 2.69Å; A238-F242 VanDerWaalsContact O-CB 3.31Å; A238-F242 WeakPolarHBondContact O-CB 3.47Å; A238-F242 PolarHBondContact O-N 3.27Å
239	H	84.7	Confident	74.5	Confident	67 Å²	67	53 Å²	53	31%	0.31	29%	0.292	S	S	.	.	H	α-helix	trans	-60.5	-48.6	173.5	172.3	-70.7	0	0	0	110.9	E217 T235 L236 Y237 V241 F242 N243	E217-H239 IonicContact OE1-CD2 3.41Å; E217-H239 PolarHBondContact OE1-CD2 3.33Å; E217-H239 IonicContact OE1-CG 3.19Å; E217-H239 IonicContact OE1-NE2 3.69Å; T235-H239 PolarHBondContact O-N 2.98Å; T235-H239 VanDerWaalsContact O-N 3.07Å; L236-H239 WeakPolarHBondContact O-CB 3.19Å; L236-H239 PolarHBondContact O-N 3.06Å; Y237-H239 VanDerWaalsContact C-N 3.31Å; Y237-H239 PolarHBondContact O-N 2.97Å; H239-V241 PolarHBondContact O-N 2.67Å; H239-F242 WeakPolarHBondContact O-CB 3.25Å; H239-F242 PolarHBondContact O-N 3.31Å; H239-N243 PolarHBondContact O-N 3.19Å
240	Y	82.4	Confident	75.4	Confident	22 Å²	22	50.9 Å²	50.9	9%	0.086	28%	0.279	C	S	.	.	H	α-helix	trans	-63	-43.9	179.4	-58.2	-48.4	0	0	0	112.4	L236 Y237 F242 N243 T244 I283 I297 A300	L236-Y240 WeakPolarHBondContact O-CD2 3.23Å; L236-Y240 PolarHBondContact O-N 3.43Å; Y237-Y240 PolarHBondContact O-N 3.11Å; Y240-F242 VanDerWaalsContact C-N 3.29Å; Y240-F242 PolarHBondContact O-N 3.47Å; Y240-N243 PolarHBondContact O-N 2.79Å; Y240-T244 WeakPolarHBondContact O-CG2 3.37Å; Y240-T244 PolarHBondContact O-N 2.73Å; Y240-T244 VanDerWaalsContact O-N 3.15Å; Y240-I283 HydrophobicContact CD1-CD1 4.1Å; Y240-I283 HydrophobicContact CD1-CG1 3.92Å; Y240-I283 HydrophobicContact CD1-CG2 4.14Å; Y240-I283 HydrophobicContact CE1-CB 4.48Å; Y240-I283 HydrophobicContact CE1-CD1 3.48Å; Y240-I283 VanDerWaalsContact CE1-CD1 3.48Å; Y240-I283 HydrophobicContact CE1-CG1 3.79Å; Y240-I283 HydrophobicContact CE1-CG2 3.84Å; Y240-I297 HydrophobicContact CD1-CD1 4.09Å; Y240-I297 HydrophobicContact CD2-CD1 3.44Å; Y240-I297 VanDerWaalsContact CD2-CD1 3.44Å; Y240-I297 HydrophobicContact CE2-CD1 3.91Å; Y240-I297 HydrophobicContact CG-CD1 3.54Å; Y240-A300 HydrophobicContact CD2-CB 4.11Å; Y240-A300 HydrophobicContact CE2-CB 3.71Å
241	V	81.7	Confident	77	Confident	7 Å²	7	42.7 Å²	42.7	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-38.4	175.1	176.9	0	0	0	0	111.3	F220 Y237 H239 T244 L245 L280	F220-V241 HydrophobicContact CE1-CB 4.19Å; F220-V241 HydrophobicContact CE1-CG1 4.08Å; F220-V241 HydrophobicContact CZ-CB 4.42Å; F220-V241 HydrophobicContact CZ-CG1 3.79Å; Y237-V241 HydrophobicContact CD1-CG2 3.91Å; Y237-V241 HydrophobicContact CE1-CG2 3.58Å; Y237-V241 WeakPolarHBondContact O-CG2 3.44Å; Y237-V241 PolarHBondContact O-N 3.19Å; H239-V241 PolarHBondContact O-N 2.67Å; V241-T244 PolarHBondContact O-N 3.31Å; V241-T244 PolarHBondContact O-OG1 2.88Å; V241-L245 HydrophobicContact CG1-CD1 4.46Å; V241-L245 WeakPolarHBondContact O-CG 3.37Å; V241-L245 PolarHBondContact O-N 3.37Å; V241-L280 HydrophobicContact CG2-CD1 3.95Å
242	F	83.2	Confident	78.5	Confident	6 Å²	6	42.8 Å²	42.8	3%	0.026	23%	0.234	C	C	.	.	H	α-helix	trans	-61.3	-45.2	175.2	-177.7	-90.4	0	0	0	111.4	V215 E217 F220 A238 H239 Y240 T244 L245 D246 V253	V215-F242 HydrophobicContact CG1-CE2 4.27Å; E217-F242 HydrophobicContact CB-CD1 3.93Å; E217-F242 HydrophobicContact CB-CD2 4.35Å; E217-F242 HydrophobicContact CB-CE1 3.8Å; E217-F242 HydrophobicContact CB-CE2 4.21Å; E217-F242 HydrophobicContact CB-CG 4.2Å; E217-F242 HydrophobicContact CB-CZ 3.93Å; E217-F242 HydrophobicContact CG-CB 4.27Å; E217-F242 HydrophobicContact CG-CD1 3.68Å; E217-F242 HydrophobicContact CG-CD2 4.37Å; E217-F242 HydrophobicContact CG-CE1 4.08Å; E217-F242 HydrophobicContact CG-CG 3.84Å; F220-F242 HydrophobicContact CB-CD2 3.7Å; F220-F242 HydrophobicContact CB-CE2 4.28Å; F220-F242 HydrophobicContact CD1-CB 3.91Å; F220-F242 HydrophobicContact CD1-CD2 4.19Å; F220-F242 HydrophobicContact CD2-CD2 4.43Å; F220-F242 HydrophobicContact CE1-CB 4.28Å; F220-F242 HydrophobicContact CG-CB 4.45Å; F220-F242 AromaticContact CG-CD2 3.87Å; F220-F242 HydrophobicContact CG-CD2 3.87Å; A238-F242 VanDerWaalsContact O-CB 3.31Å; A238-F242 WeakPolarHBondContact O-CB 3.47Å; A238-F242 PolarHBondContact O-N 3.27Å; H239-F242 WeakPolarHBondContact O-CB 3.25Å; H239-F242 PolarHBondContact O-N 3.31Å; Y240-F242 VanDerWaalsContact C-N 3.29Å; Y240-F242 PolarHBondContact O-N 3.47Å; F242-T244 VanDerWaalsContact C-N 3.26Å; F242-T244 PolarHBondContact O-N 2.68Å; F242-L245 WeakPolarHBondContact O-CB 3.26Å; F242-L245 PolarHBondContact O-N 3.49Å; F242-D246 HydrophobicContact CD1-CB 4.28Å; F242-D246 HydrophobicContact CE1-CB 3.96Å; F242-D246 WeakPolarHBondContact O-CB 3.5Å; F242-D246 PolarHBondContact O-N 3.04Å; F242-V253 HydrophobicContact CD2-CG2 3.81Å; F242-V253 HydrophobicContact CE1-CG2 4.29Å; F242-V253 HydrophobicContact CE2-CB 4Å; F242-V253 HydrophobicContact CE2-CG2 3.38Å; F242-V253 HydrophobicContact CG-CG2 4.44Å; F242-V253 HydrophobicContact CZ-CB 4.42Å; F242-V253 HydrophobicContact CZ-CG2 3.66Å
243	N	84.2	Confident	79.6	Confident	32 Å²	32	41.7 Å²	41.7	17%	0.171	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-34.4	178.7	-159.4	50.4	0	0	0	112.5	H239 Y240 L245 D246 H249 I283	H239-N243 PolarHBondContact O-N 3.19Å; Y240-N243 PolarHBondContact O-N 2.79Å; N243-L245 VanDerWaalsContact C-N 3.27Å; N243-L245 PolarHBondContact O-N 2.95Å; N243-D246 PolarHBondContact O-N 3.43Å; N243-H249 PolarHBondContact OD1-ND1 3.43Å; N243-I283 PolarHBondContact ND2-O 3.29Å
244	T	80.9	Confident	80.3	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-70.3	-20.9	174.5	63.9	0	0	0	0	114.8	Y240 V241 F242 W276 S279 L280	Y240-T244 WeakPolarHBondContact O-CG2 3.37Å; Y240-T244 PolarHBondContact O-N 2.73Å; Y240-T244 VanDerWaalsContact O-N 3.15Å; V241-T244 PolarHBondContact O-N 3.31Å; V241-T244 PolarHBondContact O-OG1 2.88Å; F242-T244 VanDerWaalsContact C-N 3.26Å; F242-T244 PolarHBondContact O-N 2.68Å; T244-W276 WeakPolarHBondContact OG1-CZ2 3.41Å; T244-S279 WeakPolarHBondContact CG2-O 3.32Å; T244-L280 HydrophobicContact CG2-CB 3.74Å; T244-L280 HydrophobicContact CG2-CD1 3.65Å; T244-L280 HydrophobicContact CG2-CG 4.31Å
245	L	79.9	Confident	80.8	Confident	8 Å²	8	38.4 Å²	38.4	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-89.4	-34.1	175.7	-64.9	171.2	0	0	0	110.5	F220 V241 F242 N243 Q247 V253 F258	F220-L245 HydrophobicContact CE2-CD1 4.02Å; F220-L245 HydrophobicContact CZ-CD1 4.18Å; V241-L245 HydrophobicContact CG1-CD1 4.46Å; V241-L245 WeakPolarHBondContact O-CG 3.37Å; V241-L245 PolarHBondContact O-N 3.37Å; F242-L245 WeakPolarHBondContact O-CB 3.26Å; F242-L245 PolarHBondContact O-N 3.49Å; N243-L245 VanDerWaalsContact C-N 3.27Å; N243-L245 PolarHBondContact O-N 2.95Å; L245-Q247 VanDerWaalsContact C-N 3.33Å; L245-Q247 PolarHBondContact O-N 2.95Å; L245-Q247 VanDerWaalsContact O-N 3.14Å; L245-V253 HydrophobicContact CB-CG1 4.14Å; L245-V253 HydrophobicContact CB-CG2 3.82Å; L245-F258 HydrophobicContact CD1-CD2 4.48Å
246	D	82.8	Confident	81	Confident	6 Å²	6	37.6 Å²	37.6	3%	0.032	20%	0.2	C	C	.	.			trans	-84.5	65.2	178.6	-170.9	32.4	0	0	0	111.6	F242 N243 D248 H249 S250 G251 V253	F242-D246 HydrophobicContact CD1-CB 4.28Å; F242-D246 HydrophobicContact CE1-CB 3.96Å; F242-D246 WeakPolarHBondContact O-CB 3.5Å; F242-D246 PolarHBondContact O-N 3.04Å; N243-D246 PolarHBondContact O-N 3.43Å; D246-D248 PolarHBondContact O-N 3.09Å; D246-H249 PolarHBondContact O-N 3.03Å; D246-H249 WeakPolarHBondContact OD2-CA 3.48Å; D246-S250 PolarHBondContact OD1-N 3.26Å; D246-S250 VanDerWaalsContact OD1-N 3.09Å; D246-S250 PolarHBondContact OD1-OG 2.72Å; D246-S250 PolarHBondContact OD2-N 3.12Å; D246-G251 VanDerWaalsContact OD2-CA 3.27Å; D246-G251 WeakPolarHBondContact OD2-CA 3.39Å; D246-G251 PolarHBondContact OD2-N 3.36Å; D246-V253 HydrophobicContact CB-CG2 3.89Å
247	Q	73.1	Confident	81.1	Confident	124 Å²	124	35.9 Å²	35.9	58%	0.579	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.8	-175.3	-65.6	-170.7	0.9	0	0	114	L245 H249	L245-Q247 VanDerWaalsContact C-N 3.33Å; L245-Q247 PolarHBondContact O-N 2.95Å; L245-Q247 VanDerWaalsContact O-N 3.14Å; Q247-H249 VanDerWaalsContact C-N 3.32Å
248	D	78.4	Confident	81	Confident	105 Å²	105	35.9 Å²	35.9	56%	0.561	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	2.1	177.4	69.5	-17.6	0	0	0	113	D246 S250	D246-D248 PolarHBondContact O-N 3.09Å; D248-S250 PolarHBondContact O-N 3.05Å; D248-S250 VanDerWaalsContact O-N 3.11Å; D248-S250 VanDerWaalsContact OD1-CB 3.26Å; D248-S250 WeakPolarHBondContact OD1-CB 3.31Å; D248-S250 PolarHBondContact OD1-N 3.31Å; D248-S250 PolarHBondContact OD1-OG 2.87Å; D248-S250 WeakPolarHBondContact OD2-CB 3.12Å
249	H	77	Confident	80.9	Confident	109 Å²	109	35.9 Å²	35.9	51%	0.505	19%	0.192	S	C	.	.			trans	47.5	35.2	-175.3	-58.2	-64.2	0	0	0	112.5	N243 D246 Q247 G251	N243-H249 PolarHBondContact OD1-ND1 3.43Å; D246-H249 PolarHBondContact O-N 3.03Å; D246-H249 WeakPolarHBondContact OD2-CA 3.48Å; Q247-H249 VanDerWaalsContact C-N 3.32Å; H249-G251 PolarHBondContact O-N 3.44Å
250	S	80.3	Confident	80.7	Confident	54 Å²	54	36.6 Å²	36.6	38%	0.378	20%	0.195	S	C	.	.			trans	-73.8	-12.7	-179.4	64.5	0	0	0	0	112.1	D246 D248 I252	D246-S250 PolarHBondContact OD1-N 3.26Å; D246-S250 VanDerWaalsContact OD1-N 3.09Å; D246-S250 PolarHBondContact OD1-OG 2.72Å; D246-S250 PolarHBondContact OD2-N 3.12Å; D248-S250 PolarHBondContact O-N 3.05Å; D248-S250 VanDerWaalsContact O-N 3.11Å; D248-S250 VanDerWaalsContact OD1-CB 3.26Å; D248-S250 WeakPolarHBondContact OD1-CB 3.31Å; D248-S250 PolarHBondContact OD1-N 3.31Å; D248-S250 PolarHBondContact OD1-OG 2.87Å; D248-S250 WeakPolarHBondContact OD2-CB 3.12Å; S250-I252 PolarHBondContact O-N 3.23Å; S250-I252 VanDerWaalsContact OG-CG1 3.23Å; S250-I252 WeakPolarHBondContact OG-CG1 3.29Å; S250-I252 PolarHBondContact OG-N 2.72Å; S250-I252 PolarHBondContact OG-O 3.39Å
251	G	81	Confident	80.5	Confident	37 Å²	37	35.8 Å²	35.8	38%	0.381	19%	0.193	S	C	.	.	S	Bend	trans	73.7	7.2	-171.1	0	0	0	0	0	112.6	D246 H249	D246-G251 VanDerWaalsContact OD2-CA 3.27Å; D246-G251 WeakPolarHBondContact OD2-CA 3.39Å; D246-G251 PolarHBondContact OD2-N 3.36Å; H249-G251 PolarHBondContact O-N 3.44Å
252	I	83.8	Confident	80.2	Confident	72 Å²	72	35.8 Å²	35.8	37%	0.369	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	116.5	179.5	54.5	169.5	0	0	0	110.6	K216 S250 S254	K216-I252 HydrophobicContact CG-CG2 4.19Å; S250-I252 PolarHBondContact O-N 3.23Å; S250-I252 VanDerWaalsContact OG-CG1 3.23Å; S250-I252 WeakPolarHBondContact OG-CG1 3.29Å; S250-I252 PolarHBondContact OG-N 2.72Å; S250-I252 PolarHBondContact OG-O 3.39Å; I252-S254 PolarHBondContact O-N 2.73Å
253	V	82.8	Confident	80	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	117.4	173.5	172.9	0	0	0	0	108.7	V215 F242 L245 D246 D257 F258	V215-V253 HydrophobicContact CB-CB 4.28Å; V215-V253 PolarHBondContact N-O 3.45Å; V215-V253 PolarHBondContact O-N 3.33Å; F242-V253 HydrophobicContact CD2-CG2 3.81Å; F242-V253 HydrophobicContact CE1-CG2 4.29Å; F242-V253 HydrophobicContact CE2-CB 4Å; F242-V253 HydrophobicContact CE2-CG2 3.38Å; F242-V253 HydrophobicContact CG-CG2 4.44Å; F242-V253 HydrophobicContact CZ-CB 4.42Å; F242-V253 HydrophobicContact CZ-CG2 3.66Å; L245-V253 HydrophobicContact CB-CG1 4.14Å; L245-V253 HydrophobicContact CB-CG2 3.82Å; D246-V253 HydrophobicContact CB-CG2 3.89Å; V253-D257 HydrophobicContact CG1-CB 4.11Å; V253-F258 HydrophobicContact CG1-CB 4.04Å
