A0A5K4F7E0_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F7E0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 264 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	38.8	Very low	42.8	Very low	235 Å²	235	154.6 Å²	154.6	100%	1.158	82%	0.824	S	S	*	*				0	108.7	0	-79.1	164.4	145.2	0	0	107.4
2	N	43.8	Very low	43.1	Very low	144 Å²	144	153.3 Å²	153.3	77%	0.77	82%	0.817	S	S	*	*			trans	51.7	140.1	154.2	-60.1	7.7	0	0	0	119.9
3	N	41.4	Very low	43.4	Very low	127 Å²	127	152.8 Å²	152.8	68%	0.679	81%	0.812	S	S	*	*			cis	-171.2	123.1	-1.4	-89.2	-11.8	0	0	0	103.4
4	S	44.5	Very low	43.5	Very low	97 Å²	97	150 Å²	150	68%	0.678	80%	0.804	S	S	*	*				55.5	144.3	93.5	64.6	0	0	0	0	117.9
5	E	46.3	Very low	43.2	Very low	177 Å²	177	148.1 Å²	148.1	83%	0.827	80%	0.8	S	S	*	*			trans	107.7	96.3	168.6	-62.7	174.8	-175.5	0	0	114
6	I	43.7	Very low	43	Very low	154 Å²	154	149.1 Å²	149.1	79%	0.79	80%	0.801	S	S	*	*				53.8	117.7	66.4	-52.7	177.1	0	0	0	113.1
7	I	44.3	Very low	42.7	Very low	168 Å²	168	152.1 Å²	152.1	86%	0.862	81%	0.805	S	S	*	*			trans	-169.9	133.4	130.1	-86.8	144.2	0	0	0	109.6
8	K	37.4	Very low	42.8	Very low	200 Å²	200	153.1 Å²	153.1	87%	0.87	80%	0.803	S	S	*	*			trans	-88.5	153.9	175.8	-64.4	172.1	174	176.8	0	110.7
9	A	44	Very low	42.4	Very low	101 Å²	101	154.7 Å²	154.7	84%	0.835	80%	0.803	S	S	*	*			trans	-171.1	127.3	134.9	0	0	0	0	0	110.5
10	N	39.1	Very low	42.4	Very low	150 Å²	150	157.3 Å²	157.3	80%	0.802	81%	0.808	S	S	*	*			trans	-75.6	159.8	164.4	-69.3	-40.1	0	0	0	109.2
11	D	47.9	Very low	42.2	Very low	148 Å²	148	158.4 Å²	158.4	79%	0.791	81%	0.809	S	S	*	*			trans	-173.7	119.3	135.5	-84.4	-19.2	0	0	0	110.6
12	D	46.1	Very low	42.4	Very low	139 Å²	139	151 Å²	151	74%	0.743	79%	0.794	S	S	*	*				73.7	144.8	128.8	-73.9	-10.2	0	0	0	125.6
13	I	46.7	Very low	42.6	Very low	147 Å²	147	153.4 Å²	153.4	75%	0.754	80%	0.797	S	S	*	*			trans	102.4	94.4	146.9	-69.9	147.4	0	0	0	119.5
14	T	45.3	Very low	42.9	Very low	113 Å²	113	157.8 Å²	157.8	69%	0.693	81%	0.81	S	S	*	*				59.3	118.6	126.3	24.6	0	0	0	0	124.1
15	T	39.1	Very low	42.7	Very low	122 Å²	122	157.5 Å²	157.5	75%	0.748	81%	0.808	S	S	*	*			trans	25.2	132	131.5	57.3	0	0	0	0	120.7
16	M	40.3	Very low	42.8	Very low	164 Å²	164	159.1 Å²	159.1	81%	0.808	81%	0.807	S	S	*	*			trans	-167.8	126.7	135.4	-96.7	-71.5	-87.8	0	0	111.5
17	K	36.9	Very low	42.9	Very low	200 Å²	200	161.3 Å²	161.3	87%	0.87	81%	0.811	S	S	*	*			trans	-78.6	141.7	170.2	-73.2	176.2	174.8	173.5	0	110
18	H	45	Very low	42.7	Very low	169 Å²	169	161 Å²	161	78%	0.782	81%	0.811	S	S	*	*			trans	-138.8	130.9	159.7	-101.3	-73.9	0	0	0	113.1
19	K	34.6	Very low	43	Very low	185 Å²	185	156 Å²	156	80%	0.804	80%	0.8	S	S	*	*			trans	-100.5	135.8	171.7	-171.1	-177.2	-172.3	179.3	0	107.2
20	K	42.1	Very low	43.1	Very low	206 Å²	206	159 Å²	159	90%	0.896	80%	0.797	S	S	*	*			trans	-160.7	133.4	159.1	-111.7	173.3	-173.7	-179.7	0	113
21	H	38.3	Very low	43.3	Very low	181 Å²	181	159 Å²	159	84%	0.838	79%	0.79	S	S	*	*			trans	-69.7	155.3	179.4	-85.8	-96.6	0	0	0	114
22	G	44.4	Very low	43.3	Very low	80 Å²	80	159 Å²	159	83%	0.825	78%	0.783	S	S	*	*			trans	-142.8	125.9	161.1	0	0	0	0	0	111.1
23	K	47.5	Very low	43.1	Very low	193 Å²	193	158.4 Å²	158.4	84%	0.839	78%	0.775	S	S	*	*			trans	-87.3	145.7	-172.3	-63.2	166.1	176	172	0	111.5
24	F	47.3	Very low	42.8	Very low	220 Å²	220	160 Å²	160	97%	0.965	78%	0.777	S	S	*	*			trans	-145.7	126.6	147.4	-101.6	-84	0	0	0	109.9
25	S	41.7	Very low	42.6	Very low	91 Å²	91	159.5 Å²	159.5	64%	0.636	78%	0.778	S	S	*	*			trans	-141.4	154.4	176.1	61.1	0	0	0	0	110.8
26	R	47.5	Very low	42.5	Very low	211 Å²	211	161.4 Å²	161.4	80%	0.796	78%	0.778	S	S	*	*			trans	83.3	124.6	168	-51.9	-173.9	-140.5	131.7	1.8	116.4
27	F	45	Very low	42.3	Very low	199 Å²	199	162.6 Å²	162.6	87%	0.873	78%	0.775	S	S	*	*				-163.2	139.2	87.2	-109.5	-91.4	0	0	0	111.4
28	L	40.3	Very low	42.2	Very low	163 Å²	163	159.1 Å²	159.1	85%	0.853	77%	0.766	S	S	*	*			trans	-103.4	161.8	179.5	-85	164.8	0	0	0	110.7
29	S	43.6	Very low	41.6	Very low	93 Å²	93	159.4 Å²	159.4	65%	0.65	77%	0.768	S	S	*	*			trans	111.6	151.6	134.9	79.2	0	0	0	0	118.8
30	H	46	Very low	41.7	Very low	164 Å²	164	159.6 Å²	159.6	76%	0.759	77%	0.771	S	S	*	*			trans	106.2	126.3	172.3	-57.9	-60.7	0	0	0	115
31	F	43.8	Very low	41.2	Very low	151 Å²	151	154.3 Å²	154.3	66%	0.662	76%	0.76	S	S	*	*			cis	-179.6	140.4	-11.6	-140.8	-134.7	0	0	0	108.1
32	K	47.4	Very low	41.3	Very low	147 Å²	147	154.9 Å²	154.9	64%	0.639	76%	0.76	S	S	*	*			trans	60.5	147.8	143.7	-75.3	-176.1	174.6	-178.4	0	120.3
33	H	42.6	Very low	40.7	Very low	127 Å²	127	158.4 Å²	158.4	59%	0.588	76%	0.757	S	S	*	*			cis	-168	148	9.6	-124.9	-40.7	0	0	0	111.5
34	K	40	Very low	40	Very low	180 Å²	180	157.5 Å²	157.5	78%	0.783	75%	0.753	S	S	*	*			trans	37.6	146.8	130.5	-84.2	-179	-179.6	-179.6	0	120.2
35	S	40.3	Very low	39.4	Very low	103 Å²	103	153 Å²	153	72%	0.72	74%	0.743	S	S	*	*			cis	-174.6	136.1	27.8	32.1	0	0	0	0	108.1
36	H	38.1	Very low	39.1	Very low	162 Å²	162	155 Å²	155	75%	0.75	75%	0.751	S	S	*	*				76.9	135.1	85.4	-114.2	-80.3	0	0	0	117.4
37	Y	35.9	Very low	39.1	Very low	189 Å²	189	152.2 Å²	152.2	74%	0.741	75%	0.751	S	S	*	*			trans	81.7	142.3	159.1	-77.2	-63	0	0	0	118.7
38	D	35.6	Very low	39.3	Very low	127 Å²	127	147.7 Å²	147.7	68%	0.679	74%	0.741	S	S	*	*			cis	-161.1	168.4	0.8	-137	-16.8	0	0	0	111.3
39	Q	32.3	Very low	40	Very low	176 Å²	176	145.9 Å²	145.9	82%	0.822	74%	0.739	S	S	*	*			trans	-53.2	138.5	177.5	-169.1	175.9	23.4	0	0	117.3
40	E	35.9	Very low	40	Very low	189 Å²	189	147 Å²	147	88%	0.883	74%	0.744	S	S	*	*			trans	-163.5	143.7	138.6	-120.7	-177.3	174.7	0	0	114.1
41	S	32.3	Very low	39.5	Very low	94 Å²	94	146 Å²	146	66%	0.657	75%	0.75	S	S	*	*			trans	-99.2	150.8	-169.8	43.9	0	0	0	0	111.9
42	K	38.8	Very low	39.3	Very low	194 Å²	194	146.8 Å²	146.8	84%	0.843	76%	0.76	S	S	*	*			trans	171.2	106.3	139.4	-92.3	155.2	-171.2	175	0	113.8
43	M	33.3	Very low	38.7	Very low	154 Å²	154	145.5 Å²	145.5	76%	0.759	77%	0.769	S	S	*	*				60.5	128.4	120.5	-152.7	173.7	177.1	0	0	122.4
44	K	32.7	Very low	38.5	Very low	174 Å²	174	147.8 Å²	147.8	76%	0.757	78%	0.784	S	S	*	*			trans	76.2	132.8	147.2	-99.1	-178.6	179	-177.6	0	116.3
45	V	35	Very low	38.1	Very low	125 Å²	125	143.9 Å²	143.9	76%	0.758	78%	0.78	S	S	*	*			cis	-160.8	152.3	38.5	171.9	0	0	0	0	110.5
46	V	34.1	Very low	37.8	Very low	132 Å²	132	144.4 Å²	144.4	80%	0.8	78%	0.783	S	S	*	*			trans	-75.4	135.2	172.5	171.9	0	0	0	0	112.8
47	I	47.1	Very low	38.1	Very low	154 Å²	154	144.7 Å²	144.7	79%	0.79	79%	0.789	S	S	*	*			trans	-148	128.1	156.8	-50.6	178.1	0	0	0	109.9
48	P	49.8	Very low	38.3	Very low	104 Å²	104	142.8 Å²	142.8	68%	0.675	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-91.4	155	171.2	35.8	-30.7	0	0	0	112.3
49	P	56.4	Low	38.9	Very low	125 Å²	125	143 Å²	143	81%	0.812	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-86.3	160.3	179.8	34.6	-32.1	0	0	0	113.3
50	P	42.6	Very low	39.2	Very low	116 Å²	116	143.2 Å²	143.2	75%	0.753	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-93.8	152.2	-155.5	36.2	-34.1	0	0	0	115.4
51	T	36.3	Very low	39.4	Very low	143 Å²	143	139.1 Å²	139.1	88%	0.877	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-72.6	134.5	166.1	19.2	0	0	0	0	111.5
52	L	39.1	Very low	39.9	Very low	168 Å²	168	141.2 Å²	141.2	88%	0.88	80%	0.796	S	S	*	*			trans	-114.1	125	170.3	-72.1	174.7	0	0	0	110.8
53	S	34	Very low	40.1	Very low	119 Å²	119	140.1 Å²	140.1	83%	0.832	79%	0.794	S	S	*	*			trans	-100.4	142.4	170	46.2	0	0	0	0	110.3
54	I	39	Very low	40.4	Very low	175 Å²	175	138.8 Å²	138.8	90%	0.897	79%	0.794	S	S	*	*			trans	-116.6	123.6	174.5	-64.4	172.9	0	0	0	108.4
55	S	32.1	Very low	40.6	Very low	99 Å²	99	137.9 Å²	137.9	69%	0.692	80%	0.796	S	S	*	*			trans	-114.3	142.1	175.6	58.6	0	0	0	0	111.3
56	S	33.8	Very low	40.7	Very low	113 Å²	113	137.1 Å²	137.1	79%	0.79	80%	0.797	S	S	*	*			trans	74.2	118.1	140.4	-52.5	0	0	0	0	120.9
57	I	43.7	Very low	41	Very low	169 Å²	169	135.5 Å²	135.5	87%	0.867	79%	0.791	S	S	*	*			trans	-143.2	119.8	144.9	-58	-178.5	0	0	0	108.6
58	N	41.4	Very low	40.8	Very low	149 Å²	149	136.2 Å²	136.2	80%	0.797	80%	0.795	S	S	*	*			trans	-93.9	165.9	162.1	-89.7	-12.6	0	0	0	109.5
59	P	47	Very low	40.2	Very low	131 Å²	131	138.3 Å²	138.3	85%	0.851	80%	0.801	S	S	*	*				-147.7	168.5	113.8	33.4	-14	0	0	0	116.3
60	E	38.9	Very low	39.7	Very low	180 Å²	180	136.8 Å²	136.8	84%	0.841	79%	0.791	S	S	*	*			trans	-90.9	165.6	-163.1	-58.9	164.7	122	0	0	116.8
61	S	40.6	Very low	39.5	Very low	104 Å²	104	139.6 Å²	139.6	73%	0.727	79%	0.793	S	S	*	*				105.7	144.9	127.2	73.9	0	0	0	0	121.6
62	L	43.2	Very low	39.6	Very low	137 Å²	137	138.4 Å²	138.4	72%	0.717	79%	0.791	S	S	*	*			trans	101	93.2	164	-53.3	177.4	0	0	0	116.3
63	E	42.2	Very low	39.8	Very low	172 Å²	172	139.7 Å²	139.7	80%	0.804	79%	0.792	S	S	*	*				91.9	146.7	89.3	-83.7	-169.9	-162.7	0	0	111
64	T	39	Very low	40	Very low	125 Å²	125	137.3 Å²	137.3	77%	0.767	79%	0.786	S	S	*	*			cis	-167.9	162.4	-16.2	-82.9	0	0	0	0	105.6
65	I	36.6	Very low	39.9	Very low	155 Å²	155	135.4 Å²	135.4	80%	0.795	79%	0.787	S	S	*	*			trans	-85.4	165.2	-155.4	-63.4	157.7	0	0	0	115.9
66	S	37.1	Very low	40.4	Very low	110 Å²	110	135.7 Å²	135.7	77%	0.769	79%	0.789	S	S	*	*			trans	100.4	136.1	154.5	77.3	0	0	0	0	114.9
67	S	40.2	Very low	41.2	Very low	98 Å²	98	136.7 Å²	136.7	69%	0.685	79%	0.79	S	S	*	*			cis	-169.2	141.1	36.1	50.3	0	0	0	0	112.8
68	I	43.7	Very low	41.2	Very low	168 Å²	168	135.7 Å²	135.7	86%	0.862	79%	0.785	S	S	*	*			trans	67	119.1	135.4	-53	165.3	0	0	0	121.2
69	N	37.6	Very low	41.3	Very low	149 Å²	149	133.8 Å²	133.8	80%	0.797	78%	0.783	S	S	*	*			trans	-59.7	-174.5	167.7	-101.9	-14.9	0	0	0	116.1
70	P	45.5	Very low	41.5	Very low	93 Å²	93	134.6 Å²	134.6	60%	0.604	78%	0.781	S	S	*	*			cis	-138	-172	-30	33.3	-11.6	0	0	0	113.8
71	H	38.3	Very low	41.4	Very low	175 Å²	175	137.4 Å²	137.4	81%	0.81	78%	0.784	S	S	*	*			trans	82.4	101.9	166.6	-63.7	-64.2	0	0	0	119.1
72	S	39.4	Very low	41.3	Very low	118 Å²	118	142 Å²	142	83%	0.825	79%	0.791	S	S	*	*				172.7	150.9	111.1	56.3	0	0	0	0	111.1
73	H	42.7	Very low	41.3	Very low	195 Å²	195	142.5 Å²	142.5	90%	0.903	80%	0.8	S	S	*	*			trans	-64.9	133.5	-173.2	-59.1	-91.5	0	0	0	112.1
74	G	38.6	Very low	41.2	Very low	69 Å²	69	137.2 Å²	137.2	71%	0.711	79%	0.792	S	S	*	*			trans	-173.8	76.9	176	0	0	0	0	0	111.7	S76	G74-S76 PolarHBondContact O-N 3.36Å
75	C	36.5	Very low	41.4	Very low	135 Å²	135	142 Å²	142	91%	0.912	80%	0.802	S	S	*	*			trans	-65.7	110.9	172.4	-156.7	0	0	0	0	109
76	S	43	Very low	41.6	Very low	105 Å²	105	137.5 Å²	137.5	73%	0.734	79%	0.794	S	S	*	*			trans	-151.7	94	163.1	50.2	0	0	0	0	109.8	G74 I78	G74-S76 PolarHBondContact O-N 3.36Å; S76-I78 PolarHBondContact O-N 2.91Å
77	T	49.1	Very low	41.7	Very low	133 Å²	133	142.6 Å²	142.6	82%	0.816	80%	0.802	S	S	*	*			trans	-73.4	109.9	168.3	-49	0	0	0	0	108	S79	T77-S79 PolarHBondContact O-N 2.82Å
78	I	45.4	Very low	42	Very low	148 Å²	148	146 Å²	146	76%	0.759	81%	0.807	S	S	*	*			trans	-69.7	114.5	167.8	-69.6	169.1	0	0	0	107.8	S76 N80	S76-I78 PolarHBondContact O-N 2.91Å; I78-N80 PolarHBondContact O-N 2.81Å
79	S	43.7	Very low	41.9	Very low	109 Å²	109	145 Å²	145	76%	0.762	80%	0.804	S	S	*	*			trans	-83.8	105	177.2	41.7	0	0	0	0	110.7	T77 W81	T77-S79 PolarHBondContact O-N 2.82Å; S79-W81 PolarHBondContact O-N 3.36Å
80	N	50.2	Low	42.7	Very low	149 Å²	149	144 Å²	144	80%	0.797	80%	0.802	S	S	*	*			trans	-78.7	96.4	167.2	-79.3	-7.2	0	0	0	110.6	I78 F82	I78-N80 PolarHBondContact O-N 2.81Å; N80-F82 PolarHBondContact O-N 2.83Å; N80-F82 VanDerWaalsContact O-N 3.16Å
81	W	36.4	Very low	42.8	Very low	238 Å²	238	148.4 Å²	148.4	90%	0.902	82%	0.815	S	S	*	*				31.1	68.1	119	-144.4	-35	0	0	0	118.2	S79	S79-W81 PolarHBondContact O-N 3.36Å
82	F	39.5	Very low	43.2	Very low	202 Å²	202	146.3 Å²	146.3	89%	0.886	81%	0.81	S	S	*	*			trans	-154.6	81.6	148	-119.1	-84.8	0	0	0	110.1	N80 G84	N80-F82 PolarHBondContact O-N 2.83Å; N80-F82 VanDerWaalsContact O-N 3.16Å; F82-G84 VanDerWaalsContact C-N 3.29Å; F82-G84 PolarHBondContact O-N 2.97Å
83	T	42.1	Very low	43.7	Very low	146 Å²	146	149.1 Å²	149.1	90%	0.896	81%	0.807	S	S	*	*			trans	-72.6	84.2	163.3	33.6	0	0	0	0	109.4
84	G	41.3	Very low	44.2	Very low	62 Å²	62	148.5 Å²	148.5	64%	0.639	80%	0.797	S	S	*	*			trans	-121.4	90.3	164.5	0	0	0	0	0	109	F82 G86	F82-G84 VanDerWaalsContact C-N 3.29Å; F82-G84 PolarHBondContact O-N 2.97Å; G84-G86 PolarHBondContact O-N 3.43Å
85	K	42.2	Very low	44.7	Very low	224 Å²	224	146.2 Å²	146.2	97%	0.974	77%	0.77	S	S	*	*			trans	-62.2	113.7	173	-74.8	-175.6	175.3	178.2	0	109.1
86	G	41	Very low	45.7	Very low	61 Å²	61	147.7 Å²	147.7	63%	0.629	77%	0.767	S	S	*	*			trans	178.9	79.7	171.6	0	0	0	0	0	111.2	G84 E88	G84-G86 PolarHBondContact O-N 3.43Å; G86-E88 PolarHBondContact O-N 2.94Å
87	K	39.6	Very low	46.3	Very low	218 Å²	218	145 Å²	145	95%	0.948	75%	0.746	S	S	*	*			trans	-69.7	80.9	161.2	-79.3	-177.7	175.4	177.5	0	107.5
88	E	45.6	Very low	46.9	Very low	169 Å²	169	147.1 Å²	147.1	79%	0.79	74%	0.744	S	S	*	*			trans	-86	120.9	166	56.2	-172.7	174.9	0	0	109	G86 V90	G86-E88 PolarHBondContact O-N 2.94Å; E88-V90 PolarHBondContact O-N 3.01Å
89	N	42.9	Very low	47.9	Very low	148 Å²	148	141.5 Å²	141.5	79%	0.791	71%	0.713	S	S	*	*			trans	-60.7	116.4	176.4	-85.8	-77.3	0	0	0	109.2	H91	N89-H91 PolarHBondContact O-N 2.65Å
90	V	53	Low	49	Very low	126 Å²	126	144.9 Å²	144.9	76%	0.764	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	25.1	-180	-175.7	0	0	0	0	112.3	E88	E88-V90 PolarHBondContact O-N 3.01Å
91	H	49	Very low	50.1	Low	187 Å²	187	141.8 Å²	141.8	87%	0.866	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	5	-176.1	-107.7	49.4	0	0	0	115.4	N89	N89-H91 PolarHBondContact O-N 2.65Å
92	D	46.1	Very low	51.5	Low	131 Å²	131	131.9 Å²	131.9	70%	0.701	65%	0.651	S	S	*	*			trans	-119.1	67.8	176.7	-153.7	3.7	0	0	0	110.9	R94	D92-R94 PolarHBondContact O-N 2.72Å
93	K	50.7	Low	52.8	Low	177 Å²	177	131.9 Å²	131.9	77%	0.77	65%	0.651	S	S	*	*			trans	-77.7	72.1	166.6	-70.1	-173.2	-177.6	179.9	0	108.5	S95	K93-S95 PolarHBondContact O-N 3.15Å
94	R	51.5	Low	54.3	Low	181 Å²	181	130.3 Å²	130.3	68%	0.683	63%	0.634	S	S	*	*			trans	-52.9	124.3	164.1	-136.8	174.2	-173.2	169.1	5.2	107.2	D92 I96	D92-R94 PolarHBondContact O-N 2.72Å; R94-I96 PolarHBondContact O-N 3.12Å
95	S	50.8	Low	55.8	Low	22 Å²	22	127.7 Å²	127.7	15%	0.154	61%	0.605	C	S	.	*			trans	-44	124.4	-176	46.1	0	0	0	0	111.9	K93 V97 R99 D118	K93-S95 PolarHBondContact O-N 3.15Å; S95-V97 PolarHBondContact O-N 2.82Å; S95-R99 PolarHBondContact OG-NH1 3.21Å; S95-D118 WeakPolarHBondContact CB-OD1 3.4Å
96	I	56.5	Low	57.4	Low	165 Å²	165	124.4 Å²	124.4	85%	0.846	59%	0.593	S	S	*	*	S	Bend	trans	-70.8	-14.2	-176.6	-64	167.4	0	0	0	111	R94 K98	R94-I96 PolarHBondContact O-N 3.12Å; I96-K98 PolarHBondContact O-N 3.26Å; I96-K98 VanDerWaalsContact O-N 3.13Å
97	V	56.6	Low	59.4	Low	49 Å²	49	122.8 Å²	122.8	30%	0.297	58%	0.576	S	S	.	*			trans	-73.5	105.3	179.6	-172.5	0	0	0	0	109.6	S95 R99	S95-V97 PolarHBondContact O-N 2.82Å; V97-R99 HydrophobicContact CB-CG 4.44Å; V97-R99 HydrophobicContact CG1-CG 3.91Å; V97-R99 PolarHBondContact O-N 3.43Å
98	K	60	Low	61.7	Low	177 Å²	177	116.4 Å²	116.4	77%	0.77	56%	0.556	S	S	*	*			trans	-66.4	83	169.5	-73.1	-177.7	-179.7	173	0	109.9	I96	I96-K98 PolarHBondContact O-N 3.26Å; I96-K98 VanDerWaalsContact O-N 3.13Å
