A0A0D9R155_CHLSB Loading...

Integrin-linked kinase-associated serine/threonine phosphatase 2C

Protein phosphatase that may play a role in regulation of cell cycle progression via dephosphorylation of its substrates whose appropriate phosphorylation states might be crucial for cell proliferation. Selectively associates with integrin linked kinase (ILK), to modulate cell adhesion and growth factor signaling. Inhibits the ILK-GSK3B signaling axis and may play an important role in inhibiting oncogenic transformation.

AlphaFold DB , UniProt , Accession A0A0D9R155, Species CHLSB (Chlorocebus sabaeus, Green monkey), Gene ILKAP, Length 392 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.1	Very low	45.7	Very low	231 Å²	231	163.7 Å²	163.7	100%	1.138	88%	0.88	S	S	*	*				0	85	0	-83.4	-179.3	172.4	0	0	105.2
2	D	39.1	Very low	45.1	Very low	162 Å²	162	170.8 Å²	170.8	87%	0.866	89%	0.885	S	S	*	*			trans	-110.5	115	179	-68.5	-52	0	0	0	107
3	L	42.3	Very low	45	Very low	165 Å²	165	166.8 Å²	166.8	86%	0.864	88%	0.881	S	S	*	*			trans	-96.2	104.7	171.3	-90.5	101.5	0	0	0	108
4	F	47.6	Very low	45	Very low	207 Å²	207	163.9 Å²	163.9	91%	0.908	88%	0.876	S	S	*	*			trans	-128.6	110.2	154.9	-95.9	-87.5	0	0	0	107.3
5	G	42.3	Very low	44.7	Very low	72 Å²	72	169.2 Å²	169.2	74%	0.742	88%	0.879	S	S	*	*			trans	-91.4	134.2	169.9	0	0	0	0	0	109.7
6	D	46.3	Very low	44.5	Very low	166 Å²	166	166.8 Å²	166.8	89%	0.888	88%	0.877	S	S	*	*			trans	-62.5	139.4	176.7	-66.9	-49	0	0	0	112.6
7	L	49.9	Very low	43.9	Very low	167 Å²	167	162.9 Å²	162.9	87%	0.874	87%	0.874	S	S	*	*			trans	-119.1	135.4	163.9	-83.3	166.3	0	0	0	109.1
8	P	50.9	Low	43.4	Very low	121 Å²	121	159.9 Å²	159.9	79%	0.786	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-86.1	147.6	-172.3	32.4	-33.2	0	0	0	114
9	E	52.4	Low	42.7	Very low	186 Å²	186	155.2 Å²	155.2	87%	0.869	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-74	150.2	173.3	-64.9	-172.9	155.6	0	0	112.9
10	P	49	Very low	42.3	Very low	128 Å²	128	158.1 Å²	158.1	83%	0.831	87%	0.871	S	S	*	*	P	Polyproline II helix	trans	-86.5	133.4	175.6	31.6	-31	0	0	0	113.7
11	E	40.8	Very low	41.9	Very low	196 Å²	196	159.7 Å²	159.7	92%	0.916	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-69.7	146.1	-180	-67.6	-174.3	152.7	0	0	114.8
12	R	38.3	Very low	41.5	Very low	249 Å²	249	153.1 Å²	153.1	94%	0.94	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-78.3	135.1	167.9	-77.5	177.2	171.6	-179.3	-2	111
13	S	44.4	Very low	41.2	Very low	118 Å²	118	154.6 Å²	154.6	83%	0.825	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-97.3	145.9	170	53.3	0	0	0	0	113
14	P	45	Very low	40.8	Very low	126 Å²	126	157 Å²	157	82%	0.818	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-100.5	157.8	-174.9	37.5	-33	0	0	0	114.7
15	R	39.3	Very low	40.1	Very low	244 Å²	244	150.6 Å²	150.6	92%	0.921	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-92.1	153.3	159	-71	-175.5	-177	-173.4	1.3	109
16	P	43	Very low	40.4	Very low	131 Å²	131	152.8 Å²	152.8	85%	0.851	85%	0.854	S	S	*	*				-146.7	-173.4	68.3	33.6	-8.8	0	0	0	112.5
17	A	32.7	Very low	39.9	Very low	100 Å²	100	152.5 Å²	152.5	83%	0.826	85%	0.851	S	S	*	*			cis	-166.9	-177.4	37.1	0	0	0	0	0	112.9
18	A	36	Very low	39.2	Very low	109 Å²	109	152.1 Å²	152.1	90%	0.901	85%	0.849	S	S	*	*			trans	-70.7	164.2	-163.2	0	0	0	0	0	119.3
19	G	29.9	Very low	38.5	Very low	71 Å²	71	154.8 Å²	154.8	73%	0.732	85%	0.849	S	S	*	*			trans	175.7	124.7	156.7	0	0	0	0	0	116.2
20	K	34.8	Very low	37.6	Very low	212 Å²	212	153.1 Å²	153.1	92%	0.922	85%	0.846	S	S	*	*			trans	102.4	107.3	153.9	-61.2	-172.3	176.8	-178.5	0	120.1
21	E	33.6	Very low	37	Very low	193 Å²	193	154.2 Å²	154.2	90%	0.902	84%	0.844	S	S	*	*			trans	-66.9	147.8	146.7	-69	177.2	128.9	0	0	111.5
22	A	32.8	Very low	37.1	Very low	93 Å²	93	152.9 Å²	152.9	77%	0.769	84%	0.843	S	S	*	*				177.4	127.3	125.3	0	0	0	0	0	113.6
23	Q	34	Very low	37.5	Very low	193 Å²	193	146.9 Å²	146.9	90%	0.902	84%	0.836	S	S	*	*			trans	87.3	113.8	143.1	-69.3	-179.4	-4.7	0	0	123.5
24	K	34.1	Very low	37.3	Very low	215 Å²	215	147.2 Å²	147.2	94%	0.935	84%	0.835	S	S	*	*			trans	-48.1	156	155.1	-63.8	169.4	171	177.9	0	112.3
25	G	33.4	Very low	36.9	Very low	73 Å²	73	146.3 Å²	146.3	75%	0.753	84%	0.839	S	S	*	*			cis	177	-157.2	8.3	0	0	0	0	0	106.1
26	P	46.7	Very low	36.8	Very low	118 Å²	118	140.5 Å²	140.5	77%	0.766	84%	0.836	S	S	*	*			cis	-129.4	157.3	-16.7	38.6	-21.1	0	0	0	115.6
27	L	37.5	Very low	36.4	Very low	159 Å²	159	139.2 Å²	139.2	83%	0.832	83%	0.829	S	S	*	*			trans	42.5	127.6	135.3	-55.2	172	0	0	0	122.5
28	L	35.2	Very low	36.4	Very low	160 Å²	160	141 Å²	141	84%	0.838	83%	0.83	S	S	*	*				-162.2	110.6	126.9	-97.5	130.9	0	0	0	111.3
29	F	34.8	Very low	36.1	Very low	177 Å²	177	142.6 Å²	142.6	78%	0.776	82%	0.824	S	S	*	*			trans	63.5	100.7	156.7	-76.7	-96.4	0	0	0	122.1
30	D	33.7	Very low	36.3	Very low	151 Å²	151	144 Å²	144	81%	0.807	82%	0.822	S	S	*	*			trans	-59.3	146.4	136.3	-72.2	-52.5	0	0	0	111.8
31	D	37	Very low	36	Very low	150 Å²	150	137.6 Å²	137.6	80%	0.802	82%	0.817	S	S	*	*			trans	-168.3	89.2	142.7	-98.4	-23	0	0	0	110.6
32	L	41.8	Very low	36	Very low	168 Å²	168	134.5 Å²	134.5	88%	0.88	82%	0.817	S	S	*	*			trans	-141.4	126.8	156.2	-78.7	176.2	0	0	0	108.9
33	P	47.3	Very low	35.9	Very low	123 Å²	123	133.8 Å²	133.8	80%	0.799	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-78	144.2	177.3	29.8	-31.9	0	0	0	111.9
34	P	41.1	Very low	35.9	Very low	125 Å²	125	128.2 Å²	128.2	81%	0.812	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-84.8	154.1	178.1	33.7	-32.6	0	0	0	112.7
35	A	35.6	Very low	36.3	Very low	108 Å²	108	123.9 Å²	123.9	89%	0.893	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-63.8	134.5	174	0	0	0	0	0	112