254	S	82.5	Confident	79.6	Confident	12 Å²	12	35.9 Å²	35.9	8%	0.084	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	167.7	175.2	83.5	0	0	0	0	111.4	Y180 I252 E256 D257 F258	Y180-S254 VanDerWaalsContact OH-CB 3.27Å; Y180-S254 WeakPolarHBondContact OH-CB 3.04Å; Y180-S254 PolarHBondContact OH-OG 2.67Å; I252-S254 PolarHBondContact O-N 2.73Å; S254-E256 PolarHBondContact O-N 3.04Å; S254-E256 PolarHBondContact OG-N 3.03Å; S254-D257 WeakPolarHBondContact CB-OD2 3.48Å; S254-D257 PolarHBondContact N-OD2 3.19Å; S254-D257 PolarHBondContact OG-N 3.5Å; S254-D257 PolarHBondContact OG-OD2 2.9Å; S254-F258 WeakPolarHBondContact O-CB 3.19Å; S254-F258 PolarHBondContact O-N 3.19Å; S254-F258 VanDerWaalsContact O-N 3.08Å
255	F	80.1	Confident	79.2	Confident	1 Å²	1	36.5 Å²	36.5	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-62.9	-33.8	175.5	178.5	-111	0	0	0	112	Y180 P182 L188 I199 I202 Y203 F206 F258 V259	Y180-F255 HydrophobicContact CE1-CB 4.24Å; P182-F255 HydrophobicContact CB-CB 4.49Å; P182-F255 HydrophobicContact CB-CD1 3.88Å; L188-F255 HydrophobicContact CD1-CD1 4Å; L188-F255 HydrophobicContact CD1-CE1 3.85Å; I199-F255 HydrophobicContact CG2-CE1 3.89Å; I199-F255 HydrophobicContact CG2-CZ 4Å; I202-F255 HydrophobicContact CB-CE2 4.36Å; I202-F255 HydrophobicContact CB-CZ 4.45Å; I202-F255 HydrophobicContact CG2-CE2 3.95Å; I202-F255 HydrophobicContact CG2-CZ 4.45Å; Y203-F255 VanDerWaalsContact CB-CZ 3.43Å; Y203-F255 AromaticContact CD2-CD1 3.71Å; Y203-F255 HydrophobicContact CD2-CD1 3.71Å; Y203-F255 AromaticContact CD2-CD2 3.75Å; Y203-F255 HydrophobicContact CD2-CD2 3.75Å; Y203-F255 AromaticContact CD2-CE1 3.68Å; Y203-F255 HydrophobicContact CD2-CE1 3.68Å; Y203-F255 AromaticContact CD2-CE2 3.75Å; Y203-F255 HydrophobicContact CD2-CE2 3.75Å; Y203-F255 AromaticContact CD2-CG 3.73Å; Y203-F255 HydrophobicContact CD2-CG 3.73Å; Y203-F255 AromaticContact CD2-CZ 3.7Å; Y203-F255 HydrophobicContact CD2-CZ 3.7Å; Y203-F255 HydrophobicContact CE2-CD1 4.3Å; Y203-F255 HydrophobicContact CE2-CG 4.23Å; Y203-F255 HydrophobicContact CG-CE1 4.27Å; Y203-F255 HydrophobicContact CG-CE2 4.27Å; Y203-F255 HydrophobicContact CG-CZ 4.05Å; F206-F255 HydrophobicContact CB-CD2 4.06Å; F206-F255 HydrophobicContact CB-CE2 4.18Å; F206-F255 HydrophobicContact CD1-CB 4.5Å; F206-F255 AromaticContact CD1-CD2 3.98Å; F206-F255 HydrophobicContact CD1-CD2 3.98Å; F206-F255 HydrophobicContact CD2-CD2 4.11Å; F206-F255 HydrophobicContact CE1-CB 4.16Å; F206-F255 HydrophobicContact CE1-CD2 4.4Å; F206-F255 HydrophobicContact CE2-CD2 4.49Å; F206-F255 AromaticContact CG-CD2 3.81Å; F206-F255 HydrophobicContact CG-CD2 3.81Å; F206-F255 HydrophobicContact CG-CE2 4.41Å; F206-F255 HydrophobicContact CZ-CB 4.31Å; F255-F258 PolarHBondContact O-N 3.46Å; F255-V259 HydrophobicContact CD1-CG2 4.18Å; F255-V259 HydrophobicContact CD2-CG2 3.98Å; F255-V259 HydrophobicContact CE1-CG2 3.67Å; F255-V259 HydrophobicContact CE2-CG2 3.43Å; F255-V259 VanDerWaalsContact CE2-CG2 3.43Å; F255-V259 HydrophobicContact CG-CG2 4.33Å; F255-V259 HydrophobicContact CZ-CG2 3.26Å; F255-V259 VanDerWaalsContact O-CG2 3.29Å; F255-V259 WeakPolarHBondContact O-CG2 3.31Å; F255-V259 PolarHBondContact O-N 2.94Å
256	E	81.3	Confident	78.5	Confident	40 Å²	40	38.1 Å²	38.1	19%	0.187	21%	0.21	C	C	.	.	H	α-helix	trans	-66.9	-49.2	-178.5	-55.4	175.6	-176.6	0	0	110.1	Y180 D183 L188 S254 F258 V259 Q260	Y180-E256 VanDerWaalsContact OH-CG 3.24Å; Y180-E256 WeakPolarHBondContact OH-CG 3.4Å; Y180-E256 PolarHBondContact OH-OE1 3.26Å; D183-E256 WeakPolarHBondContact CA-OE1 3.22Å; D183-E256 HydrophobicContact CB-CG 4.4Å; D183-E256 WeakPolarHBondContact CB-OE1 3.44Å; D183-E256 VanDerWaalsContact CG-OE1 3.23Å; D183-E256 PolarHBondContact N-OE1 2.97Å; L188-E256 HydrophobicContact CD2-CB 4.02Å; L188-E256 HydrophobicContact CD2-CG 3.95Å; S254-E256 PolarHBondContact O-N 3.04Å; S254-E256 PolarHBondContact OG-N 3.03Å; E256-F258 VanDerWaalsContact C-N 3.28Å; E256-F258 PolarHBondContact O-N 3.11Å; E256-V259 PolarHBondContact O-N 2.91Å; E256-Q260 VanDerWaalsContact O-CB 3.28Å; E256-Q260 WeakPolarHBondContact O-CB 3.35Å; E256-Q260 PolarHBondContact O-N 2.71Å
257	D	81.2	Confident	78	Confident	35 Å²	35	42.7 Å²	42.7	19%	0.187	23%	0.226	C	C	.	.	H	α-helix	trans	-59.4	-41.9	176.8	-55.2	-44	0	0	0	111.2	V253 S254 Q260 G261	V253-D257 HydrophobicContact CG1-CB 4.11Å; S254-D257 WeakPolarHBondContact CB-OD2 3.48Å; S254-D257 PolarHBondContact N-OD2 3.19Å; S254-D257 PolarHBondContact OG-N 3.5Å; S254-D257 PolarHBondContact OG-OD2 2.9Å; D257-Q260 PolarHBondContact O-N 3.44Å; D257-G261 PolarHBondContact O-N 3.06Å
258	F	79.3	Confident	77.8	Confident	13 Å²	13	37.4 Å²	37.4	6%	0.057	21%	0.205	C	C	.	.	H	α-helix	trans	-62.5	-47.9	177.1	-174.6	-108.6	0	0	0	112	I151 I202 F206 L245 V253 S254 F255 E256 L262	I151-F258 HydrophobicContact CD1-CZ 4.16Å; I202-F258 HydrophobicContact CG2-CD1 4.09Å; I202-F258 HydrophobicContact CG2-CE1 3.86Å; F206-F258 HydrophobicContact CD2-CB 4.44Å; F206-F258 AromaticContact CD2-CD1 3.68Å; F206-F258 HydrophobicContact CD2-CD1 3.68Å; F206-F258 HydrophobicContact CD2-CE1 4.05Å; F206-F258 HydrophobicContact CD2-CG 4.05Å; F206-F258 HydrophobicContact CE2-CB 4Å; F206-F258 HydrophobicContact CE2-CD1 4.08Å; F206-F258 AromaticContact CE2-CG 3.98Å; F206-F258 HydrophobicContact CE2-CG 3.98Å; L245-F258 HydrophobicContact CD1-CD2 4.48Å; V253-F258 HydrophobicContact CG1-CB 4.04Å; S254-F258 WeakPolarHBondContact O-CB 3.19Å; S254-F258 PolarHBondContact O-N 3.19Å; S254-F258 VanDerWaalsContact O-N 3.08Å; F255-F258 PolarHBondContact O-N 3.46Å; E256-F258 VanDerWaalsContact C-N 3.28Å; E256-F258 PolarHBondContact O-N 3.11Å; F258-L262 HydrophobicContact CD1-CD1 3.73Å; F258-L262 HydrophobicContact CE1-CD1 3.35Å; F258-L262 HydrophobicContact CE1-CG 4.28Å; F258-L262 HydrophobicContact CE2-CD1 4.42Å; F258-L262 HydrophobicContact CG-CD1 4.43Å; F258-L262 HydrophobicContact CZ-CD1 3.74Å; F258-L262 HydrophobicContact CZ-CG 4.3Å; F258-L262 WeakPolarHBondContact O-CB 3.1Å; F258-L262 WeakPolarHBondContact O-CG 3.25Å; F258-L262 PolarHBondContact O-N 3.38Å
259	V	79.3	Confident	77.8	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-69.4	-35	179.4	178.5	0	0	0	0	111.4	T192 F194 I199 I202 F255 E256 L262 S263	T192-V259 HydrophobicContact CG2-CB 4.48Å; T192-V259 HydrophobicContact CG2-CG1 3.68Å; F194-V259 HydrophobicContact CD2-CG1 3.99Å; F194-V259 HydrophobicContact CE2-CG1 4.44Å; I199-V259 HydrophobicContact CG1-CG1 4.35Å; I202-V259 HydrophobicContact CG2-CG2 4.06Å; F255-V259 HydrophobicContact CD1-CG2 4.18Å; F255-V259 HydrophobicContact CD2-CG2 3.98Å; F255-V259 HydrophobicContact CE1-CG2 3.67Å; F255-V259 HydrophobicContact CE2-CG2 3.43Å; F255-V259 VanDerWaalsContact CE2-CG2 3.43Å; F255-V259 HydrophobicContact CG-CG2 4.33Å; F255-V259 HydrophobicContact CZ-CG2 3.26Å; F255-V259 VanDerWaalsContact O-CG2 3.29Å; F255-V259 WeakPolarHBondContact O-CG2 3.31Å; F255-V259 PolarHBondContact O-N 2.94Å; E256-V259 PolarHBondContact O-N 2.91Å; V259-L262 PolarHBondContact O-N 3.47Å; V259-S263 WeakPolarHBondContact O-CB 3.28Å; V259-S263 PolarHBondContact O-N 2.97Å
260	Q	80.1	Confident	77.7	Confident	81 Å²	81	34 Å²	34	38%	0.379	20%	0.197	S	C	.	.	H	α-helix	trans	-66.9	-47.7	176.8	-173.1	168.3	-2.5	0	0	111.5	E256 D257 L262 S263 I264	E256-Q260 VanDerWaalsContact O-CB 3.28Å; E256-Q260 WeakPolarHBondContact O-CB 3.35Å; E256-Q260 PolarHBondContact O-N 2.71Å; D257-Q260 PolarHBondContact O-N 3.44Å; Q260-L262 VanDerWaalsContact C-N 3.32Å; Q260-L262 PolarHBondContact O-N 3Å; Q260-S263 WeakPolarHBondContact O-CB 3.47Å; Q260-S263 PolarHBondContact O-N 2.98Å; Q260-S263 VanDerWaalsContact O-N 3.11Å; Q260-I264 PolarHBondContact O-N 3.49Å
261	G	77.8	Confident	77.6	Confident	5 Å²	5	35.2 Å²	35.2	5%	0.052	20%	0.197	C	C	.	.	H	α-helix	trans	-58.1	-44.4	172.4	0	0	0	0	0	111.8	D257 S263 I264 L265	D257-G261 PolarHBondContact O-N 3.06Å; G261-S263 VanDerWaalsContact C-N 3.31Å; G261-S263 PolarHBondContact O-N 3.28Å; G261-I264 PolarHBondContact O-N 3.25Å; G261-L265 WeakPolarHBondContact O-CB 3.12Å; G261-L265 VanDerWaalsContact O-CG 3.28Å; G261-L265 WeakPolarHBondContact O-CG 3.29Å; G261-L265 PolarHBondContact O-N 3.03Å
262	L	76.3	Confident	77.5	Confident	7 Å²	7	36.4 Å²	36.4	4%	0.037	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-35.9	174.6	-75.7	177.6	0	0	0	113.3	F144 F194 I202 F258 V259 Q260 L265 S266	F144-L262 HydrophobicContact CE1-CD2 3.52Å; F144-L262 HydrophobicContact CZ-CD2 3.59Å; F194-L262 HydrophobicContact CE2-CB 4.06Å; F194-L262 HydrophobicContact CZ-CB 4.33Å; I202-L262 HydrophobicContact CD1-CD1 4.47Å; I202-L262 HydrophobicContact CG2-CD1 3.91Å; F258-L262 HydrophobicContact CD1-CD1 3.73Å; F258-L262 HydrophobicContact CE1-CD1 3.35Å; F258-L262 HydrophobicContact CE1-CG 4.28Å; F258-L262 HydrophobicContact CE2-CD1 4.42Å; F258-L262 HydrophobicContact CG-CD1 4.43Å; F258-L262 HydrophobicContact CZ-CD1 3.74Å; F258-L262 HydrophobicContact CZ-CG 4.3Å; F258-L262 WeakPolarHBondContact O-CB 3.1Å; F258-L262 WeakPolarHBondContact O-CG 3.25Å; F258-L262 PolarHBondContact O-N 3.38Å; V259-L262 PolarHBondContact O-N 3.47Å; Q260-L262 VanDerWaalsContact C-N 3.32Å; Q260-L262 PolarHBondContact O-N 3Å; L262-L265 PolarHBondContact O-N 2.76Å; L262-S266 VanDerWaalsContact O-CB 3.25Å; L262-S266 WeakPolarHBondContact O-CB 3.43Å; L262-S266 PolarHBondContact O-N 3.08Å; L262-S266 PolarHBondContact O-OG 3.01Å
263	S	78.3	Confident	77.2	Confident	7 Å²	7	34.2 Å²	34.2	5%	0.049	18%	0.18	C	C	.	.	H	α-helix	trans	-66.6	-43.5	178.8	178	0	0	0	0	111	R193 F194 V259 Q260 G261 R267 G268	R193-S263 PolarHBondContact N-OG 3.45Å; F194-S263 VanDerWaalsContact CE2-CA 3.5Å; V259-S263 WeakPolarHBondContact O-CB 3.28Å; V259-S263 PolarHBondContact O-N 2.97Å; Q260-S263 WeakPolarHBondContact O-CB 3.47Å; Q260-S263 PolarHBondContact O-N 2.98Å; Q260-S263 VanDerWaalsContact O-N 3.11Å; G261-S263 VanDerWaalsContact C-N 3.31Å; G261-S263 PolarHBondContact O-N 3.28Å; S263-R267 CarbonylContact O-C 3.59Å; S263-R267 WeakPolarHBondContact O-CA 3.16Å; S263-R267 PolarHBondContact O-N 3.5Å; S263-G268 PolarHBondContact O-N 3.07Å
264	I	75.1	Confident	77	Confident	34 Å²	34	35 Å²	35	17%	0.174	19%	0.185	C	C	.	.	H	α-helix	trans	-64.5	-46.1	175.6	-65.8	165	0	0	0	110.3	Q260 G261 G268 E272 W276	Q260-I264 PolarHBondContact O-N 3.49Å; G261-I264 PolarHBondContact O-N 3.25Å; I264-G268 WeakPolarHBondContact O-CA 3.5Å; I264-G268 PolarHBondContact O-N 3.09Å; I264-E272 HydrophobicContact CG2-CB 4.06Å; I264-W276 HydrophobicContact CG2-CB 4.07Å; I264-W276 HydrophobicContact CG2-CG 4.44Å
265	L	72.1	Confident	77	Confident	15 Å²	15	39.6 Å²	39.6	8%	0.079	20%	0.2	C	C	.	.	H	α-helix	trans	-63.9	-49.5	-179.9	-70.9	171.7	0	0	0	111.8	F144 G261 L262 K273 W276 F363	F144-L265 HydrophobicContact CE1-CD1 4.35Å; F144-L265 HydrophobicContact CZ-CD1 4.16Å; G261-L265 WeakPolarHBondContact O-CB 3.12Å; G261-L265 VanDerWaalsContact O-CG 3.28Å; G261-L265 WeakPolarHBondContact O-CG 3.29Å; G261-L265 PolarHBondContact O-N 3.03Å; L262-L265 PolarHBondContact O-N 2.76Å; L265-K273 WeakPolarHBondContact O-CE 3.32Å; L265-W276 HydrophobicContact CD1-CH2 4.29Å; L265-W276 HydrophobicContact CD1-CZ2 3.97Å; L265-W276 HydrophobicContact CD2-CD2 3.7Å; L265-W276 HydrophobicContact CD2-CE3 3.56Å; L265-W276 HydrophobicContact CD2-CG 4.41Å; L265-W276 HydrophobicContact CD2-CH2 3.96Å; L265-W276 HydrophobicContact CD2-CZ2 4.08Å; L265-W276 HydrophobicContact CD2-CZ3 3.7Å; L265-W276 HydrophobicContact CG-CD2 4.38Å; L265-W276 HydrophobicContact CG-CZ2 4.4Å; L265-F363 HydrophobicContact CB-CE1 4.09Å; L265-F363 HydrophobicContact CB-CZ 3.8Å; L265-F363 HydrophobicContact CD2-CE2 4.49Å; L265-F363 HydrophobicContact CD2-CZ 4.06Å; L265-F363 WeakPolarHBondContact O-CD1 3.1Å; L265-F363 WeakPolarHBondContact O-CD2 3.35Å; L265-F363 WeakPolarHBondContact O-CE1 3.37Å; L265-F363 WeakPolarHBondContact O-CE2 3.37Å; L265-F363 VanDerWaalsContact O-CG 3.28Å; L265-F363 WeakPolarHBondContact O-CG 3.48Å; L265-F363 WeakPolarHBondContact O-CZ 3.32Å