99	R	66.7	Low	63.8	Low	30 Å²	30	109.4 Å²	109.4	11%	0.113	52%	0.524	C	S	.	.			trans	-71.5	129.5	173.1	-60.4	-174.5	175.2	83.2	3	109.1	S95 V97 F111 S117 D118 N148 Y150	S95-R99 PolarHBondContact OG-NH1 3.21Å; V97-R99 HydrophobicContact CB-CG 4.44Å; V97-R99 HydrophobicContact CG1-CG 3.91Å; V97-R99 PolarHBondContact O-N 3.43Å; R99-F111 HydrophobicContact CB-CB 4.27Å; R99-F111 HydrophobicContact CB-CD1 3.66Å; R99-F111 HydrophobicContact CB-CD2 4.24Å; R99-F111 HydrophobicContact CB-CE1 3.99Å; R99-F111 HydrophobicContact CB-CG 3.79Å; R99-F111 HydrophobicContact CB-CZ 4.42Å; R99-F111 HydrophobicContact CG-CD1 4.25Å; R99-S117 VanDerWaalsContact NH2-C 3.34Å; R99-S117 PolarHBondContact NH2-O 3.46Å; R99-D118 IonicContact NH1-OD1 3.92Å; R99-D118 IonicContact NH2-OD1 2.92Å; R99-N148 PolarHBondContact NE-O 2.86Å; R99-N148 PolarHBondContact NH2-O 3.07Å; R99-Y150 WeakPolarHBondContact CA-OH 3.28Å; R99-Y150 HydrophobicContact CB-CE1 4.09Å; R99-Y150 HydrophobicContact CG-CE1 3.94Å
100	R	67.9	Low	66	Low	181 Å²	181	106.3 Å²	106.3	68%	0.683	51%	0.507	S	S	*	.			trans	-134.9	135.5	178.5	-72.7	-177.8	175.7	164.8	-3.4	109.3	Y150	R100-Y150 PolarHBondContact N-OH 3Å; R100-Y150 PolarHBondContact O-OH 2.9Å
101	K	72.3	Confident	67.8	Low	83 Å²	83	102.1 Å²	102.1	36%	0.361	48%	0.478	S	S	.	.			trans	-61.8	135.4	169.2	174.2	178.8	178.7	-169.7	0	109.2	I105 G107 V109 F111	K101-I105 WeakPolarHBondContact CE-O 3.44Å; K101-I105 PolarHBondContact NZ-O 3.32Å; K101-G107 PolarHBondContact NZ-O 2.78Å; K101-V109 HydrophobicContact CB-CB 4.24Å; K101-V109 HydrophobicContact CB-CG2 4.48Å; K101-V109 HydrophobicContact CD-CB 3.94Å; K101-V109 HydrophobicContact CD-CG2 3.68Å; K101-V109 HydrophobicContact CG-CB 4.06Å; K101-V109 HydrophobicContact CG-CG2 3.79Å; K101-F111 HydrophobicContact CB-CE2 4.29Å; K101-F111 HydrophobicContact CB-CZ 4.49Å
102	Y	66.5	Low	69.6	Low	30 Å²	30	94.5 Å²	94.5	12%	0.118	44%	0.444	C	S	.	.			trans	-69.8	133.3	170.9	-164.2	-106.7	0	0	0	110.6	E104 I105 T156 M187 Y210 R212	Y102-E104 HydrophobicContact CD1-CB 4.09Å; Y102-E104 HydrophobicContact CE1-CB 4.05Å; Y102-E104 HydrophobicContact CE1-CG 4.2Å; Y102-E104 PolarHBondContact O-N 3.36Å; Y102-E104 VanDerWaalsContact O-N 3.07Å; Y102-I105 PolarHBondContact O-N 2.94Å; Y102-T156 PolarHBondContact N-OG1 2.68Å; Y102-M187 HydrophobicContact CD1-SD 3.48Å; Y102-M187 WeakPolarHBondContact CD1-SD 3.33Å; Y102-M187 HydrophobicContact CE1-SD 3.38Å; Y102-M187 WeakPolarHBondContact CE1-SD 3.35Å; Y102-Y210 HydrophobicContact CE1-CE1 4.11Å; Y102-Y210 WeakPolarHBondContact CE1-OH 3.22Å; Y102-Y210 PolarHBondContact OH-OH 3.03Å; Y102-R212 HydrophobicContact CE2-CG 4.25Å
103	K	66.7	Low	71.2	Confident	203 Å²	203	94 Å²	94	88%	0.883	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-27.7	-165.9	-70.9	-176.3	178.7	-179	0	114
104	E	74.1	Confident	72.7	Confident	113 Å²	113	88.9 Å²	88.9	53%	0.528	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.2	-172.7	-68.5	172.1	-178.9	0	0	113.7	Y102 Q106 M187 Y210	Y102-E104 HydrophobicContact CD1-CB 4.09Å; Y102-E104 HydrophobicContact CE1-CB 4.05Å; Y102-E104 HydrophobicContact CE1-CG 4.2Å; Y102-E104 PolarHBondContact O-N 3.36Å; Y102-E104 VanDerWaalsContact O-N 3.07Å; E104-Q106 PolarHBondContact O-N 3.23Å; E104-M187 HydrophobicContact CB-CE 3.84Å; E104-M187 HydrophobicContact CB-SD 3.97Å; E104-M187 WeakPolarHBondContact OE2-CE 3.41Å; E104-Y210 PolarHBondContact OE2-OH 2.98Å
105	I	71.8	Confident	74	Confident	6 Å²	6	85.3 Å²	85.3	3%	0.031	42%	0.42	C	S	.	.			trans	-78.1	127.2	-175.6	-61	177.8	0	0	0	110.2	K101 Y102 V109 T156 A186 M187	K101-I105 WeakPolarHBondContact CE-O 3.44Å; K101-I105 PolarHBondContact NZ-O 3.32Å; Y102-I105 PolarHBondContact O-N 2.94Å; I105-V109 HydrophobicContact CG2-CG2 4.36Å; I105-T156 WeakPolarHBondContact CD1-O 3.45Å; I105-T156 WeakPolarHBondContact CD1-OG1 3.39Å; I105-A186 HydrophobicContact CD1-CB 3.9Å; I105-M187 HydrophobicContact CG1-CG 3.95Å
106	Q	76.8	Confident	75.6	Confident	155 Å²	155	86.3 Å²	86.3	72%	0.724	43%	0.427	S	S	*	.			trans	-79.5	145.2	176.1	-61.1	-176	3.6	0	0	111	E104 S158	E104-Q106 PolarHBondContact O-N 3.23Å; Q106-S158 WeakPolarHBondContact O-CB 3.01Å; Q106-S158 PolarHBondContact O-OG 2.92Å
107	G	82.6	Confident	77.2	Confident	27 Å²	27	78.5 Å²	78.5	28%	0.278	39%	0.387	S	S	.	.	S	Bend	trans	89.8	-179	178.8	0	0	0	0	0	115.3	K101	K101-G107 PolarHBondContact NZ-O 2.78Å
108	T	86.8	Confident	78.8	Confident	85 Å²	85	78.1 Å²	78.1	52%	0.521	38%	0.383	S	S	.	.			trans	-84.3	129.7	-176.7	-57.5	0	0	0	0	111.1	I110 S158 I159	T108-I110 HydrophobicContact CG2-CG1 4.13Å; T108-S158 WeakPolarHBondContact O-CA 3.44Å; T108-S158 WeakPolarHBondContact O-CB 3.43Å; T108-I159 HydrophobicContact CG2-CD1 4.28Å; T108-I159 PolarHBondContact O-N 3.04Å
109	V	89.5	Confident	80.3	Confident	22 Å²	22	72.7 Å²	72.7	13%	0.133	37%	0.365	C	S	.	.			trans	-113.9	123.5	173	179.6	0	0	0	0	107.9	K101 I105 F111 I147	K101-V109 HydrophobicContact CB-CB 4.24Å; K101-V109 HydrophobicContact CB-CG2 4.48Å; K101-V109 HydrophobicContact CD-CB 3.94Å; K101-V109 HydrophobicContact CD-CG2 3.68Å; K101-V109 HydrophobicContact CG-CB 4.06Å; K101-V109 HydrophobicContact CG-CG2 3.79Å; I105-V109 HydrophobicContact CG2-CG2 4.36Å; V109-F111 HydrophobicContact CG1-CD2 4.4Å; V109-F111 HydrophobicContact CG1-CE1 4.11Å; V109-F111 HydrophobicContact CG1-CE2 3.75Å; V109-F111 HydrophobicContact CG1-CZ 3.59Å; V109-I147 HydrophobicContact CG1-CD1 3.65Å
110	I	89.9	Confident	81.6	Confident	83 Å²	83	71.9 Å²	71.9	43%	0.426	36%	0.362	S	S	.	.			trans	-111.4	136	175.3	-63.9	179	0	0	0	108	T108 A146 I147 I159	T108-I110 HydrophobicContact CG2-CG1 4.13Å; I110-A146 HydrophobicContact CB-CB 4.36Å; I110-A146 HydrophobicContact CG2-CB 3.81Å; I110-A146 CarbonylContact O-C 3.49Å; I110-A146 WeakPolarHBondContact O-CA 3.39Å; I110-I147 PolarHBondContact O-N 2.91Å; I110-I159 HydrophobicContact CB-CD1 3.99Å; I110-I159 HydrophobicContact CD1-CD1 3.31Å; I110-I159 HydrophobicContact CG1-CD1 3.47Å; I110-I159 VanDerWaalsContact CG1-CD1 3.47Å
111	F	90.4	Very high	82.9	Confident	37 Å²	37	64 Å²	64	16%	0.162	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-108.5	137	173.6	-62.7	-78.4	0	0	0	109.3	R99 K101 V109 I147 Y150 T156	R99-F111 HydrophobicContact CB-CB 4.27Å; R99-F111 HydrophobicContact CB-CD1 3.66Å; R99-F111 HydrophobicContact CB-CD2 4.24Å; R99-F111 HydrophobicContact CB-CE1 3.99Å; R99-F111 HydrophobicContact CB-CG 3.79Å; R99-F111 HydrophobicContact CB-CZ 4.42Å; R99-F111 HydrophobicContact CG-CD1 4.25Å; K101-F111 HydrophobicContact CB-CE2 4.29Å; K101-F111 HydrophobicContact CB-CZ 4.49Å; V109-F111 HydrophobicContact CG1-CD2 4.4Å; V109-F111 HydrophobicContact CG1-CE1 4.11Å; V109-F111 HydrophobicContact CG1-CE2 3.75Å; V109-F111 HydrophobicContact CG1-CZ 3.59Å; F111-I147 HydrophobicContact CD1-CB 3.82Å; F111-I147 HydrophobicContact CD1-CD1 4.38Å; F111-I147 HydrophobicContact CD1-CG2 4.09Å; F111-I147 HydrophobicContact CE1-CB 4.17Å; F111-I147 HydrophobicContact CE1-CD1 3.92Å; F111-I147 HydrophobicContact CE1-CG2 4.25Å; F111-Y150 HydrophobicContact CD1-CE1 4.16Å; F111-Y150 HydrophobicContact CE1-CD1 4.16Å; F111-Y150 AromaticContact CE1-CE1 3.63Å; F111-Y150 HydrophobicContact CE1-CE1 3.63Å; F111-T156 HydrophobicContact CE1-CG2 4.13Å; F111-T156 HydrophobicContact CZ-CG2 4.21Å
112	D	87.6	Confident	83.9	Confident	27 Å²	27	67.1 Å²	67.1	14%	0.144	34%	0.343	C	S	.	.			trans	-76	135.1	167.5	-163.7	-27.9	0	0	0	108.6	T114 S117 A146 I147 N148	D112-T114 VanDerWaalsContact OD1-CB 3.28Å; D112-T114 WeakPolarHBondContact OD1-CB 3.38Å; D112-T114 WeakPolarHBondContact OD1-CG2 3Å; D112-T114 PolarHBondContact OD1-N 3.08Å; D112-T114 PolarHBondContact OD1-OG1 2.86Å; D112-S117 VanDerWaalsContact CB-OG 3.23Å; D112-S117 WeakPolarHBondContact CB-OG 3.45Å; D112-S117 VanDerWaalsContact CG-OG 3.28Å; D112-S117 PolarHBondContact O-OG 2.98Å; D112-S117 PolarHBondContact OD1-OG 2.92Å; D112-A146 HydrophobicContact CB-CB 4.2Å; D112-I147 PolarHBondContact N-O 3.34Å; D112-N148 WeakPolarHBondContact CB-OD1 2.84Å; D112-N148 PolarHBondContact OD2-OD1 2.88Å
113	Q	79	Confident	85.3	Confident	120 Å²	120	66.5 Å²	66.5	56%	0.561	34%	0.341	S	S	*	.			trans	-113.7	5.5	-177.4	-63.7	179.8	24.7	0	0	111.9
114	T	81.8	Confident	86.7	Confident	70 Å²	70	56.9 Å²	56.9	43%	0.429	30%	0.299	S	S	.	.	S	Bend	trans	-70.9	164.2	178.5	61.2	0	0	0	0	111.7	D112 S116 S117	D112-T114 VanDerWaalsContact OD1-CB 3.28Å; D112-T114 WeakPolarHBondContact OD1-CB 3.38Å; D112-T114 WeakPolarHBondContact OD1-CG2 3Å; D112-T114 PolarHBondContact OD1-N 3.08Å; D112-T114 PolarHBondContact OD1-OG1 2.86Å; T114-S116 PolarHBondContact O-N 2.86Å; T114-S116 PolarHBondContact OG1-OG 2.81Å; T114-S117 WeakPolarHBondContact O-CB 3.25Å; T114-S117 PolarHBondContact O-N 3.32Å; T114-S117 VanDerWaalsContact O-N 3.09Å; T114-S117 PolarHBondContact O-OG 3.02Å
115	T	80.2	Confident	87.6	Confident	106 Å²	106	55.9 Å²	55.9	65%	0.65	29%	0.293	S	S	*	.	H	α-helix	trans	-60.5	-23.9	174.3	49.8	0	0	0	0	112.8	S117 D118	T115-S117 VanDerWaalsContact C-N 3.29Å; T115-S117 PolarHBondContact O-N 3.05Å; T115-D118 PolarHBondContact O-N 2.95Å
116	S	84.7	Confident	88.7	Confident	44 Å²	44	60.8 Å²	60.8	31%	0.308	32%	0.32	S	S	.	.	H	α-helix	trans	-61.9	-38.2	174.7	77.2	0	0	0	0	111.7	T114 D118 V119 Y120	T114-S116 PolarHBondContact O-N 2.86Å; T114-S116 PolarHBondContact OG1-OG 2.81Å; S116-D118 VanDerWaalsContact C-N 3.26Å; S116-D118 PolarHBondContact O-N 2.8Å; S116-V119 WeakPolarHBondContact O-CB 3.25Å; S116-V119 PolarHBondContact O-N 3.01Å; S116-Y120 WeakPolarHBondContact O-CD2 3.08Å; S116-Y120 PolarHBondContact O-N 2.97Å
117	S	88.7	Confident	89.6	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-32.7	-178.8	-46	0	0	0	0	112.6	R99 D112 T114 T115 D121	R99-S117 VanDerWaalsContact NH2-C 3.34Å; R99-S117 PolarHBondContact NH2-O 3.46Å; D112-S117 VanDerWaalsContact CB-OG 3.23Å; D112-S117 WeakPolarHBondContact CB-OG 3.45Å; D112-S117 VanDerWaalsContact CG-OG 3.28Å; D112-S117 PolarHBondContact O-OG 2.98Å; D112-S117 PolarHBondContact OD1-OG 2.92Å; T114-S117 WeakPolarHBondContact O-CB 3.25Å; T114-S117 PolarHBondContact O-N 3.32Å; T114-S117 VanDerWaalsContact O-N 3.09Å; T114-S117 PolarHBondContact O-OG 3.02Å; T115-S117 VanDerWaalsContact C-N 3.29Å; T115-S117 PolarHBondContact O-N 3.05Å; S117-D121 WeakPolarHBondContact O-CB 3.38Å; S117-D121 PolarHBondContact O-N 3.33Å
118	D	90	Very high	90.3	Very high	42 Å²	42	54.4 Å²	54.4	23%	0.225	29%	0.288	C	S	.	.	H	α-helix	trans	-73.6	-28.4	176.9	-68	-14.9	0	0	0	112.5	S95 R99 T115 S116 R122	S95-D118 WeakPolarHBondContact CB-OD1 3.4Å; R99-D118 IonicContact NH1-OD1 3.92Å; R99-D118 IonicContact NH2-OD1 2.92Å; T115-D118 PolarHBondContact O-N 2.95Å; S116-D118 VanDerWaalsContact C-N 3.26Å; S116-D118 PolarHBondContact O-N 2.8Å; D118-R122 PolarHBondContact O-N 2.94Å
119	V	92.8	Very high	90.7	Very high	63 Å²	63	52.2 Å²	52.2	38%	0.382	27%	0.273	S	S	.	.	H	α-helix	trans	-71.7	-48.2	172.9	179.4	0	0	0	0	109.9	S116 D121 R122 I123 M264	S116-V119 WeakPolarHBondContact O-CB 3.25Å; S116-V119 PolarHBondContact O-N 3.01Å; V119-D121 VanDerWaalsContact C-N 3.29Å; V119-D121 PolarHBondContact O-N 2.97Å; V119-R122 PolarHBondContact O-N 2.71Å; V119-I123 HydrophobicContact CG1-CD1 3.84Å; V119-I123 WeakPolarHBondContact O-CG1 3.48Å; V119-I123 PolarHBondContact O-N 2.7Å; V119-I123 VanDerWaalsContact O-N 3.09Å; V119-M264 HydrophobicContact CG1-SD 4.29Å
120	Y	94.4	Very high	90.9	Very high	12 Å²	12	53.3 Å²	53.3	5%	0.047	29%	0.289	C	S	.	.	H	α-helix	trans	-57.2	-42.2	174.4	-70.7	-69.3	0	0	0	112.3	S116 R122 I123 L124 I139 N148 S233 F259 M264	S116-Y120 WeakPolarHBondContact O-CD2 3.08Å; S116-Y120 PolarHBondContact O-N 2.97Å; Y120-R122 VanDerWaalsContact C-N 3.33Å; Y120-R122 PolarHBondContact O-N 2.76Å; Y120-I123 PolarHBondContact O-N 2.73Å; Y120-L124 VanDerWaalsContact O-CB 3.27Å; Y120-L124 WeakPolarHBondContact O-CB 3.19Å; Y120-L124 PolarHBondContact O-N 3.18Å; Y120-I139 HydrophobicContact CD1-CB 4.49Å; Y120-I139 HydrophobicContact CD1-CD1 4.06Å; Y120-I139 HydrophobicContact CD1-CG2 3.67Å; Y120-I139 HydrophobicContact CE1-CG2 3.97Å; Y120-I139 HydrophobicContact CG-CG2 4.19Å; Y120-N148 HydrophobicContact CD2-CB 3.52Å; Y120-N148 HydrophobicContact CE2-CB 4.19Å; Y120-N148 WeakPolarHBondContact CE2-ND2 3.3Å; Y120-N148 HydrophobicContact CG-CB 3.83Å; Y120-S233 PolarHBondContact OH-OG 3.35Å; Y120-S233 VanDerWaalsContact OH-OG 3.1Å; Y120-F259 HydrophobicContact CD1-CE1 4.17Å; Y120-F259 HydrophobicContact CD1-CZ 4.41Å; Y120-F259 HydrophobicContact CE1-CD1 4.3Å; Y120-F259 HydrophobicContact CE1-CE1 4.29Å; Y120-M264 HydrophobicContact CD1-SD 4.37Å; Y120-M264 HydrophobicContact CE1-CB 3.84Å; Y120-M264 HydrophobicContact CE1-CG 4.21Å; Y120-M264 HydrophobicContact CE1-SD 3.85Å; Y120-M264 VanDerWaalsContact OH-CA 3.24Å; Y120-M264 WeakPolarHBondContact OH-CA 3.22Å; Y120-M264 WeakPolarHBondContact OH-CB 3.3Å; Y120-M264 PolarHBondContact OH-OXT 3.31Å
121	D	94	Very high	91.1	Very high	15 Å²	15	51.8 Å²	51.8	8%	0.08	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-42.2	-178.9	-172.4	70.4	0	0	0	111.7	S117 V119 K125 A149	S117-D121 WeakPolarHBondContact O-CB 3.38Å; S117-D121 PolarHBondContact O-N 3.33Å; V119-D121 VanDerWaalsContact C-N 3.29Å; V119-D121 PolarHBondContact O-N 2.97Å; D121-K125 WeakPolarHBondContact O-CB 3.47Å; D121-K125 WeakPolarHBondContact O-CG 3.46Å; D121-K125 PolarHBondContact O-N 3.3Å; D121-K125 WeakPolarHBondContact OD1-CE 3.48Å; D121-K125 IonicContact OD1-NZ 2.83Å; D121-K125 PolarHBondContact OD1-NZ 3.12Å; D121-K125 WeakPolarHBondContact OD2-CE 3.47Å; D121-K125 IonicContact OD2-NZ 3.3Å; D121-K125 PolarHBondContact OD2-NZ 3.42Å; D121-A149 HydrophobicContact CB-CB 4.17Å
122	R	93.9	Very high	91.2	Very high	149 Å²	149	60.2 Å²	60.2	56%	0.562	31%	0.314	S	S	*	.	H	α-helix	trans	-63.6	-46.2	176	-166.6	-167.6	-34.3	-81.8	-13	111.9	D118 V119 Y120 N126	D118-R122 PolarHBondContact O-N 2.94Å; V119-R122 PolarHBondContact O-N 2.71Å; Y120-R122 VanDerWaalsContact C-N 3.33Å; Y120-R122 PolarHBondContact O-N 2.76Å; R122-N126 VanDerWaalsContact O-CB 3.24Å; R122-N126 WeakPolarHBondContact O-CB 3.21Å; R122-N126 VanDerWaalsContact O-CG 3.32Å; R122-N126 PolarHBondContact O-N 3.49Å
123	I	95	Very high	91.5	Very high	18 Å²	18	60.1 Å²	60.1	9%	0.092	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-46.7	-179.8	-64.4	162.5	0	0	0	110	V119 Y120 K125 S127 I128 M255 Y258 F259 M264	V119-I123 HydrophobicContact CG1-CD1 3.84Å; V119-I123 WeakPolarHBondContact O-CG1 3.48Å; V119-I123 PolarHBondContact O-N 2.7Å; V119-I123 VanDerWaalsContact O-N 3.09Å; Y120-I123 PolarHBondContact O-N 2.73Å; I123-K125 PolarHBondContact O-N 3.11Å; I123-S127 WeakPolarHBondContact O-CA 3.26Å; I123-S127 VanDerWaalsContact O-CB 3.27Å; I123-S127 WeakPolarHBondContact O-CB 3.4Å; I123-S127 PolarHBondContact O-N 3.37Å; I123-I128 PolarHBondContact O-N 3.09Å; I123-M255 HydrophobicContact CG2-SD 4.2Å; I123-Y258 HydrophobicContact CD1-CE1 3.94Å; I123-F259 HydrophobicContact CD1-CE1 4.08Å; I123-F259 HydrophobicContact CG2-CE1 3.92Å; I123-F259 HydrophobicContact CG2-CZ 4.05Å; I123-M264 HydrophobicContact CD1-CE 3.91Å; I123-M264 HydrophobicContact CD1-SD 4.46Å