36	S	36.9	Very low	36.4	Very low	122 Å²	122	128 Å²	128	85%	0.853	81%	0.811	S	S	*	*			trans	-109.2	137.5	167.1	53.8	0	0	0	0	111
37	S	34.8	Very low	35.8	Very low	103 Å²	103	129 Å²	129	72%	0.72	81%	0.809	S	S	*	*			trans	-101.6	168.3	174	49.4	0	0	0	0	110.9
38	T	33.3	Very low	35.6	Very low	138 Å²	138	131.6 Å²	131.6	85%	0.847	81%	0.814	S	S	*	*			trans	82.9	137.2	176.7	76	0	0	0	0	113.8
39	D	30.7	Very low	35.5	Very low	142 Å²	142	131.5 Å²	131.5	76%	0.759	81%	0.814	S	S	*	*			cis	-161.6	164.4	13.9	-166.9	18.3	0	0	0	110.5
40	S	33.2	Very low	35.6	Very low	100 Å²	100	130.9 Å²	130.9	70%	0.699	82%	0.819	S	S	*	*			trans	10.2	137.1	156.2	64	0	0	0	0	122.6
41	G	29	Very low	35.9	Very low	79 Å²	79	131.8 Å²	131.8	81%	0.814	82%	0.822	S	S	*	*			trans	162.2	104.7	159.6	0	0	0	0	0	116.6
42	S	33	Very low	36.4	Very low	128 Å²	128	130.4 Å²	130.4	90%	0.895	82%	0.822	S	S	*	*			trans	-55.3	145.6	171.7	51.4	0	0	0	0	115.8
43	G	30.3	Very low	36.4	Very low	77 Å²	77	128.6 Å²	128.6	79%	0.794	82%	0.82	S	S	*	*			trans	150.7	96.4	150.1	0	0	0	0	0	117.8
44	G	34.8	Very low	35.7	Very low	77 Å²	77	127.3 Å²	127.3	79%	0.794	82%	0.82	S	S	*	*			trans	73	159.4	135.2	0	0	0	0	0	120.7
45	P	43	Very low	35.3	Very low	123 Å²	123	127.4 Å²	127.4	80%	0.799	82%	0.823	S	S	*	*			trans	-111.8	146.5	-144.6	37.6	-26.1	0	0	0	113.8
46	L	34.2	Very low	35.2	Very low	161 Å²	161	127.9 Å²	127.9	84%	0.843	82%	0.82	S	S	*	*			trans	-157	145.1	168.8	-70.6	-177.4	0	0	0	105.4
47	L	35.6	Very low	34.9	Very low	139 Å²	139	125.7 Å²	125.7	73%	0.728	82%	0.817	S	S	*	*			cis	-176.7	116.5	17.4	-113.5	154.9	0	0	0	103
48	F	32.9	Very low	34.6	Very low	213 Å²	213	128.5 Å²	128.5	93%	0.934	82%	0.824	S	S	*	*			trans	-175.7	88.2	155.8	-106.6	-72.6	0	0	0	108.5
49	D	32.6	Very low	34.4	Very low	158 Å²	158	127 Å²	127	85%	0.845	82%	0.819	S	S	*	*			trans	-145.6	106.5	160.3	-99.7	-28.2	0	0	0	106.2
50	D	36.6	Very low	34.3	Very low	164 Å²	164	124.1 Å²	124.1	88%	0.877	82%	0.823	S	S	*	*			trans	-167.5	86.5	159.1	-98.5	-24.5	0	0	0	109
51	L	40.4	Very low	34	Very low	169 Å²	169	124.3 Å²	124.3	89%	0.885	82%	0.824	S	S	*	*			trans	-134.4	126.9	160	-76.9	174.7	0	0	0	108.6
52	P	46.7	Very low	34	Very low	121 Å²	121	128.8 Å²	128.8	79%	0.786	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-77.4	147	177.4	29.7	-32.5	0	0	0	112
53	P	43.5	Very low	33.9	Very low	130 Å²	130	127 Å²	127	84%	0.844	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-86.5	165.5	-177.7	34.6	-33.7	0	0	0	113.9
54	A	32	Very low	34.6	Very low	96 Å²	96	129.3 Å²	129.3	79%	0.793	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-56.3	151.1	-177.4	0	0	0	0	0	115.7
55	S	32.7	Very low	34.2	Very low	127 Å²	127	131.6 Å²	131.6	89%	0.888	83%	0.826	S	S	*	*			trans	-111.3	113.7	154.9	61.5	0	0	0	0	109.1
56	S	32.3	Very low	33.5	Very low	119 Å²	119	133.4 Å²	133.4	83%	0.832	83%	0.828	S	S	*	*			trans	-125.1	113.5	166.9	53.5	0	0	0	0	106.6
57	G	30.6	Very low	33.2	Very low	76 Å²	76	130.7 Å²	130.7	78%	0.784	82%	0.822	S	S	*	*			trans	-145.5	85.6	-177.5	0	0	0	0	0	110.2
58	D	29.1	Very low	32.8	Very low	162 Å²	162	132.6 Å²	132.6	87%	0.866	83%	0.827	S	S	*	*			trans	56.5	151.3	137.8	-133.6	-3.7	0	0	0	123.9
59	S	30	Very low	32.5	Very low	107 Å²	107	130.9 Å²	130.9	75%	0.748	82%	0.824	S	S	*	*			trans	-61.5	156.2	-170.5	54.3	0	0	0	0	118.6
60	G	27.1	Very low	32.2	Very low	80 Å²	80	128.5 Å²	128.5	83%	0.825	82%	0.815	S	S	*	*			trans	-172.9	99	168.5	0	0	0	0	0	112.2
61	S	28.1	Very low	31.7	Very low	105 Å²	105	129.3 Å²	129.3	73%	0.734	81%	0.811	S	S	*	*			trans	-63.6	147.4	177.3	52.5	0	0	0	0	115.2
62	L	28.8	Very low	31	Very low	173 Å²	173	126.7 Å²	126.7	91%	0.906	80%	0.798	S	S	*	*				163.6	141.7	118.1	-86	158.3	0	0	0	111.7
63	A	30.8	Very low	30	Very low	91 Å²	91	129.2 Å²	129.2	75%	0.752	80%	0.799	S	S	*	*			trans	-92.9	-162	-175.2	0	0	0	0	0	112.1
64	P	43.8	Very low	29.3	Very low	124 Å²	124	126.3 Å²	126.3	81%	0.805	79%	0.793	S	S	*	*				-114.3	168.1	-105.2	33.2	-14.9	0	0	0	112.9
65	S	27.9	Very low	29	Very low	125 Å²	125	132.2 Å²	132.2	87%	0.874	80%	0.8	S	S	*	*			trans	-152.3	135.2	158.1	36.1	0	0	0	0	114.1
66	I	27.9	Very low	28.8	Very low	162 Å²	162	130.1 Å²	130.1	83%	0.831	80%	0.799	S	S	*	*			trans	-65.5	142.8	172.8	-67.7	159.9	0	0	0	110
67	S	28.1	Very low	28.8	Very low	104 Å²	104	128.8 Å²	128.8	73%	0.727	80%	0.795	S	S	*	*				169	132.5	120.4	41.6	0	0	0	0	114.9
68	Q	26.9	Very low	28.6	Very low	179 Å²	179	134.8 Å²	134.8	84%	0.836	80%	0.8	S	S	*	*			trans	18.5	122.1	142.6	-69.2	169.1	-39.5	0	0	119.1
69	M	25.9	Very low	28.6	Very low	177 Å²	177	139.5 Å²	139.5	87%	0.872	81%	0.805	S	S	*	*				71	129.9	74.2	-148.2	-176.4	-168.5	0	0	114
70	V	27.3	Very low	28.5	Very low	107 Å²	107	143.8 Å²	143.8	65%	0.648	81%	0.81	S	S	*	*			trans	117.6	108	150.1	-176.9	0	0	0	0	117.3
71	K	25.8	Very low	28.4	Very low	182 Å²	182	146.1 Å²	146.1	79%	0.791	81%	0.809	S	S	*	*			trans	56.9	156.5	136	-61.5	176.7	-172.3	177.3	0	119.2
72	N	25.6	Very low	28.2	Very low	113 Å²	113	145.6 Å²	145.6	60%	0.604	81%	0.805	S	S	*	*			cis	-164.2	157.8	5.2	-129.8	13.5	0	0	0	107.5
73	E	26	Very low	28.1	Very low	175 Å²	175	145.8 Å²	145.8	82%	0.818	80%	0.802	S	S	*	*			trans	49.9	137.2	138.8	-62.4	173.3	146	0	0	121
74	G	28	Very low	27.9	Very low	69 Å²	69	150.4 Å²	150.4	71%	0.711	81%	0.808	S	S	*	*			cis	170.5	-180	4.8	0	0	0	0	0	113
75	K	26.9	Very low	27.2	Very low	219 Å²	219	153.4 Å²	153.4	95%	0.952	81%	0.811	S	S	*	*			trans	60.4	113	150	-65.5	179.6	178.5	173	0	120.6
76	G	28.6	Very low	27.3	Very low	83 Å²	83	157.2 Å²	157.2	86%	0.856	81%	0.812	S	S	*	*			trans	-152	125.7	148.1	0	0	0	0	0	109.4
77	A	31.4	Very low	27.1	Very low	92 Å²	92	158 Å²	158	76%	0.76	82%	0.817	S	S	*	*			trans	-107.1	151	-158.2	0	0	0	0	0	115.1