266	S	66.3	Low	77.1	Confident	42 Å²	42	41.2 Å²	41.2	29%	0.294	21%	0.206	S	C	.	.	H	α-helix	trans	-81	-41.3	-172.3	64.1	0	0	0	0	114.6	F194 L262	F194-S266 WeakPolarHBondContact CZ-OG 3.14Å; L262-S266 VanDerWaalsContact O-CB 3.25Å; L262-S266 WeakPolarHBondContact O-CB 3.43Å; L262-S266 PolarHBondContact O-N 3.08Å; L262-S266 PolarHBondContact O-OG 3.01Å
267	R	71.4	Confident	77.1	Confident	102 Å²	102	40 Å²	40	39%	0.385	20%	0.201	S	C	.	.	H	α-helix	trans	-126.5	14.4	-171.9	-64.4	-177.7	179	166.8	8.6	111.9	R193 E198 S263	R193-R267 HydrophobicContact CB-CB 3.95Å; R193-R267 WeakPolarHBondContact CD-O 3.31Å; R193-R267 PolarHBondContact NH1-O 2.81Å; R193-R267 VanDerWaalsContact O-CD 3.29Å; R193-R267 WeakPolarHBondContact O-CD 3.46Å; R193-R267 PolarHBondContact O-NH1 2.88Å; E198-R267 VanDerWaalsContact CD-NH2 3.32Å; E198-R267 IonicContact OE1-CZ 2.59Å; E198-R267 IonicContact OE1-NH1 3.57Å; E198-R267 IonicContact OE1-NH2 3.82Å; E198-R267 PolarHBondContact OE1-NH2 2.91Å; E198-R267 IonicContact OE2-CZ 3.97Å; E198-R267 IonicContact OE2-NH1 3.58Å; E198-R267 PolarHBondContact OE2-NH1 2.84Å; E198-R267 IonicContact OE2-NH2 2.92Å; E198-R267 PolarHBondContact OE2-NH2 2.8Å; S263-R267 CarbonylContact O-C 3.59Å; S263-R267 WeakPolarHBondContact O-CA 3.16Å; S263-R267 PolarHBondContact O-N 3.5Å
268	G	69.6	Low	77.2	Confident	12 Å²	12	38.9 Å²	38.9	12%	0.124	20%	0.195	C	C	.	.			trans	-64.6	151.5	174.5	0	0	0	0	0	113.4	R193 S263 I264 E272 K273	R193-G268 VanDerWaalsContact NH1-CA 3.34Å; S263-G268 PolarHBondContact O-N 3.07Å; I264-G268 WeakPolarHBondContact O-CA 3.5Å; I264-G268 PolarHBondContact O-N 3.09Å; G268-E272 VanDerWaalsContact CA-OE2 3.25Å; G268-E272 WeakPolarHBondContact CA-OE2 3.39Å; G268-K273 WeakPolarHBondContact O-CE 3.08Å
269	S	77.8	Confident	77.4	Confident	54 Å²	54	40.5 Å²	40.5	38%	0.378	21%	0.208	S	C	.	.			trans	-66.3	160.7	160.5	76.3	0	0	0	0	110.1	E271 E272 K273	S269-E271 PolarHBondContact O-N 3.06Å; S269-E271 PolarHBondContact OG-N 2.76Å; S269-E272 PolarHBondContact N-OE2 3.37Å; S269-E272 PolarHBondContact O-N 3.22Å; S269-E272 WeakPolarHBondContact OG-CG 3.39Å; S269-E272 PolarHBondContact OG-N 3.14Å; S269-E272 VanDerWaalsContact OG-N 3.15Å; S269-K273 WeakPolarHBondContact O-CG 3.5Å; S269-K273 PolarHBondContact O-N 3.45Å
270	V	76.2	Confident	77.6	Confident	88 Å²	88	40.7 Å²	40.7	53%	0.533	21%	0.209	S	C	.	.	H	α-helix	trans	-55.2	-39.4	174.8	175.5	0	0	0	0	110.8	K273 L274	V270-K273 PolarHBondContact O-N 3.47Å; V270-L274 HydrophobicContact CG1-CD1 4.01Å; V270-L274 HydrophobicContact CG1-CG 4.37Å; V270-L274 WeakPolarHBondContact O-CB 3.44Å; V270-L274 VanDerWaalsContact O-CG 3.27Å; V270-L274 WeakPolarHBondContact O-CG 3.3Å; V270-L274 PolarHBondContact O-N 3.02Å
271	E	78.1	Confident	77.8	Confident	80 Å²	80	37.7 Å²	37.7	37%	0.374	19%	0.194	S	C	.	.	H	α-helix	trans	-66.8	-42.6	178.8	-169.1	179.5	158.1	0	0	112.7	S269 K273 L274 R275	S269-E271 PolarHBondContact O-N 3.06Å; S269-E271 PolarHBondContact OG-N 2.76Å; E271-K273 VanDerWaalsContact C-N 3.3Å; E271-K273 PolarHBondContact O-N 3.31Å; E271-L274 PolarHBondContact O-N 2.99Å; E271-R275 WeakPolarHBondContact O-CG 3.33Å; E271-R275 PolarHBondContact O-N 2.83Å; E271-R275 IonicContact OE1-CZ 2.76Å; E271-R275 IonicContact OE1-NE 3.33Å; E271-R275 PolarHBondContact OE1-NE 2.62Å; E271-R275 IonicContact OE1-NH2 3.85Å; E271-R275 PolarHBondContact OE1-NH2 3.07Å
272	E	79.3	Confident	78.2	Confident	62 Å²	62	37.9 Å²	37.9	29%	0.29	19%	0.194	S	C	.	.	H	α-helix	trans	-63.2	-38.7	175.9	-69.9	168.9	152.7	0	0	111.4	R193 I264 G268 S269 R275 W276	R193-E272 IonicContact CZ-OE1 3.5Å; R193-E272 IonicContact CZ-OE2 2.77Å; R193-E272 IonicContact NH1-OE1 3.7Å; R193-E272 IonicContact NH1-OE2 3.38Å; R193-E272 PolarHBondContact NH1-OE2 3.13Å; R193-E272 IonicContact NH2-OE1 3.36Å; R193-E272 PolarHBondContact NH2-OE1 2.79Å; R193-E272 IonicContact NH2-OE2 2.77Å; R193-E272 PolarHBondContact NH2-OE2 2.88Å; R193-E272 VanDerWaalsContact NH2-OE2 3.13Å; I264-E272 HydrophobicContact CG2-CB 4.06Å; G268-E272 VanDerWaalsContact CA-OE2 3.25Å; G268-E272 WeakPolarHBondContact CA-OE2 3.39Å; S269-E272 PolarHBondContact N-OE2 3.37Å; S269-E272 PolarHBondContact O-N 3.22Å; S269-E272 WeakPolarHBondContact OG-CG 3.39Å; S269-E272 PolarHBondContact OG-N 3.14Å; S269-E272 VanDerWaalsContact OG-N 3.15Å; E272-R275 PolarHBondContact O-N 2.87Å; E272-W276 WeakPolarHBondContact O-CB 3.41Å; E272-W276 PolarHBondContact O-N 3.01Å
273	K	76.9	Confident	78.5	Confident	26 Å²	26	39.2 Å²	39.2	11%	0.113	20%	0.201	C	C	.	.	H	α-helix	trans	-67.2	-39.6	175.7	-68.6	177.2	-175.4	-177.3	0	112.4	L265 G268 S269 V270 E271 W276 T277 D360 F363	L265-K273 WeakPolarHBondContact O-CE 3.32Å; G268-K273 WeakPolarHBondContact O-CE 3.08Å; S269-K273 WeakPolarHBondContact O-CG 3.5Å; S269-K273 PolarHBondContact O-N 3.45Å; V270-K273 PolarHBondContact O-N 3.47Å; E271-K273 VanDerWaalsContact C-N 3.3Å; E271-K273 PolarHBondContact O-N 3.31Å; K273-W276 PolarHBondContact O-N 3.17Å; K273-T277 WeakPolarHBondContact O-CB 3.44Å; K273-T277 PolarHBondContact O-N 3.23Å; K273-T277 PolarHBondContact O-OG1 2.86Å; K273-D360 WeakPolarHBondContact CD-OD1 3.18Å; K273-F363 HydrophobicContact CD-CD2 4.12Å
274	L	78.3	Confident	78.8	Confident	19 Å²	19	42.9 Å²	42.9	10%	0.099	22%	0.22	C	C	.	.	H	α-helix	trans	-65.3	-41	175.1	-73	171.9	0	0	0	111.3	V270 E271 T277 F278 F342 L343 C346	V270-L274 HydrophobicContact CG1-CD1 4.01Å; V270-L274 HydrophobicContact CG1-CG 4.37Å; V270-L274 WeakPolarHBondContact O-CB 3.44Å; V270-L274 VanDerWaalsContact O-CG 3.27Å; V270-L274 WeakPolarHBondContact O-CG 3.3Å; V270-L274 PolarHBondContact O-N 3.02Å; E271-L274 PolarHBondContact O-N 2.99Å; L274-T277 CarbonylContact O-C 3.57Å; L274-T277 PolarHBondContact O-N 2.92Å; L274-F278 PolarHBondContact O-N 3.43Å; L274-F342 HydrophobicContact CD2-CE1 4.35Å; L274-L343 HydrophobicContact CB-CD2 3.58Å; L274-L343 HydrophobicContact CD1-CD2 3.78Å; L274-L343 HydrophobicContact CG-CD2 4.31Å; L274-C346 HydrophobicContact CD1-CB 4.49Å; L274-C346 HydrophobicContact CD2-CB 4.2Å
275	R	83.1	Confident	79.1	Confident	109 Å²	109	43.4 Å²	43.4	41%	0.411	23%	0.234	S	C	.	.	H	α-helix	trans	-63.2	-41.7	173.9	-71.3	177.3	-172.1	-84.8	-3.5	112.2	E271 E272 T277 F278 S279 L339	E271-R275 WeakPolarHBondContact O-CG 3.33Å; E271-R275 PolarHBondContact O-N 2.83Å; E271-R275 IonicContact OE1-CZ 2.76Å; E271-R275 IonicContact OE1-NE 3.33Å; E271-R275 PolarHBondContact OE1-NE 2.62Å; E271-R275 IonicContact OE1-NH2 3.85Å; E271-R275 PolarHBondContact OE1-NH2 3.07Å; E272-R275 PolarHBondContact O-N 2.87Å; R275-T277 VanDerWaalsContact C-N 3.33Å; R275-F278 WeakPolarHBondContact O-CB 3.35Å; R275-F278 PolarHBondContact O-N 3.38Å; R275-S279 PolarHBondContact O-N 2.91Å; R275-L339 HydrophobicContact CG-CD1 4.31Å; R275-L339 HydrophobicContact CG-CD2 4.41Å
276	W	81.1	Confident	79.8	Confident	35 Å²	35	46.6 Å²	46.6	13%	0.133	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-40.3	174.1	-171.8	86.8	0	0	0	111.7	T244 I264 L265 E272 K273 F278 S279 L280	T244-W276 WeakPolarHBondContact OG1-CZ2 3.41Å; I264-W276 HydrophobicContact CG2-CB 4.07Å; I264-W276 HydrophobicContact CG2-CG 4.44Å; L265-W276 HydrophobicContact CD1-CH2 4.29Å; L265-W276 HydrophobicContact CD1-CZ2 3.97Å; L265-W276 HydrophobicContact CD2-CD2 3.7Å; L265-W276 HydrophobicContact CD2-CE3 3.56Å; L265-W276 HydrophobicContact CD2-CG 4.41Å; L265-W276 HydrophobicContact CD2-CH2 3.96Å; L265-W276 HydrophobicContact CD2-CZ2 4.08Å; L265-W276 HydrophobicContact CD2-CZ3 3.7Å; L265-W276 HydrophobicContact CG-CD2 4.38Å; L265-W276 HydrophobicContact CG-CZ2 4.4Å; E272-W276 WeakPolarHBondContact O-CB 3.41Å; E272-W276 PolarHBondContact O-N 3.01Å; K273-W276 PolarHBondContact O-N 3.17Å; W276-F278 VanDerWaalsContact C-N 3.34Å; W276-F278 PolarHBondContact O-N 3.21Å; W276-S279 PolarHBondContact O-N 3.42Å; W276-L280 HydrophobicContact CZ3-CD2 4.19Å; W276-L280 PolarHBondContact O-N 2.97Å
277	T	81.2	Confident	80.8	Confident	13 Å²	13	46.1 Å²	46.1	8%	0.08	25%	0.253	C	S	.	.	H	α-helix	trans	-64.7	-39.4	175.1	-54.2	0	0	0	0	110.9	K273 L274 R275 S279 L280 Y281 F342 M356	K273-T277 WeakPolarHBondContact O-CB 3.44Å; K273-T277 PolarHBondContact O-N 3.23Å; K273-T277 PolarHBondContact O-OG1 2.86Å; L274-T277 CarbonylContact O-C 3.57Å; L274-T277 PolarHBondContact O-N 2.92Å; R275-T277 VanDerWaalsContact C-N 3.33Å; T277-S279 PolarHBondContact O-N 3.36Å; T277-L280 VanDerWaalsContact O-CB 3.29Å; T277-L280 WeakPolarHBondContact O-CB 3.35Å; T277-L280 PolarHBondContact O-N 2.82Å; T277-L280 VanDerWaalsContact O-N 3.08Å; T277-Y281 HydrophobicContact CG2-CD2 4.1Å; T277-Y281 HydrophobicContact CG2-CE2 3.98Å; T277-Y281 WeakPolarHBondContact O-CD2 3.43Å; T277-Y281 PolarHBondContact O-N 3.42Å; T277-Y281 VanDerWaalsContact O-N 3.16Å; T277-F342 HydrophobicContact CG2-CZ 4.18Å; T277-M356 HydrophobicContact CG2-CE 3.9Å
278	F	83.7	Confident	81.7	Confident	12 Å²	12	45.5 Å²	45.5	5%	0.053	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-47.9	173.6	-177.9	-87.7	0	0	0	111.2	L274 R275 W276 L280 Y281 D282 G287 I289 L339 F342	L274-F278 PolarHBondContact O-N 3.43Å; R275-F278 WeakPolarHBondContact O-CB 3.35Å; R275-F278 PolarHBondContact O-N 3.38Å; W276-F278 VanDerWaalsContact C-N 3.34Å; W276-F278 PolarHBondContact O-N 3.21Å; F278-L280 PolarHBondContact O-N 2.96Å; F278-Y281 WeakPolarHBondContact O-CA 3.42Å; F278-Y281 PolarHBondContact O-N 3.36Å; F278-D282 HydrophobicContact CD1-CB 4.35Å; F278-D282 HydrophobicContact CE1-CB 4.05Å; F278-D282 WeakPolarHBondContact O-CB 3.37Å; F278-D282 PolarHBondContact O-N 2.86Å; F278-G287 WeakPolarHBondContact CZ-O 3.4Å; F278-I289 HydrophobicContact CD2-CD1 3.42Å; F278-I289 VanDerWaalsContact CD2-CD1 3.42Å; F278-I289 HydrophobicContact CD2-CG1 4.16Å; F278-I289 HydrophobicContact CE2-CD1 3.34Å; F278-I289 HydrophobicContact CE2-CG1 3.68Å; F278-I289 HydrophobicContact CG-CD1 4.21Å; F278-I289 HydrophobicContact CZ-CD1 4.08Å; F278-I289 HydrophobicContact CZ-CG1 3.91Å; F278-L339 HydrophobicContact CB-CD1 3.63Å; F278-L339 HydrophobicContact CD1-CB 4.47Å; F278-L339 HydrophobicContact CD1-CD1 3.93Å; F278-L339 HydrophobicContact CD2-CB 4.29Å; F278-L339 HydrophobicContact CD2-CD1 3.73Å; F278-L339 HydrophobicContact CE1-CB 4.28Å; F278-L339 VanDerWaalsContact CE2-CA 3.49Å; F278-L339 HydrophobicContact CE2-CB 4.09Å; F278-L339 HydrophobicContact CE2-CD1 4.38Å; F278-L339 HydrophobicContact CG-CB 4.48Å; F278-L339 HydrophobicContact CG-CD1 3.47Å; F278-L339 VanDerWaalsContact CG-CD1 3.47Å; F278-L339 HydrophobicContact CZ-CB 4.09Å; F278-F342 HydrophobicContact CB-CD1 4.19Å; F278-F342 HydrophobicContact CB-CE1 4.15Å; F278-F342 HydrophobicContact CD2-CB 3.74Å; F278-F342 AromaticContact CD2-CD1 3.99Å; F278-F342 HydrophobicContact CD2-CD1 3.99Å; F278-F342 HydrophobicContact CD2-CD2 4.1Å; F278-F342 AromaticContact CD2-CG 3.69Å; F278-F342 HydrophobicContact CD2-CG 3.69Å; F278-F342 HydrophobicContact CE2-CB 4.06Å; F278-F342 HydrophobicContact CE2-CG 4.43Å
279	S	83.7	Confident	82.6	Confident	48 Å²	48	44.9 Å²	44.9	34%	0.336	25%	0.247	S	C	.	.	H	α-helix	trans	-61	-25.5	175	175.8	0	0	0	0	113.4	T244 R275 W276 T277 D282	T244-S279 WeakPolarHBondContact CG2-O 3.32Å; R275-S279 PolarHBondContact O-N 2.91Å; W276-S279 PolarHBondContact O-N 3.42Å; T277-S279 PolarHBondContact O-N 3.36Å; S279-D282 VanDerWaalsContact O-O 3.09Å