124	L	95.8	Very high	92.2	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.288	C	S	.	.	I	π-helix	trans	-61.1	-46.6	179.9	-176.3	144.8	0	0	0	111.6	Y120 I128 L129 A137 I139 A149	Y120-L124 VanDerWaalsContact O-CB 3.27Å; Y120-L124 WeakPolarHBondContact O-CB 3.19Å; Y120-L124 PolarHBondContact O-N 3.18Å; L124-I128 WeakPolarHBondContact O-CB 3.35Å; L124-I128 PolarHBondContact O-N 2.91Å; L124-L129 HydrophobicContact CD2-CD1 3.48Å; L124-L129 VanDerWaalsContact CD2-CD1 3.48Å; L124-L129 HydrophobicContact CD2-CG 4Å; L124-L129 PolarHBondContact O-N 3.47Å; L124-A137 HydrophobicContact CD1-CB 3.95Å; L124-A137 HydrophobicContact CG-CB 4.14Å; L124-I139 HydrophobicContact CB-CD1 3.99Å; L124-I139 HydrophobicContact CD1-CB 4.5Å; L124-I139 HydrophobicContact CD1-CD1 3.85Å; L124-I139 HydrophobicContact CD1-CG1 3.87Å; L124-I139 HydrophobicContact CG-CD1 4.47Å; L124-A149 HydrophobicContact CB-CB 4.06Å; L124-A149 HydrophobicContact CD1-CB 3.93Å
125	K	94.4	Very high	92.8	Very high	92 Å²	92	55 Å²	55	40%	0.4	28%	0.284	S	S	.	.	I	π-helix	trans	-70.9	-41.4	-178.4	-72.3	174.3	179.1	163	0	112.8	D121 I123 G130	D121-K125 WeakPolarHBondContact O-CB 3.47Å; D121-K125 WeakPolarHBondContact O-CG 3.46Å; D121-K125 PolarHBondContact O-N 3.3Å; D121-K125 WeakPolarHBondContact OD1-CE 3.48Å; D121-K125 IonicContact OD1-NZ 2.83Å; D121-K125 PolarHBondContact OD1-NZ 3.12Å; D121-K125 WeakPolarHBondContact OD2-CE 3.47Å; D121-K125 IonicContact OD2-NZ 3.3Å; D121-K125 PolarHBondContact OD2-NZ 3.42Å; I123-K125 PolarHBondContact O-N 3.11Å; K125-G130 WeakPolarHBondContact O-CA 3.36Å; K125-G130 PolarHBondContact O-N 3.3Å
126	N	95.1	Very high	93.5	Very high	110 Å²	110	50 Å²	50	59%	0.588	25%	0.253	S	S	*	.	I	π-helix	trans	-88.5	-46.4	-173.6	-63.7	-12.9	0	0	0	112.7	R122 G130	R122-N126 VanDerWaalsContact O-CB 3.24Å; R122-N126 WeakPolarHBondContact O-CB 3.21Å; R122-N126 VanDerWaalsContact O-CG 3.32Å; R122-N126 PolarHBondContact O-N 3.49Å; N126-G130 WeakPolarHBondContact O-CA 3.29Å
127	S	95.4	Very high	94	Very high	48 Å²	48	47.9 Å²	47.9	34%	0.336	24%	0.238	S	C	.	.	I	π-helix	trans	-95.1	-24.5	-170.1	-51.5	0	0	0	0	113.7	I123 T131	I123-S127 WeakPolarHBondContact O-CA 3.26Å; I123-S127 VanDerWaalsContact O-CB 3.27Å; I123-S127 WeakPolarHBondContact O-CB 3.4Å; I123-S127 PolarHBondContact O-N 3.37Å; S127-T131 WeakPolarHBondContact O-CG2 3.4Å
128	I	96.2	Very high	94.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.238	C	C	.	.	I	π-helix	trans	-101.5	-67.4	178.7	-54.8	180	0	0	0	109.7	I123 L124 G130 T131 V134 A137 L235 L252 M255	I123-I128 PolarHBondContact O-N 3.09Å; L124-I128 WeakPolarHBondContact O-CB 3.35Å; L124-I128 PolarHBondContact O-N 2.91Å; I128-G130 PolarHBondContact O-N 2.56Å; I128-T131 PolarHBondContact O-N 2.83Å; I128-T131 PolarHBondContact O-OG1 2.79Å; I128-V134 HydrophobicContact CG2-CB 3.94Å; I128-V134 HydrophobicContact CG2-CG1 4.01Å; I128-V134 HydrophobicContact CG2-CG2 3.91Å; I128-A137 HydrophobicContact CG2-CB 4.07Å; I128-L235 HydrophobicContact CD1-CD1 3.94Å; I128-L235 HydrophobicContact CD1-CD2 4.18Å; I128-L252 HydrophobicContact CG2-CD2 4.21Å; I128-M255 HydrophobicContact CD1-CB 4.41Å; I128-M255 HydrophobicContact CD1-CG 4.22Å; I128-M255 HydrophobicContact CG1-CG 3.96Å; I128-M255 HydrophobicContact CG1-SD 4.19Å
129	L	95.3	Very high	94.7	Very high	38 Å²	38	45.9 Å²	45.9	20%	0.199	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-69.8	-32.2	-178.6	-63.8	-179.5	0	0	0	112.6	L124 T131 R132 V134 A137	L124-L129 HydrophobicContact CD2-CD1 3.48Å; L124-L129 VanDerWaalsContact CD2-CD1 3.48Å; L124-L129 HydrophobicContact CD2-CG 4Å; L124-L129 PolarHBondContact O-N 3.47Å; L129-T131 PolarHBondContact O-N 3.21Å; L129-R132 PolarHBondContact O-N 3.22Å; L129-R132 VanDerWaalsContact O-N 3.09Å; L129-V134 HydrophobicContact CD2-CB 4.49Å; L129-V134 HydrophobicContact CD2-CG1 4.1Å; L129-A137 HydrophobicContact CD2-CB 4.09Å; L129-A137 HydrophobicContact CG-CB 4.49Å
130	G	93.7	Very high	94.8	Very high	46 Å²	46	42.9 Å²	42.9	47%	0.474	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-62.9	-23.5	178.6	0	0	0	0	0	114	K125 N126 I128 R132	K125-G130 WeakPolarHBondContact O-CA 3.36Å; K125-G130 PolarHBondContact O-N 3.3Å; N126-G130 WeakPolarHBondContact O-CA 3.29Å; I128-G130 PolarHBondContact O-N 2.56Å; G130-R132 PolarHBondContact O-N 2.83Å
131	T	94.1	Very high	94.8	Very high	50 Å²	50	44.4 Å²	44.4	31%	0.307	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-72	-17.6	176.6	67.7	0	0	0	0	113.3	S127 I128 L129 L133 L251	S127-T131 WeakPolarHBondContact O-CG2 3.4Å; I128-T131 PolarHBondContact O-N 2.83Å; I128-T131 PolarHBondContact O-OG1 2.79Å; L129-T131 PolarHBondContact O-N 3.21Å; T131-L133 PolarHBondContact O-N 2.92Å; T131-L133 VanDerWaalsContact O-N 3.11Å; T131-L133 PolarHBondContact OG1-N 3.13Å; T131-L251 HydrophobicContact CG2-CD1 4.38Å; T131-L251 HydrophobicContact CG2-CD2 3.76Å; T131-L251 WeakPolarHBondContact OG1-CD2 3.23Å
132	R	92.4	Very high	94.7	Very high	215 Å²	215	48.7 Å²	48.7	81%	0.811	23%	0.233	S	C	*	.	S	Bend	trans	62	6	-173.6	-48.5	-179.3	-179.4	-170.1	-1.2	115	L129 G130	L129-R132 PolarHBondContact O-N 3.22Å; L129-R132 VanDerWaalsContact O-N 3.09Å; G130-R132 PolarHBondContact O-N 2.83Å
133	L	94	Very high	94.5	Very high	25 Å²	25	53 Å²	53	13%	0.131	25%	0.25	C	C	.	.	S	Bend	trans	-74.6	-39	171.4	-69.2	175.4	0	0	0	110.9	T131 Y239 R244 D247 A248 L251	T131-L133 PolarHBondContact O-N 2.92Å; T131-L133 VanDerWaalsContact O-N 3.11Å; T131-L133 PolarHBondContact OG1-N 3.13Å; L133-Y239 VanDerWaalsContact O-CB 3.3Å; L133-Y239 WeakPolarHBondContact O-CB 3.23Å; L133-R244 HydrophobicContact CD2-CB 3.86Å; L133-R244 VanDerWaalsContact CD2-CZ 3.43Å; L133-D247 HydrophobicContact CD1-CB 3.95Å; L133-D247 HydrophobicContact CD2-CB 4.19Å; L133-A248 HydrophobicContact CB-CB 4.08Å; L133-L251 HydrophobicContact CD1-CD2 4.2Å
134	V	95.3	Very high	94.3	Very high	4 Å²	4	55 Å²	55	2%	0.024	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.7	179.5	-180	0	0	0	0	109.3	I128 L129 K136 A137 A237 L252	I128-V134 HydrophobicContact CG2-CB 3.94Å; I128-V134 HydrophobicContact CG2-CG1 4.01Å; I128-V134 HydrophobicContact CG2-CG2 3.91Å; L129-V134 HydrophobicContact CD2-CB 4.49Å; L129-V134 HydrophobicContact CD2-CG1 4.1Å; V134-K136 WeakPolarHBondContact CG1-O 3.39Å; V134-A137 HydrophobicContact CG1-CB 4.09Å; V134-A237 HydrophobicContact CG1-CB 3.8Å; V134-L252 HydrophobicContact CG2-CD2 4.2Å; V134-L252 HydrophobicContact CG2-CG 4.41Å
135	K	92.9	Very high	94.1	Very high	78 Å²	78	55.1 Å²	55.1	34%	0.339	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-40.3	-178.9	-55.8	-68.3	-177.3	164	0	111.9	Y209 Y223 I238 E240	K135-Y209 WeakPolarHBondContact CB-OH 3.35Å; K135-Y223 HydrophobicContact CG-CE1 4.02Å; K135-I238 PolarHBondContact N-O 2.84Å; K135-E240 WeakPolarHBondContact CE-OE2 3.18Å; K135-E240 IonicContact NZ-OE2 3.15Å; K135-E240 PolarHBondContact NZ-OE2 2.92Å
136	K	94.7	Very high	94	Very high	1 Å²	1	51 Å²	51	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	143.4	176.7	-46.1	-166.3	-176.1	176.9	0	110.5	V134 G151 P152 D154 F155 D188 Y209 Y210 A237 I238	V134-K136 WeakPolarHBondContact CG1-O 3.39Å; K136-G151 CarbonylContact C-O 3.5Å; K136-G151 VanDerWaalsContact CA-O 3.31Å; K136-G151 WeakPolarHBondContact CA-O 3.49Å; K136-P152 HydrophobicContact CD-CG 4.48Å; K136-P152 HydrophobicContact CG-CG 4.17Å; K136-D154 IonicContact NZ-OD2 3.93Å; K136-D154 PolarHBondContact NZ-OD2 3.39Å; K136-F155 HydrophobicContact CB-CB 4.24Å; K136-F155 HydrophobicContact CB-CD1 3.95Å; K136-F155 HydrophobicContact CB-CD2 4Å; K136-F155 HydrophobicContact CB-CE1 4.24Å; K136-F155 HydrophobicContact CB-CE2 4.34Å; K136-F155 HydrophobicContact CB-CG 3.81Å; K136-F155 HydrophobicContact CB-CZ 4.44Å; K136-F155 HydrophobicContact CD-CB 4.17Å; K136-F155 HydrophobicContact CD-CD2 3.62Å; K136-F155 HydrophobicContact CD-CE2 4.24Å; K136-F155 HydrophobicContact CD-CG 4.02Å; K136-D188 IonicContact NZ-OD1 2.72Å; K136-D188 PolarHBondContact NZ-OD1 3.08Å; K136-D188 VanDerWaalsContact NZ-OD1 3.15Å; K136-D188 IonicContact NZ-OD2 2.86Å; K136-D188 PolarHBondContact NZ-OD2 2.95Å; K136-Y209 HydrophobicContact CD-CE2 4.21Å; K136-Y209 HydrophobicContact CG-CE2 4.32Å; K136-Y210 VanDerWaalsContact CE-O 3.25Å; K136-Y210 WeakPolarHBondContact CE-O 3.49Å; K136-Y210 PolarHBondContact NZ-O 3.36Å; K136-A237 CarbonylContact O-C 3.5Å; K136-A237 VanDerWaalsContact O-CA 3.28Å; K136-A237 WeakPolarHBondContact O-CA 3.47Å; K136-I238 HydrophobicContact CB-CB 4.27Å; K136-I238 HydrophobicContact CD-CD1 4.39Å; K136-I238 PolarHBondContact N-O 2.75Å; K136-I238 PolarHBondContact O-N 2.72Å
137	A	96.9	Very high	94	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	149.3	175.4	0	0	0	0	0	111.1	L124 I128 L129 V134 Y150 G151 F155 I236 A237	L124-A137 HydrophobicContact CD1-CB 3.95Å; L124-A137 HydrophobicContact CG-CB 4.14Å; I128-A137 HydrophobicContact CG2-CB 4.07Å; L129-A137 HydrophobicContact CD2-CB 4.09Å; L129-A137 HydrophobicContact CG-CB 4.49Å; V134-A137 HydrophobicContact CG1-CB 4.09Å; A137-Y150 CarbonylContact O-C 3.58Å; A137-Y150 WeakPolarHBondContact O-CA 3.13Å; A137-G151 PolarHBondContact N-O 3.03Å; A137-G151 PolarHBondContact O-N 3.26Å; A137-G151 VanDerWaalsContact O-O 3.07Å; A137-F155 VanDerWaalsContact C-CD1 3.49Å; A137-I236 CarbonylContact C-O 3.52Å; A137-I236 VanDerWaalsContact CA-O 3.25Å; A137-I236 WeakPolarHBondContact CA-O 3.48Å; A137-A237 HydrophobicContact CB-CB 4.33Å
138	V	96.4	Very high	94	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	138.9	171.9	62.9	0	0	0	0	109.2	I147 A149 F155 P157 I236	V138-I147 HydrophobicContact CG2-CG1 4.26Å; V138-I147 HydrophobicContact CG2-CG2 3.89Å; V138-A149 CarbonylContact C-O 3.58Å; V138-A149 WeakPolarHBondContact CA-O 3.41Å; V138-A149 WeakPolarHBondContact CG2-O 3.06Å; V138-F155 HydrophobicContact CB-CD1 3.8Å; V138-F155 HydrophobicContact CB-CE1 3.98Å; V138-F155 HydrophobicContact CG1-CD1 3.86Å; V138-F155 HydrophobicContact CG1-CE1 3.54Å; V138-F155 HydrophobicContact CG1-CZ 4.45Å; V138-P157 HydrophobicContact CG1-CG 3.97Å; V138-P157 HydrophobicContact CG2-CG 4.19Å; V138-I236 HydrophobicContact CG1-CB 3.8Å; V138-I236 HydrophobicContact CG1-CD1 4.41Å; V138-I236 PolarHBondContact N-O 2.86Å; V138-I236 PolarHBondContact O-N 2.82Å
139	I	96.5	Very high	93.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	123.6	170	-62.7	160.1	0	0	0	107.6	Y120 L124 N148 A149 L234 L235 F259	Y120-I139 HydrophobicContact CD1-CB 4.49Å; Y120-I139 HydrophobicContact CD1-CD1 4.06Å; Y120-I139 HydrophobicContact CD1-CG2 3.67Å; Y120-I139 HydrophobicContact CE1-CG2 3.97Å; Y120-I139 HydrophobicContact CG-CG2 4.19Å; L124-I139 HydrophobicContact CB-CD1 3.99Å; L124-I139 HydrophobicContact CD1-CB 4.5Å; L124-I139 HydrophobicContact CD1-CD1 3.85Å; L124-I139 HydrophobicContact CD1-CG1 3.87Å; L124-I139 HydrophobicContact CG-CD1 4.47Å; I139-N148 HydrophobicContact CG2-CB 4.26Å; I139-N148 WeakPolarHBondContact O-CB 2.98Å; I139-N148 PolarHBondContact O-N 3.42Å; I139-A149 HydrophobicContact CB-CB 4.39Å; I139-A149 HydrophobicContact CD1-CB 4.47Å; I139-A149 PolarHBondContact N-O 3.28Å; I139-A149 PolarHBondContact O-N 3.37Å; I139-A149 VanDerWaalsContact O-N 3.16Å; I139-L234 CarbonylContact C-O 3.55Å; I139-L234 WeakPolarHBondContact CA-O 3.1Å; I139-L235 HydrophobicContact CD1-CD1 4.42Å; I139-L235 HydrophobicContact CG1-CD1 3.67Å; I139-F259 HydrophobicContact CD1-CE2 3.86Å; I139-F259 HydrophobicContact CD1-CZ 3.51Å; I139-F259 HydrophobicContact CG1-CE2 4.27Å; I139-F259 HydrophobicContact CG1-CZ 4.4Å
140	C	95.3	Very high	93.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	153	177.7	-59.2	0	0	0	0	110.2	R142 A146 I162 S233 L234	C140-R142 PolarHBondContact O-N 2.99Å; C140-A146 CarbonylContact C-O 3.48Å; C140-A146 VanDerWaalsContact CA-O 3.24Å; C140-A146 WeakPolarHBondContact CA-O 3.2Å; C140-I162 HydrophobicContact CB-CD1 4.2Å; C140-I162 VanDerWaalsContact SG-CD1 3.58Å; C140-S233 CarbonylContact O-C 3.52Å; C140-S233 VanDerWaalsContact O-CA 3.28Å; C140-S233 WeakPolarHBondContact O-CA 3.35Å; C140-L234 HydrophobicContact CB-CB 4.49Å; C140-L234 PolarHBondContact N-O 3.25Å; C140-L234 PolarHBondContact O-N 2.81Å
141	N	93.4	Very high	93.7	Very high	43 Å²	43	41 Å²	41	23%	0.23	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	128.6	166.2	-174.8	-62.9	0	0	0	109.4	R143 S144 G145 A146	N141-R143 VanDerWaalsContact C-N 3.27Å; N141-R143 PolarHBondContact O-N 3.45Å; N141-R143 PolarHBondContact OD1-N 3.22Å; N141-S144 WeakPolarHBondContact CB-OG 3.42Å; N141-S144 PolarHBondContact OD1-N 2.81Å; N141-G145 WeakPolarHBondContact O-CA 2.96Å; N141-G145 PolarHBondContact O-N 3.3Å; N141-A146 PolarHBondContact N-O 3.37Å
142	R	91.8	Very high	93.5	Very high	105 Å²	105	41.3 Å²	41.3	40%	0.396	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-30.6	-176.2	-177.2	175.2	169.2	-171.7	-3.1	113.1	C140 M166 T230 N232	C140-R142 PolarHBondContact O-N 2.99Å; R142-M166 HydrophobicContact CG-CE 3.84Å; R142-T230 VanDerWaalsContact CD-O 3.22Å; R142-T230 WeakPolarHBondContact CD-O 3.05Å; R142-T230 PolarHBondContact NH1-O 3.19Å; R142-N232 WeakPolarHBondContact CB-O 3.24Å; R142-N232 PolarHBondContact N-O 3.16Å
143	R	89.5	Confident	93.2	Very high	241 Å²	241	37 Å²	37	91%	0.909	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-47	-176.1	-166.8	179.9	83.2	146.1	2.8	112.6	N141	N141-R143 VanDerWaalsContact C-N 3.27Å; N141-R143 PolarHBondContact O-N 3.45Å; N141-R143 PolarHBondContact OD1-N 3.22Å
144	S	90.8	Very high	92.8	Very high	59 Å²	59	35.9 Å²	35.9	41%	0.413	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-19	-175.2	62.7	0	0	0	0	113.8	N141 A146	N141-S144 WeakPolarHBondContact CB-OG 3.42Å; N141-S144 PolarHBondContact OD1-N 2.81Å; S144-A146 PolarHBondContact O-N 2.93Å; S144-A146 VanDerWaalsContact OG-CB 3.29Å; S144-A146 WeakPolarHBondContact OG-CB 3.46Å; S144-A146 PolarHBondContact OG-N 3.13Å
145	G	91.8	Very high	92.6	Very high	3 Å²	3	35.7 Å²	35.7	3%	0.031	17%	0.167	C	C	.	.			trans	68.9	10.1	-168.5	0	0	0	0	0	113.4	N141 I162	N141-G145 WeakPolarHBondContact O-CA 2.96Å; N141-G145 PolarHBondContact O-N 3.3Å; G145-I162 WeakPolarHBondContact O-CD1 3.18Å
146	A	93.3	Very high	92.6	Very high	5 Å²	5	32 Å²	32	4%	0.041	15%	0.15	C	C	.	.			trans	-71.2	134.8	177.5	0	0	0	0	0	110.7	I110 D112 C140 N141 S144 N148	I110-A146 HydrophobicContact CB-CB 4.36Å; I110-A146 HydrophobicContact CG2-CB 3.81Å; I110-A146 CarbonylContact O-C 3.49Å; I110-A146 WeakPolarHBondContact O-CA 3.39Å; D112-A146 HydrophobicContact CB-CB 4.2Å; C140-A146 CarbonylContact C-O 3.48Å; C140-A146 VanDerWaalsContact CA-O 3.24Å; C140-A146 WeakPolarHBondContact CA-O 3.2Å; N141-A146 PolarHBondContact N-O 3.37Å; S144-A146 PolarHBondContact O-N 2.93Å; S144-A146 VanDerWaalsContact OG-CB 3.29Å; S144-A146 WeakPolarHBondContact OG-CB 3.46Å; S144-A146 PolarHBondContact OG-N 3.13Å; A146-N148 PolarHBondContact O-N 3.11Å
147	I	95.1	Very high	92.6	Very high	1 Å²	1	32 Å²	32	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	119.4	178.3	-61.6	175.2	0	0	0	109.3	V109 I110 F111 D112 V138 Y150 T156	V109-I147 HydrophobicContact CG1-CD1 3.65Å; I110-I147 PolarHBondContact O-N 2.91Å; F111-I147 HydrophobicContact CD1-CB 3.82Å; F111-I147 HydrophobicContact CD1-CD1 4.38Å; F111-I147 HydrophobicContact CD1-CG2 4.09Å; F111-I147 HydrophobicContact CE1-CB 4.17Å; F111-I147 HydrophobicContact CE1-CD1 3.92Å; F111-I147 HydrophobicContact CE1-CG2 4.25Å; D112-I147 PolarHBondContact N-O 3.34Å; V138-I147 HydrophobicContact CG2-CG1 4.26Å; V138-I147 HydrophobicContact CG2-CG2 3.89Å; I147-Y150 HydrophobicContact CG2-CD1 3.66Å; I147-Y150 HydrophobicContact CG2-CG 4.26Å; I147-T156 HydrophobicContact CD1-CG2 4.28Å