78	K	26.9	Very low	27.1	Very low	201 Å²	201	156.1 Å²	156.1	87%	0.874	82%	0.815	S	S	*	*			trans	67.1	119	145.2	-76.2	177.3	175.8	175.9	0	120.4
79	R	29.8	Very low	27.2	Very low	261 Å²	261	153.1 Å²	153.1	99%	0.985	81%	0.813	S	S	*	*				-152	145.3	113.5	-101.7	168.9	-169.4	162.5	2.8	109.8
80	K	26.2	Very low	27.4	Very low	197 Å²	197	153.9 Å²	153.9	86%	0.857	82%	0.815	S	S	*	*			trans	-129.2	136.6	-159.1	-176.2	-170.5	-174.2	-171.7	0	108.6
81	T	25.1	Very low	27.4	Very low	130 Å²	130	156.8 Å²	156.8	80%	0.798	82%	0.822	S	S	*	*			trans	-167	100	157	28.6	0	0	0	0	105.8
82	S	25.5	Very low	27.7	Very low	94 Å²	94	155.8 Å²	155.8	66%	0.657	82%	0.824	S	S	*	*				64.7	123.2	97.8	61.7	0	0	0	0	111.6
83	E	25.2	Very low	27.8	Very low	177 Å²	177	155.9 Å²	155.9	83%	0.827	83%	0.829	S	S	*	*			cis	-151	158.2	12.8	-80.1	143.4	173.3	0	0	105.3
84	E	27.6	Very low	28.1	Very low	187 Å²	187	155.7 Å²	155.7	87%	0.874	83%	0.828	S	S	*	*				178.9	135.1	72.7	-124.8	169.8	-165.7	0	0	107.3
85	E	28.7	Very low	28.4	Very low	188 Å²	188	161.4 Å²	161.4	88%	0.879	83%	0.833	S	S	*	*			trans	-85	136	173.8	-69.3	178.3	148.5	0	0	110.6
86	K	29	Very low	28.5	Very low	204 Å²	204	160 Å²	160	89%	0.887	83%	0.827	S	S	*	*			trans	-169.2	98.2	138.9	-107.9	167.7	-174.4	179.2	0	111.2	G88	K86-G88 PolarHBondContact O-N 2.88Å
87	N	25.7	Very low	28.7	Very low	178 Å²	178	162.3 Å²	162.3	95%	0.952	82%	0.824	S	S	*	*			trans	-69.7	103.3	157.7	-83.2	-19.1	0	0	0	108.2
88	G	26.4	Very low	28.7	Very low	65 Å²	65	163.2 Å²	163.2	67%	0.67	82%	0.823	S	S	*	*			trans	-93.5	110.4	165	0	0	0	0	0	109.1	K86 E90	K86-G88 PolarHBondContact O-N 2.88Å; G88-E90 PolarHBondContact O-N 3.48Å
89	S	29.3	Very low	29.2	Very low	116 Å²	116	163.5 Å²	163.5	81%	0.811	83%	0.825	S	S	*	*			trans	-52.5	116.7	165	46.5	0	0	0	0	110.4	E91	S89-E91 PolarHBondContact O-N 2.86Å
90	E	29.9	Very low	29.8	Very low	193 Å²	193	154.2 Å²	154.2	90%	0.902	80%	0.804	S	S	*	*			trans	-69	100.2	164	-72.4	-173	165.4	0	0	107.9	G88 L92	G88-E90 PolarHBondContact O-N 3.48Å; E90-L92 PolarHBondContact O-N 3.48Å
91	E	27.4	Very low	30.9	Very low	169 Å²	169	150.7 Å²	150.7	79%	0.79	80%	0.804	S	S	*	*			trans	-60.6	101.2	171.1	-165.6	175.9	-172.3	0	0	108	S89 V93	S89-E91 PolarHBondContact O-N 2.86Å; E91-V93 VanDerWaalsContact C-N 3.26Å; E91-V93 PolarHBondContact O-N 2.65Å
92	L	31.7	Very low	32.9	Very low	161 Å²	161	148.5 Å²	148.5	84%	0.843	79%	0.794	S	S	*	*			trans	-58.9	97	161.8	-81	160.1	0	0	0	106.8	E90 E94	E90-L92 PolarHBondContact O-N 3.48Å; L92-E94 PolarHBondContact O-N 3.4Å
93	V	29.1	Very low	35.7	Very low	115 Å²	115	148.4 Å²	148.4	70%	0.697	79%	0.789	S	S	*	*			trans	-64.9	87.1	166.5	-176.5	0	0	0	0	106.5	E91 K95	E91-V93 VanDerWaalsContact C-N 3.26Å; E91-V93 PolarHBondContact O-N 2.65Å; V93-K95 VanDerWaalsContact C-N 3.25Å; V93-K95 PolarHBondContact O-N 2.78Å
94	E	32	Very low	38.9	Very low	171 Å²	171	143.5 Å²	143.5	80%	0.799	77%	0.768	S	S	*	*			trans	-55.6	98.6	158.8	-79.4	-173.4	159	0	0	106.2	L92 K96	L92-E94 PolarHBondContact O-N 3.4Å; E94-K96 PolarHBondContact O-N 3.41Å
95	K	34	Very low	42	Very low	188 Å²	188	135.4 Å²	135.4	82%	0.817	73%	0.729	S	S	*	*			trans	-58.4	94.7	162.4	-80.9	-176.3	176.8	177.2	0	106.1	V93 V97	V93-K95 VanDerWaalsContact C-N 3.25Å; V93-K95 PolarHBondContact O-N 2.78Å; K95-V97 VanDerWaalsContact C-N 3.32Å; K95-V97 PolarHBondContact O-N 3.01Å
96	K	29.6	Very low	45.2	Very low	190 Å²	190	128.3 Å²	128.3	83%	0.826	71%	0.707	S	S	*	*			trans	-48.6	102.6	163.9	-83.8	-179.7	173.6	174.2	0	106.6	E94 C98	E94-K96 PolarHBondContact O-N 3.41Å; K96-C98 VanDerWaalsContact C-N 3.3Å; K96-C98 PolarHBondContact O-N 3.07Å
97	V	33.2	Very low	48.4	Very low	132 Å²	132	119.3 Å²	119.3	80%	0.8	67%	0.668	S	S	*	*			trans	-62.5	102.5	165.9	174.9	0	0	0	0	104.6	K95 K99	K95-V97 VanDerWaalsContact C-N 3.32Å; K95-V97 PolarHBondContact O-N 3.01Å; V97-K99 PolarHBondContact O-N 3.23Å
98	C	31.2	Very low	51.8	Low	110 Å²	110	114.4 Å²	114.4	74%	0.743	64%	0.638	S	S	*	*			trans	-55.1	105.8	167.8	-69.4	0	0	0	0	106.6	K96 A100	K96-C98 VanDerWaalsContact C-N 3.3Å; K96-C98 PolarHBondContact O-N 3.07Å; C98-A100 PolarHBondContact O-N 3.26Å
99	K	37	Very low	55.3	Low	208 Å²	208	111.7 Å²	111.7	90%	0.904	61%	0.611	S	S	*	*			trans	-66.5	70.4	159.5	-87.1	-176	173.5	179.5	0	107.3	V97 S101	V97-K99 PolarHBondContact O-N 3.23Å; K99-S101 PolarHBondContact O-N 3.01Å
100	A	42.8	Very low	58.6	Low	66 Å²	66	106.7 Å²	106.7	55%	0.545	57%	0.574	S	S	.	*			trans	-63.7	128.2	152.2	0	0	0	0	0	105.2	C98 S102	C98-A100 PolarHBondContact O-N 3.26Å; A100-S102 PolarHBondContact O-N 3.01Å; A100-S102 PolarHBondContact O-OG 2.77Å
101	S	48.6	Very low	61.8	Low	122 Å²	122	99.4 Å²	99.4	85%	0.853	54%	0.543	S	S	*	.			trans	-52.3	92.7	167	174.4	0	0	0	0	107.5	K99 V103	K99-S101 PolarHBondContact O-N 3.01Å; S101-V103 PolarHBondContact O-N 2.85Å; S101-V103 VanDerWaalsContact O-N 3.15Å
102	S	67.4	Low	65.2	Low	84 Å²	84	91.7 Å²	91.7	59%	0.587	51%	0.508	S	S	*	.			trans	-80	106.5	-166.9	-64.9	0	0	0	0	106.4	A100 I104	A100-S102 PolarHBondContact O-N 3.01Å; A100-S102 PolarHBondContact O-OG 2.77Å; S102-I104 PolarHBondContact O-N 2.87Å
103	V	84.5	Confident	68.4	Low	93 Å²	93	87.2 Å²	87.2	56%	0.564	48%	0.483	S	S	*	.			trans	-50.8	127.3	173.4	178.5	0	0	0	0	108.2	S101 N227	S101-V103 PolarHBondContact O-N 2.85Å; S101-V103 VanDerWaalsContact O-N 3.15Å; V103-N227 PolarHBondContact O-ND2 2.92Å
104	I	90.9	Very high	71.7	Confident	73 Å²	73	84.6 Å²	84.6	37%	0.374	46%	0.46	S	S	.	.			trans	-86.4	112.8	-178.7	-68.1	155.2	0	0	0	107.7	S102 G106 T143 R144 N227	S102-I104 PolarHBondContact O-N 2.87Å; I104-G106 PolarHBondContact O-N 2.74Å; I104-T143 HydrophobicContact CD1-CG2 4.21Å; I104-T143 WeakPolarHBondContact CD1-OG1 3.47Å; I104-R144 HydrophobicContact CG2-CB 4.43Å; I104-N227 WeakPolarHBondContact CA-OD1 3.26Å