280	L	84	Confident	83.1	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-71.8	-33.7	172.1	-173.8	67.8	0	0	0	112.4	V241 T244 W276 T277 F278 I297	V241-L280 HydrophobicContact CG2-CD1 3.95Å; T244-L280 HydrophobicContact CG2-CB 3.74Å; T244-L280 HydrophobicContact CG2-CD1 3.65Å; T244-L280 HydrophobicContact CG2-CG 4.31Å; W276-L280 HydrophobicContact CZ3-CD2 4.19Å; W276-L280 PolarHBondContact O-N 2.97Å; T277-L280 VanDerWaalsContact O-CB 3.29Å; T277-L280 WeakPolarHBondContact O-CB 3.35Å; T277-L280 PolarHBondContact O-N 2.82Å; T277-L280 VanDerWaalsContact O-N 3.08Å; F278-L280 PolarHBondContact O-N 2.96Å; L280-I297 WeakPolarHBondContact O-CD1 3.37Å
281	Y	83.4	Confident	83.7	Confident	17 Å²	17	44.6 Å²	44.6	7%	0.067	23%	0.231	C	C	.	.	H	α-helix	trans	-81.9	-33.9	178.3	-85.6	-99.3	0	0	0	112.8	T277 F278 I283 I289 M294 I297 M356 F359	T277-Y281 HydrophobicContact CG2-CD2 4.1Å; T277-Y281 HydrophobicContact CG2-CE2 3.98Å; T277-Y281 WeakPolarHBondContact O-CD2 3.43Å; T277-Y281 PolarHBondContact O-N 3.42Å; T277-Y281 VanDerWaalsContact O-N 3.16Å; F278-Y281 WeakPolarHBondContact O-CA 3.42Å; F278-Y281 PolarHBondContact O-N 3.36Å; Y281-I283 PolarHBondContact O-N 3.38Å; Y281-I289 HydrophobicContact CG-CD1 4.38Å; Y281-M294 HydrophobicContact CD1-CG 4.44Å; Y281-M294 HydrophobicContact CE1-CG 4.3Å; Y281-I297 HydrophobicContact CD1-CB 4.44Å; Y281-I297 HydrophobicContact CD1-CG2 4.22Å; Y281-I297 HydrophobicContact CE1-CB 4.49Å; Y281-I297 HydrophobicContact CE1-CG2 3.97Å; Y281-M356 HydrophobicContact CD2-CE 4.3Å; Y281-M356 HydrophobicContact CE2-CE 3.63Å; Y281-F359 HydrophobicContact CE2-CE1 4.32Å; Y281-F359 HydrophobicContact CE2-CZ 4.24Å; Y281-F359 WeakPolarHBondContact OH-CZ 3.25Å
282	D	86.1	Confident	84.1	Confident	10 Å²	10	46.5 Å²	46.5	5%	0.053	24%	0.24	C	C	.	.			trans	-79.2	89.6	174.3	178	6.8	0	0	0	109.8	F278 S279 N284 G285 D286 G287 I289	F278-D282 HydrophobicContact CD1-CB 4.35Å; F278-D282 HydrophobicContact CE1-CB 4.05Å; F278-D282 WeakPolarHBondContact O-CB 3.37Å; F278-D282 PolarHBondContact O-N 2.86Å; S279-D282 VanDerWaalsContact O-O 3.09Å; D282-N284 PolarHBondContact OD1-OD1 3.33Å; D282-N284 VanDerWaalsContact OD1-OD1 3.04Å; D282-G285 VanDerWaalsContact OD1-CA 3.31Å; D282-G285 WeakPolarHBondContact OD1-CA 3.24Å; D282-G285 PolarHBondContact OD1-N 2.95Å; D282-G285 WeakPolarHBondContact OD2-CA 3.48Å; D282-D286 PolarHBondContact OD1-N 3.21Å; D282-D286 PolarHBondContact OD2-N 3Å; D282-G287 WeakPolarHBondContact OD2-CA 3.46Å; D282-G287 PolarHBondContact OD2-N 3.39Å; D282-I289 HydrophobicContact CB-CG1 4.26Å
283	I	83.6	Confident	84.5	Confident	35 Å²	35	44.1 Å²	44.1	18%	0.179	23%	0.229	C	C	.	.	S	Bend	trans	-70.5	-38.2	-174.4	-61.1	171.7	0	0	0	110.6	Y240 N243 Y281 E293 D296 I297	Y240-I283 HydrophobicContact CD1-CD1 4.1Å; Y240-I283 HydrophobicContact CD1-CG1 3.92Å; Y240-I283 HydrophobicContact CD1-CG2 4.14Å; Y240-I283 HydrophobicContact CE1-CB 4.48Å; Y240-I283 HydrophobicContact CE1-CD1 3.48Å; Y240-I283 VanDerWaalsContact CE1-CD1 3.48Å; Y240-I283 HydrophobicContact CE1-CG1 3.79Å; Y240-I283 HydrophobicContact CE1-CG2 3.84Å; N243-I283 PolarHBondContact ND2-O 3.29Å; Y281-I283 PolarHBondContact O-N 3.38Å; I283-E293 HydrophobicContact CB-CG 4.11Å; I283-E293 HydrophobicContact CD1-CB 3.99Å; I283-E293 HydrophobicContact CD1-CG 4.07Å; I283-E293 HydrophobicContact CG1-CB 4.23Å; I283-E293 HydrophobicContact CG1-CG 4.21Å; I283-D296 HydrophobicContact CD1-CB 3.78Å; I283-I297 HydrophobicContact CD1-CD1 4.32Å; I283-I297 HydrophobicContact CD1-CG1 4.2Å; I283-I297 HydrophobicContact CG1-CD1 4.21Å; I283-I297 HydrophobicContact CG1-CG1 4.34Å
284	N	83.2	Confident	84.9	Confident	83 Å²	83	43 Å²	43	44%	0.444	22%	0.224	S	C	.	.	S	Bend	trans	-86.8	-13.2	-174.8	73.2	25.6	0	0	0	113.3	D282 D286 E293	D282-N284 PolarHBondContact OD1-OD1 3.33Å; D282-N284 VanDerWaalsContact OD1-OD1 3.04Å; N284-D286 VanDerWaalsContact C-N 3.34Å; N284-D286 PolarHBondContact ND2-OD2 2.93Å; N284-D286 WeakPolarHBondContact OD1-CA 3.38Å; N284-D286 WeakPolarHBondContact OD1-CB 3.42Å; N284-D286 PolarHBondContact OD1-N 3.28Å; N284-D286 PolarHBondContact OD1-OD1 3.14Å; N284-D286 VanDerWaalsContact OD1-OD1 3.14Å; N284-D286 PolarHBondContact OD1-OD2 3.06Å; N284-E293 WeakPolarHBondContact CB-OE1 3.4Å; N284-E293 PolarHBondContact N-OE1 2.91Å; N284-E293 PolarHBondContact ND2-OE1 3.15Å
285	G	83	Confident	85.2	Confident	45 Å²	45	43.6 Å²	43.6	46%	0.464	23%	0.229	S	C	.	.			trans	74.2	19.3	178	0	0	0	0	0	114.2	D282 G287	D282-G285 VanDerWaalsContact OD1-CA 3.31Å; D282-G285 WeakPolarHBondContact OD1-CA 3.24Å; D282-G285 PolarHBondContact OD1-N 2.95Å; D282-G285 WeakPolarHBondContact OD2-CA 3.48Å; G285-G287 PolarHBondContact O-N 2.97Å
286	D	85.7	Confident	85.3	Confident	82 Å²	82	42.2 Å²	42.2	44%	0.439	23%	0.229	S	C	.	.	S	Bend	trans	-81	-4.8	-177.5	72.8	12	0	0	0	113.2	D282 N284 F288	D282-D286 PolarHBondContact OD1-N 3.21Å; D282-D286 PolarHBondContact OD2-N 3Å; N284-D286 VanDerWaalsContact C-N 3.34Å; N284-D286 PolarHBondContact ND2-OD2 2.93Å; N284-D286 WeakPolarHBondContact OD1-CA 3.38Å; N284-D286 WeakPolarHBondContact OD1-CB 3.42Å; N284-D286 PolarHBondContact OD1-N 3.28Å; N284-D286 PolarHBondContact OD1-OD1 3.14Å; N284-D286 VanDerWaalsContact OD1-OD1 3.14Å; N284-D286 PolarHBondContact OD1-OD2 3.06Å; D286-F288 VanDerWaalsContact O-CD2 3.26Å; D286-F288 WeakPolarHBondContact O-CD2 3.23Å; D286-F288 WeakPolarHBondContact O-CE2 3.28Å; D286-F288 WeakPolarHBondContact OD1-CA 3.39Å; D286-F288 WeakPolarHBondContact OD1-CB 3.29Å; D286-F288 PolarHBondContact OD1-N 2.67Å
287	G	86.4	Confident	85.3	Confident	32 Å²	32	40.5 Å²	40.5	33%	0.33	22%	0.223	S	C	.	.	S	Bend	trans	86.5	8.4	-179.1	0	0	0	0	0	113.9	F278 D282 G285	F278-G287 WeakPolarHBondContact CZ-O 3.4Å; D282-G287 WeakPolarHBondContact OD2-CA 3.46Å; D282-G287 PolarHBondContact OD2-N 3.39Å; G285-G287 PolarHBondContact O-N 2.97Å
288	F	90.3	Very high	85.1	Confident	89 Å²	89	40.8 Å²	40.8	39%	0.39	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138.5	179.7	-56.3	-86.7	0	0	0	110.2	D286 V336 T338	D286-F288 VanDerWaalsContact O-CD2 3.26Å; D286-F288 WeakPolarHBondContact O-CD2 3.23Å; D286-F288 WeakPolarHBondContact O-CE2 3.28Å; D286-F288 WeakPolarHBondContact OD1-CA 3.39Å; D286-F288 WeakPolarHBondContact OD1-CB 3.29Å; D286-F288 PolarHBondContact OD1-N 2.67Å; F288-V336 HydrophobicContact CB-CB 4.15Å; F288-V336 HydrophobicContact CB-CG1 4.42Å; F288-V336 HydrophobicContact CD1-CB 4.28Å; F288-V336 HydrophobicContact CD1-CG2 3.87Å; F288-T338 HydrophobicContact CD1-CG2 3.77Å; F288-T338 HydrophobicContact CE1-CG2 3.7Å
289	I	88.6	Confident	84.9	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.4	173.4	-59.1	163.1	0	0	0	108.6	F278 Y281 D282 M294 F326 V337 F342	F278-I289 HydrophobicContact CD2-CD1 3.42Å; F278-I289 VanDerWaalsContact CD2-CD1 3.42Å; F278-I289 HydrophobicContact CD2-CG1 4.16Å; F278-I289 HydrophobicContact CE2-CD1 3.34Å; F278-I289 HydrophobicContact CE2-CG1 3.68Å; F278-I289 HydrophobicContact CG-CD1 4.21Å; F278-I289 HydrophobicContact CZ-CD1 4.08Å; F278-I289 HydrophobicContact CZ-CG1 3.91Å; Y281-I289 HydrophobicContact CG-CD1 4.38Å; D282-I289 HydrophobicContact CB-CG1 4.26Å; I289-M294 HydrophobicContact CG2-CB 4.33Å; I289-M294 HydrophobicContact CG2-CE 4.16Å; I289-F326 WeakPolarHBondContact O-CE2 3.48Å; I289-V337 HydrophobicContact CB-CB 4.21Å; I289-V337 PolarHBondContact N-O 3.33Å; I289-V337 PolarHBondContact O-N 3.34Å; I289-F342 HydrophobicContact CD1-CD2 4.04Å; I289-F342 HydrophobicContact CD1-CE2 4.31Å
290	T	90.1	Very high	84.6	Confident	30 Å²	30	40.2 Å²	40.2	18%	0.184	22%	0.22	C	C	.	.			trans	-86.7	164.7	173.5	64.3	0	0	0	0	111.8	E292 E293 M294 V336	T290-E292 VanDerWaalsContact C-N 3.26Å; T290-E292 PolarHBondContact O-N 3.18Å; T290-E293 WeakPolarHBondContact CB-OE2 3.39Å; T290-E293 PolarHBondContact N-OE2 3.39Å; T290-E293 PolarHBondContact O-N 2.89Å; T290-E293 WeakPolarHBondContact OG1-CG 3.46Å; T290-E293 PolarHBondContact OG1-N 3.04Å; T290-E293 PolarHBondContact OG1-OE2 3.34Å; T290-M294 PolarHBondContact O-N 3.47Å; T290-V336 HydrophobicContact CG2-CG1 4.43Å
291	R	86.9	Confident	84.1	Confident	106 Å²	106	40.8 Å²	40.8	40%	0.4	22%	0.223	S	C	.	.	H	α-helix	trans	-64.7	-36	177.1	-73.9	-178.8	-67.9	-160	-7.9	111.8	T295 F326	R291-T295 WeakPolarHBondContact O-CB 3.33Å; R291-T295 PolarHBondContact O-N 3.22Å; R291-T295 PolarHBondContact O-OG1 3.3Å; R291-F326 HydrophobicContact CB-CD2 4.4Å; R291-F326 HydrophobicContact CB-CE2 4.35Å; R291-F326 HydrophobicContact CG-CB 4.46Å; R291-F326 HydrophobicContact CG-CD1 3.64Å; R291-F326 HydrophobicContact CG-CD2 3.55Å; R291-F326 HydrophobicContact CG-CE1 3.65Å; R291-F326 HydrophobicContact CG-CE2 3.55Å; R291-F326 HydrophobicContact CG-CG 3.59Å; R291-F326 HydrophobicContact CG-CZ 3.61Å
292	E	87.4	Confident	83.4	Confident	119 Å²	119	44.1 Å²	44.1	56%	0.556	24%	0.236	S	C	*	.	H	α-helix	trans	-60.9	-50.6	177.1	-66.4	71.3	-159	0	0	109.7	T290 M294 T295 D296	T290-E292 VanDerWaalsContact C-N 3.26Å; T290-E292 PolarHBondContact O-N 3.18Å; E292-M294 PolarHBondContact O-N 2.67Å; E292-T295 WeakPolarHBondContact O-CB 3.21Å; E292-T295 PolarHBondContact O-N 3.36Å; E292-T295 VanDerWaalsContact O-N 3.09Å; E292-D296 PolarHBondContact O-N 3.4Å
293	E	87.6	Confident	82.7	Confident	12 Å²	12	47.3 Å²	47.3	6%	0.056	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-41.2	179.3	-68.9	164.1	144	0	0	112.4	I283 N284 T290 T295 D296 I297	I283-E293 HydrophobicContact CB-CG 4.11Å; I283-E293 HydrophobicContact CD1-CB 3.99Å; I283-E293 HydrophobicContact CD1-CG 4.07Å; I283-E293 HydrophobicContact CG1-CB 4.23Å; I283-E293 HydrophobicContact CG1-CG 4.21Å; N284-E293 WeakPolarHBondContact CB-OE1 3.4Å; N284-E293 PolarHBondContact N-OE1 2.91Å; N284-E293 PolarHBondContact ND2-OE1 3.15Å; T290-E293 WeakPolarHBondContact CB-OE2 3.39Å; T290-E293 PolarHBondContact N-OE2 3.39Å; T290-E293 PolarHBondContact O-N 2.89Å; T290-E293 WeakPolarHBondContact OG1-CG 3.46Å; T290-E293 PolarHBondContact OG1-N 3.04Å; T290-E293 PolarHBondContact OG1-OE2 3.34Å; E293-T295 VanDerWaalsContact C-N 3.27Å; E293-T295 PolarHBondContact O-N 2.68Å; E293-D296 PolarHBondContact O-N 3.46Å; E293-I297 WeakPolarHBondContact O-CG1 2.96Å; E293-I297 PolarHBondContact O-N 3.41Å
294	M	85.3	Confident	81.9	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.015	25%	0.245	C	C	.	.	H	α-helix	trans	-62	-37.2	174.5	-169.9	174.1	-70	0	0	111.8	Y281 I289 T290 E292 V298 V322 I325 F326 M329	Y281-M294 HydrophobicContact CD1-CG 4.44Å; Y281-M294 HydrophobicContact CE1-CG 4.3Å; I289-M294 HydrophobicContact CG2-CB 4.33Å; I289-M294 HydrophobicContact CG2-CE 4.16Å; T290-M294 PolarHBondContact O-N 3.47Å; E292-M294 PolarHBondContact O-N 2.67Å; M294-V298 WeakPolarHBondContact O-CB 3.2Å; M294-V298 WeakPolarHBondContact O-CG2 3.01Å; M294-V298 PolarHBondContact O-N 2.74Å; M294-V298 VanDerWaalsContact O-N 3.12Å; M294-V322 HydrophobicContact CB-CG1 3.96Å; M294-V322 HydrophobicContact CG-CG1 3.81Å; M294-V322 HydrophobicContact SD-CG1 3.96Å; M294-I325 HydrophobicContact CE-CG2 4.4Å; M294-I325 HydrophobicContact SD-CB 4.29Å; M294-I325 HydrophobicContact SD-CG2 3.95Å; M294-F326 HydrophobicContact CE-CD2 3.99Å; M294-F326 HydrophobicContact SD-CB 4.24Å; M294-F326 HydrophobicContact SD-CD2 4.14Å; M294-M329 HydrophobicContact CE-SD 3.84Å
295	T	84.3	Confident	80.9	Confident	32 Å²	32	46.2 Å²	46.2	20%	0.196	24%	0.244	C	C	.	.	H	α-helix	trans	-66.7	-42.7	176.8	-58.2	0	0	0	0	111.5	R291 E292 E293 V298 T299	R291-T295 WeakPolarHBondContact O-CB 3.33Å; R291-T295 PolarHBondContact O-N 3.22Å; R291-T295 PolarHBondContact O-OG1 3.3Å; E292-T295 WeakPolarHBondContact O-CB 3.21Å; E292-T295 PolarHBondContact O-N 3.36Å; E292-T295 VanDerWaalsContact O-N 3.09Å; E293-T295 VanDerWaalsContact C-N 3.27Å; E293-T295 PolarHBondContact O-N 2.68Å; T295-V298 PolarHBondContact O-N 3.19Å; T295-T299 VanDerWaalsContact O-CB 3.29Å; T295-T299 WeakPolarHBondContact O-CB 3.36Å; T295-T299 PolarHBondContact O-N 3.48Å; T295-T299 PolarHBondContact O-OG1 3.35Å