148	N	94.2	Very high	92.4	Very high	1 Å²	1	32 Å²	32	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-47	171.8	-74.5	-32.1	0	0	0	111.1	R99 D112 Y120 I139 A146	R99-N148 PolarHBondContact NE-O 2.86Å; R99-N148 PolarHBondContact NH2-O 3.07Å; D112-N148 WeakPolarHBondContact CB-OD1 2.84Å; D112-N148 PolarHBondContact OD2-OD1 2.88Å; Y120-N148 HydrophobicContact CD2-CB 3.52Å; Y120-N148 HydrophobicContact CE2-CB 4.19Å; Y120-N148 WeakPolarHBondContact CE2-ND2 3.3Å; Y120-N148 HydrophobicContact CG-CB 3.83Å; I139-N148 HydrophobicContact CG2-CB 4.26Å; I139-N148 WeakPolarHBondContact O-CB 2.98Å; I139-N148 PolarHBondContact O-N 3.42Å; A146-N148 PolarHBondContact O-N 3.11Å
149	A	94.6	Very high	92.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	149.9	-176.3	0	0	0	0	0	110.6	D121 L124 V138 I139	D121-A149 HydrophobicContact CB-CB 4.17Å; L124-A149 HydrophobicContact CB-CB 4.06Å; L124-A149 HydrophobicContact CD1-CB 3.93Å; V138-A149 CarbonylContact C-O 3.58Å; V138-A149 WeakPolarHBondContact CA-O 3.41Å; V138-A149 WeakPolarHBondContact CG2-O 3.06Å; I139-A149 HydrophobicContact CB-CB 4.39Å; I139-A149 HydrophobicContact CD1-CB 4.47Å; I139-A149 PolarHBondContact N-O 3.28Å; I139-A149 PolarHBondContact O-N 3.37Å; I139-A149 VanDerWaalsContact O-N 3.16Å
150	Y	94.4	Very high	92.1	Very high	22 Å²	22	39.6 Å²	39.6	9%	0.086	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	158.1	178.5	64.5	-79.9	0	0	0	111.3	R99 R100 F111 A137 I147 T156	R99-Y150 WeakPolarHBondContact CA-OH 3.28Å; R99-Y150 HydrophobicContact CB-CE1 4.09Å; R99-Y150 HydrophobicContact CG-CE1 3.94Å; R100-Y150 PolarHBondContact N-OH 3Å; R100-Y150 PolarHBondContact O-OH 2.9Å; F111-Y150 HydrophobicContact CD1-CE1 4.16Å; F111-Y150 HydrophobicContact CE1-CD1 4.16Å; F111-Y150 AromaticContact CE1-CE1 3.63Å; F111-Y150 HydrophobicContact CE1-CE1 3.63Å; A137-Y150 CarbonylContact O-C 3.58Å; A137-Y150 WeakPolarHBondContact O-CA 3.13Å; I147-Y150 HydrophobicContact CG2-CD1 3.66Å; I147-Y150 HydrophobicContact CG2-CG 4.26Å; Y150-T156 HydrophobicContact CD1-CG2 4.19Å; Y150-T156 HydrophobicContact CD2-CG2 3.31Å; Y150-T156 HydrophobicContact CE1-CG2 4.2Å; Y150-T156 HydrophobicContact CE2-CG2 3.28Å; Y150-T156 HydrophobicContact CG-CG2 3.78Å
151	G	90.9	Very high	92	Very high	7 Å²	7	40.5 Å²	40.5	7%	0.072	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	143.4	168.6	0	0	0	0	0	110.9	K136 A137	K136-G151 CarbonylContact C-O 3.5Å; K136-G151 VanDerWaalsContact CA-O 3.31Å; K136-G151 WeakPolarHBondContact CA-O 3.49Å; A137-G151 PolarHBondContact N-O 3.03Å; A137-G151 PolarHBondContact O-N 3.26Å; A137-G151 VanDerWaalsContact O-O 3.07Å
152	P	89.7	Confident	92.1	Very high	57 Å²	57	38.6 Å²	38.6	37%	0.37	18%	0.181	S	C	.	.	S	Bend	cis	-69.2	-178.2	-7.3	6.5	6.1	0	0	0	112.4	K136 D154 F155	K136-P152 HydrophobicContact CD-CG 4.48Å; K136-P152 HydrophobicContact CG-CG 4.17Å; P152-D154 VanDerWaalsContact CB-OD1 3.26Å; P152-D154 WeakPolarHBondContact CB-OD1 3.31Å; P152-D154 WeakPolarHBondContact CG-OD1 3.5Å; P152-D154 PolarHBondContact O-N 3.4Å; P152-D154 VanDerWaalsContact O-N 3.08Å; P152-F155 PolarHBondContact O-N 3.33Å
153	E	84.9	Confident	92.1	Very high	124 Å²	124	37.6 Å²	37.6	58%	0.579	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-22.5	-173.9	-68.4	-173.6	168.9	0	0	114.8	F155 R212	E153-F155 VanDerWaalsContact C-N 3.34Å; E153-R212 IonicContact OE2-NH1 3.01Å; E153-R212 PolarHBondContact OE2-NH1 3.05Å
154	D	85.6	Confident	92.2	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.016	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-18	178.4	63.7	-35	0	0	0	112.9	K136 P152 T156 Y210 R212	K136-D154 IonicContact NZ-OD2 3.93Å; K136-D154 PolarHBondContact NZ-OD2 3.39Å; P152-D154 VanDerWaalsContact CB-OD1 3.26Å; P152-D154 WeakPolarHBondContact CB-OD1 3.31Å; P152-D154 WeakPolarHBondContact CG-OD1 3.5Å; P152-D154 PolarHBondContact O-N 3.4Å; P152-D154 VanDerWaalsContact O-N 3.08Å; D154-T156 VanDerWaalsContact C-N 3.3Å; D154-T156 PolarHBondContact O-N 2.81Å; D154-Y210 HydrophobicContact CB-CD1 4.29Å; D154-Y210 HydrophobicContact CB-CE1 4.16Å; D154-R212 HydrophobicContact CB-CB 4.43Å
155	F	92.3	Very high	92.3	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.			trans	-89.2	60.9	-175.7	-155.3	-119.2	0	0	0	112.5	K136 A137 V138 P152 E153 P157 I185 A186 I236 I238	K136-F155 HydrophobicContact CB-CB 4.24Å; K136-F155 HydrophobicContact CB-CD1 3.95Å; K136-F155 HydrophobicContact CB-CD2 4Å; K136-F155 HydrophobicContact CB-CE1 4.24Å; K136-F155 HydrophobicContact CB-CE2 4.34Å; K136-F155 HydrophobicContact CB-CG 3.81Å; K136-F155 HydrophobicContact CB-CZ 4.44Å; K136-F155 HydrophobicContact CD-CB 4.17Å; K136-F155 HydrophobicContact CD-CD2 3.62Å; K136-F155 HydrophobicContact CD-CE2 4.24Å; K136-F155 HydrophobicContact CD-CG 4.02Å; A137-F155 VanDerWaalsContact C-CD1 3.49Å; V138-F155 HydrophobicContact CB-CD1 3.8Å; V138-F155 HydrophobicContact CB-CE1 3.98Å; V138-F155 HydrophobicContact CG1-CD1 3.86Å; V138-F155 HydrophobicContact CG1-CE1 3.54Å; V138-F155 HydrophobicContact CG1-CZ 4.45Å; P152-F155 PolarHBondContact O-N 3.33Å; E153-F155 VanDerWaalsContact C-N 3.34Å; F155-P157 WeakPolarHBondContact O-CD 3.47Å; F155-I185 HydrophobicContact CE2-CG2 3.74Å; F155-I185 HydrophobicContact CZ-CG2 3.66Å; F155-A186 HydrophobicContact CD2-CB 4.09Å; F155-I236 HydrophobicContact CE1-CG2 4.35Å; F155-I236 HydrophobicContact CZ-CG2 4.09Å; F155-I238 HydrophobicContact CD2-CD1 4.37Å; F155-I238 HydrophobicContact CE2-CD1 3.44Å; F155-I238 VanDerWaalsContact CE2-CD1 3.44Å; F155-I238 HydrophobicContact CE2-CG1 4.19Å; F155-I238 HydrophobicContact CZ-CD1 3.76Å; F155-I238 HydrophobicContact CZ-CG1 3.99Å
156	T	92.4	Very high	92.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.14	C	C	.	.			trans	-116.1	75.9	-177.3	44.6	0	0	0	0	112.6	Y102 I105 F111 I147 Y150 D154	Y102-T156 PolarHBondContact N-OG1 2.68Å; I105-T156 WeakPolarHBondContact CD1-O 3.45Å; I105-T156 WeakPolarHBondContact CD1-OG1 3.39Å; F111-T156 HydrophobicContact CE1-CG2 4.13Å; F111-T156 HydrophobicContact CZ-CG2 4.21Å; I147-T156 HydrophobicContact CD1-CG2 4.28Å; Y150-T156 HydrophobicContact CD1-CG2 4.19Å; Y150-T156 HydrophobicContact CD2-CG2 3.31Å; Y150-T156 HydrophobicContact CE1-CG2 4.2Å; Y150-T156 HydrophobicContact CE2-CG2 3.28Å; Y150-T156 HydrophobicContact CG-CG2 3.78Å; D154-T156 VanDerWaalsContact C-N 3.3Å; D154-T156 PolarHBondContact O-N 2.81Å
157	P	93.9	Very high	92.2	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.006	17%	0.167	C	C	.	.			trans	-60.9	147.4	-174.6	27.9	-36.7	0	0	0	113.1	V138 F155 Q161 I162 I185	V138-P157 HydrophobicContact CG1-CG 3.97Å; V138-P157 HydrophobicContact CG2-CG 4.19Å; F155-P157 WeakPolarHBondContact O-CD 3.47Å; P157-Q161 VanDerWaalsContact CA-OE1 3.31Å; P157-Q161 HydrophobicContact CB-CB 4.45Å; P157-I162 HydrophobicContact CB-CD1 4.48Å; P157-I162 HydrophobicContact CB-CG1 4.12Å; P157-I162 HydrophobicContact CG-CD1 4.17Å; P157-I162 HydrophobicContact CG-CG1 4.11Å; P157-I185 HydrophobicContact CB-CG2 4.14Å
158	S	93.6	Very high	92	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.007	17%	0.169	C	C	.	.			trans	-78.3	161.1	173	73.2	0	0	0	0	111.9	Q106 T108 E160 Q161 I162	Q106-S158 WeakPolarHBondContact O-CB 3.01Å; Q106-S158 PolarHBondContact O-OG 2.92Å; T108-S158 WeakPolarHBondContact O-CA 3.44Å; T108-S158 WeakPolarHBondContact O-CB 3.43Å; S158-E160 PolarHBondContact O-N 2.69Å; S158-Q161 WeakPolarHBondContact O-CB 3.38Å; S158-Q161 PolarHBondContact O-N 3.2Å; S158-Q161 VanDerWaalsContact O-N 3.13Å; S158-Q161 WeakPolarHBondContact OG-CG 3.36Å; S158-Q161 PolarHBondContact OG-N 3.46Å; S158-I162 WeakPolarHBondContact O-CG1 3.41Å; S158-I162 PolarHBondContact O-N 2.96Å
159	I	93.2	Very high	91.8	Very high	32 Å²	32	33.7 Å²	33.7	16%	0.164	17%	0.17	C	C	.	.	H	α-helix	trans	-60.2	-36.1	177.8	-68.6	168.8	0	0	0	111.1	T108 I110 I162 N163	T108-I159 HydrophobicContact CG2-CD1 4.28Å; T108-I159 PolarHBondContact O-N 3.04Å; I110-I159 HydrophobicContact CB-CD1 3.99Å; I110-I159 HydrophobicContact CD1-CD1 3.31Å; I110-I159 HydrophobicContact CG1-CD1 3.47Å; I110-I159 VanDerWaalsContact CG1-CD1 3.47Å; I159-I162 PolarHBondContact O-N 2.86Å; I159-N163 WeakPolarHBondContact O-CB 3.11Å; I159-N163 PolarHBondContact O-N 2.9Å; I159-N163 PolarHBondContact O-ND2 2.86Å
160	E	92.8	Very high	91.4	Very high	126 Å²	126	38 Å²	38	59%	0.589	19%	0.189	S	C	*	.	H	α-helix	trans	-62.8	-43.6	176.5	-66.7	168	-164.7	0	0	111.3	S158 N163 K164	S158-E160 PolarHBondContact O-N 2.69Å; E160-N163 PolarHBondContact O-N 2.82Å; E160-K164 PolarHBondContact O-N 2.82Å
161	Q	94.1	Very high	90.7	Very high	19 Å²	19	37.2 Å²	37.2	9%	0.089	19%	0.188	C	C	.	.	H	α-helix	trans	-65	-43.8	176.1	-69.1	174.9	-25.2	0	0	111.5	P157 S158 K164 F165 Q184 I185 A186	P157-Q161 VanDerWaalsContact CA-OE1 3.31Å; P157-Q161 HydrophobicContact CB-CB 4.45Å; S158-Q161 WeakPolarHBondContact O-CB 3.38Å; S158-Q161 PolarHBondContact O-N 3.2Å; S158-Q161 VanDerWaalsContact O-N 3.13Å; S158-Q161 WeakPolarHBondContact OG-CG 3.36Å; S158-Q161 PolarHBondContact OG-N 3.46Å; Q161-K164 PolarHBondContact O-N 2.98Å; Q161-F165 WeakPolarHBondContact O-CB 3.5Å; Q161-F165 PolarHBondContact O-N 2.84Å; Q161-Q184 WeakPolarHBondContact CB-O 3.43Å; Q161-Q184 WeakPolarHBondContact CG-O 3.31Å; Q161-I185 HydrophobicContact CB-CD1 4.32Å; Q161-A186 PolarHBondContact NE2-O 2.83Å
162	I	94.4	Very high	89.8	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-61.8	-43.7	175.5	-67.2	165.3	0	0	0	110.6	C140 G145 P157 S158 I159 K164 F165 M166 L234	C140-I162 HydrophobicContact CB-CD1 4.2Å; C140-I162 VanDerWaalsContact SG-CD1 3.58Å; G145-I162 WeakPolarHBondContact O-CD1 3.18Å; P157-I162 HydrophobicContact CB-CD1 4.48Å; P157-I162 HydrophobicContact CB-CG1 4.12Å; P157-I162 HydrophobicContact CG-CD1 4.17Å; P157-I162 HydrophobicContact CG-CG1 4.11Å; S158-I162 WeakPolarHBondContact O-CG1 3.41Å; S158-I162 PolarHBondContact O-N 2.96Å; I159-I162 PolarHBondContact O-N 2.86Å; I162-K164 PolarHBondContact O-N 2.81Å; I162-F165 VanDerWaalsContact O-CB 3.31Å; I162-F165 WeakPolarHBondContact O-CB 3.34Å; I162-F165 PolarHBondContact O-N 2.93Å; I162-M166 HydrophobicContact CG2-CG 4.3Å; I162-M166 VanDerWaalsContact O-CG 3.25Å; I162-M166 WeakPolarHBondContact O-CG 3.25Å; I162-M166 PolarHBondContact O-N 3.23Å; I162-L234 HydrophobicContact CG2-CD2 3.78Å
163	N	92.5	Very high	89	Confident	84 Å²	84	45 Å²	45	45%	0.449	21%	0.21	S	C	.	.	H	α-helix	trans	-64	-42	178	-73.3	-21	0	0	0	111.7	I159 E160 F165 M166 I167	I159-N163 WeakPolarHBondContact O-CB 3.11Å; I159-N163 PolarHBondContact O-N 2.9Å; I159-N163 PolarHBondContact O-ND2 2.86Å; E160-N163 PolarHBondContact O-N 2.82Å; N163-F165 VanDerWaalsContact C-N 3.31Å; N163-F165 PolarHBondContact O-N 2.81Å; N163-M166 PolarHBondContact O-N 3.13Å; N163-I167 WeakPolarHBondContact O-CG1 3.46Å; N163-I167 PolarHBondContact O-N 3.22Å
164	K	92	Very high	88.5	Confident	76 Å²	76	41.4 Å²	41.4	33%	0.33	20%	0.202	S	C	.	.	H	α-helix	trans	-60.5	-43.7	173.7	-169.3	171.5	-171.6	-178.6	0	110.9	E160 Q161 I162 I167 L168 D180 H182 F183	E160-K164 PolarHBondContact O-N 2.82Å; Q161-K164 PolarHBondContact O-N 2.98Å; I162-K164 PolarHBondContact O-N 2.81Å; K164-I167 PolarHBondContact O-N 3.06Å; K164-L168 WeakPolarHBondContact O-CG 3.39Å; K164-L168 PolarHBondContact O-N 3.03Å; K164-D180 IonicContact NZ-OD2 3.52Å; K164-D180 PolarHBondContact NZ-OD2 2.94Å; K164-H182 WeakPolarHBondContact CE-O 3.39Å; K164-H182 PolarHBondContact NZ-O 3.39Å; K164-F183 HydrophobicContact CD-CB 3.85Å; K164-F183 HydrophobicContact CG-CB 4.32Å
165	F	93.1	Very high	87.8	Confident	1 Å²	1	48.9 Å²	48.9	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-58.1	-47.9	174.9	-174.1	-85.8	0	0	0	112.3	Q161 I162 N163 I167 L168 S169 F183 I185 L202 L225 L234 I236	Q161-F165 WeakPolarHBondContact O-CB 3.5Å; Q161-F165 PolarHBondContact O-N 2.84Å; I162-F165 VanDerWaalsContact O-CB 3.31Å; I162-F165 WeakPolarHBondContact O-CB 3.34Å; I162-F165 PolarHBondContact O-N 2.93Å; N163-F165 VanDerWaalsContact C-N 3.31Å; N163-F165 PolarHBondContact O-N 2.81Å; F165-I167 VanDerWaalsContact C-N 3.31Å; F165-I167 PolarHBondContact O-N 3.33Å; F165-L168 PolarHBondContact O-N 3.22Å; F165-S169 PolarHBondContact O-N 2.81Å; F165-F183 AromaticContact CD2-CE2 3.85Å; F165-F183 HydrophobicContact CD2-CE2 3.85Å; F165-F183 HydrophobicContact CD2-CZ 4.39Å; F165-F183 HydrophobicContact CE2-CE2 4.37Å; F165-I185 HydrophobicContact CB-CD1 4.07Å; F165-I185 HydrophobicContact CD2-CD1 4.04Å; F165-I185 HydrophobicContact CD2-CG1 4.5Å; F165-I185 HydrophobicContact CG-CD1 4.39Å; F165-L202 HydrophobicContact CE2-CD1 4.15Å; F165-L202 HydrophobicContact CE2-CD2 3.71Å; F165-L202 HydrophobicContact CE2-CG 4.36Å; F165-L202 HydrophobicContact CZ-CB 3.95Å; F165-L202 HydrophobicContact CZ-CD1 4.06Å; F165-L202 HydrophobicContact CZ-CD2 3.99Å; F165-L202 HydrophobicContact CZ-CG 4.23Å; F165-L225 HydrophobicContact CE2-CD2 3.63Å; F165-L225 HydrophobicContact CZ-CD2 4.42Å; F165-L234 HydrophobicContact CD1-CD1 3.85Å; F165-L234 HydrophobicContact CD1-CD2 4.07Å; F165-L234 HydrophobicContact CE1-CD1 3.55Å; F165-I236 HydrophobicContact CD1-CD1 4.09Å; F165-I236 HydrophobicContact CD1-CG1 4.37Å; F165-I236 HydrophobicContact CD2-CD1 4.17Å; F165-I236 HydrophobicContact CE1-CD1 4.37Å; F165-I236 HydrophobicContact CE1-CG1 4.15Å; F165-I236 HydrophobicContact CE2-CD1 4.42Å; F165-I236 HydrophobicContact CE2-CG1 4.32Å; F165-I236 HydrophobicContact CG-CD1 4.02Å; F165-I236 HydrophobicContact CZ-CG1 4.15Å
166	M	91.8	Very high	87	Confident	22 Å²	22	57.8 Å²	57.8	11%	0.108	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-41.2	178.6	-71.5	-63.4	-63.9	0	0	111.9	R142 I162 N163 S169 Q170 L229 L234	R142-M166 HydrophobicContact CG-CE 3.84Å; I162-M166 HydrophobicContact CG2-CG 4.3Å; I162-M166 VanDerWaalsContact O-CG 3.25Å; I162-M166 WeakPolarHBondContact O-CG 3.25Å; I162-M166 PolarHBondContact O-N 3.23Å; N163-M166 PolarHBondContact O-N 3.13Å; M166-S169 WeakPolarHBondContact CA-OG 3.44Å; M166-S169 PolarHBondContact O-N 2.8Å; M166-S169 PolarHBondContact O-OG 3.42Å; M166-Q170 WeakPolarHBondContact O-CG 3.33Å; M166-Q170 PolarHBondContact O-N 3.46Å; M166-L229 HydrophobicContact CE-CD1 4.45Å; M166-L229 HydrophobicContact CE-CD2 3.71Å; M166-L229 HydrophobicContact SD-CD2 3.39Å; M166-L229 WeakPolarHBondContact SD-CD2 3.11Å; M166-L234 HydrophobicContact CG-CD2 4.46Å; M166-L234 HydrophobicContact SD-CD1 4.39Å; M166-L234 HydrophobicContact SD-CD2 3.92Å
167	I	90.7	Very high	86.3	Confident	117 Å²	117	62.1 Å²	62.1	60%	0.6	31%	0.312	S	S	*	.	H	α-helix	trans	-62.4	-46.3	175.8	-68	164.2	0	0	0	110.6	N163 K164 F165 S169 Q170 A171	N163-I167 WeakPolarHBondContact O-CG1 3.46Å; N163-I167 PolarHBondContact O-N 3.22Å; K164-I167 PolarHBondContact O-N 3.06Å; F165-I167 VanDerWaalsContact C-N 3.31Å; F165-I167 PolarHBondContact O-N 3.33Å; I167-S169 VanDerWaalsContact C-N 3.35Å; I167-S169 PolarHBondContact O-N 2.93Å; I167-Q170 PolarHBondContact O-N 3.17Å; I167-Q170 VanDerWaalsContact O-N 3.17Å; I167-A171 PolarHBondContact O-N 3.39Å
168	L	91.4	Very high	85.7	Confident	9 Å²	9	64.5 Å²	64.5	5%	0.047	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-41.9	178.7	-68.9	171.3	0	0	0	111.8	K164 F165 Q170 A171 I178 F183 Y192 L202	K164-L168 WeakPolarHBondContact O-CG 3.39Å; K164-L168 PolarHBondContact O-N 3.03Å; F165-L168 PolarHBondContact O-N 3.22Å; L168-Q170 PolarHBondContact O-N 3.16Å; L168-Q170 VanDerWaalsContact O-N 3.12Å; L168-A171 WeakPolarHBondContact O-CB 3.47Å; L168-A171 PolarHBondContact O-N 3.39Å; L168-A171 VanDerWaalsContact O-N 3.13Å; L168-I178 HydrophobicContact CD2-CD1 4.39Å; L168-I178 HydrophobicContact CD2-CG2 3.77Å; L168-F183 HydrophobicContact CD1-CB 4.09Å; L168-F183 HydrophobicContact CD1-CD1 3.53Å; L168-F183 HydrophobicContact CD1-CD2 4.42Å; L168-F183 HydrophobicContact CD1-CE1 4.01Å; L168-F183 HydrophobicContact CD1-CG 3.77Å; L168-Y192 HydrophobicContact CB-CD2 4.06Å; L168-Y192 HydrophobicContact CB-CE2 4.32Å; L168-Y192 HydrophobicContact CD2-CD2 4.34Å; L168-L202 HydrophobicContact CB-CD1 3.74Å