105	F	93.8	Very high	74.8	Confident	17 Å²	17	81.2 Å²	81.2	8%	0.075	44%	0.443	C	S	.	.			trans	-69.9	117	-172	-63.7	-72.9	0	0	0	111.8	L107 R144 N227 L314 P316 I390 G391 H392	F105-L107 PolarHBondContact O-N 2.84Å; F105-R144 VanDerWaalsContact C-NH1 3.26Å; F105-R144 PolarHBondContact O-NH1 2.92Å; F105-R144 PolarHBondContact O-NH2 3.43Å; F105-N227 HydrophobicContact CD2-CB 4.27Å; F105-N227 VanDerWaalsContact CD2-OD1 3.3Å; F105-N227 WeakPolarHBondContact CD2-OD1 3.38Å; F105-N227 PolarHBondContact N-OD1 2.8Å; F105-L314 HydrophobicContact CB-CD1 4.27Å; F105-L314 HydrophobicContact CD2-CB 3.66Å; F105-L314 HydrophobicContact CD2-CD1 4.06Å; F105-L314 HydrophobicContact CE2-CB 3.86Å; F105-P316 HydrophobicContact CZ-CG 4.16Å; F105-I390 HydrophobicContact CB-CG2 3.78Å; F105-I390 HydrophobicContact CD1-CG2 4.27Å; F105-I390 HydrophobicContact CG-CG2 4.09Å; F105-G391 CarbonylContact C-O 3.46Å; F105-G391 VanDerWaalsContact CA-O 3.32Å; F105-G391 WeakPolarHBondContact CA-O 3.48Å; F105-H392 AromaticContact CD1-CE1 3.88Å; F105-H392 AromaticContact CD1-ND1 3.55Å; F105-H392 AromaticContact CE1-CE1 3.68Å; F105-H392 AromaticContact CE1-ND1 3.27Å; F105-H392 VanDerWaalsContact CE1-ND1 3.27Å; F105-H392 WeakPolarHBondContact CE1-ND1 3.4Å
106	G	94.8	Very high	77.5	Confident	39 Å²	39	73.6 Å²	73.6	40%	0.402	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	136.1	179.8	0	0	0	0	0	112.5	I104 G391	I104-G106 PolarHBondContact O-N 2.74Å; G106-G391 PolarHBondContact N-O 3.48Å; G106-G391 PolarHBondContact O-N 3.12Å
107	L	97.3	Very high	80.6	Confident	15 Å²	15	71.6 Å²	71.6	8%	0.079	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.1	178.4	-60.7	179.9	0	0	0	110.4	F105 F148 A224 L314 V388 R389 I390	F105-L107 PolarHBondContact O-N 2.84Å; L107-F148 HydrophobicContact CB-CE2 4.15Å; L107-F148 HydrophobicContact CB-CZ 3.99Å; L107-F148 HydrophobicContact CD1-CE2 4.18Å; L107-A224 HydrophobicContact CD1-CB 3.29Å; L107-L314 HydrophobicContact CD2-CD1 4.31Å; L107-V388 HydrophobicContact CB-CG1 4.18Å; L107-V388 HydrophobicContact CD2-CG1 4.35Å; L107-R389 WeakPolarHBondContact CA-O 3.36Å; L107-I390 HydrophobicContact CD2-CB 4.37Å; L107-I390 HydrophobicContact CD2-CG1 3.81Å; L107-I390 HydrophobicContact CD2-CG2 4.46Å
108	K	97.9	Very high	83.5	Confident	75 Å²	75	70 Å²	70	33%	0.326	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	121.9	175.8	-173.6	169	170.1	-171.1	0	111.2	Y110 N129 D360 V388 R389	K108-Y110 HydrophobicContact CB-CE2 4.33Å; K108-Y110 VanDerWaalsContact CD-OH 3.27Å; K108-Y110 WeakPolarHBondContact CD-OH 3.47Å; K108-Y110 WeakPolarHBondContact CE-OH 3.38Å; K108-Y110 HydrophobicContact CG-CE2 4.09Å; K108-Y110 WeakPolarHBondContact O-CE2 3.48Å; K108-N129 WeakPolarHBondContact CA-OD1 3.46Å; K108-D360 IonicContact NZ-OD1 2.71Å; K108-D360 PolarHBondContact NZ-OD1 3.35Å; K108-D360 IonicContact NZ-OD2 3.91Å; K108-D360 PolarHBondContact NZ-OD2 3.24Å; K108-V388 CarbonylContact O-C 3.53Å; K108-V388 WeakPolarHBondContact O-CA 3.37Å; K108-R389 PolarHBondContact N-O 2.65Å; K108-R389 PolarHBondContact O-N 2.67Å
109	G	98.3	Very high	86.6	Confident	9 Å²	9	73.4 Å²	73.4	9%	0.093	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	146.1	179.9	0	0	0	0	0	113.4	N129 V387	G109-N129 PolarHBondContact N-OD1 2.96Å; G109-V387 CarbonylContact C-O 3.45Å
110	Y	98.6	Very high	89.4	Confident	11 Å²	11	68.6 Å²	68.6	4%	0.043	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	148.9	171.1	-53.2	-91.4	0	0	0	108.1	K108 D360 Y363 E364 M386 V387 R389	K108-Y110 HydrophobicContact CB-CE2 4.33Å; K108-Y110 VanDerWaalsContact CD-OH 3.27Å; K108-Y110 WeakPolarHBondContact CD-OH 3.47Å; K108-Y110 WeakPolarHBondContact CE-OH 3.38Å; K108-Y110 HydrophobicContact CG-CE2 4.09Å; K108-Y110 WeakPolarHBondContact O-CE2 3.48Å; Y110-D360 HydrophobicContact CE1-CB 4.03Å; Y110-D360 PolarHBondContact OH-OD1 3.36Å; Y110-Y363 HydrophobicContact CD2-CD1 4.02Å; Y110-Y363 AromaticContact CD2-CG 3.8Å; Y110-Y363 HydrophobicContact CD2-CG 3.8Å; Y110-Y363 HydrophobicContact CE2-CD1 4.18Å; Y110-Y363 HydrophobicContact CE2-CD2 4.13Å; Y110-Y363 AromaticContact CE2-CG 3.69Å; Y110-Y363 HydrophobicContact CE2-CG 3.69Å; Y110-Y363 HydrophobicContact CG-CG 4.48Å; Y110-E364 HydrophobicContact CD1-CG 3.73Å; Y110-E364 HydrophobicContact CE1-CG 4.34Å; Y110-M386 CarbonylContact O-C 3.55Å; Y110-M386 WeakPolarHBondContact O-CA 3.36Å; Y110-M386 WeakPolarHBondContact O-CG 3.17Å; Y110-V387 WeakPolarHBondContact CD2-O 3.35Å; Y110-V387 PolarHBondContact N-O 2.99Å; Y110-V387 PolarHBondContact O-N 3.07Å; Y110-R389 HydrophobicContact CE2-CB 3.88Å
111	V	98.6	Very high	92	Very high	40 Å²	40	67.4 Å²	67.4	24%	0.242	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	148.5	-175.5	62.3	0	0	0	0	111.5	E113 H125 I127 T384 V385 M386	V111-E113 HydrophobicContact CG2-CG 4.43Å; V111-H125 WeakPolarHBondContact CG1-NE2 3.42Å; V111-H125 HydrophobicContact CG2-CB 4.46Å; V111-I127 HydrophobicContact CB-CD1 3.85Å; V111-I127 HydrophobicContact CG1-CD1 3.65Å; V111-T384 HydrophobicContact CG2-CG2 4.13Å; V111-V385 CarbonylContact C-O 3.59Å; V111-V385 VanDerWaalsContact CA-O 3.26Å; V111-V385 WeakPolarHBondContact CA-O 3.48Å; V111-M386 HydrophobicContact CB-CB 4.4Å; V111-M386 HydrophobicContact CG2-CB 4.27Å
112	A	98.6	Very high	94.4	Very high	6 Å²	6	62.9 Å²	62.9	5%	0.05	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	144.3	166.3	0	0	0	0	0	110	C367 N368 A371 V385	A112-C367 VanDerWaalsContact CB-C 3.43Å; A112-C367 HydrophobicContact CB-CB 3.69Å; A112-N368 HydrophobicContact CB-CB 4.38Å; A112-A371 HydrophobicContact CB-CB 4.27Å; A112-V385 PolarHBondContact N-O 2.86Å; A112-V385 PolarHBondContact O-N 3.16Å