296	D	84.7	Confident	79.6	Confident	79 Å²	79	45.2 Å²	45.2	42%	0.422	23%	0.233	S	C	.	.	H	α-helix	trans	-63	-45.8	179.6	-77.4	-16.3	0	0	0	111.9	I283 E292 E293 T299 A300	I283-D296 HydrophobicContact CD1-CB 3.78Å; E292-D296 PolarHBondContact O-N 3.4Å; E293-D296 PolarHBondContact O-N 3.46Å; D296-T299 PolarHBondContact O-N 2.7Å; D296-A300 WeakPolarHBondContact O-CB 3.4Å; D296-A300 PolarHBondContact O-N 2.82Å
297	I	81.3	Confident	78.1	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.7	-47.9	176.7	-66.4	-69.7	0	0	0	111.3	Y240 L280 Y281 I283 E293 T299 A300 I301	Y240-I297 HydrophobicContact CD1-CD1 4.09Å; Y240-I297 HydrophobicContact CD2-CD1 3.44Å; Y240-I297 VanDerWaalsContact CD2-CD1 3.44Å; Y240-I297 HydrophobicContact CE2-CD1 3.91Å; Y240-I297 HydrophobicContact CG-CD1 3.54Å; L280-I297 WeakPolarHBondContact O-CD1 3.37Å; Y281-I297 HydrophobicContact CD1-CB 4.44Å; Y281-I297 HydrophobicContact CD1-CG2 4.22Å; Y281-I297 HydrophobicContact CE1-CB 4.49Å; Y281-I297 HydrophobicContact CE1-CG2 3.97Å; I283-I297 HydrophobicContact CD1-CD1 4.32Å; I283-I297 HydrophobicContact CD1-CG1 4.2Å; I283-I297 HydrophobicContact CG1-CD1 4.21Å; I283-I297 HydrophobicContact CG1-CG1 4.34Å; E293-I297 WeakPolarHBondContact O-CG1 2.96Å; E293-I297 PolarHBondContact O-N 3.41Å; I297-T299 VanDerWaalsContact C-N 3.32Å; I297-T299 PolarHBondContact O-N 3.18Å; I297-A300 PolarHBondContact O-N 3.48Å; I297-I301 HydrophobicContact CG2-CD1 3.92Å; I297-I301 WeakPolarHBondContact O-CD1 3.02Å; I297-I301 VanDerWaalsContact O-CG1 3.32Å; I297-I301 WeakPolarHBondContact O-CG1 3.49Å; I297-I301 PolarHBondContact O-N 2.68Å
298	V	77.6	Confident	76	Confident	19 Å²	19	57.1 Å²	57.1	12%	0.115	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-42.6	179.4	172.8	0	0	0	0	110.5	M294 T295 A300 I301 Y302 I318 V322	M294-V298 WeakPolarHBondContact O-CB 3.2Å; M294-V298 WeakPolarHBondContact O-CG2 3.01Å; M294-V298 PolarHBondContact O-N 2.74Å; M294-V298 VanDerWaalsContact O-N 3.12Å; T295-V298 PolarHBondContact O-N 3.19Å; V298-A300 PolarHBondContact O-N 3.3Å; V298-I301 WeakPolarHBondContact O-CB 3.28Å; V298-I301 PolarHBondContact O-N 3.06Å; V298-Y302 HydrophobicContact CG1-CD2 3.75Å; V298-Y302 HydrophobicContact CG1-CE2 3.51Å; V298-Y302 WeakPolarHBondContact O-CD2 3.21Å; V298-Y302 PolarHBondContact O-N 3.38Å; V298-I318 HydrophobicContact CB-CG2 4.44Å; V298-I318 HydrophobicContact CG1-CG2 3.75Å; V298-V322 HydrophobicContact CB-CG2 4.09Å; V298-V322 HydrophobicContact CG1-CG2 4.28Å; V298-V322 HydrophobicContact CG2-CG2 4Å
299	T	78.8	Confident	73.7	Confident	47 Å²	47	59.2 Å²	59.2	29%	0.288	29%	0.293	S	S	.	.	H	α-helix	trans	-61	-45.7	176.9	-58.9	0	0	0	0	111.5	T295 D296 I297 I301 Y302 E303	T295-T299 VanDerWaalsContact O-CB 3.29Å; T295-T299 WeakPolarHBondContact O-CB 3.36Å; T295-T299 PolarHBondContact O-N 3.48Å; T295-T299 PolarHBondContact O-OG1 3.35Å; D296-T299 PolarHBondContact O-N 2.7Å; I297-T299 VanDerWaalsContact C-N 3.32Å; I297-T299 PolarHBondContact O-N 3.18Å; T299-I301 VanDerWaalsContact C-N 3.26Å; T299-I301 PolarHBondContact O-N 2.89Å; T299-Y302 WeakPolarHBondContact O-CB 3.44Å; T299-Y302 PolarHBondContact O-N 3.27Å; T299-E303 PolarHBondContact O-N 3.49Å
300	A	77.4	Confident	71.6	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-35.4	176.3	0	0	0	0	0	112.7	L236 Y240 D296 I297 V298 E303 L304	L236-A300 HydrophobicContact CB-CB 3.84Å; Y240-A300 HydrophobicContact CD2-CB 4.11Å; Y240-A300 HydrophobicContact CE2-CB 3.71Å; D296-A300 WeakPolarHBondContact O-CB 3.4Å; D296-A300 PolarHBondContact O-N 2.82Å; I297-A300 PolarHBondContact O-N 3.48Å; V298-A300 PolarHBondContact O-N 3.3Å; A300-E303 PolarHBondContact O-N 2.97Å; A300-L304 VanDerWaalsContact O-CB 3.3Å; A300-L304 WeakPolarHBondContact O-CB 3.38Å; A300-L304 PolarHBondContact O-N 2.82Å
301	I	73.4	Confident	69.5	Low	16 Å²	16	72.2 Å²	72.2	8%	0.082	36%	0.356	C	S	.	.	H	α-helix	trans	-66.2	-41.4	173.3	-65.9	154.9	0	0	0	111.1	F137 Y237 I297 V298 T299 L304 M305	F137-I301 HydrophobicContact CE1-CD1 4.23Å; F137-I301 HydrophobicContact CE1-CG1 4.34Å; F137-I301 HydrophobicContact CE2-CG2 4.25Å; F137-I301 HydrophobicContact CZ-CD1 3.6Å; F137-I301 HydrophobicContact CZ-CG1 3.97Å; F137-I301 HydrophobicContact CZ-CG2 3.97Å; Y237-I301 HydrophobicContact CD2-CG1 3.98Å; Y237-I301 HydrophobicContact CE2-CD1 4.47Å; Y237-I301 HydrophobicContact CE2-CG1 3.83Å; I297-I301 HydrophobicContact CG2-CD1 3.92Å; I297-I301 WeakPolarHBondContact O-CD1 3.02Å; I297-I301 VanDerWaalsContact O-CG1 3.32Å; I297-I301 WeakPolarHBondContact O-CG1 3.49Å; I297-I301 PolarHBondContact O-N 2.68Å; V298-I301 WeakPolarHBondContact O-CB 3.28Å; V298-I301 PolarHBondContact O-N 3.06Å; T299-I301 VanDerWaalsContact C-N 3.26Å; T299-I301 PolarHBondContact O-N 2.89Å; I301-L304 WeakPolarHBondContact O-CB 3.32Å; I301-L304 PolarHBondContact O-N 2.93Å; I301-M305 WeakPolarHBondContact O-CG 3.44Å; I301-M305 PolarHBondContact O-N 3.32Å; I301-M305 VanDerWaalsContact O-N 3.11Å
302	Y	70.4	Confident	67.4	Low	87 Å²	87	72.6 Å²	72.6	34%	0.341	37%	0.374	S	S	.	.	H	α-helix	trans	-63.1	-41.7	176.4	-84.8	-78.2	0	0	0	112	V298 T299 L304 M305 P313 I318	V298-Y302 HydrophobicContact CG1-CD2 3.75Å; V298-Y302 HydrophobicContact CG1-CE2 3.51Å; V298-Y302 WeakPolarHBondContact O-CD2 3.21Å; V298-Y302 PolarHBondContact O-N 3.38Å; T299-Y302 WeakPolarHBondContact O-CB 3.44Å; T299-Y302 PolarHBondContact O-N 3.27Å; Y302-L304 VanDerWaalsContact C-N 3.28Å; Y302-L304 PolarHBondContact O-N 3.35Å; Y302-M305 PolarHBondContact O-N 2.88Å; Y302-P313 HydrophobicContact CD1-CG 4.25Å; Y302-I318 HydrophobicContact CD2-CD1 3.56Å; Y302-I318 HydrophobicContact CD2-CG1 3.86Å; Y302-I318 HydrophobicContact CE2-CD1 3.94Å; Y302-I318 HydrophobicContact CE2-CG1 3.68Å; Y302-I318 HydrophobicContact CG-CD1 3.94Å
303	E	71.3	Confident	65.6	Low	77 Å²	77	69.6 Å²	69.6	36%	0.36	37%	0.365	S	S	.	.	H	α-helix	trans	-64.4	-34	175	-67.4	-160.7	174.8	0	0	113	N233 L236 T299 A300 M305 G306	N233-E303 PolarHBondContact N-O 3.41Å; L236-E303 VanDerWaalsContact CD1-OE2 3.31Å; L236-E303 WeakPolarHBondContact CD1-OE2 3.42Å; T299-E303 PolarHBondContact O-N 3.49Å; A300-E303 PolarHBondContact O-N 2.97Å; E303-M305 VanDerWaalsContact C-N 3.33Å; E303-G306 PolarHBondContact O-N 3.11Å
304	L	67.3	Low	64.1	Low	9 Å²	9	74.2 Å²	74.2	5%	0.047	39%	0.386	C	S	.	.	H	α-helix	trans	-70.5	-27.8	177.7	-171.9	66.5	0	0	0	113.2	I140 F228 A232 P234 Y237 A300 I301 Y302 G306	I140-L304 HydrophobicContact CD1-CD2 3.27Å; I140-L304 HydrophobicContact CD1-CG 4.5Å; I140-L304 HydrophobicContact CG1-CD2 3.57Å; I140-L304 HydrophobicContact CG1-CG 4.49Å; F228-L304 HydrophobicContact CD1-CD1 3.71Å; F228-L304 HydrophobicContact CD1-CG 4.28Å; F228-L304 HydrophobicContact CD2-CD1 4.18Å; F228-L304 HydrophobicContact CE1-CD1 3.47Å; F228-L304 VanDerWaalsContact CE1-CD1 3.47Å; F228-L304 HydrophobicContact CE1-CD2 4.18Å; F228-L304 HydrophobicContact CE1-CG 3.82Å; F228-L304 HydrophobicContact CE2-CD1 3.97Å; F228-L304 HydrophobicContact CG-CD1 4.08Å; F228-L304 HydrophobicContact CZ-CD1 3.63Å; F228-L304 HydrophobicContact CZ-CD2 4.26Å; F228-L304 HydrophobicContact CZ-CG 4.24Å; A232-L304 WeakPolarHBondContact CB-O 3.28Å; P234-L304 HydrophobicContact CB-CD1 3.43Å; P234-L304 VanDerWaalsContact CB-CD1 3.43Å; Y237-L304 HydrophobicContact CD1-CD2 3.84Å; Y237-L304 HydrophobicContact CD2-CD2 4.47Å; Y237-L304 HydrophobicContact CE1-CD2 4.38Å; Y237-L304 HydrophobicContact CG-CD2 3.87Å; A300-L304 VanDerWaalsContact O-CB 3.3Å; A300-L304 WeakPolarHBondContact O-CB 3.38Å; A300-L304 PolarHBondContact O-N 2.82Å; I301-L304 WeakPolarHBondContact O-CB 3.32Å; I301-L304 PolarHBondContact O-N 2.93Å; Y302-L304 VanDerWaalsContact C-N 3.28Å; Y302-L304 PolarHBondContact O-N 3.35Å; L304-G306 PolarHBondContact O-N 3.19Å
305	M	62.1	Low	63.1	Low	86 Å²	86	80.8 Å²	80.8	42%	0.424	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-16	177.3	-74.2	-171.1	67.5	0	0	113.6	C136 I301 Y302 E303	C136-M305 HydrophobicContact CB-CE 4.04Å; C136-M305 HydrophobicContact CB-CG 3.26Å; C136-M305 HydrophobicContact CB-SD 3.5Å; C136-M305 VanDerWaalsContact CB-SD 3.5Å; C136-M305 VanDerWaalsContact SG-SD 3.61Å; I301-M305 WeakPolarHBondContact O-CG 3.44Å; I301-M305 PolarHBondContact O-N 3.32Å; I301-M305 VanDerWaalsContact O-N 3.11Å; Y302-M305 PolarHBondContact O-N 2.88Å; E303-M305 VanDerWaalsContact C-N 3.33Å
306	G	54.9	Low	62.2	Low	23 Å²	23	86.5 Å²	86.5	24%	0.237	44%	0.442	C	S	.	.			trans	75.8	143.5	-171.2	0	0	0	0	0	111	E303 L304 L308	E303-G306 PolarHBondContact O-N 3.11Å; L304-G306 PolarHBondContact O-N 3.19Å; G306-L308 PolarHBondContact O-N 3.34Å
307	R	53.5	Low	61.5	Low	243 Å²	243	89.1 Å²	89.1	92%	0.917	45%	0.449	S	S	*	.			trans	-62.4	117.9	177.4	-67.8	-176.9	178.4	160.7	-0.1	109.8
308	L	41.9	Very low	61	Low	121 Å²	121	89.7 Å²	89.7	63%	0.634	45%	0.452	S	S	*	.			trans	-69.3	125.4	154.3	-79.7	162.1	0	0	0	106.2	G306 D310 E311	G306-L308 PolarHBondContact O-N 3.34Å; L308-D310 PolarHBondContact O-N 2.71Å; L308-E311 PolarHBondContact O-N 3.15Å
309	P	42.6	Very low	61	Low	133 Å²	133	94.1 Å²	94.1	86%	0.864	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	2.5	-172.2	17.7	-25.6	0	0	0	115.5
310	D	44.3	Very low	61	Low	158 Å²	158	93.5 Å²	93.5	85%	0.845	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.7	4	-174.9	-138.6	5.3	0	0	0	114.5	L308	L308-D310 PolarHBondContact O-N 2.71Å
311	E	45.8	Very low	60.9	Low	145 Å²	145	98.4 Å²	98.4	68%	0.678	49%	0.494	S	S	*	.			trans	-135.6	81.3	178	-67.3	-173.2	170.9	0	0	108.9	L308 P313	L308-E311 PolarHBondContact O-N 3.15Å; E311-P313 WeakPolarHBondContact O-CD 3.35Å
312	C	42.9	Very low	61.3	Low	114 Å²	114	97.8 Å²	97.8	77%	0.77	49%	0.491	S	S	*	.			trans	-56	121.8	152.7	-68.2	0	0	0	0	106.2	E314	C312-E314 VanDerWaalsContact C-N 3.34Å; C312-E314 PolarHBondContact O-N 3.34Å
313	P	51.3	Low	61.9	Low	56 Å²	56	97.5 Å²	97.5	36%	0.364	49%	0.493	S	S	.	.			trans	-63.3	111.5	158.6	10.5	1.6	0	0	0	103.9	Y302 E311 E315 I318	Y302-P313 HydrophobicContact CD1-CG 4.25Å; E311-P313 WeakPolarHBondContact O-CD 3.35Å; P313-E315 PolarHBondContact O-N 3.37Å; P313-I318 HydrophobicContact CB-CD1 3.7Å; P313-I318 HydrophobicContact CB-CG1 3.82Å; P313-I318 HydrophobicContact CG-CD1 3.86Å; P313-I318 HydrophobicContact CG-CG1 4.5Å
314	E	56	Low	62.4	Low	109 Å²	109	100.3 Å²	100.3	51%	0.509	51%	0.506	S	S	.	.			trans	-46.9	123.5	157.2	-73.2	164.2	159.6	0	0	104.8	C312 E316 K317	C312-E314 VanDerWaalsContact C-N 3.34Å; C312-E314 PolarHBondContact O-N 3.34Å; E314-E316 HydrophobicContact CB-CB 4.36Å; E314-E316 CarbonylContact O-C 3.53Å; E314-E316 PolarHBondContact O-N 3.23Å; E314-K317 HydrophobicContact CB-CG 4.33Å; E314-K317 WeakPolarHBondContact O-CA 3.37Å; E314-K317 WeakPolarHBondContact O-CB 3.44Å; E314-K317 PolarHBondContact O-N 2.56Å; E314-K317 VanDerWaalsContact OE2-CE 3.24Å; E314-K317 WeakPolarHBondContact OE2-CE 3.25Å; E314-K317 IonicContact OE2-NZ 3.13Å
315	E	62.3	Low	63.1	Low	142 Å²	142	101.8 Å²	101.8	66%	0.664	51%	0.513	S	S	*	.	H	α-helix	trans	-47.9	-28.9	179.6	-138.6	175.9	-173.7	0	0	110.7	P313 I318 K319	P313-E315 PolarHBondContact O-N 3.37Å; E315-I318 PolarHBondContact O-N 3.18Å; E315-K319 WeakPolarHBondContact O-CB 3.11Å; E315-K319 WeakPolarHBondContact O-CG 3.37Å; E315-K319 PolarHBondContact O-N 3.29Å
316	E	66.1	Low	64.1	Low	152 Å²	152	97.8 Å²	97.8	71%	0.71	49%	0.494	S	S	*	.	H	α-helix	trans	-59.7	-37.2	170.3	-70.9	179.1	153.9	0	0	115.2	E314 G320	E314-E316 HydrophobicContact CB-CB 4.36Å; E314-E316 CarbonylContact O-C 3.53Å; E314-E316 PolarHBondContact O-N 3.23Å; E316-G320 PolarHBondContact O-N 2.88Å