169	S	88.9	Confident	85	Confident	3 Å²	3	72.6 Å²	72.6	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-64.4	-16.3	178	71.5	0	0	0	0	114.5	F165 M166 I167 R173	F165-S169 PolarHBondContact O-N 2.81Å; M166-S169 WeakPolarHBondContact CA-OG 3.44Å; M166-S169 PolarHBondContact O-N 2.8Å; M166-S169 PolarHBondContact O-OG 3.42Å; I167-S169 VanDerWaalsContact C-N 3.35Å; I167-S169 PolarHBondContact O-N 2.93Å; S169-R173 PolarHBondContact O-NH1 3.1Å
170	Q	86.1	Confident	84.7	Confident	89 Å²	89	74.6 Å²	74.6	42%	0.416	38%	0.376	S	S	.	.	H	α-helix	trans	-108.2	-7	179	-65.9	174.9	20.1	0	0	112.8	M166 I167 L168 E172 R173 A174	M166-Q170 WeakPolarHBondContact O-CG 3.33Å; M166-Q170 PolarHBondContact O-N 3.46Å; I167-Q170 PolarHBondContact O-N 3.17Å; I167-Q170 VanDerWaalsContact O-N 3.17Å; L168-Q170 PolarHBondContact O-N 3.16Å; L168-Q170 VanDerWaalsContact O-N 3.12Å; Q170-E172 PolarHBondContact O-N 3.13Å; Q170-R173 PolarHBondContact O-N 3.12Å; Q170-A174 WeakPolarHBondContact O-CB 3.4Å; Q170-A174 PolarHBondContact O-N 3.06Å
171	A	80.6	Confident	84.6	Confident	7 Å²	7	75.1 Å²	75.1	6%	0.058	37%	0.373	C	S	.	.	H	α-helix	trans	-64.2	-41	-170.4	0	0	0	0	0	112.4	I167 L168 A174 D175 R176 I178	I167-A171 PolarHBondContact O-N 3.39Å; L168-A171 WeakPolarHBondContact O-CB 3.47Å; L168-A171 PolarHBondContact O-N 3.39Å; L168-A171 VanDerWaalsContact O-N 3.13Å; A171-A174 PolarHBondContact O-N 3.42Å; A171-D175 PolarHBondContact O-N 2.82Å; A171-R176 PolarHBondContact O-N 3.3Å; A171-R176 VanDerWaalsContact O-N 3.12Å; A171-I178 HydrophobicContact CB-CD1 3.71Å; A171-I178 HydrophobicContact CB-CG1 3.6Å
172	E	71.2	Confident	84.6	Confident	69 Å²	69	79.2 Å²	79.2	32%	0.322	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-66.4	-43.9	178.2	-176	157.6	-145.2	0	0	112.1	Q170 A174 D175 V195	Q170-E172 PolarHBondContact O-N 3.13Å; E172-A174 PolarHBondContact O-N 2.9Å; E172-D175 PolarHBondContact O-N 2.85Å; E172-D175 VanDerWaalsContact O-N 3.16Å; E172-V195 WeakPolarHBondContact OE2-CB 3.43Å
173	R	72.5	Confident	84.6	Confident	157 Å²	157	79.3 Å²	79.3	59%	0.592	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-62.8	-17.6	174.5	-64.1	-174.5	179.5	89.9	2.1	113.8	S169 Q170 G200	S169-R173 PolarHBondContact O-NH1 3.1Å; Q170-R173 PolarHBondContact O-N 3.12Å; R173-G200 VanDerWaalsContact NH2-CA 3.33Å
174	A	74.7	Confident	84.6	Confident	49 Å²	49	80.3 Å²	80.3	41%	0.405	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-104.9	6.2	-177.1	0	0	0	0	0	113.2	Q170 A171 E172 R176	Q170-A174 WeakPolarHBondContact O-CB 3.4Å; Q170-A174 PolarHBondContact O-N 3.06Å; A171-A174 PolarHBondContact O-N 3.42Å; E172-A174 PolarHBondContact O-N 2.9Å; A174-R176 HydrophobicContact CB-CG 3.79Å; A174-R176 WeakPolarHBondContact O-CG 3.38Å; A174-R176 PolarHBondContact O-N 3.21Å; A174-R176 VanDerWaalsContact O-N 3.1Å
175	D	72.4	Confident	84.7	Confident	161 Å²	161	76.7 Å²	76.7	86%	0.861	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	32.8	-173.7	-69.7	-33.1	0	0	0	113	A171 E172	A171-D175 PolarHBondContact O-N 2.82Å; E172-D175 PolarHBondContact O-N 2.85Å; E172-D175 VanDerWaalsContact O-N 3.16Å
176	R	75.1	Confident	84.6	Confident	186 Å²	186	76.8 Å²	76.8	70%	0.702	38%	0.38	S	S	*	.			trans	-91.4	125.2	-177.7	-67.1	-177.2	-173.6	-137	1.4	109.6	A171 A174 I178	A171-R176 PolarHBondContact O-N 3.3Å; A171-R176 VanDerWaalsContact O-N 3.12Å; A174-R176 HydrophobicContact CB-CG 3.79Å; A174-R176 WeakPolarHBondContact O-CG 3.38Å; A174-R176 PolarHBondContact O-N 3.21Å; A174-R176 VanDerWaalsContact O-N 3.1Å; R176-I178 PolarHBondContact O-N 3.47Å; R176-I178 VanDerWaalsContact O-N 3.1Å
177	A	76.3	Confident	84.5	Confident	92 Å²	92	77.6 Å²	77.6	76%	0.76	38%	0.384	S	S	*	.			trans	-61.1	115.5	168.5	0	0	0	0	0	109.8	I179	A177-I179 PolarHBondContact O-N 3.48Å; A177-I179 VanDerWaalsContact O-N 3.11Å
178	I	82	Confident	84.6	Confident	51 Å²	51	72 Å²	72	26%	0.262	36%	0.355	S	S	.	.			trans	-75.2	100.6	174.2	-57.7	172.1	0	0	0	107.8	L168 A171 R176 D180 R181 Y192	L168-I178 HydrophobicContact CD2-CD1 4.39Å; L168-I178 HydrophobicContact CD2-CG2 3.77Å; A171-I178 HydrophobicContact CB-CD1 3.71Å; A171-I178 HydrophobicContact CB-CG1 3.6Å; R176-I178 PolarHBondContact O-N 3.47Å; R176-I178 VanDerWaalsContact O-N 3.1Å; I178-D180 WeakPolarHBondContact CG2-O 3.36Å; I178-R181 HydrophobicContact CG2-CG 3.78Å; I178-Y192 HydrophobicContact CD1-CD1 3.76Å; I178-Y192 HydrophobicContact CD1-CD2 4.47Å; I178-Y192 HydrophobicContact CD1-CE1 3.34Å; I178-Y192 HydrophobicContact CD1-CE2 4.08Å; I178-Y192 HydrophobicContact CD1-CG 4.31Å
179	I	79.7	Confident	84.6	Confident	171 Å²	171	72.8 Å²	72.8	88%	0.877	36%	0.361	S	S	*	.	S	Bend	trans	-71.4	-44.9	179.4	-57.4	172.7	0	0	0	110.4	A177	A177-I179 PolarHBondContact O-N 3.48Å; A177-I179 VanDerWaalsContact O-N 3.11Å
180	D	85.7	Confident	84.9	Confident	73 Å²	73	72.7 Å²	72.7	39%	0.39	36%	0.361	S	S	.	.			trans	-114.1	106.8	-179.7	179.9	25.5	0	0	0	110.6	K164 I178 H182	K164-D180 IonicContact NZ-OD2 3.52Å; K164-D180 PolarHBondContact NZ-OD2 2.94Å; I178-D180 WeakPolarHBondContact CG2-O 3.36Å; D180-H182 WeakPolarHBondContact OD1-CB 3.13Å; D180-H182 IonicContact OD1-CG 2.86Å; D180-H182 PolarHBondContact OD1-N 2.97Å; D180-H182 IonicContact OD1-ND1 2.92Å
181	R	91.6	Very high	85.4	Confident	138 Å²	138	70.3 Å²	70.3	52%	0.521	35%	0.35	S	S	.	.			trans	-84.2	-10.7	176.2	-68.5	-171.9	-68.5	-179.7	-0.7	112.9	I178 L191 Y192	I178-R181 HydrophobicContact CG2-CG 3.78Å; R181-L191 HydrophobicContact CB-CD1 3.73Å; R181-Y192 HydrophobicContact CG-CD1 4.31Å; R181-Y192 WeakPolarHBondContact O-CB 3.24Å; R181-Y192 PolarHBondContact O-N 2.99Å
182	H	93.5	Very high	86	Confident	105 Å²	105	70.6 Å²	70.6	49%	0.486	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.6	-179	-57.7	88.9	0	0	0	109.9	K164 D180 C190	K164-H182 WeakPolarHBondContact CE-O 3.39Å; K164-H182 PolarHBondContact NZ-O 3.39Å; D180-H182 WeakPolarHBondContact OD1-CB 3.13Å; D180-H182 IonicContact OD1-CG 2.86Å; D180-H182 PolarHBondContact OD1-N 2.97Å; D180-H182 IonicContact OD1-ND1 2.92Å; H182-C190 WeakPolarHBondContact CA-O 3.35Å
183	F	94.1	Very high	87	Confident	6 Å²	6	72.2 Å²	72.2	3%	0.026	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	163.6	173	67.2	-77.8	0	0	0	110	K164 F165 L168 I185 C190 L202 A204 L225	K164-F183 HydrophobicContact CD-CB 3.85Å; K164-F183 HydrophobicContact CG-CB 4.32Å; F165-F183 AromaticContact CD2-CE2 3.85Å; F165-F183 HydrophobicContact CD2-CE2 3.85Å; F165-F183 HydrophobicContact CD2-CZ 4.39Å; F165-F183 HydrophobicContact CE2-CE2 4.37Å; L168-F183 HydrophobicContact CD1-CB 4.09Å; L168-F183 HydrophobicContact CD1-CD1 3.53Å; L168-F183 HydrophobicContact CD1-CD2 4.42Å; L168-F183 HydrophobicContact CD1-CE1 4.01Å; L168-F183 HydrophobicContact CD1-CG 3.77Å; F183-I185 HydrophobicContact CD2-CD1 4.02Å; F183-I185 HydrophobicContact CD2-CG1 3.71Å; F183-I185 HydrophobicContact CE2-CD1 4.03Å; F183-I185 HydrophobicContact CE2-CG1 3.48Å; F183-I185 VanDerWaalsContact CE2-CG1 3.48Å; F183-C190 HydrophobicContact CD1-CB 3.95Å; F183-C190 HydrophobicContact CD2-CB 4.05Å; F183-C190 HydrophobicContact CE1-CB 3.57Å; F183-C190 HydrophobicContact CE2-CB 3.68Å; F183-C190 HydrophobicContact CG-CB 4.17Å; F183-C190 HydrophobicContact CZ-CB 3.43Å; F183-C190 VanDerWaalsContact CZ-CB 3.43Å; F183-C190 PolarHBondContact N-O 3.37Å; F183-C190 WeakPolarHBondContact O-CA 3.28Å; F183-C190 PolarHBondContact O-N 3.32Å; F183-C190 VanDerWaalsContact O-O 3.1Å; F183-L202 HydrophobicContact CZ-CD2 4.4Å; F183-A204 HydrophobicContact CE1-CB 3.68Å; F183-A204 HydrophobicContact CZ-CB 3.56Å; F183-L225 HydrophobicContact CZ-CD2 4.4Å
184	Q	93.2	Very high	87.9	Confident	104 Å²	104	68.7 Å²	68.7	49%	0.486	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	140.2	176.5	-69.5	179.2	-6.4	0	0	108.7	Q161 D188	Q161-Q184 WeakPolarHBondContact CB-O 3.43Å; Q161-Q184 WeakPolarHBondContact CG-O 3.31Å; Q184-D188 WeakPolarHBondContact CA-O 3.21Å
185	I	93.7	Very high	88.7	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	118.5	171.1	-66.3	-63.9	0	0	0	107.1	F155 P157 Q161 F165 F183 M187 D188 L225 I236	F155-I185 HydrophobicContact CE2-CG2 3.74Å; F155-I185 HydrophobicContact CZ-CG2 3.66Å; P157-I185 HydrophobicContact CB-CG2 4.14Å; Q161-I185 HydrophobicContact CB-CD1 4.32Å; F165-I185 HydrophobicContact CB-CD1 4.07Å; F165-I185 HydrophobicContact CD2-CD1 4.04Å; F165-I185 HydrophobicContact CD2-CG1 4.5Å; F165-I185 HydrophobicContact CG-CD1 4.39Å; F183-I185 HydrophobicContact CD2-CD1 4.02Å; F183-I185 HydrophobicContact CD2-CG1 3.71Å; F183-I185 HydrophobicContact CE2-CD1 4.03Å; F183-I185 HydrophobicContact CE2-CG1 3.48Å; F183-I185 VanDerWaalsContact CE2-CG1 3.48Å; I185-M187 PolarHBondContact O-N 3.32Å; I185-D188 PolarHBondContact N-O 3.32Å; I185-D188 PolarHBondContact O-N 3.02Å; I185-L225 HydrophobicContact CB-CD1 4.2Å; I185-L225 HydrophobicContact CG1-CD1 4.01Å; I185-L225 HydrophobicContact CG2-CD1 4.41Å; I185-I236 HydrophobicContact CD1-CD1 4.38Å; I185-I236 HydrophobicContact CG2-CG2 4.35Å
186	A	91.4	Very high	89.5	Confident	4 Å²	4	61.7 Å²	61.7	3%	0.033	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	53	-105.3	-168	0	0	0	0	0	110.6	I105 F155 Q161	I105-A186 HydrophobicContact CD1-CB 3.9Å; F155-A186 HydrophobicContact CD2-CB 4.09Å; Q161-A186 PolarHBondContact NE2-O 2.83Å
187	M	90.1	Very high	89.9	Confident	39 Å²	39	59.1 Å²	59.1	19%	0.192	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-7.7	178.5	-67.3	-161.7	67.8	0	0	113.9	Y102 E104 I105 I185 Y210	Y102-M187 HydrophobicContact CD1-SD 3.48Å; Y102-M187 WeakPolarHBondContact CD1-SD 3.33Å; Y102-M187 HydrophobicContact CE1-SD 3.38Å; Y102-M187 WeakPolarHBondContact CE1-SD 3.35Å; E104-M187 HydrophobicContact CB-CE 3.84Å; E104-M187 HydrophobicContact CB-SD 3.97Å; E104-M187 WeakPolarHBondContact OE2-CE 3.41Å; I105-M187 HydrophobicContact CG1-CG 3.95Å; I185-M187 PolarHBondContact O-N 3.32Å; M187-Y210 HydrophobicContact CB-CD1 3.81Å; M187-Y210 HydrophobicContact CB-CD2 4.34Å; M187-Y210 HydrophobicContact CB-CE1 4.48Å; M187-Y210 HydrophobicContact CB-CG 3.71Å; M187-Y210 HydrophobicContact CE-CD1 4.11Å; M187-Y210 HydrophobicContact CE-CD2 3.53Å; M187-Y210 HydrophobicContact CE-CE1 3.86Å; M187-Y210 HydrophobicContact CE-CE2 3.21Å; M187-Y210 HydrophobicContact CE-CG 3.95Å; M187-Y210 HydrophobicContact CG-CD1 4.25Å; M187-Y210 HydrophobicContact CG-CE1 4.46Å; M187-Y210 HydrophobicContact CG-CG 4.48Å; M187-Y210 HydrophobicContact SD-CD1 3.58Å; M187-Y210 VanDerWaalsContact SD-CD1 3.58Å; M187-Y210 HydrophobicContact SD-CD2 4.15Å; M187-Y210 HydrophobicContact SD-CE1 3.25Å; M187-Y210 WeakPolarHBondContact SD-CE1 3.27Å; M187-Y210 HydrophobicContact SD-CE2 3.85Å; M187-Y210 HydrophobicContact SD-CG 4.01Å
188	D	92.1	Very high	90.4	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	129.2	-175.3	-60.2	-52.7	0	0	0	109.8	K136 Q184 I185 I206 Q208 Y210 I238	K136-D188 IonicContact NZ-OD1 2.72Å; K136-D188 PolarHBondContact NZ-OD1 3.08Å; K136-D188 VanDerWaalsContact NZ-OD1 3.15Å; K136-D188 IonicContact NZ-OD2 2.86Å; K136-D188 PolarHBondContact NZ-OD2 2.95Å; Q184-D188 WeakPolarHBondContact CA-O 3.21Å; I185-D188 PolarHBondContact N-O 3.32Å; I185-D188 PolarHBondContact O-N 3.02Å; D188-I206 HydrophobicContact CB-CD1 4.36Å; D188-Q208 WeakPolarHBondContact CA-O 3.33Å; D188-Y210 WeakPolarHBondContact OD1-CB 3.34Å; D188-Y210 PolarHBondContact OD1-N 3.43Å; D188-I238 HydrophobicContact CB-CD1 4.18Å; D188-I238 WeakPolarHBondContact OD2-CD1 3.43Å
189	S	92.8	Very high	90.6	Very high	25 Å²	25	62.7 Å²	62.7	18%	0.175	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	126.6	175.4	-65.5	0	0	0	0	109.9	L207 Q208	S189-L207 PolarHBondContact O-N 2.98Å; S189-Q208 PolarHBondContact N-O 3.31Å; S189-Q208 VanDerWaalsContact N-O 3.12Å; S189-Q208 PolarHBondContact O-N 3.27Å
190	C	95	Very high	91	Very high	1 Å²	1	55 Å²	55	1%	0.007	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	147.7	-169.6	-52.1	0	0	0	0	110.9	H182 F183 A204 D205 I206	H182-C190 WeakPolarHBondContact CA-O 3.35Å; F183-C190 HydrophobicContact CD1-CB 3.95Å; F183-C190 HydrophobicContact CD2-CB 4.05Å; F183-C190 HydrophobicContact CE1-CB 3.57Å; F183-C190 HydrophobicContact CE2-CB 3.68Å; F183-C190 HydrophobicContact CG-CB 4.17Å; F183-C190 HydrophobicContact CZ-CB 3.43Å; F183-C190 VanDerWaalsContact CZ-CB 3.43Å; F183-C190 PolarHBondContact N-O 3.37Å; F183-C190 WeakPolarHBondContact O-CA 3.28Å; F183-C190 PolarHBondContact O-N 3.32Å; F183-C190 VanDerWaalsContact O-O 3.1Å; C190-A204 HydrophobicContact CB-CB 4.39Å; C190-D205 CarbonylContact C-O 3.54Å; C190-D205 WeakPolarHBondContact CA-O 3.18Å; C190-I206 HydrophobicContact CB-CD1 4.44Å; C190-I206 WeakPolarHBondContact SG-CD1 3.25Å
191	L	95	Very high	91.3	Very high	39 Å²	39	51.9 Å²	51.9	20%	0.204	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115.6	170.9	-177.7	67.9	0	0	0	109	R181 K193 A204 D205 L207	R181-L191 HydrophobicContact CB-CD1 3.73Å; L191-K193 PolarHBondContact O-N 3.37Å; L191-A204 CarbonylContact O-C 3.44Å; L191-A204 WeakPolarHBondContact O-CA 3.27Å; L191-A204 VanDerWaalsContact O-CB 3.29Å; L191-A204 WeakPolarHBondContact O-CB 3.39Å; L191-D205 PolarHBondContact N-O 3.24Å; L191-D205 PolarHBondContact O-N 2.68Å; L191-L207 HydrophobicContact CB-CD1 4Å; L191-L207 HydrophobicContact CB-CD2 4.09Å; L191-L207 HydrophobicContact CB-CG 3.96Å; L191-L207 HydrophobicContact CD2-CD2 4.43Å
192	Y	94.3	Very high	91.4	Very high	13 Å²	13	45.3 Å²	45.3	5%	0.051	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	128.9	173.7	176	-85.5	0	0	0	110.2	L168 I178 R181 V195 L202	L168-Y192 HydrophobicContact CB-CD2 4.06Å; L168-Y192 HydrophobicContact CB-CE2 4.32Å; L168-Y192 HydrophobicContact CD2-CD2 4.34Å; I178-Y192 HydrophobicContact CD1-CD1 3.76Å; I178-Y192 HydrophobicContact CD1-CD2 4.47Å; I178-Y192 HydrophobicContact CD1-CE1 3.34Å; I178-Y192 HydrophobicContact CD1-CE2 4.08Å; I178-Y192 HydrophobicContact CD1-CG 4.31Å; R181-Y192 HydrophobicContact CG-CD1 4.31Å; R181-Y192 WeakPolarHBondContact O-CB 3.24Å; R181-Y192 PolarHBondContact O-N 2.99Å; Y192-V195 HydrophobicContact CE2-CG2 3.99Å; Y192-V195 WeakPolarHBondContact OH-CG2 3.37Å; Y192-V195 PolarHBondContact OH-N 3.22Å; Y192-L202 HydrophobicContact CD2-CD1 3.87Å; Y192-L202 HydrophobicContact CD2-CD2 4.27Å; Y192-L202 HydrophobicContact CD2-CG 4.03Å; Y192-L202 HydrophobicContact CE2-CD1 3.77Å; Y192-L202 HydrophobicContact CE2-CG 3.89Å
193	K	92.5	Very high	91.5	Very high	103 Å²	103	41.4 Å²	41.4	45%	0.448	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-63.3	179.6	-179.8	176.7	175.9	177.1	0	110	L191 L203 D205 E224	L191-K193 PolarHBondContact O-N 3.37Å; K193-L203 WeakPolarHBondContact CB-O 3.22Å; K193-L203 PolarHBondContact N-O 2.97Å; K193-D205 IonicContact NZ-OD1 3.79Å; K193-E224 IonicContact NZ-OE2 2.95Å; K193-E224 PolarHBondContact NZ-OE2 3.35Å
194	D	90.9	Very high	91.6	Very high	82 Å²	82	41.1 Å²	41.1	44%	0.439	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	170.1	-175.1	-147	0.9	0	0	0	112.2	L203	D194-L203 PolarHBondContact N-O 3.4Å; D194-L203 PolarHBondContact O-N 3.09Å