113	E	98.3	Very high	95.9	Very high	67 Å²	67	59.2 Å²	59.2	31%	0.313	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.6	-176.4	-70.3	-178.6	152	0	0	110.1	V111 M121 H125 V383 T384	V111-E113 HydrophobicContact CG2-CG 4.43Å; E113-M121 HydrophobicContact CB-CE 3.75Å; E113-M121 HydrophobicContact CG-CE 4.01Å; E113-H125 IonicContact OE1-CE1 2.66Å; E113-H125 PolarHBondContact OE1-CE1 3.44Å; E113-H125 VanDerWaalsContact OE1-CE1 3.31Å; E113-H125 IonicContact OE1-CG 3.74Å; E113-H125 IonicContact OE1-ND1 2.76Å; E113-H125 PolarHBondContact OE1-ND1 3.38Å; E113-H125 IonicContact OE2-CE1 3.68Å; E113-H125 IonicContact OE2-ND1 3.64Å; E113-V383 CarbonylContact C-O 3.47Å; E113-V383 VanDerWaalsContact CA-O 3.27Å; E113-V383 WeakPolarHBondContact CA-O 2.98Å; E113-T384 HydrophobicContact CG-CG2 4.04Å
114	R	98.2	Very high	96.6	Very high	60 Å²	60	55.6 Å²	55.6	23%	0.226	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	129	171.6	-62.6	-63.1	179.4	-88.8	-4.6	109.1	G116 N368 A371 N372 V375 N382 V383	R114-G116 PolarHBondContact O-N 2.78Å; R114-N368 PolarHBondContact NH1-OD1 2.89Å; R114-N368 PolarHBondContact NH2-O 3Å; R114-N368 PolarHBondContact NH2-OD1 2.74Å; R114-A371 HydrophobicContact CG-CB 3.89Å; R114-N372 PolarHBondContact NE-OD1 3.31Å; R114-N372 PolarHBondContact NH2-ND2 2.7Å; R114-N372 PolarHBondContact NH2-OD1 3.24Å; R114-N372 VanDerWaalsContact NH2-OD1 3.15Å; R114-V375 HydrophobicContact CB-CG2 3.91Å; R114-V375 HydrophobicContact CG-CG2 4.3Å; R114-N382 CarbonylContact O-C 3.6Å; R114-N382 WeakPolarHBondContact O-CA 3.41Å; R114-V383 HydrophobicContact CB-CB 4.32Å; R114-V383 PolarHBondContact N-O 2.8Å; R114-V383 PolarHBondContact O-N 3.13Å
115	K	96.8	Very high	97	Very high	101 Å²	101	55 Å²	55	44%	0.439	27%	0.274	S	S	.	.			trans	-62.1	-29.6	171.8	-163.6	-177.7	72.7	152.7	0	112.2	R118 E119 M121 N382	K115-R118 WeakPolarHBondContact CD-O 3.18Å; K115-R118 WeakPolarHBondContact CE-O 3.16Å; K115-R118 PolarHBondContact NZ-O 3.15Å; K115-R118 PolarHBondContact O-N 2.91Å; K115-E119 WeakPolarHBondContact CD-O 3.03Å; K115-E119 PolarHBondContact NZ-O 3.18Å; K115-M121 HydrophobicContact CB-SD 4.32Å; K115-M121 HydrophobicContact CG-CB 4.2Å; K115-N382 PolarHBondContact O-ND2 2.97Å
116	G	92.3	Very high	97.2	Very high	27 Å²	27	54.9 Å²	54.9	28%	0.278	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	-143.1	-174.7	0	0	0	0	0	110.9	R114 R118	R114-G116 PolarHBondContact O-N 2.78Å; G116-R118 VanDerWaalsContact C-N 3.32Å
117	E	93.2	Very high	97.4	Very high	148 Å²	148	55.1 Å²	55.1	69%	0.692	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-6.5	179.5	-61	-173.7	170.8	0	0	113.4	A380	E117-A380 HydrophobicContact CB-CB 4.4Å
118	R	95.5	Very high	97.4	Very high	98 Å²	98	56.7 Å²	56.7	37%	0.37	28%	0.275	S	S	.	.	S	Bend	trans	-67	149.9	178.5	-60.1	-62	-167.2	86.2	-6.1	111.4	K115 G116 E120 A380 D381 N382	K115-R118 WeakPolarHBondContact CD-O 3.18Å; K115-R118 WeakPolarHBondContact CE-O 3.16Å; K115-R118 PolarHBondContact NZ-O 3.15Å; K115-R118 PolarHBondContact O-N 2.91Å; G116-R118 VanDerWaalsContact C-N 3.32Å; R118-E120 WeakPolarHBondContact CB-O 3.5Å; R118-A380 VanDerWaalsContact CD-O 3.3Å; R118-A380 WeakPolarHBondContact CD-O 3.09Å; R118-A380 WeakPolarHBondContact CG-O 3.45Å; R118-A380 PolarHBondContact NE-O 3.23Å; R118-A380 VanDerWaalsContact NE-O 3.16Å; R118-D381 VanDerWaalsContact CZ-CG 3.46Å; R118-D381 IonicContact CZ-OD1 3.85Å; R118-D381 IonicContact CZ-OD2 2.8Å; R118-D381 IonicContact NE-OD1 3.04Å; R118-D381 PolarHBondContact NE-OD1 2.94Å; R118-D381 IonicContact NH1-OD1 3.14Å; R118-D381 PolarHBondContact NH1-OD1 2.88Å; R118-D381 IonicContact NH2-OD1 2.71Å; R118-D381 PolarHBondContact NH2-OD1 2.58Å; R118-D381 IonicContact NH2-OD2 3.05Å; R118-D381 PolarHBondContact NH2-OD2 2.76Å; R118-N382 WeakPolarHBondContact CB-ND2 3.36Å
119	E	94.9	Very high	97.4	Very high	183 Å²	183	56.1 Å²	56.1	86%	0.855	28%	0.275	S	S	*	.	S	Bend	trans	-65.3	-42.7	176	-65.3	-172.5	164.5	0	0	111.5	K115	K115-E119 WeakPolarHBondContact CD-O 3.03Å; K115-E119 PolarHBondContact NZ-O 3.18Å
120	E	96.8	Very high	97.2	Very high	106 Å²	106	60.3 Å²	60.3	50%	0.495	30%	0.296	S	S	.	.	S	Bend	trans	-115.2	153.5	-177.6	-61.3	-174.5	161.2	0	0	112	R118 Q122 N382	R118-E120 WeakPolarHBondContact CB-O 3.5Å; E120-Q122 HydrophobicContact CB-CG 4.01Å; E120-Q122 PolarHBondContact OE2-NE2 3.26Å; E120-N382 PolarHBondContact O-ND2 3.1Å; E120-N382 PolarHBondContact O-OD1 3.32Å
121	M	97.9	Very high	97.1	Very high	42 Å²	42	59.9 Å²	59.9	21%	0.207	29%	0.294	C	S	.	.			trans	-93.4	102.8	164.2	-174.2	74	-169.6	0	0	107.7	E113 K115 D123 I157 N382 T384	E113-M121 HydrophobicContact CB-CE 3.75Å; E113-M121 HydrophobicContact CG-CE 4.01Å; K115-M121 HydrophobicContact CB-SD 4.32Å; K115-M121 HydrophobicContact CG-CB 4.2Å; M121-D123 HydrophobicContact CE-CB 3.57Å; M121-I157 WeakPolarHBondContact O-CD1 3.39Å; M121-N382 HydrophobicContact CE-CB 4.15Å; M121-N382 HydrophobicContact SD-CB 3.96Å; M121-T384 WeakPolarHBondContact CE-OG1 3.49Å
122	Q	98.4	Very high	96.8	Very high	27 Å²	27	58.5 Å²	58.5	13%	0.126	29%	0.286	C	S	.	.			trans	-97.7	-13.2	-178.5	-61.7	-171.4	-11.1	0	0	112.7	E120 G153 I157 S160 N382	E120-Q122 HydrophobicContact CB-CG 4.01Å; E120-Q122 PolarHBondContact OE2-NE2 3.26Å; Q122-G153 VanDerWaalsContact CB-O 3.32Å; Q122-G153 WeakPolarHBondContact CB-O 3.35Å; Q122-G153 WeakPolarHBondContact O-CA 3.37Å; Q122-G153 PolarHBondContact OE1-O 2.66Å; Q122-I157 HydrophobicContact CG-CB 4.43Å; Q122-S160 VanDerWaalsContact O-CB 3.25Å; Q122-S160 WeakPolarHBondContact O-CB 3.41Å; Q122-S160 PolarHBondContact O-OG 2.97Å; Q122-N382 PolarHBondContact N-OD1 3.23Å