317	K	69.9	Low	65.5	Low	134 Å²	134	102.1 Å²	102.1	58%	0.583	51%	0.508	S	S	*	.	H	α-helix	trans	-68.9	-38.9	174.9	-72.1	178.1	-177.3	166.1	0	111.8	E314 K321	E314-K317 HydrophobicContact CB-CG 4.33Å; E314-K317 WeakPolarHBondContact O-CA 3.37Å; E314-K317 WeakPolarHBondContact O-CB 3.44Å; E314-K317 PolarHBondContact O-N 2.56Å; E314-K317 VanDerWaalsContact OE2-CE 3.24Å; E314-K317 WeakPolarHBondContact OE2-CE 3.25Å; E314-K317 IonicContact OE2-NZ 3.13Å; K317-K321 WeakPolarHBondContact O-CB 3.39Å; K317-K321 PolarHBondContact O-N 2.96Å
318	I	70.9	Confident	66.9	Low	12 Å²	12	95.9 Å²	95.9	6%	0.062	49%	0.487	C	S	.	.	H	α-helix	trans	-67.4	-51.3	175.6	-66.5	176.8	0	0	0	109.2	V298 Y302 P313 E315 G320 K321 V322	V298-I318 HydrophobicContact CB-CG2 4.44Å; V298-I318 HydrophobicContact CG1-CG2 3.75Å; Y302-I318 HydrophobicContact CD2-CD1 3.56Å; Y302-I318 HydrophobicContact CD2-CG1 3.86Å; Y302-I318 HydrophobicContact CE2-CD1 3.94Å; Y302-I318 HydrophobicContact CE2-CG1 3.68Å; Y302-I318 HydrophobicContact CG-CD1 3.94Å; P313-I318 HydrophobicContact CB-CD1 3.7Å; P313-I318 HydrophobicContact CB-CG1 3.82Å; P313-I318 HydrophobicContact CG-CD1 3.86Å; P313-I318 HydrophobicContact CG-CG1 4.5Å; E315-I318 PolarHBondContact O-N 3.18Å; I318-G320 VanDerWaalsContact C-N 3.33Å; I318-G320 PolarHBondContact O-N 2.95Å; I318-K321 PolarHBondContact O-N 3.25Å; I318-K321 VanDerWaalsContact O-N 3.12Å; I318-V322 HydrophobicContact CG2-CG2 4.27Å; I318-V322 VanDerWaalsContact O-CG2 3.32Å; I318-V322 WeakPolarHBondContact O-CG2 3.3Å; I318-V322 PolarHBondContact O-N 3.09Å
319	K	78.4	Confident	68.8	Low	112 Å²	112	90.3 Å²	90.3	49%	0.487	46%	0.458	S	S	.	.	H	α-helix	trans	-57.7	-43.8	177	-74	177.6	-178.9	175.2	0	112.2	E315 K321 V322 E323	E315-K319 WeakPolarHBondContact O-CB 3.11Å; E315-K319 WeakPolarHBondContact O-CG 3.37Å; E315-K319 PolarHBondContact O-N 3.29Å; K319-K321 VanDerWaalsContact C-N 3.33Å; K319-K321 PolarHBondContact O-N 3.29Å; K319-V322 PolarHBondContact O-N 3.36Å; K319-E323 WeakPolarHBondContact O-CB 3.45Å; K319-E323 PolarHBondContact O-N 3.33Å
320	G	78.9	Confident	71	Confident	33 Å²	33	84.5 Å²	84.5	34%	0.34	42%	0.419	S	S	.	.	H	α-helix	trans	-63.7	-36.8	177	0	0	0	0	0	112.9	E316 I318 Q324	E316-G320 PolarHBondContact O-N 2.88Å; I318-G320 VanDerWaalsContact C-N 3.33Å; I318-G320 PolarHBondContact O-N 2.95Å; G320-Q324 VanDerWaalsContact O-CG 3.31Å; G320-Q324 WeakPolarHBondContact O-CG 3.07Å; G320-Q324 PolarHBondContact O-N 2.82Å; G320-Q324 VanDerWaalsContact O-N 3.12Å
321	K	75.7	Confident	72.8	Confident	104 Å²	104	82 Å²	82	45%	0.452	41%	0.41	S	S	.	.	H	α-helix	trans	-72.3	-40.3	175.7	-170.4	167.4	-176.7	176.5	0	112.3	K317 I318 K319 Q324 I325	K317-K321 WeakPolarHBondContact O-CB 3.39Å; K317-K321 PolarHBondContact O-N 2.96Å; I318-K321 PolarHBondContact O-N 3.25Å; I318-K321 VanDerWaalsContact O-N 3.12Å; K319-K321 VanDerWaalsContact C-N 3.33Å; K319-K321 PolarHBondContact O-N 3.29Å; K321-Q324 PolarHBondContact O-N 3.33Å; K321-I325 HydrophobicContact CG-CD1 4.14Å; K321-I325 VanDerWaalsContact O-CG1 3.29Å; K321-I325 WeakPolarHBondContact O-CG1 3.4Å; K321-I325 PolarHBondContact O-N 3.08Å; K321-I325 VanDerWaalsContact O-N 3.11Å
322	V	80.6	Confident	74.8	Confident	4 Å²	4	79.1 Å²	79.1	2%	0.024	40%	0.399	C	S	.	.	H	α-helix	trans	-61	-49.2	174	170.8	0	0	0	0	109.8	M294 V298 I318 K319 Q324 I325 F326	M294-V322 HydrophobicContact CB-CG1 3.96Å; M294-V322 HydrophobicContact CG-CG1 3.81Å; M294-V322 HydrophobicContact SD-CG1 3.96Å; V298-V322 HydrophobicContact CB-CG2 4.09Å; V298-V322 HydrophobicContact CG1-CG2 4.28Å; V298-V322 HydrophobicContact CG2-CG2 4Å; I318-V322 HydrophobicContact CG2-CG2 4.27Å; I318-V322 VanDerWaalsContact O-CG2 3.32Å; I318-V322 WeakPolarHBondContact O-CG2 3.3Å; I318-V322 PolarHBondContact O-N 3.09Å; K319-V322 PolarHBondContact O-N 3.36Å; V322-Q324 VanDerWaalsContact C-N 3.32Å; V322-Q324 PolarHBondContact O-N 3.46Å; V322-I325 PolarHBondContact O-N 3.39Å; V322-I325 VanDerWaalsContact O-N 3.07Å; V322-F326 VanDerWaalsContact O-CB 3.27Å; V322-F326 WeakPolarHBondContact O-CB 3.25Å; V322-F326 PolarHBondContact O-N 3.48Å
323	E	83.8	Confident	76.8	Confident	80 Å²	80	82.9 Å²	82.9	37%	0.374	40%	0.397	S	S	.	.	H	α-helix	trans	-59	-41.8	179.1	-172.4	64.7	-159.2	0	0	112	K319 I325 F326 Q327	K319-E323 WeakPolarHBondContact O-CB 3.45Å; K319-E323 PolarHBondContact O-N 3.33Å; E323-I325 VanDerWaalsContact C-N 3.34Å; E323-I325 PolarHBondContact O-N 2.96Å; E323-F326 PolarHBondContact O-N 3.4Å; E323-Q327 WeakPolarHBondContact O-CB 2.99Å; E323-Q327 PolarHBondContact O-N 3.46Å
324	Q	81.6	Confident	78.5	Confident	137 Å²	137	84.4 Å²	84.4	64%	0.64	40%	0.403	S	S	*	.	H	α-helix	trans	-63.7	-37	175.8	-77.4	179.5	6.1	0	0	113.3	G320 K321 V322 K328	G320-Q324 VanDerWaalsContact O-CG 3.31Å; G320-Q324 WeakPolarHBondContact O-CG 3.07Å; G320-Q324 PolarHBondContact O-N 2.82Å; G320-Q324 VanDerWaalsContact O-N 3.12Å; K321-Q324 PolarHBondContact O-N 3.33Å; V322-Q324 VanDerWaalsContact C-N 3.32Å; V322-Q324 PolarHBondContact O-N 3.46Å; Q324-K328 VanDerWaalsContact O-CG 3.31Å; Q324-K328 WeakPolarHBondContact O-CG 3.33Å
325	I	80.6	Confident	79.9	Confident	39 Å²	39	80.4 Å²	80.4	20%	0.2	39%	0.391	C	S	.	.	H	α-helix	trans	-73.9	-46.8	177.7	-67.2	167.1	0	0	0	109.5	M294 K321 V322 E323 Q327 K328 M329	M294-I325 HydrophobicContact CE-CG2 4.4Å; M294-I325 HydrophobicContact SD-CB 4.29Å; M294-I325 HydrophobicContact SD-CG2 3.95Å; K321-I325 HydrophobicContact CG-CD1 4.14Å; K321-I325 VanDerWaalsContact O-CG1 3.29Å; K321-I325 WeakPolarHBondContact O-CG1 3.4Å; K321-I325 PolarHBondContact O-N 3.08Å; K321-I325 VanDerWaalsContact O-N 3.11Å; V322-I325 PolarHBondContact O-N 3.39Å; V322-I325 VanDerWaalsContact O-N 3.07Å; E323-I325 VanDerWaalsContact C-N 3.34Å; E323-I325 PolarHBondContact O-N 2.96Å; I325-Q327 PolarHBondContact O-N 3.28Å; I325-K328 PolarHBondContact O-N 2.83Å; I325-K328 VanDerWaalsContact O-N 3.13Å; I325-M329 HydrophobicContact CG2-CE 3.58Å; I325-M329 HydrophobicContact CG2-SD 4Å; I325-M329 PolarHBondContact O-N 3.29Å
326	F	84.1	Confident	81.2	Confident	3 Å²	3	75.4 Å²	75.4	1%	0.013	37%	0.37	C	S	.	.	H	α-helix	trans	-58.3	-49.8	-179.7	-163.4	-86.4	0	0	0	110.9	I289 R291 M294 V322 E323 K328 M329 D330 G335 V337	I289-F326 WeakPolarHBondContact O-CE2 3.48Å; R291-F326 HydrophobicContact CB-CD2 4.4Å; R291-F326 HydrophobicContact CB-CE2 4.35Å; R291-F326 HydrophobicContact CG-CB 4.46Å; R291-F326 HydrophobicContact CG-CD1 3.64Å; R291-F326 HydrophobicContact CG-CD2 3.55Å; R291-F326 HydrophobicContact CG-CE1 3.65Å; R291-F326 HydrophobicContact CG-CE2 3.55Å; R291-F326 HydrophobicContact CG-CG 3.59Å; R291-F326 HydrophobicContact CG-CZ 3.61Å; M294-F326 HydrophobicContact CE-CD2 3.99Å; M294-F326 HydrophobicContact SD-CB 4.24Å; M294-F326 HydrophobicContact SD-CD2 4.14Å; V322-F326 VanDerWaalsContact O-CB 3.27Å; V322-F326 WeakPolarHBondContact O-CB 3.25Å; V322-F326 PolarHBondContact O-N 3.48Å; E323-F326 PolarHBondContact O-N 3.4Å; F326-K328 PolarHBondContact O-N 2.82Å; F326-K328 VanDerWaalsContact O-N 3.12Å; F326-M329 PolarHBondContact O-N 3.23Å; F326-D330 HydrophobicContact CD1-CB 3.98Å; F326-D330 HydrophobicContact CE1-CB 3.79Å; F326-D330 WeakPolarHBondContact CE1-OD2 3.46Å; F326-D330 VanDerWaalsContact O-CB 3.25Å; F326-D330 WeakPolarHBondContact O-CB 3.15Å; F326-D330 PolarHBondContact O-N 3.06Å; F326-G335 WeakPolarHBondContact CZ-O 3.26Å; F326-V337 HydrophobicContact CD2-CG2 4.13Å; F326-V337 HydrophobicContact CE1-CG2 4.44Å; F326-V337 HydrophobicContact CE2-CG2 3.75Å; F326-V337 HydrophobicContact CZ-CG2 3.91Å
327	Q	85	Confident	82.3	Confident	114 Å²	114	68.2 Å²	68.2	53%	0.533	34%	0.336	S	S	.	.	H	α-helix	trans	-63.6	-21.6	179.7	-173	165.4	49.2	0	0	114.1	E323 I325	E323-Q327 WeakPolarHBondContact O-CB 2.99Å; E323-Q327 PolarHBondContact O-N 3.46Å; I325-Q327 PolarHBondContact O-N 3.28Å
328	K	82.1	Confident	83.3	Confident	112 Å²	112	63.1 Å²	63.1	49%	0.487	32%	0.316	S	S	.	.	H	α-helix	trans	-87.3	-27.2	174.4	-72.3	176.2	154.6	-144.5	0	113.2	Q324 I325 F326 D349 I352	Q324-K328 VanDerWaalsContact O-CG 3.31Å; Q324-K328 WeakPolarHBondContact O-CG 3.33Å; I325-K328 PolarHBondContact O-N 2.83Å; I325-K328 VanDerWaalsContact O-N 3.13Å; F326-K328 PolarHBondContact O-N 2.82Å; F326-K328 VanDerWaalsContact O-N 3.12Å; K328-D349 IonicContact NZ-OD2 3.85Å; K328-D349 PolarHBondContact NZ-OD2 3.4Å; K328-I352 HydrophobicContact CB-CD1 3.67Å; K328-I352 HydrophobicContact CD-CD1 4.31Å
329	M	82.6	Confident	84.1	Confident	3 Å²	3	64 Å²	64	2%	0.015	32%	0.321	C	S	.	.	H	α-helix	trans	-83.2	-44.3	176.1	-70.7	179.5	179.9	0	0	111.3	M294 I325 F326 T331 V337 F342 A345 I352 M356	M294-M329 HydrophobicContact CE-SD 3.84Å; I325-M329 HydrophobicContact CG2-CE 3.58Å; I325-M329 HydrophobicContact CG2-SD 4Å; I325-M329 PolarHBondContact O-N 3.29Å; F326-M329 PolarHBondContact O-N 3.23Å; M329-T331 VanDerWaalsContact C-N 3.34Å; M329-T331 PolarHBondContact O-N 2.92Å; M329-T331 PolarHBondContact O-OG1 3.19Å; M329-V337 HydrophobicContact CB-CG1 3.99Å; M329-V337 HydrophobicContact CB-CG2 3.85Å; M329-F342 HydrophobicContact SD-CD2 4.28Å; M329-A345 HydrophobicContact CB-CB 4.23Å; M329-A345 HydrophobicContact CG-CB 3.8Å; M329-I352 HydrophobicContact CE-CG2 3.38Å; M329-I352 HydrophobicContact CG-CD1 3.99Å; M329-M356 HydrophobicContact CE-CG 4.22Å; M329-M356 HydrophobicContact CE-SD 3.43Å; M329-M356 WeakPolarHBondContact CE-SD 3.5Å
330	D	87.3	Confident	84.6	Confident	11 Å²	11	64.8 Å²	64.8	6%	0.059	33%	0.326	C	S	.	.			trans	-72.3	84.6	177.6	-178	3.5	0	0	0	110.3	F326 N332 R333 D334 G335 V337	F326-D330 HydrophobicContact CD1-CB 3.98Å; F326-D330 HydrophobicContact CE1-CB 3.79Å; F326-D330 WeakPolarHBondContact CE1-OD2 3.46Å; F326-D330 VanDerWaalsContact O-CB 3.25Å; F326-D330 WeakPolarHBondContact O-CB 3.15Å; F326-D330 PolarHBondContact O-N 3.06Å; D330-N332 PolarHBondContact OD1-OD1 3.42Å; D330-R333 WeakPolarHBondContact OD1-CA 3.24Å; D330-R333 PolarHBondContact OD1-N 3.45Å; D330-R333 WeakPolarHBondContact OD2-CA 3.27Å; D330-D334 PolarHBondContact OD1-N 3.17Å; D330-G335 WeakPolarHBondContact OD2-CA 3.23Å; D330-G335 PolarHBondContact OD2-N 2.82Å; D330-G335 VanDerWaalsContact OD2-N 3.1Å; D330-V337 HydrophobicContact CB-CG2 4.09Å
331	T	83.9	Confident	85	Confident	105 Å²	105	64.3 Å²	64.3	64%	0.644	32%	0.315	S	S	*	.	S	Bend	trans	-76.9	-34.5	-175.7	-57.4	0	0	0	0	111.2	M329	M329-T331 VanDerWaalsContact C-N 3.34Å; M329-T331 PolarHBondContact O-N 2.92Å; M329-T331 PolarHBondContact O-OG1 3.19Å
332	N	86.8	Confident	85.5	Confident	85 Å²	85	59.4 Å²	59.4	46%	0.455	29%	0.294	S	S	.	.	S	Bend	trans	-85.1	-13	-178.5	73.3	13.3	0	0	0	112.8	D330 D334 E341	D330-N332 PolarHBondContact OD1-OD1 3.42Å; N332-D334 VanDerWaalsContact C-N 3.28Å; N332-D334 VanDerWaalsContact CG-CG 3.46Å; N332-D334 VanDerWaalsContact ND2-CG 3.32Å; N332-D334 PolarHBondContact ND2-OD2 3.07Å; N332-D334 PolarHBondContact O-N 3.48Å; N332-D334 VanDerWaalsContact OD1-CB 3.28Å; N332-D334 WeakPolarHBondContact OD1-CB 3.21Å; N332-D334 PolarHBondContact OD1-N 2.94Å; N332-D334 PolarHBondContact OD1-OD1 3.07Å; N332-D334 VanDerWaalsContact OD1-OD1 3.04Å; N332-D334 PolarHBondContact OD1-OD2 3.24Å; N332-E341 WeakPolarHBondContact CB-OE1 3.38Å; N332-E341 PolarHBondContact ND2-OE1 2.84Å; N332-E341 PolarHBondContact OD1-OE1 3.5Å
333	R	85.7	Confident	85.6	Confident	193 Å²	193	59.9 Å²	59.9	73%	0.728	30%	0.296	S	S	*	.			trans	59.2	34.5	-178.8	-58.2	-176.7	-176.9	169	1	113.6	D330 G335	D330-R333 WeakPolarHBondContact OD1-CA 3.24Å; D330-R333 PolarHBondContact OD1-N 3.45Å; D330-R333 WeakPolarHBondContact OD2-CA 3.27Å; R333-G335 VanDerWaalsContact C-N 3.26Å