195	V	91	Very high	91.7	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.024	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128	160.3	174	0	0	0	0	107.5	E172 Y192 D197 I201 L202	E172-V195 WeakPolarHBondContact OE2-CB 3.43Å; Y192-V195 HydrophobicContact CE2-CG2 3.99Å; Y192-V195 WeakPolarHBondContact OH-CG2 3.37Å; Y192-V195 PolarHBondContact OH-N 3.22Å; V195-D197 PolarHBondContact O-N 3.46Å; V195-I201 CarbonylContact C-O 3.52Å; V195-I201 VanDerWaalsContact CA-O 3.28Å; V195-I201 WeakPolarHBondContact CA-O 3.4Å; V195-L202 HydrophobicContact CG2-CB 3.96Å; V195-L202 HydrophobicContact CG2-CD1 4.34Å; V195-L202 HydrophobicContact CG2-CG 4.08Å
196	D	89.5	Confident	91.7	Very high	59 Å²	59	39.9 Å²	39.9	32%	0.316	21%	0.207	S	C	.	.			trans	-68.2	119.5	176.3	177.1	0.8	0	0	0	109.4	E198 T199 G200 I201	D196-E198 VanDerWaalsContact C-N 3.29Å; D196-E198 PolarHBondContact O-N 3.05Å; D196-E198 PolarHBondContact OD1-N 3.34Å; D196-T199 WeakPolarHBondContact CB-OG1 3.34Å; D196-T199 WeakPolarHBondContact OD2-CG2 3.45Å; D196-T199 PolarHBondContact OD2-OG1 3.15Å; D196-G200 WeakPolarHBondContact O-CA 3.31Å; D196-G200 PolarHBondContact O-N 2.64Å; D196-I201 HydrophobicContact CB-CB 4.5Å; D196-I201 PolarHBondContact N-O 3.29Å
197	D	84.5	Confident	91.7	Very high	133 Å²	133	44.5 Å²	44.5	71%	0.711	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-37.1	-179	-78.3	-36.3	0	0	0	113	V195	V195-D197 PolarHBondContact O-N 3.46Å
198	E	85.1	Confident	91.6	Very high	183 Å²	183	48.4 Å²	48.4	86%	0.855	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-44.4	-174.9	-65	-171.5	170.4	0	0	111.1	D196	D196-E198 VanDerWaalsContact C-N 3.29Å; D196-E198 PolarHBondContact O-N 3.05Å; D196-E198 PolarHBondContact OD1-N 3.34Å
199	T	86.7	Confident	91.4	Very high	34 Å²	34	51 Å²	51	21%	0.209	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-16.5	-175	65.1	0	0	0	0	112.9	D196 I201 I253 R256	D196-T199 WeakPolarHBondContact CB-OG1 3.34Å; D196-T199 WeakPolarHBondContact OD2-CG2 3.45Å; D196-T199 PolarHBondContact OD2-OG1 3.15Å; T199-I201 HydrophobicContact CG2-CD1 4.33Å; T199-I201 PolarHBondContact O-N 3.05Å; T199-I201 WeakPolarHBondContact OG1-CB 3.43Å; T199-I201 WeakPolarHBondContact OG1-CD1 3.37Å; T199-I201 WeakPolarHBondContact OG1-CG1 3.42Å; T199-I253 HydrophobicContact CG2-CD1 3.96Å; T199-R256 PolarHBondContact O-NH1 2.84Å
200	G	88.4	Confident	90.9	Very high	11 Å²	11	52 Å²	52	11%	0.113	26%	0.258	C	S	.	.			trans	68.3	18.3	-174.1	0	0	0	0	0	114.3	R173 D196	R173-G200 VanDerWaalsContact NH2-CA 3.33Å; D196-G200 WeakPolarHBondContact O-CA 3.31Å; D196-G200 PolarHBondContact O-N 2.64Å
201	I	92.4	Very high	89.9	Confident	6 Å²	6	54.9 Å²	54.9	3%	0.031	28%	0.277	C	S	.	.			trans	-84.1	129	-176.8	-65.8	172.3	0	0	0	110.1	V195 D196 T199 L203 C226 L228 I253	V195-I201 CarbonylContact C-O 3.52Å; V195-I201 VanDerWaalsContact CA-O 3.28Å; V195-I201 WeakPolarHBondContact CA-O 3.4Å; D196-I201 HydrophobicContact CB-CB 4.5Å; D196-I201 PolarHBondContact N-O 3.29Å; T199-I201 HydrophobicContact CG2-CD1 4.33Å; T199-I201 PolarHBondContact O-N 3.05Å; T199-I201 WeakPolarHBondContact OG1-CB 3.43Å; T199-I201 WeakPolarHBondContact OG1-CD1 3.37Å; T199-I201 WeakPolarHBondContact OG1-CG1 3.42Å; I201-L203 HydrophobicContact CG2-CD2 3.99Å; I201-L203 HydrophobicContact CG2-CG 4.43Å; I201-C226 HydrophobicContact CG2-CB 4.47Å; I201-C226 WeakPolarHBondContact CG2-SG 3.34Å; I201-L228 HydrophobicContact CD1-CD2 3.79Å; I201-L228 HydrophobicContact CD1-CG 4.43Å; I201-L228 HydrophobicContact CG1-CD2 3.72Å; I201-L228 HydrophobicContact CG1-CG 3.98Å; I201-L228 HydrophobicContact CG2-CG 4.48Å; I201-I253 HydrophobicContact CD1-CD1 3.7Å; I201-I253 HydrophobicContact CD1-CG1 3.39Å
202	L	94.4	Very high	88.6	Confident	1 Å²	1	59 Å²	59	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	129.1	169.7	-173.9	155	0	0	0	110.3	F165 L168 F183 Y192 V195 A204 L225 C226 G227	F165-L202 HydrophobicContact CE2-CD1 4.15Å; F165-L202 HydrophobicContact CE2-CD2 3.71Å; F165-L202 HydrophobicContact CE2-CG 4.36Å; F165-L202 HydrophobicContact CZ-CB 3.95Å; F165-L202 HydrophobicContact CZ-CD1 4.06Å; F165-L202 HydrophobicContact CZ-CD2 3.99Å; F165-L202 HydrophobicContact CZ-CG 4.23Å; L168-L202 HydrophobicContact CB-CD1 3.74Å; F183-L202 HydrophobicContact CZ-CD2 4.4Å; Y192-L202 HydrophobicContact CD2-CD1 3.87Å; Y192-L202 HydrophobicContact CD2-CD2 4.27Å; Y192-L202 HydrophobicContact CD2-CG 4.03Å; Y192-L202 HydrophobicContact CE2-CD1 3.77Å; Y192-L202 HydrophobicContact CE2-CG 3.89Å; V195-L202 HydrophobicContact CG2-CB 3.96Å; V195-L202 HydrophobicContact CG2-CD1 4.34Å; V195-L202 HydrophobicContact CG2-CG 4.08Å; L202-A204 HydrophobicContact CD2-CB 4.08Å; L202-L225 HydrophobicContact CD2-CD2 4.36Å; L202-C226 CarbonylContact O-C 3.6Å; L202-C226 WeakPolarHBondContact O-CA 3.33Å; L202-G227 PolarHBondContact N-O 3.42Å; L202-G227 PolarHBondContact O-N 3.35Å
203	L	94.9	Very high	86.8	Confident	23 Å²	23	62.9 Å²	62.9	12%	0.12	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	136.4	173.4	-60.8	175.7	0	0	0	110.5	K193 D194 I201 L225 C226	K193-L203 WeakPolarHBondContact CB-O 3.22Å; K193-L203 PolarHBondContact N-O 2.97Å; D194-L203 PolarHBondContact N-O 3.4Å; D194-L203 PolarHBondContact O-N 3.09Å; I201-L203 HydrophobicContact CG2-CD2 3.99Å; I201-L203 HydrophobicContact CG2-CG 4.43Å; L203-L225 WeakPolarHBondContact CA-O 3.08Å; L203-C226 HydrophobicContact CD2-CB 4.4Å
204	A	95.6	Very high	84.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	142	175.3	0	0	0	0	0	111.1	F183 C190 L191 L202 E224 L225	F183-A204 HydrophobicContact CE1-CB 3.68Å; F183-A204 HydrophobicContact CZ-CB 3.56Å; C190-A204 HydrophobicContact CB-CB 4.39Å; L191-A204 CarbonylContact O-C 3.44Å; L191-A204 WeakPolarHBondContact O-CA 3.27Å; L191-A204 VanDerWaalsContact O-CB 3.29Å; L191-A204 WeakPolarHBondContact O-CB 3.39Å; L202-A204 HydrophobicContact CD2-CB 4.08Å; A204-E224 CarbonylContact O-C 3.53Å; A204-E224 WeakPolarHBondContact O-CA 3.19Å; A204-E224 WeakPolarHBondContact O-CG 3.18Å; A204-L225 HydrophobicContact CB-CB 4.27Å; A204-L225 HydrophobicContact CB-CD2 4.38Å; A204-L225 PolarHBondContact N-O 2.71Å; A204-L225 PolarHBondContact O-N 3.17Å
205	D	94.7	Very high	83.1	Confident	56 Å²	56	66.2 Å²	66.2	30%	0.299	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	136.7	174.4	-67.3	-30.2	0	0	0	109.6	C190 L191 K193 L207	C190-D205 CarbonylContact C-O 3.54Å; C190-D205 WeakPolarHBondContact CA-O 3.18Å; L191-D205 PolarHBondContact N-O 3.24Å; L191-D205 PolarHBondContact O-N 2.68Å; K193-D205 IonicContact NZ-OD1 3.79Å; D205-L207 PolarHBondContact O-N 3.37Å
206	I	93.9	Very high	81	Confident	21 Å²	21	74 Å²	74	11%	0.108	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	113.7	172	-60.1	-60.6	0	0	0	108.7	D188 C190 Y209 Y223 L225 I238	D188-I206 HydrophobicContact CB-CD1 4.36Å; C190-I206 HydrophobicContact CB-CD1 4.44Å; C190-I206 WeakPolarHBondContact SG-CD1 3.25Å; I206-Y209 HydrophobicContact CG2-CD2 4.27Å; I206-Y223 WeakPolarHBondContact CB-O 3.4Å; I206-Y223 PolarHBondContact N-O 2.78Å; I206-L225 HydrophobicContact CD1-CB 3.77Å; I206-L225 HydrophobicContact CD1-CD1 4.22Å; I206-L225 HydrophobicContact CG1-CB 4.41Å; I206-I238 HydrophobicContact CD1-CD1 3.79Å; I206-I238 HydrophobicContact CD1-CG1 4.18Å; I206-I238 HydrophobicContact CG1-CD1 4.36Å; I206-I238 HydrophobicContact CG1-CG2 4.03Å
207	L	91.6	Very high	79.3	Confident	101 Å²	101	77.3 Å²	77.3	53%	0.529	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-38	175.8	-61.2	-178.5	0	0	0	111.8	S189 L191 D205	S189-L207 PolarHBondContact O-N 2.98Å; L191-L207 HydrophobicContact CB-CD1 4Å; L191-L207 HydrophobicContact CB-CD2 4.09Å; L191-L207 HydrophobicContact CB-CG 3.96Å; L191-L207 HydrophobicContact CD2-CD2 4.43Å; D205-L207 PolarHBondContact O-N 3.37Å
208	Q	87.9	Confident	77.6	Confident	122 Å²	122	81 Å²	81	57%	0.57	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	109.9	177.5	-173.6	177.7	2.4	0	0	109	D188 S189	D188-Q208 WeakPolarHBondContact CA-O 3.33Å; S189-Q208 PolarHBondContact N-O 3.31Å; S189-Q208 VanDerWaalsContact N-O 3.12Å; S189-Q208 PolarHBondContact O-N 3.27Å
209	Y	87.6	Confident	76.4	Confident	54 Å²	54	75.8 Å²	75.8	21%	0.212	38%	0.381	C	S	.	.			trans	-89.3	110.7	174.8	-173	-106.7	0	0	0	109	K135 K136 I206 T211 Y223 I238	K135-Y209 WeakPolarHBondContact CB-OH 3.35Å; K136-Y209 HydrophobicContact CD-CE2 4.21Å; K136-Y209 HydrophobicContact CG-CE2 4.32Å; I206-Y209 HydrophobicContact CG2-CD2 4.27Å; Y209-T211 WeakPolarHBondContact CE1-OG1 3.43Å; Y209-Y223 HydrophobicContact CD1-CD2 4.06Å; Y209-Y223 AromaticContact CD1-CE2 3.61Å; Y209-Y223 HydrophobicContact CD1-CE2 3.61Å; Y209-Y223 HydrophobicContact CD2-CD1 4.32Å; Y209-Y223 AromaticContact CD2-CD2 3.8Å; Y209-Y223 HydrophobicContact CD2-CD2 3.8Å; Y209-Y223 HydrophobicContact CD2-CE2 4.15Å; Y209-Y223 AromaticContact CD2-CG 3.89Å; Y209-Y223 HydrophobicContact CD2-CG 3.89Å; Y209-Y223 HydrophobicContact CE1-CE1 4.4Å; Y209-Y223 AromaticContact CE1-CE2 3.98Å; Y209-Y223 HydrophobicContact CE1-CE2 3.98Å; Y209-Y223 AromaticContact CE1-CZ 3.87Å; Y209-Y223 HydrophobicContact CE2-CD1 4.16Å; Y209-Y223 HydrophobicContact CE2-CD2 4.37Å; Y209-Y223 HydrophobicContact CE2-CE1 4.32Å; Y209-Y223 HydrophobicContact CE2-CE2 4.49Å; Y209-Y223 HydrophobicContact CE2-CG 4.2Å; Y209-Y223 AromaticContact CG-CD2 3.62Å; Y209-Y223 HydrophobicContact CG-CD2 3.62Å; Y209-Y223 AromaticContact CG-CE2 3.69Å; Y209-Y223 HydrophobicContact CG-CE2 3.69Å; Y209-Y223 HydrophobicContact CG-CG 4.2Å; Y209-I238 HydrophobicContact CD2-CG2 4.27Å; Y209-I238 HydrophobicContact CE2-CG2 3.9Å
210	Y	82.3	Confident	75.4	Confident	45 Å²	45	81.2 Å²	81.2	18%	0.176	41%	0.413	C	S	.	.			trans	-81.5	148.3	171	-175.5	-95.8	0	0	0	109.3	Y102 E104 K136 D154 M187 D188	Y102-Y210 HydrophobicContact CE1-CE1 4.11Å; Y102-Y210 WeakPolarHBondContact CE1-OH 3.22Å; Y102-Y210 PolarHBondContact OH-OH 3.03Å; E104-Y210 PolarHBondContact OE2-OH 2.98Å; K136-Y210 VanDerWaalsContact CE-O 3.25Å; K136-Y210 WeakPolarHBondContact CE-O 3.49Å; K136-Y210 PolarHBondContact NZ-O 3.36Å; D154-Y210 HydrophobicContact CB-CD1 4.29Å; D154-Y210 HydrophobicContact CB-CE1 4.16Å; M187-Y210 HydrophobicContact CB-CD1 3.81Å; M187-Y210 HydrophobicContact CB-CD2 4.34Å; M187-Y210 HydrophobicContact CB-CE1 4.48Å; M187-Y210 HydrophobicContact CB-CG 3.71Å; M187-Y210 HydrophobicContact CE-CD1 4.11Å; M187-Y210 HydrophobicContact CE-CD2 3.53Å; M187-Y210 HydrophobicContact CE-CE1 3.86Å; M187-Y210 HydrophobicContact CE-CE2 3.21Å; M187-Y210 HydrophobicContact CE-CG 3.95Å; M187-Y210 HydrophobicContact CG-CD1 4.25Å; M187-Y210 HydrophobicContact CG-CE1 4.46Å; M187-Y210 HydrophobicContact CG-CG 4.48Å; M187-Y210 HydrophobicContact SD-CD1 3.58Å; M187-Y210 VanDerWaalsContact SD-CD1 3.58Å; M187-Y210 HydrophobicContact SD-CD2 4.15Å; M187-Y210 HydrophobicContact SD-CE1 3.25Å; M187-Y210 WeakPolarHBondContact SD-CE1 3.27Å; M187-Y210 HydrophobicContact SD-CE2 3.85Å; M187-Y210 HydrophobicContact SD-CG 4.01Å; D188-Y210 WeakPolarHBondContact OD1-CB 3.34Å; D188-Y210 PolarHBondContact OD1-N 3.43Å
211	T	75.6	Confident	74.9	Confident	63 Å²	63	82 Å²	82	39%	0.387	42%	0.421	S	S	.	.			trans	-146.6	135.4	164.2	-62.7	0	0	0	0	106.4	Y209	Y209-T211 WeakPolarHBondContact CE1-OG1 3.43Å
212	R	66.8	Low	74.9	Confident	124 Å²	124	89.3 Å²	89.3	47%	0.468	45%	0.453	S	S	.	.			trans	-59.4	132	177.5	-172.1	175.6	-174.1	-175.3	-2.5	110	Y102 E153 D154 N214	Y102-R212 HydrophobicContact CE2-CG 4.25Å; E153-R212 IonicContact OE2-NH1 3.01Å; E153-R212 PolarHBondContact OE2-NH1 3.05Å; D154-R212 HydrophobicContact CB-CB 4.43Å; R212-N214 PolarHBondContact O-N 2.95Å
213	P	57.3	Low	74.8	Confident	95 Å²	95	89.6 Å²	89.6	62%	0.617	45%	0.454	S	S	*	.	S	Bend	trans	-78	123.4	-168.4	31.1	-33.1	0	0	0	110.5
214	N	52.3	Low	74.9	Confident	167 Å²	167	88.8 Å²	88.8	89%	0.893	45%	0.45	S	S	*	.	S	Bend	trans	-158.8	5.5	144.5	-100.2	-9.6	0	0	0	112.1	R212	R212-N214 PolarHBondContact O-N 2.95Å
215	T	53.4	Low	74.9	Confident	89 Å²	89	88.8 Å²	88.8	55%	0.546	45%	0.45	S	S	.	.	S	Bend	trans	-124.3	123.9	165.9	47.8	0	0	0	0	107.1	E217	T215-E217 PolarHBondContact O-N 3.38Å
216	N	46.4	Very low	75	Confident	168 Å²	168	86.1 Å²	86.1	90%	0.898	44%	0.435	S	S	*	.			trans	-70.9	41	171.7	-74	-42.6	0	0	0	111.2	Y218	N216-Y218 PolarHBondContact O-N 3.25Å
217	E	53	Low	75.1	Confident	128 Å²	128	85.2 Å²	85.2	60%	0.598	43%	0.431	S	S	*	.			trans	-93.9	88.8	174.1	-71.1	178.7	178.4	0	0	106.4	T215 N219	T215-E217 PolarHBondContact O-N 3.38Å; E217-N219 PolarHBondContact O-N 3.44Å
218	Y	50.3	Low	75.3	Confident	210 Å²	210	80.4 Å²	80.4	82%	0.824	41%	0.406	S	S	*	.			trans	-59.1	90.7	150.9	-69.8	-84.7	0	0	0	105.9	N216 V220	N216-Y218 PolarHBondContact O-N 3.25Å; Y218-V220 WeakPolarHBondContact O-CG2 3.47Å; Y218-V220 PolarHBondContact O-N 3.19Å
219	N	59	Low	75.5	Confident	74 Å²	74	76.1 Å²	76.1	40%	0.396	39%	0.387	S	S	.	.			trans	-64.5	105.8	172.3	-85.2	-46.7	0	0	0	107.1	E217 G221 Y223	E217-N219 PolarHBondContact O-N 3.44Å; N219-G221 PolarHBondContact O-N 3.45Å; N219-Y223 HydrophobicContact CB-CE2 4.18Å; N219-Y223 WeakPolarHBondContact CB-OH 3.47Å; N219-Y223 VanDerWaalsContact CG-OH 3.3Å; N219-Y223 PolarHBondContact ND2-OH 3.09Å
220	V	65.9	Low	75.8	Confident	147 Å²	147	73.7 Å²	73.7	89%	0.891	38%	0.378	S	S	*	.			trans	-72.5	21.4	174.2	-164.9	0	0	0	0	110.7	Y218	Y218-V220 WeakPolarHBondContact O-CG2 3.47Å; Y218-V220 PolarHBondContact O-N 3.19Å
221	G	77.7	Confident	76.2	Confident	27 Å²	27	78.3 Å²	78.3	28%	0.278	40%	0.399	S	S	.	.			trans	-78.8	146	177.9	0	0	0	0	0	110.7	N219 Y223	N219-G221 PolarHBondContact O-N 3.45Å; G221-Y223 WeakPolarHBondContact O-CD2 3.43Å; G221-Y223 WeakPolarHBondContact O-CE2 3.38Å
222	K	91.5	Very high	77	Confident	161 Å²	161	79.3 Å²	79.3	70%	0.7	40%	0.402	S	S	*	.			trans	-82.8	137.7	161.2	-65.5	-177.1	179.4	-178.5	0	107.6	I241	K222-I241 HydrophobicContact CB-CB 4.13Å; K222-I241 HydrophobicContact CB-CD1 4.01Å; K222-I241 HydrophobicContact CB-CG1 4.35Å; K222-I241 PolarHBondContact O-N 3.3Å
223	Y	94.2	Very high	78.3	Confident	6 Å²	6	73.4 Å²	73.4	2%	0.024	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	142.8	179.6	-64	-82.6	0	0	0	110	K135 I206 Y209 N219 G221 I238 Y239 E240	K135-Y223 HydrophobicContact CG-CE1 4.02Å; I206-Y223 WeakPolarHBondContact CB-O 3.4Å; I206-Y223 PolarHBondContact N-O 2.78Å; Y209-Y223 HydrophobicContact CD1-CD2 4.06Å; Y209-Y223 AromaticContact CD1-CE2 3.61Å; Y209-Y223 HydrophobicContact CD1-CE2 3.61Å; Y209-Y223 HydrophobicContact CD2-CD1 4.32Å; Y209-Y223 AromaticContact CD2-CD2 3.8Å; Y209-Y223 HydrophobicContact CD2-CD2 3.8Å; Y209-Y223 HydrophobicContact CD2-CE2 4.15Å; Y209-Y223 AromaticContact CD2-CG 3.89Å; Y209-Y223 HydrophobicContact CD2-CG 3.89Å; Y209-Y223 HydrophobicContact CE1-CE1 4.4Å; Y209-Y223 AromaticContact CE1-CE2 3.98Å; Y209-Y223 HydrophobicContact CE1-CE2 3.98Å; Y209-Y223 AromaticContact CE1-CZ 3.87Å; Y209-Y223 HydrophobicContact CE2-CD1 4.16Å; Y209-Y223 HydrophobicContact CE2-CD2 4.37Å; Y209-Y223 HydrophobicContact CE2-CE1 4.32Å; Y209-Y223 HydrophobicContact CE2-CE2 4.49Å; Y209-Y223 HydrophobicContact CE2-CG 4.2Å; Y209-Y223 AromaticContact CG-CD2 3.62Å; Y209-Y223 HydrophobicContact CG-CD2 3.62Å; Y209-Y223 AromaticContact CG-CE2 3.69Å; Y209-Y223 HydrophobicContact CG-CE2 3.69Å; Y209-Y223 HydrophobicContact CG-CG 4.2Å; N219-Y223 HydrophobicContact CB-CE2 4.18Å; N219-Y223 WeakPolarHBondContact CB-OH 3.47Å; N219-Y223 VanDerWaalsContact CG-OH 3.3Å; N219-Y223 PolarHBondContact ND2-OH 3.09Å; G221-Y223 WeakPolarHBondContact O-CD2 3.43Å; G221-Y223 WeakPolarHBondContact O-CE2 3.38Å; Y223-I238 HydrophobicContact CD1-CG2 4.2Å; Y223-I238 HydrophobicContact CG-CG2 4.36Å; Y223-Y239 WeakPolarHBondContact CA-O 3.19Å; Y223-Y239 WeakPolarHBondContact CD1-O 3.28Å; Y223-E240 HydrophobicContact CD1-CB 4.01Å; Y223-E240 HydrophobicContact CD1-CG 4.4Å; Y223-E240 HydrophobicContact CE1-CB 3.77Å; Y223-E240 HydrophobicContact CE1-CG 3.98Å