123	D	98.7	Very high	96.3	Very high	7 Å²	7	63 Å²	63	4%	0.037	31%	0.306	C	S	.	.			trans	-68.2	157.9	171.7	-56.6	-5.1	0	0	0	112.1	M121 F151 C325 T384	M121-D123 HydrophobicContact CE-CB 3.57Å; D123-F151 CarbonylContact C-O 3.55Å; D123-F151 WeakPolarHBondContact CA-O 3.41Å; D123-F151 WeakPolarHBondContact CB-O 3.24Å; D123-C325 PolarHBondContact OD2-SG 3.36Å; D123-T384 WeakPolarHBondContact CB-OG1 3.48Å; D123-T384 WeakPolarHBondContact OD2-CB 3.38Å; D123-T384 PolarHBondContact OD2-N 3.29Å; D123-T384 PolarHBondContact OD2-OG1 2.96Å
124	A	98.8	Very high	96	Very high	16 Å²	16	65 Å²	65	13%	0.132	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	165.3	166.5	0	0	0	0	0	110.4	F151 A164	A124-F151 HydrophobicContact CB-CB 4.39Å; A124-F151 HydrophobicContact CB-CD2 4.45Å; A124-F151 PolarHBondContact N-O 3.31Å; A124-F151 PolarHBondContact O-N 2.97Å; A124-A164 HydrophobicContact CB-CB 3.76Å
125	H	98.8	Very high	95.4	Very high	61 Å²	61	62.2 Å²	62.2	28%	0.282	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	165.9	176.6	68.8	-88	0	0	0	112.2	V111 E113 A149 T384 M386	V111-H125 WeakPolarHBondContact CG1-NE2 3.42Å; V111-H125 HydrophobicContact CG2-CB 4.46Å; E113-H125 IonicContact OE1-CE1 2.66Å; E113-H125 PolarHBondContact OE1-CE1 3.44Å; E113-H125 VanDerWaalsContact OE1-CE1 3.31Å; E113-H125 IonicContact OE1-CG 3.74Å; E113-H125 IonicContact OE1-ND1 2.76Å; E113-H125 PolarHBondContact OE1-ND1 3.38Å; E113-H125 IonicContact OE2-CE1 3.68Å; E113-H125 IonicContact OE2-ND1 3.64Å; H125-A149 CarbonylContact C-O 3.43Å; H125-A149 VanDerWaalsContact CA-O 3.24Å; H125-A149 WeakPolarHBondContact CA-O 3.25Å; H125-A149 WeakPolarHBondContact CB-O 3.44Å; H125-T384 HydrophobicContact CB-CG2 4.36Å; H125-M386 HydrophobicContact CB-CE 3.75Å
126	V	98.8	Very high	94.6	Very high	14 Å²	14	64 Å²	64	9%	0.085	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	130	174	174.3	0	0	0	0	109.6	L128 Y147 F148 A149 F151 A164 M386	V126-L128 HydrophobicContact CG1-CD1 3.81Å; V126-L128 HydrophobicContact CG1-CD2 4.34Å; V126-L128 HydrophobicContact CG1-CG 3.65Å; V126-Y147 HydrophobicContact CB-CD1 4.45Å; V126-Y147 HydrophobicContact CB-CE1 4.07Å; V126-Y147 HydrophobicContact CG1-CD1 3.83Å; V126-Y147 HydrophobicContact CG1-CE1 3.85Å; V126-F148 CarbonylContact O-C 3.57Å; V126-F148 WeakPolarHBondContact O-CA 3.4Å; V126-A149 PolarHBondContact N-O 3.48Å; V126-A149 PolarHBondContact O-N 2.65Å; V126-F151 HydrophobicContact CG2-CE2 4Å; V126-A164 HydrophobicContact CG2-CB 3.95Å; V126-A164 WeakPolarHBondContact CG2-O 3.24Å; V126-M386 WeakPolarHBondContact O-CE 3.46Å
127	I	98.8	Very high	93.2	Very high	44 Å²	44	66.7 Å²	66.7	23%	0.226	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	114.1	171	-65.6	171.9	0	0	0	108	V111 N129 F148 M386	V111-I127 HydrophobicContact CB-CD1 3.85Å; V111-I127 HydrophobicContact CG1-CD1 3.65Å; I127-N129 WeakPolarHBondContact CG2-OD1 3.47Å; I127-F148 HydrophobicContact CG1-CD1 4.47Å; I127-F148 HydrophobicContact CG2-CD1 4.08Å; I127-F148 HydrophobicContact CG2-CE1 3.95Å; I127-M386 HydrophobicContact CD1-CE 4.2Å; I127-M386 HydrophobicContact CD1-CG 4.45Å; I127-M386 HydrophobicContact CG1-CE 3.58Å; I127-M386 HydrophobicContact CG1-CG 4.47Å; I127-M386 HydrophobicContact CG1-SD 3.93Å
128	L	98.3	Very high	91.8	Very high	48 Å²	48	60.8 Å²	60.8	25%	0.251	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	94.4	172.7	-54	170.2	0	0	0	108	V126 D130 I131 Y147 H168	V126-L128 HydrophobicContact CG1-CD1 3.81Å; V126-L128 HydrophobicContact CG1-CD2 4.34Å; V126-L128 HydrophobicContact CG1-CG 3.65Å; L128-D130 PolarHBondContact O-N 3.18Å; L128-I131 HydrophobicContact CB-CG2 3.45Å; L128-I131 VanDerWaalsContact CB-CG2 3.45Å; L128-I131 HydrophobicContact CD1-CG2 3.79Å; L128-I131 HydrophobicContact CG-CG2 4.13Å; L128-Y147 WeakPolarHBondContact CA-O 3.39Å; L128-Y147 HydrophobicContact CD1-CD1 4.11Å; L128-Y147 PolarHBondContact N-O 2.55Å; L128-Y147 PolarHBondContact O-N 2.88Å; L128-H168 HydrophobicContact CD1-CB 3.95Å
129	N	97.1	Very high	90.5	Very high	63 Å²	63	56.1 Å²	56.1	34%	0.337	28%	0.278	S	S	.	.	S	Bend	trans	-63.4	-31.3	-174.6	-63	-41.4	0	0	0	112.3	K108 G109 I127 S146	K108-N129 WeakPolarHBondContact CA-OD1 3.46Å; G109-N129 PolarHBondContact N-OD1 2.96Å; I127-N129 WeakPolarHBondContact CG2-OD1 3.47Å; N129-S146 VanDerWaalsContact O-CB 3.25Å; N129-S146 WeakPolarHBondContact O-CB 3.4Å; N129-S146 PolarHBondContact O-OG 3.36Å
130	D	95.1	Very high	89.2	Confident	97 Å²	97	52.1 Å²	52.1	52%	0.519	27%	0.271	S	S	.	.			trans	-147.7	122.7	176.7	-166.4	-15.6	0	0	0	108.9	L128 T132 V145	L128-D130 PolarHBondContact O-N 3.18Å; D130-T132 WeakPolarHBondContact OD1-CB 3.3Å; D130-T132 PolarHBondContact OD1-N 3.36Å; D130-T132 PolarHBondContact OD1-OG1 2.95Å; D130-V145 WeakPolarHBondContact CA-O 3.25Å
131	I	94.8	Very high	88.2	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.015	28%	0.276	C	S	.	.			trans	-126.4	23	173.6	60.4	171.8	0	0	0	111.5	L128 E133 E134 C135 V145 I172	L128-I131 HydrophobicContact CB-CG2 3.45Å; L128-I131 VanDerWaalsContact CB-CG2 3.45Å; L128-I131 HydrophobicContact CD1-CG2 3.79Å; L128-I131 HydrophobicContact CG-CG2 4.13Å; I131-E133 VanDerWaalsContact C-N 3.3Å; I131-E133 PolarHBondContact O-N 3.24Å; I131-E134 WeakPolarHBondContact CA-OE2 3.29Å; I131-E134 PolarHBondContact O-N 3.28Å; I131-C135 PolarHBondContact O-N 2.82Å; I131-C135 VanDerWaalsContact O-N 3.14Å; I131-C135 PolarHBondContact O-SG 3.26Å; I131-V145 HydrophobicContact CD1-CG1 3.8Å; I131-V145 HydrophobicContact CG1-CB 3.86Å; I131-V145 HydrophobicContact CG1-CG1 3.6Å; I131-V145 WeakPolarHBondContact CG1-O 3.29Å; I131-V145 PolarHBondContact N-O 3.33Å; I131-I172 HydrophobicContact CB-CD1 4.46Å; I131-I172 HydrophobicContact CD1-CD1 4.31Å; I131-I172 HydrophobicContact CD1-CG1 4.01Å; I131-I172 HydrophobicContact CG2-CD1 4.5Å