334	D	87.3	Confident	85.7	Confident	89 Å²	89	61.4 Å²	61.4	48%	0.476	30%	0.303	S	S	.	.	S	Bend	trans	-82.8	-6.5	176.5	69.8	7.9	0	0	0	112.7	D330 N332 V336	D330-D334 PolarHBondContact OD1-N 3.17Å; N332-D334 VanDerWaalsContact C-N 3.28Å; N332-D334 VanDerWaalsContact CG-CG 3.46Å; N332-D334 VanDerWaalsContact ND2-CG 3.32Å; N332-D334 PolarHBondContact ND2-OD2 3.07Å; N332-D334 PolarHBondContact O-N 3.48Å; N332-D334 VanDerWaalsContact OD1-CB 3.28Å; N332-D334 WeakPolarHBondContact OD1-CB 3.21Å; N332-D334 PolarHBondContact OD1-N 2.94Å; N332-D334 PolarHBondContact OD1-OD1 3.07Å; N332-D334 VanDerWaalsContact OD1-OD1 3.04Å; N332-D334 PolarHBondContact OD1-OD2 3.24Å; D334-V336 VanDerWaalsContact CG-CG2 3.48Å; D334-V336 WeakPolarHBondContact OD1-CG2 3.42Å; D334-V336 PolarHBondContact OD1-N 2.78Å
335	G	85	Confident	85.7	Confident	25 Å²	25	55.3 Å²	55.3	26%	0.258	28%	0.276	S	S	.	.	S	Bend	trans	85.4	9.1	178.7	0	0	0	0	0	114	F326 D330 R333	F326-G335 WeakPolarHBondContact CZ-O 3.26Å; D330-G335 WeakPolarHBondContact OD2-CA 3.23Å; D330-G335 PolarHBondContact OD2-N 2.82Å; D330-G335 VanDerWaalsContact OD2-N 3.1Å; R333-G335 VanDerWaalsContact C-N 3.26Å
336	V	89.6	Confident	85.6	Confident	37 Å²	37	53.7 Å²	53.7	22%	0.224	27%	0.268	C	S	.	.	S	Bend	trans	-131.5	154.7	171.4	-65.6	0	0	0	0	110.2	F288 T290 D334	F288-V336 HydrophobicContact CB-CB 4.15Å; F288-V336 HydrophobicContact CB-CG1 4.42Å; F288-V336 HydrophobicContact CD1-CB 4.28Å; F288-V336 HydrophobicContact CD1-CG2 3.87Å; T290-V336 HydrophobicContact CG2-CG1 4.43Å; D334-V336 VanDerWaalsContact CG-CG2 3.48Å; D334-V336 WeakPolarHBondContact OD1-CG2 3.42Å; D334-V336 PolarHBondContact OD1-N 2.78Å
337	V	89.1	Confident	85.2	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	114.6	173.7	176.7	0	0	0	0	108.9	I289 F326 M329 D330 E341 F342	I289-V337 HydrophobicContact CB-CB 4.21Å; I289-V337 PolarHBondContact N-O 3.33Å; I289-V337 PolarHBondContact O-N 3.34Å; F326-V337 HydrophobicContact CD2-CG2 4.13Å; F326-V337 HydrophobicContact CE1-CG2 4.44Å; F326-V337 HydrophobicContact CE2-CG2 3.75Å; F326-V337 HydrophobicContact CZ-CG2 3.91Å; M329-V337 HydrophobicContact CB-CG1 3.99Å; M329-V337 HydrophobicContact CB-CG2 3.85Å; D330-V337 HydrophobicContact CB-CG2 4.09Å; V337-E341 HydrophobicContact CG1-CB 4.26Å; V337-F342 HydrophobicContact CG1-CB 4.1Å
338	T	91.1	Very high	84.9	Confident	27 Å²	27	61.7 Å²	61.7	17%	0.166	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	162.3	174.9	58.5	0	0	0	0	111.9	F288 E340 E341 F342	F288-T338 HydrophobicContact CD1-CG2 3.77Å; F288-T338 HydrophobicContact CE1-CG2 3.7Å; T338-E340 VanDerWaalsContact C-N 3.27Å; T338-E340 PolarHBondContact O-N 3.06Å; T338-E341 WeakPolarHBondContact CB-OE2 3.27Å; T338-E341 PolarHBondContact N-OE2 2.84Å; T338-E341 PolarHBondContact O-N 3.41Å; T338-E341 WeakPolarHBondContact OG1-CB 3.34Å; T338-E341 VanDerWaalsContact OG1-CG 3.22Å; T338-E341 WeakPolarHBondContact OG1-CG 3.4Å; T338-E341 PolarHBondContact OG1-N 3.26Å; T338-E341 PolarHBondContact OG1-OE2 2.85Å; T338-F342 WeakPolarHBondContact O-CB 3.27Å; T338-F342 PolarHBondContact O-N 3.19Å
339	L	87.4	Confident	84.5	Confident	31 Å²	31	58.4 Å²	58.4	16%	0.162	29%	0.29	C	S	.	.	H	α-helix	trans	-58.9	-40	175.7	179.2	62.6	0	0	0	112.1	R275 F278 F342 L343	R275-L339 HydrophobicContact CG-CD1 4.31Å; R275-L339 HydrophobicContact CG-CD2 4.41Å; F278-L339 HydrophobicContact CB-CD1 3.63Å; F278-L339 HydrophobicContact CD1-CB 4.47Å; F278-L339 HydrophobicContact CD1-CD1 3.93Å; F278-L339 HydrophobicContact CD2-CB 4.29Å; F278-L339 HydrophobicContact CD2-CD1 3.73Å; F278-L339 HydrophobicContact CE1-CB 4.28Å; F278-L339 VanDerWaalsContact CE2-CA 3.49Å; F278-L339 HydrophobicContact CE2-CB 4.09Å; F278-L339 HydrophobicContact CE2-CD1 4.38Å; F278-L339 HydrophobicContact CG-CB 4.48Å; F278-L339 HydrophobicContact CG-CD1 3.47Å; F278-L339 VanDerWaalsContact CG-CD1 3.47Å; F278-L339 HydrophobicContact CZ-CB 4.09Å; L339-F342 WeakPolarHBondContact O-CB 3.48Å; L339-F342 PolarHBondContact O-N 3.09Å; L339-L343 HydrophobicContact CD1-CD1 4.33Å; L339-L343 HydrophobicContact CD1-CG 4.25Å; L339-L343 HydrophobicContact CG-CD1 4.18Å; L339-L343 HydrophobicContact CG-CG 4.5Å; L339-L343 WeakPolarHBondContact O-CB 3.4Å; L339-L343 VanDerWaalsContact O-CG 3.25Å; L339-L343 WeakPolarHBondContact O-CG 3.36Å; L339-L343 PolarHBondContact O-N 2.84Å
340	E	88	Confident	83.8	Confident	129 Å²	129	63 Å²	63	60%	0.603	32%	0.315	S	S	*	.	H	α-helix	trans	-61.6	-47.9	176.1	-73.2	68.8	-153.1	0	0	111.4	T338 F342 L343 E344	T338-E340 VanDerWaalsContact C-N 3.27Å; T338-E340 PolarHBondContact O-N 3.06Å; E340-F342 VanDerWaalsContact C-N 3.31Å; E340-F342 PolarHBondContact O-N 3.36Å; E340-L343 PolarHBondContact O-N 3.35Å; E340-E344 VanDerWaalsContact O-CB 3.26Å; E340-E344 WeakPolarHBondContact O-CB 3.28Å; E340-E344 PolarHBondContact O-N 2.8Å
341	E	88.1	Confident	82.8	Confident	23 Å²	23	65 Å²	65	11%	0.107	33%	0.332	C	S	.	.	H	α-helix	trans	-63.5	-38.4	177.3	-74.3	165.6	148.9	0	0	112	N332 V337 T338 E344 A345	N332-E341 WeakPolarHBondContact CB-OE1 3.38Å; N332-E341 PolarHBondContact ND2-OE1 2.84Å; N332-E341 PolarHBondContact OD1-OE1 3.5Å; V337-E341 HydrophobicContact CG1-CB 4.26Å; T338-E341 WeakPolarHBondContact CB-OE2 3.27Å; T338-E341 PolarHBondContact N-OE2 2.84Å; T338-E341 PolarHBondContact O-N 3.41Å; T338-E341 WeakPolarHBondContact OG1-CB 3.34Å; T338-E341 VanDerWaalsContact OG1-CG 3.22Å; T338-E341 WeakPolarHBondContact OG1-CG 3.4Å; T338-E341 PolarHBondContact OG1-N 3.26Å; T338-E341 PolarHBondContact OG1-OE2 2.85Å; E341-E344 PolarHBondContact O-N 3.43Å; E341-A345 WeakPolarHBondContact O-CB 3.26Å; E341-A345 PolarHBondContact O-N 2.9Å
342	F	85	Confident	82.1	Confident	1 Å²	1	60.3 Å²	60.3	0%	0.004	30%	0.304	C	S	.	.	H	α-helix	trans	-62.3	-47.2	175	-178.8	-94	0	0	0	112.3	L274 T277 F278 I289 M329 V337 T338 L339 E340 A345 C346 M356	L274-F342 HydrophobicContact CD2-CE1 4.35Å; T277-F342 HydrophobicContact CG2-CZ 4.18Å; F278-F342 HydrophobicContact CB-CD1 4.19Å; F278-F342 HydrophobicContact CB-CE1 4.15Å; F278-F342 HydrophobicContact CD2-CB 3.74Å; F278-F342 AromaticContact CD2-CD1 3.99Å; F278-F342 HydrophobicContact CD2-CD1 3.99Å; F278-F342 HydrophobicContact CD2-CD2 4.1Å; F278-F342 AromaticContact CD2-CG 3.69Å; F278-F342 HydrophobicContact CD2-CG 3.69Å; F278-F342 HydrophobicContact CE2-CB 4.06Å; F278-F342 HydrophobicContact CE2-CG 4.43Å; I289-F342 HydrophobicContact CD1-CD2 4.04Å; I289-F342 HydrophobicContact CD1-CE2 4.31Å; M329-F342 HydrophobicContact SD-CD2 4.28Å; V337-F342 HydrophobicContact CG1-CB 4.1Å; T338-F342 WeakPolarHBondContact O-CB 3.27Å; T338-F342 PolarHBondContact O-N 3.19Å; L339-F342 WeakPolarHBondContact O-CB 3.48Å; L339-F342 PolarHBondContact O-N 3.09Å; E340-F342 VanDerWaalsContact C-N 3.31Å; E340-F342 PolarHBondContact O-N 3.36Å; F342-A345 PolarHBondContact O-N 3.04Å; F342-C346 WeakPolarHBondContact O-CB 3.13Å; F342-C346 PolarHBondContact O-N 3.37Å; F342-C346 PolarHBondContact O-SG 3.05Å; F342-M356 HydrophobicContact CD2-SD 4.19Å; F342-M356 HydrophobicContact CE1-CE 4.42Å; F342-M356 HydrophobicContact CE1-SD 4.36Å; F342-M356 HydrophobicContact CE2-CE 3.32Å; F342-M356 HydrophobicContact CE2-SD 3.32Å; F342-M356 WeakPolarHBondContact CE2-SD 3.43Å; F342-M356 HydrophobicContact CZ-CE 3.21Å; F342-M356 HydrophobicContact CZ-SD 3.42Å; F342-M356 WeakPolarHBondContact CZ-SD 3.31Å
343	L	83.9	Confident	81	Confident	14 Å²	14	58 Å²	58	7%	0.073	29%	0.294	C	S	.	.	H	α-helix	trans	-65.7	-40.2	177.8	-71	174.5	0	0	0	111.5	L274 L339 E340 C346 R347	L274-L343 HydrophobicContact CB-CD2 3.58Å; L274-L343 HydrophobicContact CD1-CD2 3.78Å; L274-L343 HydrophobicContact CG-CD2 4.31Å; L339-L343 HydrophobicContact CD1-CD1 4.33Å; L339-L343 HydrophobicContact CD1-CG 4.25Å; L339-L343 HydrophobicContact CG-CD1 4.18Å; L339-L343 HydrophobicContact CG-CG 4.5Å; L339-L343 WeakPolarHBondContact O-CB 3.4Å; L339-L343 VanDerWaalsContact O-CG 3.25Å; L339-L343 WeakPolarHBondContact O-CG 3.36Å; L339-L343 PolarHBondContact O-N 2.84Å; E340-L343 PolarHBondContact O-N 3.35Å; L343-C346 PolarHBondContact O-N 2.85Å; L343-R347 VanDerWaalsContact O-CG 3.32Å; L343-R347 WeakPolarHBondContact O-CG 3.2Å; L343-R347 PolarHBondContact O-N 3.25Å; L343-R347 VanDerWaalsContact O-N 3.08Å
344	E	84.9	Confident	79.9	Confident	112 Å²	112	55.9 Å²	55.9	52%	0.523	29%	0.286	S	S	.	.	H	α-helix	trans	-65.1	-46.5	176.7	-173	111.2	-146.8	0	0	110.9	E340 E341 C346 R347 N348	E340-E344 VanDerWaalsContact O-CB 3.26Å; E340-E344 WeakPolarHBondContact O-CB 3.28Å; E340-E344 PolarHBondContact O-N 2.8Å; E341-E344 PolarHBondContact O-N 3.43Å; E344-C346 VanDerWaalsContact C-N 3.33Å; E344-C346 PolarHBondContact O-N 3.39Å; E344-R347 PolarHBondContact O-N 2.87Å; E344-R347 VanDerWaalsContact O-N 3.09Å; E344-N348 VanDerWaalsContact CG-ND2 3.35Å; E344-N348 WeakPolarHBondContact CG-ND2 3.29Å; E344-N348 VanDerWaalsContact O-CB 3.31Å; E344-N348 WeakPolarHBondContact O-CB 3.46Å; E344-N348 PolarHBondContact O-N 2.77Å; E344-N348 PolarHBondContact OE1-ND2 3.18Å; E344-N348 VanDerWaalsContact OE1-ND2 3.15Å
345	A	82.4	Confident	78.4	Confident	8 Å²	8	54.3 Å²	54.3	7%	0.066	28%	0.282	C	S	.	.	H	α-helix	trans	-61.5	-40.3	176.4	0	0	0	0	0	112.1	M329 E341 F342 R347 D349 I352	M329-A345 HydrophobicContact CB-CB 4.23Å; M329-A345 HydrophobicContact CG-CB 3.8Å; E341-A345 WeakPolarHBondContact O-CB 3.26Å; E341-A345 PolarHBondContact O-N 2.9Å; F342-A345 PolarHBondContact O-N 3.04Å; A345-R347 VanDerWaalsContact C-N 3.29Å; A345-R347 PolarHBondContact O-N 3.18Å; A345-D349 PolarHBondContact O-N 3.3Å; A345-I352 HydrophobicContact CB-CD1 4.13Å; A345-I352 HydrophobicContact CB-CG2 4.48Å
346	C	77.6	Confident	77	Confident	6 Å²	6	53.5 Å²	53.5	4%	0.041	27%	0.271	C	S	.	.	H	α-helix	trans	-67.5	-25.7	174.8	-72.3	0	0	0	0	113.7	L274 F342 L343 E344 S353 M356	L274-C346 HydrophobicContact CD1-CB 4.49Å; L274-C346 HydrophobicContact CD2-CB 4.2Å; F342-C346 WeakPolarHBondContact O-CB 3.13Å; F342-C346 PolarHBondContact O-N 3.37Å; F342-C346 PolarHBondContact O-SG 3.05Å; L343-C346 PolarHBondContact O-N 2.85Å; E344-C346 VanDerWaalsContact C-N 3.33Å; E344-C346 PolarHBondContact O-N 3.39Å; C346-S353 WeakPolarHBondContact O-CB 3.32Å; C346-S353 PolarHBondContact O-OG 3.3Å; C346-M356 PolarHBondContact SG-SD 2.59Å
347	R	76.9	Confident	74.8	Confident	167 Å²	167	53 Å²	53	63%	0.63	27%	0.27	S	S	*	.	H	α-helix	trans	-86.9	-35.7	176.7	-75.8	175.5	-178.4	168.3	3	112.6	L343 E344 A345	L343-R347 VanDerWaalsContact O-CG 3.32Å; L343-R347 WeakPolarHBondContact O-CG 3.2Å; L343-R347 PolarHBondContact O-N 3.25Å; L343-R347 VanDerWaalsContact O-N 3.08Å; E344-R347 PolarHBondContact O-N 2.87Å; E344-R347 VanDerWaalsContact O-N 3.09Å; A345-R347 VanDerWaalsContact C-N 3.29Å; A345-R347 PolarHBondContact O-N 3.18Å
348	N	77.5	Confident	72.6	Confident	117 Å²	117	54.9 Å²	54.9	63%	0.626	28%	0.281	S	S	*	.	H	α-helix	trans	-93.6	-32	-170.3	-70.5	-13.9	0	0	0	113.6	E344	E344-N348 VanDerWaalsContact CG-ND2 3.35Å; E344-N348 WeakPolarHBondContact CG-ND2 3.29Å; E344-N348 VanDerWaalsContact O-CB 3.31Å; E344-N348 WeakPolarHBondContact O-CB 3.46Å; E344-N348 PolarHBondContact O-N 2.77Å; E344-N348 PolarHBondContact OE1-ND2 3.18Å; E344-N348 VanDerWaalsContact OE1-ND2 3.15Å