224	E	95.3	Very high	80.1	Confident	6 Å²	6	69 Å²	69	3%	0.028	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	137.3	172.6	-165.2	173.3	59.9	0	0	107.7	K193 A204 I238 Y239 I241 K249	K193-E224 IonicContact NZ-OE2 2.95Å; K193-E224 PolarHBondContact NZ-OE2 3.35Å; A204-E224 CarbonylContact O-C 3.53Å; A204-E224 WeakPolarHBondContact O-CA 3.19Å; A204-E224 WeakPolarHBondContact O-CG 3.18Å; E224-I238 WeakPolarHBondContact O-CA 3.49Å; E224-Y239 HydrophobicContact CB-CD2 4.45Å; E224-Y239 HydrophobicContact CB-CE2 3.64Å; E224-Y239 HydrophobicContact CG-CE2 4.41Å; E224-Y239 PolarHBondContact N-O 2.87Å; E224-Y239 PolarHBondContact O-N 3.31Å; E224-Y239 VanDerWaalsContact O-N 3.13Å; E224-Y239 PolarHBondContact OE1-OH 3.24Å; E224-I241 HydrophobicContact CB-CD1 3.82Å; E224-I241 HydrophobicContact CB-CG1 3.75Å; E224-K249 WeakPolarHBondContact OE1-CE 3.47Å; E224-K249 IonicContact OE1-NZ 3.68Å; E224-K249 PolarHBondContact OE1-NZ 2.87Å
225	L	96.7	Very high	82.2	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	134	170	-176.5	149.3	0	0	0	108.6	F165 F183 I185 L202 L203 A204 I206 I236 A237 I238	F165-L225 HydrophobicContact CE2-CD2 3.63Å; F165-L225 HydrophobicContact CZ-CD2 4.42Å; F183-L225 HydrophobicContact CZ-CD2 4.4Å; I185-L225 HydrophobicContact CB-CD1 4.2Å; I185-L225 HydrophobicContact CG1-CD1 4.01Å; I185-L225 HydrophobicContact CG2-CD1 4.41Å; L202-L225 HydrophobicContact CD2-CD2 4.36Å; L203-L225 WeakPolarHBondContact CA-O 3.08Å; A204-L225 HydrophobicContact CB-CB 4.27Å; A204-L225 HydrophobicContact CB-CD2 4.38Å; A204-L225 PolarHBondContact N-O 2.71Å; A204-L225 PolarHBondContact O-N 3.17Å; I206-L225 HydrophobicContact CD1-CB 3.77Å; I206-L225 HydrophobicContact CD1-CD1 4.22Å; I206-L225 HydrophobicContact CG1-CB 4.41Å; L225-I236 HydrophobicContact CD1-CG2 3.82Å; L225-I236 HydrophobicContact CD2-CG2 4Å; L225-I236 HydrophobicContact CG-CG2 3.94Å; L225-A237 WeakPolarHBondContact CA-O 3.4Å; L225-I238 HydrophobicContact CB-CG1 4.21Å; L225-I238 HydrophobicContact CD1-CD1 4.32Å; L225-I238 HydrophobicContact CD1-CG1 4.08Å; L225-I238 HydrophobicContact CG-CG1 4.22Å
226	C	95.9	Very high	84.3	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.1	175.2	173.3	0	0	0	0	108	I201 L202 L203 A237 Y239 L252	I201-C226 HydrophobicContact CG2-CB 4.47Å; I201-C226 WeakPolarHBondContact CG2-SG 3.34Å; L202-C226 CarbonylContact O-C 3.6Å; L202-C226 WeakPolarHBondContact O-CA 3.33Å; L203-C226 HydrophobicContact CD2-CB 4.4Å; C226-A237 PolarHBondContact N-O 3.24Å; C226-A237 PolarHBondContact O-N 2.96Å; C226-Y239 HydrophobicContact CB-CD1 4.48Å; C226-Y239 HydrophobicContact CB-CE1 3.57Å; C226-L252 HydrophobicContact CB-CD1 3.91Å
227	G	96.2	Very high	86.7	Confident	2 Å²	2	48.8 Å²	48.8	2%	0.021	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	139.7	171	0	0	0	0	0	113.5	L202 L235	L202-G227 PolarHBondContact N-O 3.42Å; L202-G227 PolarHBondContact O-N 3.35Å; G227-L235 CarbonylContact C-O 3.58Å; G227-L235 WeakPolarHBondContact CA-O 3.39Å
228	L	95.2	Very high	88.8	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	131.1	-169	-53.3	97	0	0	0	109.2	I201 L235 L252 I253 R256	I201-L228 HydrophobicContact CD1-CD2 3.79Å; I201-L228 HydrophobicContact CD1-CG 4.43Å; I201-L228 HydrophobicContact CG1-CD2 3.72Å; I201-L228 HydrophobicContact CG1-CG 3.98Å; I201-L228 HydrophobicContact CG2-CG 4.48Å; L228-L235 HydrophobicContact CD1-CB 4.45Å; L228-L235 HydrophobicContact CD1-CD2 4.07Å; L228-L235 HydrophobicContact CD1-CG 4.13Å; L228-L235 PolarHBondContact N-O 3.2Å; L228-L235 PolarHBondContact O-N 3.06Å; L228-L252 HydrophobicContact CD1-CB 3.79Å; L228-L252 HydrophobicContact CD1-CD1 4.44Å; L228-L252 HydrophobicContact CD1-CG 4.49Å; L228-L252 HydrophobicContact CD2-CB 4.23Å; L228-L252 WeakPolarHBondContact CD2-O 3.43Å; L228-I253 HydrophobicContact CD2-CG1 4.29Å; L228-R256 HydrophobicContact CB-CB 4.21Å; L228-R256 HydrophobicContact CB-CG 4.23Å; L228-R256 HydrophobicContact CD2-CB 3.93Å
229	L	93.6	Very high	90.9	Very high	32 Å²	32	32.7 Å²	32.7	17%	0.168	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.9	174	-64.3	176.2	0	0	0	109.8	M166 L234	M166-L229 HydrophobicContact CE-CD1 4.45Å; M166-L229 HydrophobicContact CE-CD2 3.71Å; M166-L229 HydrophobicContact SD-CD2 3.39Å; M166-L229 WeakPolarHBondContact SD-CD2 3.11Å; L229-L234 HydrophobicContact CD2-CB 4.38Å; L229-L234 HydrophobicContact CD2-CD1 3.61Å
230	T	93	Very high	92.6	Very high	3 Å²	3	33 Å²	33	2%	0.018	17%	0.17	C	C	.	.			trans	-109.6	-178.3	166.9	65.1	0	0	0	0	108.5	R142 S233 R256 F259 D260	R142-T230 VanDerWaalsContact CD-O 3.22Å; R142-T230 WeakPolarHBondContact CD-O 3.05Å; R142-T230 PolarHBondContact NH1-O 3.19Å; T230-S233 PolarHBondContact N-O 3.05Å; T230-S233 WeakPolarHBondContact OG1-CA 3.38Å; T230-S233 WeakPolarHBondContact OG1-CB 3.28Å; T230-S233 PolarHBondContact OG1-N 3.12Å; T230-S233 PolarHBondContact OG1-O 3.1Å; T230-R256 HydrophobicContact CG2-CB 4.25Å; T230-R256 HydrophobicContact CG2-CG 3.58Å; T230-F259 HydrophobicContact CG2-CB 3.85Å; T230-F259 HydrophobicContact CG2-CD2 4.26Å; T230-D260 WeakPolarHBondContact CA-OD1 3.34Å; T230-D260 WeakPolarHBondContact CB-OD1 3.12Å
231	K	91.7	Very high	93.8	Very high	141 Å²	141	29.1 Å²	29.1	61%	0.613	14%	0.144	S	C	*	.	S	Bend	trans	-58	-48.4	174.7	-73.2	169	-173.5	168.6	0	112.1	D260	K231-D260 WeakPolarHBondContact CG-OD1 3.3Å; K231-D260 PolarHBondContact N-OD1 3.34Å
232	N	92.5	Very high	94.5	Very high	84 Å²	84	29.9 Å²	29.9	45%	0.449	15%	0.152	S	C	.	.	S	Bend	trans	-116.1	-15.3	-170.7	-63.7	-26.5	0	0	0	113.9	R142 G263 M264	R142-N232 WeakPolarHBondContact CB-O 3.24Å; R142-N232 PolarHBondContact N-O 3.16Å; N232-G263 PolarHBondContact ND2-O 3.5Å; N232-M264 VanDerWaalsContact CB-OXT 3.27Å; N232-M264 WeakPolarHBondContact CB-OXT 3.33Å
233	S	93.8	Very high	94.4	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.007	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	161.3	-175.7	-67.4	0	0	0	0	113.7	Y120 C140 T230 M264	Y120-S233 PolarHBondContact OH-OG 3.35Å; Y120-S233 VanDerWaalsContact OH-OG 3.1Å; C140-S233 CarbonylContact O-C 3.52Å; C140-S233 VanDerWaalsContact O-CA 3.28Å; C140-S233 WeakPolarHBondContact O-CA 3.35Å; T230-S233 PolarHBondContact N-O 3.05Å; T230-S233 WeakPolarHBondContact OG1-CA 3.38Å; T230-S233 WeakPolarHBondContact OG1-CB 3.28Å; T230-S233 PolarHBondContact OG1-N 3.12Å; T230-S233 PolarHBondContact OG1-O 3.1Å; S233-M264 VanDerWaalsContact CB-OXT 3.3Å; S233-M264 WeakPolarHBondContact CB-OXT 3.34Å; S233-M264 PolarHBondContact N-OXT 3.31Å; S233-M264 PolarHBondContact OG-OXT 3.2Å
234	L	95.2	Very high	94.3	Very high	1 Å²	1	37 Å²	37	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	121.5	172.2	164.7	65.8	0	0	0	107.2	I139 C140 I162 F165 M166 L229 I236	I139-L234 CarbonylContact C-O 3.55Å; I139-L234 WeakPolarHBondContact CA-O 3.1Å; C140-L234 HydrophobicContact CB-CB 4.49Å; C140-L234 PolarHBondContact N-O 3.25Å; C140-L234 PolarHBondContact O-N 2.81Å; I162-L234 HydrophobicContact CG2-CD2 3.78Å; F165-L234 HydrophobicContact CD1-CD1 3.85Å; F165-L234 HydrophobicContact CD1-CD2 4.07Å; F165-L234 HydrophobicContact CE1-CD1 3.55Å; M166-L234 HydrophobicContact CG-CD2 4.46Å; M166-L234 HydrophobicContact SD-CD1 4.39Å; M166-L234 HydrophobicContact SD-CD2 3.92Å; L229-L234 HydrophobicContact CD2-CB 4.38Å; L229-L234 HydrophobicContact CD2-CD1 3.61Å; L234-I236 HydrophobicContact CD1-CD1 4.41Å; L234-I236 HydrophobicContact CD1-CG1 3.95Å; L234-I236 HydrophobicContact CD2-CD1 3.87Å; L234-I236 HydrophobicContact CD2-CG1 4.27Å; L234-I236 HydrophobicContact CG-CD1 4.14Å; L234-I236 HydrophobicContact CG-CG1 3.98Å
235	L	96.7	Very high	94.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.7	173.3	172.2	60.6	0	0	0	108.3	I128 I139 G227 L228 L252 M255 F259	I128-L235 HydrophobicContact CD1-CD1 3.94Å; I128-L235 HydrophobicContact CD1-CD2 4.18Å; I139-L235 HydrophobicContact CD1-CD1 4.42Å; I139-L235 HydrophobicContact CG1-CD1 3.67Å; G227-L235 CarbonylContact C-O 3.58Å; G227-L235 WeakPolarHBondContact CA-O 3.39Å; L228-L235 HydrophobicContact CD1-CB 4.45Å; L228-L235 HydrophobicContact CD1-CD2 4.07Å; L228-L235 HydrophobicContact CD1-CG 4.13Å; L228-L235 PolarHBondContact N-O 3.2Å; L228-L235 PolarHBondContact O-N 3.06Å; L235-L252 HydrophobicContact CD2-CD2 3.87Å; L235-L252 HydrophobicContact CG-CD2 4.41Å; L235-M255 HydrophobicContact CD2-CB 4.23Å; L235-F259 HydrophobicContact CD2-CE2 4.22Å
236	I	97.2	Very high	94.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.8	171.6	-59.9	165.5	0	0	0	107.8	A137 V138 F155 F165 I185 L225 L234	A137-I236 CarbonylContact C-O 3.52Å; A137-I236 VanDerWaalsContact CA-O 3.25Å; A137-I236 WeakPolarHBondContact CA-O 3.48Å; V138-I236 HydrophobicContact CG1-CB 3.8Å; V138-I236 HydrophobicContact CG1-CD1 4.41Å; V138-I236 PolarHBondContact N-O 2.86Å; V138-I236 PolarHBondContact O-N 2.82Å; F155-I236 HydrophobicContact CE1-CG2 4.35Å; F155-I236 HydrophobicContact CZ-CG2 4.09Å; F165-I236 HydrophobicContact CD1-CD1 4.09Å; F165-I236 HydrophobicContact CD1-CG1 4.37Å; F165-I236 HydrophobicContact CD2-CD1 4.17Å; F165-I236 HydrophobicContact CE1-CD1 4.37Å; F165-I236 HydrophobicContact CE1-CG1 4.15Å; F165-I236 HydrophobicContact CE2-CD1 4.42Å; F165-I236 HydrophobicContact CE2-CG1 4.32Å; F165-I236 HydrophobicContact CG-CD1 4.02Å; F165-I236 HydrophobicContact CZ-CG1 4.15Å; I185-I236 HydrophobicContact CD1-CD1 4.38Å; I185-I236 HydrophobicContact CG2-CG2 4.35Å; L225-I236 HydrophobicContact CD1-CG2 3.82Å; L225-I236 HydrophobicContact CD2-CG2 4Å; L225-I236 HydrophobicContact CG-CG2 3.94Å; L234-I236 HydrophobicContact CD1-CD1 4.41Å; L234-I236 HydrophobicContact CD1-CG1 3.95Å; L234-I236 HydrophobicContact CD2-CD1 3.87Å; L234-I236 HydrophobicContact CD2-CG1 4.27Å; L234-I236 HydrophobicContact CG-CD1 4.14Å; L234-I236 HydrophobicContact CG-CG1 3.98Å
237	A	97.3	Very high	94.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	148.2	-177.4	0	0	0	0	0	111.7	V134 K136 A137 L225 C226 L252	V134-A237 HydrophobicContact CG1-CB 3.8Å; K136-A237 CarbonylContact O-C 3.5Å; K136-A237 VanDerWaalsContact O-CA 3.28Å; K136-A237 WeakPolarHBondContact O-CA 3.47Å; A137-A237 HydrophobicContact CB-CB 4.33Å; L225-A237 WeakPolarHBondContact CA-O 3.4Å; C226-A237 PolarHBondContact N-O 3.24Å; C226-A237 PolarHBondContact O-N 2.96Å; A237-L252 HydrophobicContact CB-CD1 3.69Å; A237-L252 HydrophobicContact CB-CD2 3.56Å; A237-L252 HydrophobicContact CB-CG 4.3Å
238	I	96.2	Very high	94.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	125.9	173.3	-59.9	175.6	0	0	0	108.4	K135 K136 F155 D188 I206 Y209 Y223 E224 L225	K135-I238 PolarHBondContact N-O 2.84Å; K136-I238 HydrophobicContact CB-CB 4.27Å; K136-I238 HydrophobicContact CD-CD1 4.39Å; K136-I238 PolarHBondContact N-O 2.75Å; K136-I238 PolarHBondContact O-N 2.72Å; F155-I238 HydrophobicContact CD2-CD1 4.37Å; F155-I238 HydrophobicContact CE2-CD1 3.44Å; F155-I238 VanDerWaalsContact CE2-CD1 3.44Å; F155-I238 HydrophobicContact CE2-CG1 4.19Å; F155-I238 HydrophobicContact CZ-CD1 3.76Å; F155-I238 HydrophobicContact CZ-CG1 3.99Å; D188-I238 HydrophobicContact CB-CD1 4.18Å; D188-I238 WeakPolarHBondContact OD2-CD1 3.43Å; I206-I238 HydrophobicContact CD1-CD1 3.79Å; I206-I238 HydrophobicContact CD1-CG1 4.18Å; I206-I238 HydrophobicContact CG1-CD1 4.36Å; I206-I238 HydrophobicContact CG1-CG2 4.03Å; Y209-I238 HydrophobicContact CD2-CG2 4.27Å; Y209-I238 HydrophobicContact CE2-CG2 3.9Å; Y223-I238 HydrophobicContact CD1-CG2 4.2Å; Y223-I238 HydrophobicContact CG-CG2 4.36Å; E224-I238 WeakPolarHBondContact O-CA 3.49Å; L225-I238 HydrophobicContact CB-CG1 4.21Å; L225-I238 HydrophobicContact CD1-CD1 4.32Å; L225-I238 HydrophobicContact CD1-CG1 4.08Å; L225-I238 HydrophobicContact CG-CG1 4.22Å
239	Y	94.8	Very high	94.1	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	164	173.2	54.7	-101.2	0	0	0	110.7	L133 Y223 E224 C226 T245 A248 K249 L252	L133-Y239 VanDerWaalsContact O-CB 3.3Å; L133-Y239 WeakPolarHBondContact O-CB 3.23Å; Y223-Y239 WeakPolarHBondContact CA-O 3.19Å; Y223-Y239 WeakPolarHBondContact CD1-O 3.28Å; E224-Y239 HydrophobicContact CB-CD2 4.45Å; E224-Y239 HydrophobicContact CB-CE2 3.64Å; E224-Y239 HydrophobicContact CG-CE2 4.41Å; E224-Y239 PolarHBondContact N-O 2.87Å; E224-Y239 PolarHBondContact O-N 3.31Å; E224-Y239 VanDerWaalsContact O-N 3.13Å; E224-Y239 PolarHBondContact OE1-OH 3.24Å; C226-Y239 HydrophobicContact CB-CD1 4.48Å; C226-Y239 HydrophobicContact CB-CE1 3.57Å; Y239-T245 HydrophobicContact CD2-CG2 4.31Å; Y239-T245 HydrophobicContact CE2-CG2 3.66Å; Y239-A248 HydrophobicContact CD1-CB 3.98Å; Y239-A248 HydrophobicContact CD2-CB 4.33Å; Y239-A248 HydrophobicContact CG-CB 3.83Å; Y239-K249 HydrophobicContact CE1-CG 4.21Å; Y239-K249 WeakPolarHBondContact OH-CE 3.29Å; Y239-L252 HydrophobicContact CD1-CD1 4.1Å; Y239-L252 HydrophobicContact CE1-CD1 4.12Å
240	E	93.4	Very high	94.2	Very high	79 Å²	79	52.5 Å²	52.5	37%	0.369	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	132.1	178.1	-169.1	176.1	170.2	0	0	110.1	K135 Y223 G242	K135-E240 WeakPolarHBondContact CE-OE2 3.18Å; K135-E240 IonicContact NZ-OE2 3.15Å; K135-E240 PolarHBondContact NZ-OE2 2.92Å; Y223-E240 HydrophobicContact CD1-CB 4.01Å; Y223-E240 HydrophobicContact CD1-CG 4.4Å; Y223-E240 HydrophobicContact CE1-CB 3.77Å; Y223-E240 HydrophobicContact CE1-CG 3.98Å; E240-G242 PolarHBondContact O-N 2.73Å
241	I	92.8	Very high	94.4	Very high	66 Å²	66	53.3 Å²	53.3	34%	0.338	27%	0.27	S	S	.	.			trans	-77.3	113.1	175.7	-54.1	177.9	0	0	0	108	K222 E224	K222-I241 HydrophobicContact CB-CB 4.13Å; K222-I241 HydrophobicContact CB-CD1 4.01Å; K222-I241 HydrophobicContact CB-CG1 4.35Å; K222-I241 PolarHBondContact O-N 3.3Å; E224-I241 HydrophobicContact CB-CD1 3.82Å; E224-I241 HydrophobicContact CB-CG1 3.75Å
242	G	90.6	Very high	94.6	Very high	43 Å²	43	46.6 Å²	46.6	44%	0.443	24%	0.241	S	C	.	.	S	Bend	trans	-167.4	-150.6	175.9	0	0	0	0	0	111.4	E240 R244 T245	E240-G242 PolarHBondContact O-N 2.73Å; G242-R244 PolarHBondContact O-N 3.21Å; G242-T245 PolarHBondContact N-OG1 2.8Å; G242-T245 PolarHBondContact O-N 3.31Å; G242-T245 PolarHBondContact O-OG1 2.93Å
243	N	90.2	Very high	94.8	Very high	172 Å²	172	43.8 Å²	43.8	92%	0.92	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-25.1	-176.3	-63.7	-12	0	0	0	113.4
244	R	92.1	Very high	94.9	Very high	146 Å²	146	48.5 Å²	48.5	55%	0.551	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102	18.9	-176.2	-55.4	-170.2	70.9	-171.7	-0.9	113.7	L133 G242 N246 D247 A248	L133-R244 HydrophobicContact CD2-CB 3.86Å; L133-R244 VanDerWaalsContact CD2-CZ 3.43Å; G242-R244 PolarHBondContact O-N 3.21Å; R244-N246 VanDerWaalsContact C-N 3.35Å; R244-N246 PolarHBondContact O-N 3.3Å; R244-D247 IonicContact NE-OD2 2.76Å; R244-D247 PolarHBondContact NE-OD2 2.89Å; R244-D247 IonicContact NH2-OD2 3.92Å; R244-D247 PolarHBondContact O-N 3.18Å; R244-A248 PolarHBondContact O-N 3.44Å; R244-A248 VanDerWaalsContact O-N 3.12Å