132	T	92.2	Very high	87.7	Confident	11 Å²	11	51.2 Å²	51.2	7%	0.067	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-38.3	-173.7	-51.4	0	0	0	0	111.3	D130 C135 R144 V145	D130-T132 WeakPolarHBondContact OD1-CB 3.3Å; D130-T132 PolarHBondContact OD1-N 3.36Å; D130-T132 PolarHBondContact OD1-OG1 2.95Å; T132-C135 PolarHBondContact O-N 2.88Å; T132-R144 VanDerWaalsContact OG1-CA 3.29Å; T132-R144 WeakPolarHBondContact OG1-CA 3.15Å; T132-V145 PolarHBondContact OG1-N 2.8Å
133	E	89.6	Confident	87.2	Confident	101 Å²	101	53.8 Å²	53.8	47%	0.472	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-40.4	179.7	-65.2	-56.3	121.3	0	0	112	I131 C135 R136	I131-E133 VanDerWaalsContact C-N 3.3Å; I131-E133 PolarHBondContact O-N 3.24Å; E133-C135 PolarHBondContact O-N 3.07Å; E133-R136 VanDerWaalsContact CD-NE 3.31Å; E133-R136 WeakPolarHBondContact O-CB 3.27Å; E133-R136 WeakPolarHBondContact O-CG 3.32Å; E133-R136 PolarHBondContact O-N 2.82Å; E133-R136 VanDerWaalsContact O-N 3.1Å; E133-R136 IonicContact OE1-CZ 2.88Å; E133-R136 IonicContact OE1-NE 3.07Å; E133-R136 PolarHBondContact OE1-NE 3.01Å; E133-R136 IonicContact OE1-NH1 3.59Å; E133-R136 IonicContact OE1-NH2 2.65Å; E133-R136 PolarHBondContact OE1-NH2 3.46Å; E133-R136 VanDerWaalsContact OE2-CD 3.26Å; E133-R136 WeakPolarHBondContact OE2-CD 3.26Å; E133-R136 IonicContact OE2-CZ 2.83Å; E133-R136 IonicContact OE2-NE 3.01Å; E133-R136 PolarHBondContact OE2-NE 2.73Å; E133-R136 IonicContact OE2-NH1 2.78Å; E133-R136 PolarHBondContact OE2-NH1 2.9Å; E133-R136 IonicContact OE2-NH2 3.41Å; E133-R136 PolarHBondContact OE2-NH2 2.58Å
134	E	90.3	Very high	86.8	Confident	109 Å²	109	54.6 Å²	54.6	51%	0.509	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-30.7	178.8	-65.5	84.3	166.2	0	0	111.4	I131 R136 I172	I131-E134 WeakPolarHBondContact CA-OE2 3.29Å; I131-E134 PolarHBondContact O-N 3.28Å; E134-R136 PolarHBondContact O-N 2.88Å; E134-I172 HydrophobicContact CB-CD1 4.09Å; E134-I172 HydrophobicContact CB-CG1 4.42Å; E134-I172 HydrophobicContact CB-CG2 3.83Å; E134-I172 VanDerWaalsContact O-CG2 3.26Å; E134-I172 WeakPolarHBondContact O-CG2 3.4Å
135	C	86.4	Confident	86.7	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.007	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	5.5	174.7	-67.7	0	0	0	0	113.8	I131 T132 E133 P137 V145 F175	I131-C135 PolarHBondContact O-N 2.82Å; I131-C135 VanDerWaalsContact O-N 3.14Å; I131-C135 PolarHBondContact O-SG 3.26Å; T132-C135 PolarHBondContact O-N 2.88Å; E133-C135 PolarHBondContact O-N 3.07Å; C135-P137 CarbonylContact O-C 3.57Å; C135-V145 HydrophobicContact CB-CG2 4.42Å; C135-F175 HydrophobicContact CB-CB 4.37Å; C135-F175 HydrophobicContact CB-CD1 3.67Å; C135-F175 HydrophobicContact CB-CE1 4.16Å; C135-F175 HydrophobicContact CB-CG 4.06Å
136	R	79.4	Confident	86.6	Confident	138 Å²	138	50.9 Å²	50.9	52%	0.521	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-70.6	148	-171.3	-80.6	179.8	172	-168.6	0.3	116.8	E133 E134 K177	E133-R136 VanDerWaalsContact CD-NE 3.31Å; E133-R136 WeakPolarHBondContact O-CB 3.27Å; E133-R136 WeakPolarHBondContact O-CG 3.32Å; E133-R136 PolarHBondContact O-N 2.82Å; E133-R136 VanDerWaalsContact O-N 3.1Å; E133-R136 IonicContact OE1-CZ 2.88Å; E133-R136 IonicContact OE1-NE 3.07Å; E133-R136 PolarHBondContact OE1-NE 3.01Å; E133-R136 IonicContact OE1-NH1 3.59Å; E133-R136 IonicContact OE1-NH2 2.65Å; E133-R136 PolarHBondContact OE1-NH2 3.46Å; E133-R136 VanDerWaalsContact OE2-CD 3.26Å; E133-R136 WeakPolarHBondContact OE2-CD 3.26Å; E133-R136 IonicContact OE2-CZ 2.83Å; E133-R136 IonicContact OE2-NE 3.01Å; E133-R136 PolarHBondContact OE2-NE 2.73Å; E133-R136 IonicContact OE2-NH1 2.78Å; E133-R136 PolarHBondContact OE2-NH1 2.9Å; E133-R136 IonicContact OE2-NH2 3.41Å; E133-R136 PolarHBondContact OE2-NH2 2.58Å; E134-R136 PolarHBondContact O-N 2.88Å; R136-K177 PolarHBondContact O-NZ 3.17Å
137	P	63.8	Low	86.6	Confident	83 Å²	83	50.3 Å²	50.3	54%	0.539	27%	0.266	S	S	.	.	S	Bend	cis	-73.6	122.7	-13.1	30	-30.7	0	0	0	109.4	C135	C135-P137 CarbonylContact O-C 3.57Å
138	P	64.6	Low	86.6	Confident	24 Å²	24	48.2 Å²	48.2	16%	0.156	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-65.8	161.4	168.1	34.8	-37	0	0	0	107.7	S140 I142	P138-S140 PolarHBondContact O-N 3.3Å; P138-I142 HydrophobicContact CB-CB 4.12Å; P138-I142 HydrophobicContact CB-CG2 4.32Å
139	S	67.3	Low	86.6	Confident	1 Å²	1	46 Å²	46	1%	0.007	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-47.2	140.7	164.3	171.4	0	0	0	0	109.5	L141 I142 G178	S139-L141 PolarHBondContact O-N 3.19Å; S139-L141 PolarHBondContact OG-N 3.14Å; S139-I142 PolarHBondContact O-N 2.91Å; S139-G178 WeakPolarHBondContact CA-O 3.19Å; S139-G178 WeakPolarHBondContact CB-O 3.45Å
140	S	68.2	Low	86.7	Confident	99 Å²	99	43 Å²	43	69%	0.692	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-12.5	178.4	57.2	0	0	0	0	113.8	P138	P138-S140 PolarHBondContact O-N 3.3Å
141	L	75.9	Confident	86.9	Confident	115 Å²	115	38.4 Å²	38.4	60%	0.602	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-11	178.6	-58.1	176.1	0	0	0	114.4	S139	S139-L141 PolarHBondContact O-N 3.19Å; S139-L141 PolarHBondContact OG-N 3.14Å
142	I	85.7	Confident	87.1	Confident	13 Å²	13	38.9 Å²	38.9	7%	0.067	21%	0.205	C	C	.	.			trans	-104.9	122.6	-176.1	-61.3	171.1	0	0	0	108.9	P138 S139 V145 F175 V183 V225	P138-I142 HydrophobicContact CB-CB 4.12Å; P138-I142 HydrophobicContact CB-CG2 4.32Å; S139-I142 PolarHBondContact O-N 2.91Å; I142-V145 HydrophobicContact CG2-CG2 3.73Å; I142-F175 HydrophobicContact CD1-CE1 3.81Å; I142-F175 HydrophobicContact CD1-CZ 4.03Å; I142-V183 HydrophobicContact CD1-CG1 4.28Å; I142-V225 HydrophobicContact CB-CG1 4.37Å; I142-V225 HydrophobicContact CD1-CG1 3.86Å; I142-V225 HydrophobicContact CG1-CG1 3.78Å; I142-V225 HydrophobicContact CG2-CG1 3.76Å