349	D	74.8	Confident	70.3	Confident	43 Å²	43	54.9 Å²	54.9	23%	0.23	28%	0.279	C	S	.	.			trans	-108.6	106.8	179.6	-172.7	-29.5	0	0	0	110.1	K328 A345 A351 I352 S353	K328-D349 IonicContact NZ-OD2 3.85Å; K328-D349 PolarHBondContact NZ-OD2 3.4Å; A345-D349 PolarHBondContact O-N 3.3Å; D349-A351 PolarHBondContact O-N 3.44Å; D349-A351 WeakPolarHBondContact OD1-CA 3.31Å; D349-A351 VanDerWaalsContact OD1-CB 3.23Å; D349-A351 WeakPolarHBondContact OD1-CB 3.4Å; D349-A351 PolarHBondContact OD1-N 3.29Å; D349-I352 HydrophobicContact CB-CB 3.97Å; D349-I352 HydrophobicContact CB-CD1 3.87Å; D349-I352 HydrophobicContact CB-CG1 3.91Å; D349-I352 CarbonylContact O-C 3.59Å; D349-I352 PolarHBondContact O-N 3.44Å; D349-I352 VanDerWaalsContact O-N 3.15Å; D349-I352 PolarHBondContact OD1-N 2.97Å; D349-I352 VanDerWaalsContact OD1-N 3.15Å; D349-S353 WeakPolarHBondContact O-CB 3.19Å; D349-S353 PolarHBondContact O-N 3.39Å
350	D	68.4	Low	68.1	Low	101 Å²	101	55.2 Å²	55.2	54%	0.54	28%	0.281	S	S	.	.	H	α-helix	trans	-57.1	-26.9	175.4	-111.1	19.4	0	0	0	114.2	R354	D350-R354 WeakPolarHBondContact O-CB 3.47Å; D350-R354 WeakPolarHBondContact O-CG 3.49Å; D350-R354 PolarHBondContact O-N 2.7Å; D350-R354 PolarHBondContact O-NE 3.16Å; D350-R354 IonicContact OD2-CZ 2.8Å; D350-R354 IonicContact OD2-NH2 3.77Å; D350-R354 PolarHBondContact OD2-NH2 2.72Å
351	A	66.4	Low	65.4	Low	51 Å²	51	53.4 Å²	53.4	42%	0.421	28%	0.279	S	S	.	.	H	α-helix	trans	-81.1	-37.8	176.1	0	0	0	0	0	111.6	D349 R354 S355	D349-A351 PolarHBondContact O-N 3.44Å; D349-A351 WeakPolarHBondContact OD1-CA 3.31Å; D349-A351 VanDerWaalsContact OD1-CB 3.23Å; D349-A351 WeakPolarHBondContact OD1-CB 3.4Å; D349-A351 PolarHBondContact OD1-N 3.29Å; A351-R354 PolarHBondContact O-N 3.21Å; A351-S355 VanDerWaalsContact O-CB 3.26Å; A351-S355 WeakPolarHBondContact O-CB 3.15Å; A351-S355 PolarHBondContact O-N 3.31Å
352	I	67.7	Low	63	Low	8 Å²	8	53 Å²	53	4%	0.041	28%	0.279	C	S	.	.	H	α-helix	trans	-65.9	-53	169.3	-66.5	178	0	0	0	108.3	K328 M329 A345 D349 R354 S355 M356	K328-I352 HydrophobicContact CB-CD1 3.67Å; K328-I352 HydrophobicContact CD-CD1 4.31Å; M329-I352 HydrophobicContact CE-CG2 3.38Å; M329-I352 HydrophobicContact CG-CD1 3.99Å; A345-I352 HydrophobicContact CB-CD1 4.13Å; A345-I352 HydrophobicContact CB-CG2 4.48Å; D349-I352 HydrophobicContact CB-CB 3.97Å; D349-I352 HydrophobicContact CB-CD1 3.87Å; D349-I352 HydrophobicContact CB-CG1 3.91Å; D349-I352 CarbonylContact O-C 3.59Å; D349-I352 PolarHBondContact O-N 3.44Å; D349-I352 VanDerWaalsContact O-N 3.15Å; D349-I352 PolarHBondContact OD1-N 2.97Å; D349-I352 VanDerWaalsContact OD1-N 3.15Å; I352-R354 PolarHBondContact O-N 3.03Å; I352-S355 CarbonylContact O-C 3.56Å; I352-S355 WeakPolarHBondContact O-CA 3.12Å; I352-S355 WeakPolarHBondContact O-CB 2.92Å; I352-S355 PolarHBondContact O-N 3.44Å; I352-M356 HydrophobicContact CG2-CG 3.75Å; I352-M356 HydrophobicContact CG2-SD 4.07Å; I352-M356 WeakPolarHBondContact O-CB 3.38Å; I352-M356 WeakPolarHBondContact O-CG 3.4Å; I352-M356 PolarHBondContact O-N 2.56Å
353	S	65.2	Low	60.6	Low	36 Å²	36	58.7 Å²	58.7	25%	0.252	30%	0.304	S	S	.	.	H	α-helix	trans	-54.4	-36.1	173.6	-158.9	0	0	0	0	111.9	C346 D349 M356 S357	C346-S353 WeakPolarHBondContact O-CB 3.32Å; C346-S353 PolarHBondContact O-OG 3.3Å; D349-S353 WeakPolarHBondContact O-CB 3.19Å; D349-S353 PolarHBondContact O-N 3.39Å; S353-M356 CarbonylContact O-C 3.59Å; S353-S357 WeakPolarHBondContact O-CA 3.21Å; S353-S357 WeakPolarHBondContact O-CB 3.14Å; S353-S357 PolarHBondContact O-N 2.83Å; S353-S357 PolarHBondContact O-OG 3.21Å
354	R	61.3	Low	59.4	Low	148 Å²	148	60.9 Å²	60.9	56%	0.558	32%	0.315	S	S	*	.	H	α-helix	trans	-74.7	-39.3	171.9	-80.9	177	-126.7	131.3	-3.9	112.9	D350 A351 I352 M356 S357 V358	D350-R354 WeakPolarHBondContact O-CB 3.47Å; D350-R354 WeakPolarHBondContact O-CG 3.49Å; D350-R354 PolarHBondContact O-N 2.7Å; D350-R354 PolarHBondContact O-NE 3.16Å; D350-R354 IonicContact OD2-CZ 2.8Å; D350-R354 IonicContact OD2-NH2 3.77Å; D350-R354 PolarHBondContact OD2-NH2 2.72Å; A351-R354 PolarHBondContact O-N 3.21Å; I352-R354 PolarHBondContact O-N 3.03Å; R354-M356 VanDerWaalsContact C-N 3.26Å; R354-M356 PolarHBondContact O-N 3.37Å; R354-S357 WeakPolarHBondContact CA-OG 3.46Å; R354-V358 WeakPolarHBondContact O-CB 3.43Å; R354-V358 WeakPolarHBondContact O-CG2 3.01Å; R354-V358 PolarHBondContact O-N 3.11Å
355	S	56.4	Low	58.1	Low	56 Å²	56	58.2 Å²	58.2	39%	0.392	31%	0.305	S	S	.	.	H	α-helix	trans	-63.5	-37.5	175.2	-160.9	0	0	0	0	110.7	A351 I352 F359	A351-S355 VanDerWaalsContact O-CB 3.26Å; A351-S355 WeakPolarHBondContact O-CB 3.15Å; A351-S355 PolarHBondContact O-N 3.31Å; I352-S355 CarbonylContact O-C 3.56Å; I352-S355 WeakPolarHBondContact O-CA 3.12Å; I352-S355 WeakPolarHBondContact O-CB 2.92Å; I352-S355 PolarHBondContact O-N 3.44Å; S355-F359 WeakPolarHBondContact O-CD2 3.23Å; S355-F359 WeakPolarHBondContact O-CE2 3.34Å
356	M	55	Low	56.7	Low	8 Å²	8	61 Å²	61	4%	0.039	32%	0.318	C	S	.	.	H	α-helix	trans	-86.4	-30	179.2	-58.9	-134.5	74.5	0	0	112.9	T277 Y281 M329 F342 C346 I352 S353 R354 V358 F359 D360	T277-M356 HydrophobicContact CG2-CE 3.9Å; Y281-M356 HydrophobicContact CD2-CE 4.3Å; Y281-M356 HydrophobicContact CE2-CE 3.63Å; M329-M356 HydrophobicContact CE-CG 4.22Å; M329-M356 HydrophobicContact CE-SD 3.43Å; M329-M356 WeakPolarHBondContact CE-SD 3.5Å; F342-M356 HydrophobicContact CD2-SD 4.19Å; F342-M356 HydrophobicContact CE1-CE 4.42Å; F342-M356 HydrophobicContact CE1-SD 4.36Å; F342-M356 HydrophobicContact CE2-CE 3.32Å; F342-M356 HydrophobicContact CE2-SD 3.32Å; F342-M356 WeakPolarHBondContact CE2-SD 3.43Å; F342-M356 HydrophobicContact CZ-CE 3.21Å; F342-M356 HydrophobicContact CZ-SD 3.42Å; F342-M356 WeakPolarHBondContact CZ-SD 3.31Å; C346-M356 PolarHBondContact SG-SD 2.59Å; I352-M356 HydrophobicContact CG2-CG 3.75Å; I352-M356 HydrophobicContact CG2-SD 4.07Å; I352-M356 WeakPolarHBondContact O-CB 3.38Å; I352-M356 WeakPolarHBondContact O-CG 3.4Å; I352-M356 PolarHBondContact O-N 2.56Å; S353-M356 CarbonylContact O-C 3.59Å; R354-M356 VanDerWaalsContact C-N 3.26Å; R354-M356 PolarHBondContact O-N 3.37Å; M356-V358 VanDerWaalsContact C-N 3.33Å; M356-F359 VanDerWaalsContact C-CD2 3.49Å; M356-F359 WeakPolarHBondContact O-CA 3.39Å; M356-F359 WeakPolarHBondContact O-CB 3.38Å; M356-F359 WeakPolarHBondContact O-CD2 3.42Å; M356-F359 WeakPolarHBondContact O-CG 3.45Å; M356-F359 PolarHBondContact O-N 3.13Å; M356-D360 PolarHBondContact O-N 3.23Å
357	S	43.9	Very low	55.5	Low	28 Å²	28	64.2 Å²	64.2	20%	0.196	33%	0.334	C	S	.	.	H	α-helix	trans	-85.9	-6.8	172.3	70.5	0	0	0	0	111.9	S353 R354 F359 D360 T361	S353-S357 WeakPolarHBondContact O-CA 3.21Å; S353-S357 WeakPolarHBondContact O-CB 3.14Å; S353-S357 PolarHBondContact O-N 2.83Å; S353-S357 PolarHBondContact O-OG 3.21Å; R354-S357 WeakPolarHBondContact CA-OG 3.46Å; S357-F359 PolarHBondContact O-N 3.39Å; S357-D360 VanDerWaalsContact C-N 3.34Å; S357-D360 CarbonylContact O-C 3.39Å; S357-D360 PolarHBondContact O-N 3.13Å; S357-T361 WeakPolarHBondContact O-CA 3.45Å; S357-T361 VanDerWaalsContact O-CB 3.32Å; S357-T361 WeakPolarHBondContact O-CB 3.49Å; S357-T361 PolarHBondContact O-N 2.71Å; S357-T361 PolarHBondContact O-OG1 2.89Å
358	V	41.6	Very low	54.1	Low	38 Å²	38	57.8 Å²	57.8	23%	0.23	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-21	154.4	164	0	0	0	0	110.3	F137 R354 M356	F137-V358 HydrophobicContact CB-CG1 3.82Å; F137-V358 HydrophobicContact CD2-CG1 3.34Å; F137-V358 HydrophobicContact CE2-CG1 4.2Å; F137-V358 HydrophobicContact CG-CG1 3.85Å; R354-V358 WeakPolarHBondContact O-CB 3.43Å; R354-V358 WeakPolarHBondContact O-CG2 3.01Å; R354-V358 PolarHBondContact O-N 3.11Å; M356-V358 VanDerWaalsContact C-N 3.33Å
359	F	44.4	Very low	52.6	Low	28 Å²	28	53.9 Å²	53.9	12%	0.123	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-19.2	168.5	-46	-112.4	0	0	0	113	F137 Y281 S355 M356 S357 A362	F137-F359 AromaticContact CD1-CD1 3.78Å; F137-F359 HydrophobicContact CD1-CD1 3.78Å; F137-F359 AromaticContact CD1-CE1 3.93Å; F137-F359 HydrophobicContact CD1-CE1 3.93Å; F137-F359 HydrophobicContact CD1-CG 4.41Å; F137-F359 AromaticContact CE1-CD1 3.38Å; F137-F359 HydrophobicContact CE1-CD1 3.38Å; F137-F359 AromaticContact CE1-CE1 3.06Å; F137-F359 HydrophobicContact CE1-CE1 3.06Å; F137-F359 HydrophobicContact CE1-CG 4.3Å; F137-F359 AromaticContact CE1-CZ 3.79Å; F137-F359 HydrophobicContact CE1-CZ 3.79Å; F137-F359 HydrophobicContact CE2-CE1 4.08Å; F137-F359 HydrophobicContact CE2-CE2 4.37Å; F137-F359 AromaticContact CE2-CZ 3.95Å; F137-F359 HydrophobicContact CE2-CZ 3.95Å; F137-F359 AromaticContact CZ-CD1 3.83Å; F137-F359 HydrophobicContact CZ-CD1 3.83Å; F137-F359 AromaticContact CZ-CE1 3.13Å; F137-F359 HydrophobicContact CZ-CE1 3.13Å; F137-F359 HydrophobicContact CZ-CE2 4.13Å; F137-F359 AromaticContact CZ-CZ 3.32Å; F137-F359 HydrophobicContact CZ-CZ 3.32Å; Y281-F359 HydrophobicContact CE2-CE1 4.32Å; Y281-F359 HydrophobicContact CE2-CZ 4.24Å; Y281-F359 WeakPolarHBondContact OH-CZ 3.25Å; S355-F359 WeakPolarHBondContact O-CD2 3.23Å; S355-F359 WeakPolarHBondContact O-CE2 3.34Å; M356-F359 VanDerWaalsContact C-CD2 3.49Å; M356-F359 WeakPolarHBondContact O-CA 3.39Å; M356-F359 WeakPolarHBondContact O-CB 3.38Å; M356-F359 WeakPolarHBondContact O-CD2 3.42Å; M356-F359 WeakPolarHBondContact O-CG 3.45Å; M356-F359 PolarHBondContact O-N 3.13Å; S357-F359 PolarHBondContact O-N 3.39Å; F359-A362 WeakPolarHBondContact O-CB 3.29Å
360	D	40.2	Very low	51	Low	37 Å²	37	54.6 Å²	54.6	20%	0.198	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-35	-175.2	-154.3	14.3	0	0	0	114.4	K273 M356 S357 A362 F363	K273-D360 WeakPolarHBondContact CD-OD1 3.18Å; M356-D360 PolarHBondContact O-N 3.23Å; S357-D360 VanDerWaalsContact C-N 3.34Å; S357-D360 CarbonylContact O-C 3.39Å; S357-D360 PolarHBondContact O-N 3.13Å; D360-A362 PolarHBondContact O-N 3.15Å; D360-F363 PolarHBondContact O-N 3.31Å
361	T	32.3	Very low	49.7	Very low	92 Å²	92	51.1 Å²	51.1	56%	0.564	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	10.2	162.6	53.4	0	0	0	0	112.4	R141 S357 F363	R141-T361 PolarHBondContact NH1-O 3.25Å; S357-T361 WeakPolarHBondContact O-CA 3.45Å; S357-T361 VanDerWaalsContact O-CB 3.32Å; S357-T361 WeakPolarHBondContact O-CB 3.49Å; S357-T361 PolarHBondContact O-N 2.71Å; S357-T361 PolarHBondContact O-OG1 2.89Å; T361-F363 VanDerWaalsContact C-N 3.35Å
362	A	36.5	Very low	48.3	Very low	13 Å²	13	51.1 Å²	51.1	11%	0.107	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	11.1	170.2	0	0	0	0	0	114.5	R141 F359 D360	R141-A362 HydrophobicContact CB-CB 4.29Å; R141-A362 WeakPolarHBondContact CD-O 3.45Å; R141-A362 HydrophobicContact CG-CB 3.95Å; R141-A362 WeakPolarHBondContact CG-O 3.23Å; R141-A362 VanDerWaalsContact NE-C 3.31Å; R141-A362 PolarHBondContact NE-O 3.13Å; R141-A362 VanDerWaalsContact NH1-CA 3.29Å; R141-A362 PolarHBondContact NH2-O 3.21Å; F359-A362 WeakPolarHBondContact O-CB 3.29Å; D360-A362 PolarHBondContact O-N 3.15Å
363	F	34.7	Very low	46.5	Very low	121 Å²	121	55 Å²	55	53%	0.531	29%	0.29	S	S	.	.			trans	-132	0	171.4	-60.5	-74.2	0	0	0	112.8	R141 L265 K273 D360 T361	R141-F363 VanDerWaalsContact NH2-CA 3.35Å; R141-F363 PolarHBondContact NH2-OXT 3.2Å; L265-F363 HydrophobicContact CB-CE1 4.09Å; L265-F363 HydrophobicContact CB-CZ 3.8Å; L265-F363 HydrophobicContact CD2-CE2 4.49Å; L265-F363 HydrophobicContact CD2-CZ 4.06Å; L265-F363 WeakPolarHBondContact O-CD1 3.1Å; L265-F363 WeakPolarHBondContact O-CD2 3.35Å; L265-F363 WeakPolarHBondContact O-CE1 3.37Å; L265-F363 WeakPolarHBondContact O-CE2 3.37Å; L265-F363 VanDerWaalsContact O-CG 3.28Å; L265-F363 WeakPolarHBondContact O-CG 3.48Å; L265-F363 WeakPolarHBondContact O-CZ 3.32Å; K273-F363 HydrophobicContact CD-CD2 4.12Å; D360-F363 PolarHBondContact O-N 3.31Å; T361-F363 VanDerWaalsContact C-N 3.35Å

Retrieved 363 of 363 residues in 391.6 ms (Link to these results)

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