245	T	94.2	Very high	94.9	Very high	18 Å²	18	49.8 Å²	49.8	11%	0.11	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-43.4	-179.7	-56	0	0	0	0	111.6	Y239 G242 A248 K249	Y239-T245 HydrophobicContact CD2-CG2 4.31Å; Y239-T245 HydrophobicContact CE2-CG2 3.66Å; G242-T245 PolarHBondContact N-OG1 2.8Å; G242-T245 PolarHBondContact O-N 3.31Å; G242-T245 PolarHBondContact O-OG1 2.93Å; T245-A248 PolarHBondContact O-N 3.49Å; T245-K249 PolarHBondContact O-N 2.96Å
246	N	94.3	Very high	94.8	Very high	123 Å²	123	51.6 Å²	51.6	66%	0.658	26%	0.26	S	S	*	.	H	α-helix	trans	-66.8	-41.1	-179.6	-65.9	-22.7	0	0	0	111.4	R244 A248 K249 Q250	R244-N246 VanDerWaalsContact C-N 3.35Å; R244-N246 PolarHBondContact O-N 3.3Å; N246-A248 VanDerWaalsContact C-N 3.29Å; N246-A248 PolarHBondContact O-N 3.37Å; N246-K249 PolarHBondContact O-N 3.13Å; N246-Q250 WeakPolarHBondContact O-CB 3.36Å; N246-Q250 PolarHBondContact O-N 2.97Å
247	D	96.2	Very high	94.7	Very high	78 Å²	78	55.3 Å²	55.3	42%	0.417	28%	0.28	S	S	.	.	H	α-helix	trans	-57.2	-43.4	173.8	-56.2	-7.8	0	0	0	111.3	L133 R244 L251	L133-D247 HydrophobicContact CD1-CB 3.95Å; L133-D247 HydrophobicContact CD2-CB 4.19Å; R244-D247 IonicContact NE-OD2 2.76Å; R244-D247 PolarHBondContact NE-OD2 2.89Å; R244-D247 IonicContact NH2-OD2 3.92Å; R244-D247 PolarHBondContact O-N 3.18Å; D247-L251 WeakPolarHBondContact O-CB 3.33Å; D247-L251 PolarHBondContact O-N 3.11Å
248	A	96	Very high	94.7	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.008	30%	0.299	C	S	.	.	H	α-helix	trans	-65.9	-42.9	179.4	0	0	0	0	0	112	L133 Y239 R244 T245 N246 L252	L133-A248 HydrophobicContact CB-CB 4.08Å; Y239-A248 HydrophobicContact CD1-CB 3.98Å; Y239-A248 HydrophobicContact CD2-CB 4.33Å; Y239-A248 HydrophobicContact CG-CB 3.83Å; R244-A248 PolarHBondContact O-N 3.44Å; R244-A248 VanDerWaalsContact O-N 3.12Å; T245-A248 PolarHBondContact O-N 3.49Å; N246-A248 VanDerWaalsContact C-N 3.29Å; N246-A248 PolarHBondContact O-N 3.37Å; A248-L252 VanDerWaalsContact O-CG 3.31Å; A248-L252 WeakPolarHBondContact O-CG 3.41Å; A248-L252 PolarHBondContact O-N 2.98Å
249	K	95.2	Very high	94.6	Very high	49 Å²	49	60.3 Å²	60.3	21%	0.213	30%	0.3	C	S	.	.	H	α-helix	trans	-62.7	-47.5	175.8	-73.5	-177.4	177.2	-177.5	0	111.6	E224 Y239 T245 N246 L251 L252 I253	E224-K249 WeakPolarHBondContact OE1-CE 3.47Å; E224-K249 IonicContact OE1-NZ 3.68Å; E224-K249 PolarHBondContact OE1-NZ 2.87Å; Y239-K249 HydrophobicContact CE1-CG 4.21Å; Y239-K249 WeakPolarHBondContact OH-CE 3.29Å; T245-K249 PolarHBondContact O-N 2.96Å; N246-K249 PolarHBondContact O-N 3.13Å; K249-L251 PolarHBondContact O-N 2.67Å; K249-L252 PolarHBondContact O-N 2.66Å; K249-L252 VanDerWaalsContact O-N 3.15Å; K249-I253 WeakPolarHBondContact O-CG1 3.24Å; K249-I253 PolarHBondContact O-N 3.05Å
250	Q	95.5	Very high	94.6	Very high	97 Å²	97	62.1 Å²	62.1	45%	0.453	31%	0.31	S	S	.	.	H	α-helix	trans	-60.8	-44.6	-179.8	-176.8	59	29.6	0	0	111.6	N246 L252 I253 E254	N246-Q250 WeakPolarHBondContact O-CB 3.36Å; N246-Q250 PolarHBondContact O-N 2.97Å; Q250-L252 VanDerWaalsContact C-N 3.3Å; Q250-L252 PolarHBondContact O-N 2.83Å; Q250-I253 WeakPolarHBondContact O-CB 3.3Å; Q250-I253 PolarHBondContact O-N 3.2Å; Q250-E254 WeakPolarHBondContact CG-OE1 3.32Å; Q250-E254 PolarHBondContact NE2-OE1 2.8Å; Q250-E254 VanDerWaalsContact NE2-OE1 3.08Å; Q250-E254 WeakPolarHBondContact O-CG 3.4Å; Q250-E254 PolarHBondContact O-N 2.71Å
251	L	96.6	Very high	94.6	Very high	20 Å²	20	62.2 Å²	62.2	11%	0.105	32%	0.324	C	S	.	.	H	α-helix	trans	-55.7	-44.8	174.1	174.9	69	0	0	0	112	T131 L133 D247 K249 I253 E254 M255	T131-L251 HydrophobicContact CG2-CD1 4.38Å; T131-L251 HydrophobicContact CG2-CD2 3.76Å; T131-L251 WeakPolarHBondContact OG1-CD2 3.23Å; L133-L251 HydrophobicContact CD1-CD2 4.2Å; D247-L251 WeakPolarHBondContact O-CB 3.33Å; D247-L251 PolarHBondContact O-N 3.11Å; K249-L251 PolarHBondContact O-N 2.67Å; L251-I253 VanDerWaalsContact C-N 3.35Å; L251-E254 PolarHBondContact O-N 3.47Å; L251-M255 HydrophobicContact CD1-CE 3.96Å; L251-M255 HydrophobicContact CD1-CG 4.44Å; L251-M255 WeakPolarHBondContact O-CG 3.24Å; L251-M255 PolarHBondContact O-N 3.21Å
252	L	96.5	Very high	94.6	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-67.3	-36.6	-178.5	-69.4	170.6	0	0	0	112.2	I128 V134 C226 L228 L235 A237 Y239 A248 K249 Q250 M255 R256	I128-L252 HydrophobicContact CG2-CD2 4.21Å; V134-L252 HydrophobicContact CG2-CD2 4.2Å; V134-L252 HydrophobicContact CG2-CG 4.41Å; C226-L252 HydrophobicContact CB-CD1 3.91Å; L228-L252 HydrophobicContact CD1-CB 3.79Å; L228-L252 HydrophobicContact CD1-CD1 4.44Å; L228-L252 HydrophobicContact CD1-CG 4.49Å; L228-L252 HydrophobicContact CD2-CB 4.23Å; L228-L252 WeakPolarHBondContact CD2-O 3.43Å; L235-L252 HydrophobicContact CD2-CD2 3.87Å; L235-L252 HydrophobicContact CG-CD2 4.41Å; A237-L252 HydrophobicContact CB-CD1 3.69Å; A237-L252 HydrophobicContact CB-CD2 3.56Å; A237-L252 HydrophobicContact CB-CG 4.3Å; Y239-L252 HydrophobicContact CD1-CD1 4.1Å; Y239-L252 HydrophobicContact CE1-CD1 4.12Å; A248-L252 VanDerWaalsContact O-CG 3.31Å; A248-L252 WeakPolarHBondContact O-CG 3.41Å; A248-L252 PolarHBondContact O-N 2.98Å; K249-L252 PolarHBondContact O-N 2.66Å; K249-L252 VanDerWaalsContact O-N 3.15Å; Q250-L252 VanDerWaalsContact C-N 3.3Å; Q250-L252 PolarHBondContact O-N 2.83Å; L252-M255 PolarHBondContact O-N 3.16Å; L252-R256 PolarHBondContact O-N 2.94Å
253	I	95.7	Very high	94.6	Very high	25 Å²	25	64.7 Å²	64.7	13%	0.128	34%	0.335	C	S	.	.	H	α-helix	trans	-61.4	-49.2	173	-69.8	164.9	0	0	0	110.5	T199 I201 L228 K249 Q250 L251 M255 R256 D257	T199-I253 HydrophobicContact CG2-CD1 3.96Å; I201-I253 HydrophobicContact CD1-CD1 3.7Å; I201-I253 HydrophobicContact CD1-CG1 3.39Å; L228-I253 HydrophobicContact CD2-CG1 4.29Å; K249-I253 WeakPolarHBondContact O-CG1 3.24Å; K249-I253 PolarHBondContact O-N 3.05Å; Q250-I253 WeakPolarHBondContact O-CB 3.3Å; Q250-I253 PolarHBondContact O-N 3.2Å; L251-I253 VanDerWaalsContact C-N 3.35Å; I253-M255 VanDerWaalsContact C-N 3.26Å; I253-M255 PolarHBondContact O-N 3.05Å; I253-R256 WeakPolarHBondContact O-CB 3.12Å; I253-R256 PolarHBondContact O-N 2.76Å; I253-R256 VanDerWaalsContact O-N 3.13Å; I253-D257 PolarHBondContact O-N 2.59Å
254	E	95.8	Very high	94.5	Very high	99 Å²	99	57.8 Å²	57.8	46%	0.463	30%	0.297	S	S	.	.	H	α-helix	trans	-59.9	-38.5	178	-71.4	170.7	-167.4	0	0	111.8	Q250 L251 D257 Y258	Q250-E254 WeakPolarHBondContact CG-OE1 3.32Å; Q250-E254 PolarHBondContact NE2-OE1 2.8Å; Q250-E254 VanDerWaalsContact NE2-OE1 3.08Å; Q250-E254 WeakPolarHBondContact O-CG 3.4Å; Q250-E254 PolarHBondContact O-N 2.71Å; L251-E254 PolarHBondContact O-N 3.47Å; E254-D257 PolarHBondContact O-N 3.1Å; E254-Y258 VanDerWaalsContact O-CB 3.3Å; E254-Y258 WeakPolarHBondContact O-CB 3.19Å; E254-Y258 PolarHBondContact O-N 2.86Å
255	M	95.7	Very high	94.6	Very high	28 Å²	28	53.4 Å²	53.4	14%	0.138	29%	0.285	C	S	.	.	H	α-helix	trans	-68	-37.9	176.2	-69	-68.5	136.7	0	0	112.6	I123 I128 L235 L251 L252 I253 Y258 F259	I123-M255 HydrophobicContact CG2-SD 4.2Å; I128-M255 HydrophobicContact CD1-CB 4.41Å; I128-M255 HydrophobicContact CD1-CG 4.22Å; I128-M255 HydrophobicContact CG1-CG 3.96Å; I128-M255 HydrophobicContact CG1-SD 4.19Å; L235-M255 HydrophobicContact CD2-CB 4.23Å; L251-M255 HydrophobicContact CD1-CE 3.96Å; L251-M255 HydrophobicContact CD1-CG 4.44Å; L251-M255 WeakPolarHBondContact O-CG 3.24Å; L251-M255 PolarHBondContact O-N 3.21Å; L252-M255 PolarHBondContact O-N 3.16Å; I253-M255 VanDerWaalsContact C-N 3.26Å; I253-M255 PolarHBondContact O-N 3.05Å; M255-Y258 PolarHBondContact O-N 2.87Å; M255-F259 VanDerWaalsContact O-CD2 3.23Å; M255-F259 WeakPolarHBondContact O-CD2 3.48Å; M255-F259 VanDerWaalsContact O-CG 3.24Å; M255-F259 WeakPolarHBondContact O-CG 3.35Å; M255-F259 PolarHBondContact O-N 3.16Å
256	R	95.1	Very high	94.6	Very high	38 Å²	38	55.3 Å²	55.3	14%	0.143	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-50.4	172.5	177.1	-156.1	66.4	-165.5	1.2	110.5	T199 L228 T230 L252 I253 Y258 F259 D260	T199-R256 PolarHBondContact O-NH1 2.84Å; L228-R256 HydrophobicContact CB-CB 4.21Å; L228-R256 HydrophobicContact CB-CG 4.23Å; L228-R256 HydrophobicContact CD2-CB 3.93Å; T230-R256 HydrophobicContact CG2-CB 4.25Å; T230-R256 HydrophobicContact CG2-CG 3.58Å; L252-R256 PolarHBondContact O-N 2.94Å; I253-R256 WeakPolarHBondContact O-CB 3.12Å; I253-R256 PolarHBondContact O-N 2.76Å; I253-R256 VanDerWaalsContact O-N 3.13Å; R256-Y258 VanDerWaalsContact C-N 3.27Å; R256-Y258 PolarHBondContact O-N 2.92Å; R256-F259 PolarHBondContact O-N 3.27Å; R256-F259 VanDerWaalsContact O-N 3.11Å; R256-D260 PolarHBondContact O-N 3.19Å
257	D	95.2	Very high	94.6	Very high	79 Å²	79	51.5 Å²	51.5	42%	0.422	27%	0.274	S	S	.	.	H	α-helix	trans	-63.6	-37	-178.4	-64.9	-11.2	0	0	0	111.2	I253 E254 D260 A261	I253-D257 PolarHBondContact O-N 2.59Å; E254-D257 PolarHBondContact O-N 3.1Å; D257-D260 PolarHBondContact O-N 3.2Å; D257-A261 WeakPolarHBondContact O-CB 3.27Å; D257-A261 PolarHBondContact O-N 2.96Å
258	Y	95.7	Very high	94.5	Very high	103 Å²	103	49.9 Å²	49.9	40%	0.404	27%	0.265	S	S	.	.	H	α-helix	trans	-61	-47.2	171.5	176.5	-99.8	0	0	0	112.3	I123 E254 M255 R256 D260 A261 Q262 M264	I123-Y258 HydrophobicContact CD1-CE1 3.94Å; E254-Y258 VanDerWaalsContact O-CB 3.3Å; E254-Y258 WeakPolarHBondContact O-CB 3.19Å; E254-Y258 PolarHBondContact O-N 2.86Å; M255-Y258 PolarHBondContact O-N 2.87Å; R256-Y258 VanDerWaalsContact C-N 3.27Å; R256-Y258 PolarHBondContact O-N 2.92Å; Y258-D260 PolarHBondContact O-N 3.01Å; Y258-A261 PolarHBondContact O-N 3.48Å; Y258-Q262 HydrophobicContact CD1-CG 4.37Å; Y258-Q262 HydrophobicContact CD2-CG 4.23Å; Y258-Q262 HydrophobicContact CE1-CG 3.95Å; Y258-Q262 HydrophobicContact CE2-CG 3.79Å; Y258-Q262 VanDerWaalsContact O-CG 3.3Å; Y258-Q262 WeakPolarHBondContact O-CG 3.35Å; Y258-Q262 PolarHBondContact O-N 3.46Å; Y258-M264 HydrophobicContact CD1-CE 4.27Å; Y258-M264 HydrophobicContact CE1-CE 3.69Å
259	F	94.7	Very high	94.4	Very high	1 Å²	1	53 Å²	53	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-46.3	177	-67.1	-32.8	0	0	0	111.7	Y120 I123 I139 T230 L235 M255 R256 A261 Q262 G263 M264	Y120-F259 HydrophobicContact CD1-CE1 4.17Å; Y120-F259 HydrophobicContact CD1-CZ 4.41Å; Y120-F259 HydrophobicContact CE1-CD1 4.3Å; Y120-F259 HydrophobicContact CE1-CE1 4.29Å; I123-F259 HydrophobicContact CD1-CE1 4.08Å; I123-F259 HydrophobicContact CG2-CE1 3.92Å; I123-F259 HydrophobicContact CG2-CZ 4.05Å; I139-F259 HydrophobicContact CD1-CE2 3.86Å; I139-F259 HydrophobicContact CD1-CZ 3.51Å; I139-F259 HydrophobicContact CG1-CE2 4.27Å; I139-F259 HydrophobicContact CG1-CZ 4.4Å; T230-F259 HydrophobicContact CG2-CB 3.85Å; T230-F259 HydrophobicContact CG2-CD2 4.26Å; L235-F259 HydrophobicContact CD2-CE2 4.22Å; M255-F259 VanDerWaalsContact O-CD2 3.23Å; M255-F259 WeakPolarHBondContact O-CD2 3.48Å; M255-F259 VanDerWaalsContact O-CG 3.24Å; M255-F259 WeakPolarHBondContact O-CG 3.35Å; M255-F259 PolarHBondContact O-N 3.16Å; R256-F259 PolarHBondContact O-N 3.27Å; R256-F259 VanDerWaalsContact O-N 3.11Å; F259-A261 VanDerWaalsContact C-N 3.3Å; F259-A261 PolarHBondContact O-N 3.47Å; F259-Q262 PolarHBondContact O-N 2.89Å; F259-Q262 VanDerWaalsContact O-N 3.16Å; F259-G263 PolarHBondContact O-N 3.11Å; F259-G263 VanDerWaalsContact O-N 3.11Å; F259-M264 HydrophobicContact CB-CB 4.09Å; F259-M264 HydrophobicContact CD1-CB 4.24Å; F259-M264 HydrophobicContact CD1-CE 3.69Å; F259-M264 HydrophobicContact CD1-SD 4.45Å; F259-M264 HydrophobicContact CE1-CE 4.21Å; F259-M264 HydrophobicContact CG-CB 4.5Å; F259-M264 PolarHBondContact O-N 2.95Å
260	D	94.2	Very high	94.4	Very high	40 Å²	40	53.3 Å²	53.3	21%	0.214	29%	0.286	C	S	.	.	H	α-helix	trans	-61.6	-37.3	177.3	-83.6	-38.7	0	0	0	113	T230 K231 R256 D257 Y258 G263	T230-D260 WeakPolarHBondContact CA-OD1 3.34Å; T230-D260 WeakPolarHBondContact CB-OD1 3.12Å; K231-D260 WeakPolarHBondContact CG-OD1 3.3Å; K231-D260 PolarHBondContact N-OD1 3.34Å; R256-D260 PolarHBondContact O-N 3.19Å; D257-D260 PolarHBondContact O-N 3.2Å; Y258-D260 PolarHBondContact O-N 3.01Å; D260-G263 PolarHBondContact O-N 2.77Å
261	A	94.8	Very high	94.3	Very high	81 Å²	81	50.1 Å²	50.1	67%	0.669	27%	0.274	S	S	*	.	H	α-helix	trans	-68.8	-34.1	176.6	0	0	0	0	0	112.8	D257 Y258 F259 G263	D257-A261 WeakPolarHBondContact O-CB 3.27Å; D257-A261 PolarHBondContact O-N 2.96Å; Y258-A261 PolarHBondContact O-N 3.48Å; F259-A261 VanDerWaalsContact C-N 3.3Å; F259-A261 PolarHBondContact O-N 3.47Å; A261-G263 VanDerWaalsContact C-N 3.3Å
262	Q	92.8	Very high	94.1	Very high	114 Å²	114	52.5 Å²	52.5	53%	0.533	29%	0.287	S	S	.	.	H	α-helix	trans	-83.5	-3	177	-62.1	-58.5	-47.1	0	0	113.3	Y258 F259 M264	Y258-Q262 HydrophobicContact CD1-CG 4.37Å; Y258-Q262 HydrophobicContact CD2-CG 4.23Å; Y258-Q262 HydrophobicContact CE1-CG 3.95Å; Y258-Q262 HydrophobicContact CE2-CG 3.79Å; Y258-Q262 VanDerWaalsContact O-CG 3.3Å; Y258-Q262 WeakPolarHBondContact O-CG 3.35Å; Y258-Q262 PolarHBondContact O-N 3.46Å; F259-Q262 PolarHBondContact O-N 2.89Å; F259-Q262 VanDerWaalsContact O-N 3.16Å; Q262-M264 HydrophobicContact CB-CB 4.46Å; Q262-M264 HydrophobicContact CB-CE 3.48Å; Q262-M264 VanDerWaalsContact CB-CE 3.48Å; Q262-M264 HydrophobicContact CB-CG 4.06Å; Q262-M264 HydrophobicContact CG-CE 3.77Å; Q262-M264 PolarHBondContact O-N 3.37Å
263	G	89.3	Confident	93.9	Very high	46 Å²	46	56.8 Å²	56.8	47%	0.474	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	21.4	-174.7	0	0	0	0	0	113.6	N232 F259 D260 A261	N232-G263 PolarHBondContact ND2-O 3.5Å; F259-G263 PolarHBondContact O-N 3.11Å; F259-G263 VanDerWaalsContact O-N 3.11Å; D260-G263 PolarHBondContact O-N 2.77Å; A261-G263 VanDerWaalsContact C-N 3.3Å
264	M	88.1	Confident	93.8	Very high	28 Å²	28	59.7 Å²	59.7	14%	0.138	33%	0.328	C	S	.	.			trans	-89	0	177.9	-76.3	-164	-70.9	0	0	112	V119 Y120 I123 N232 S233 Y258 F259 Q262	V119-M264 HydrophobicContact CG1-SD 4.29Å; Y120-M264 HydrophobicContact CD1-SD 4.37Å; Y120-M264 HydrophobicContact CE1-CB 3.84Å; Y120-M264 HydrophobicContact CE1-CG 4.21Å; Y120-M264 HydrophobicContact CE1-SD 3.85Å; Y120-M264 VanDerWaalsContact OH-CA 3.24Å; Y120-M264 WeakPolarHBondContact OH-CA 3.22Å; Y120-M264 WeakPolarHBondContact OH-CB 3.3Å; Y120-M264 PolarHBondContact OH-OXT 3.31Å; I123-M264 HydrophobicContact CD1-CE 3.91Å; I123-M264 HydrophobicContact CD1-SD 4.46Å; N232-M264 VanDerWaalsContact CB-OXT 3.27Å; N232-M264 WeakPolarHBondContact CB-OXT 3.33Å; S233-M264 VanDerWaalsContact CB-OXT 3.3Å; S233-M264 WeakPolarHBondContact CB-OXT 3.34Å; S233-M264 PolarHBondContact N-OXT 3.31Å; S233-M264 PolarHBondContact OG-OXT 3.2Å; Y258-M264 HydrophobicContact CD1-CE 4.27Å; Y258-M264 HydrophobicContact CE1-CE 3.69Å; F259-M264 HydrophobicContact CB-CB 4.09Å; F259-M264 HydrophobicContact CD1-CB 4.24Å; F259-M264 HydrophobicContact CD1-CE 3.69Å; F259-M264 HydrophobicContact CD1-SD 4.45Å; F259-M264 HydrophobicContact CE1-CE 4.21Å; F259-M264 HydrophobicContact CG-CB 4.5Å; F259-M264 PolarHBondContact O-N 2.95Å; Q262-M264 HydrophobicContact CB-CB 4.46Å; Q262-M264 HydrophobicContact CB-CE 3.48Å; Q262-M264 VanDerWaalsContact CB-CE 3.48Å; Q262-M264 HydrophobicContact CB-CG 4.06Å; Q262-M264 HydrophobicContact CG-CE 3.77Å; Q262-M264 PolarHBondContact O-N 3.37Å

Retrieved 264 of 264 residues in 159.8 ms (Link to these results)

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