143	T	88.1	Confident	87.4	Confident	82 Å²	82	38.4 Å²	38.4	50%	0.503	20%	0.203	S	C	.	.			trans	-103.2	-26.3	-178.1	60.9	0	0	0	0	113.1	I104 D226	I104-T143 HydrophobicContact CD1-CG2 4.21Å; I104-T143 WeakPolarHBondContact CD1-OG1 3.47Å; T143-D226 WeakPolarHBondContact CA-OD1 3.37Å; T143-D226 WeakPolarHBondContact CB-OD1 3.37Å; T143-D226 PolarHBondContact N-OD1 3.34Å; T143-D226 PolarHBondContact OG1-OD1 3.03Å
144	R	91.4	Very high	87.8	Confident	23 Å²	23	35.6 Å²	35.6	9%	0.087	19%	0.19	C	C	.	.			trans	-145.7	141.5	176.8	-177.8	-171.2	61.5	-150.7	3	112.4	I104 F105 T132 V225 D226	I104-R144 HydrophobicContact CG2-CB 4.43Å; F105-R144 VanDerWaalsContact C-NH1 3.26Å; F105-R144 PolarHBondContact O-NH1 2.92Å; F105-R144 PolarHBondContact O-NH2 3.43Å; T132-R144 VanDerWaalsContact OG1-CA 3.29Å; T132-R144 WeakPolarHBondContact OG1-CA 3.15Å; R144-V225 WeakPolarHBondContact O-CA 3.35Å; R144-D226 PolarHBondContact N-OD1 3.46Å; R144-D226 PolarHBondContact NH2-O 3.49Å; R144-D226 PolarHBondContact O-N 3.41Å
145	V	95.4	Very high	88.1	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	130	163.9	-169.5	0	0	0	0	110.2	D130 I131 T132 C135 I142 F175 L223 A224	D130-V145 WeakPolarHBondContact CA-O 3.25Å; I131-V145 HydrophobicContact CD1-CG1 3.8Å; I131-V145 HydrophobicContact CG1-CB 3.86Å; I131-V145 HydrophobicContact CG1-CG1 3.6Å; I131-V145 WeakPolarHBondContact CG1-O 3.29Å; I131-V145 PolarHBondContact N-O 3.33Å; T132-V145 PolarHBondContact OG1-N 2.8Å; C135-V145 HydrophobicContact CB-CG2 4.42Å; I142-V145 HydrophobicContact CG2-CG2 3.73Å; V145-F175 HydrophobicContact CG1-CE2 4.1Å; V145-F175 HydrophobicContact CG1-CZ 4.21Å; V145-F175 HydrophobicContact CG2-CE1 3.97Å; V145-F175 HydrophobicContact CG2-CE2 4.37Å; V145-F175 HydrophobicContact CG2-CZ 3.67Å; V145-L223 HydrophobicContact CG1-CD1 3.53Å; V145-A224 CarbonylContact C-O 3.42Å; V145-A224 VanDerWaalsContact CA-O 3.29Å; V145-A224 WeakPolarHBondContact CA-O 3.48Å
146	S	97.6	Very high	88.6	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	148.7	173	-48	0	0	0	0	110.2	N129 L223 A224	N129-S146 VanDerWaalsContact O-CB 3.25Å; N129-S146 WeakPolarHBondContact O-CB 3.4Å; N129-S146 PolarHBondContact O-OG 3.36Å; S146-L223 WeakPolarHBondContact O-CA 3.39Å; S146-A224 PolarHBondContact N-O 3.27Å; S146-A224 PolarHBondContact O-N 3.18Å
147	Y	98.6	Very high	89.5	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.008	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	130.7	-177.4	178.3	-88.5	0	0	0	112	V126 L128 A149 L167 H168 L171 C221	V126-Y147 HydrophobicContact CB-CD1 4.45Å; V126-Y147 HydrophobicContact CB-CE1 4.07Å; V126-Y147 HydrophobicContact CG1-CD1 3.83Å; V126-Y147 HydrophobicContact CG1-CE1 3.85Å; L128-Y147 WeakPolarHBondContact CA-O 3.39Å; L128-Y147 HydrophobicContact CD1-CD1 4.11Å; L128-Y147 PolarHBondContact N-O 2.55Å; L128-Y147 PolarHBondContact O-N 2.88Å; Y147-A149 HydrophobicContact CE1-CB 3.63Å; Y147-A149 WeakPolarHBondContact OH-CB 3.43Å; Y147-L167 WeakPolarHBondContact OH-CD2 3.37Å; Y147-H168 HydrophobicContact CD1-CB 3.8Å; Y147-H168 HydrophobicContact CE1-CB 3.64Å; Y147-H168 HydrophobicContact CG-CB 4.35Å; Y147-L171 HydrophobicContact CD2-CD2 3.61Å; Y147-L171 HydrophobicContact CE2-CD2 3.91Å; Y147-C221 HydrophobicContact CE2-CB 3.73Å
148	F	98.9	Very high	91.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	135	179.7	-53.2	-80.7	0	0	0	109.1	L107 V126 I127 C221 V222 L323 M386 V388	L107-F148 HydrophobicContact CB-CE2 4.15Å; L107-F148 HydrophobicContact CB-CZ 3.99Å; L107-F148 HydrophobicContact CD1-CE2 4.18Å; V126-F148 CarbonylContact O-C 3.57Å; V126-F148 WeakPolarHBondContact O-CA 3.4Å; I127-F148 HydrophobicContact CG1-CD1 4.47Å; I127-F148 HydrophobicContact CG2-CD1 4.08Å; I127-F148 HydrophobicContact CG2-CE1 3.95Å; F148-C221 CarbonylContact O-C 3.54Å; F148-C221 WeakPolarHBondContact O-CA 3.25Å; F148-V222 PolarHBondContact N-O 2.88Å; F148-V222 PolarHBondContact O-N 3.27Å; F148-L323 HydrophobicContact CB-CD2 4.49Å; F148-M386 HydrophobicContact CB-SD 3.76Å; F148-M386 HydrophobicContact CD1-SD 4.33Å; F148-M386 HydrophobicContact CG-SD 4.49Å; F148-V388 HydrophobicContact CB-CG2 4.04Å; F148-V388 HydrophobicContact CD1-CG1 4.39Å; F148-V388 HydrophobicContact CD1-CG2 3.68Å; F148-V388 HydrophobicContact CD2-CG1 4.1Å; F148-V388 HydrophobicContact CD2-CG2 3.94Å; F148-V388 HydrophobicContact CE1-CG1 4Å; F148-V388 HydrophobicContact CE1-CG2 4.1Å; F148-V388 HydrophobicContact CE2-CG1 3.68Å; F148-V388 HydrophobicContact CE2-CG2 4.34Å; F148-V388 HydrophobicContact CG-CG1 4.43Å; F148-V388 HydrophobicContact CG-CG2 3.59Å; F148-V388 HydrophobicContact CZ-CG1 3.64Å; F148-V388 HydrophobicContact CZ-CG2 4.42Å
149	A	98.9	Very high	92.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	148.5	179.5	0	0	0	0	0	113.8	H125 V126 Y147 F151 T220 C221 M386	H125-A149 CarbonylContact C-O 3.43Å; H125-A149 VanDerWaalsContact CA-O 3.24Å; H125-A149 WeakPolarHBondContact CA-O 3.25Å; H125-A149 WeakPolarHBondContact CB-O 3.44Å; V126-A149 PolarHBondContact N-O 3.48Å; V126-A149 PolarHBondContact O-N 2.65Å; Y147-A149 HydrophobicContact CE1-CB 3.63Å; Y147-A149 WeakPolarHBondContact OH-CB 3.43Å; A149-F151 HydrophobicContact CB-CE1 4.41Å; A149-F151 HydrophobicContact CB-CE2 3.63Å; A149-F151 HydrophobicContact CB-CZ 3.58Å; A149-T220 VanDerWaalsContact CA-O 3.25Å; A149-T220 WeakPolarHBondContact CA-O 3.13Å; A149-C221 HydrophobicContact CB-CB 3.7Å; A149-M386 VanDerWaalsContact O-CE 3.24Å; A149-M386 WeakPolarHBondContact O-CE 3.48Å
150	V	98.9	Very high	94.2	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.6	169.1	174	0	0	0	0	108.3	T220 L323 C325 T384 M386	V150-T220 PolarHBondContact N-O 2.8Å; V150-T220 PolarHBondContact O-N 3.03Å; V150-L323 HydrophobicContact CG2-CB 3.85Å; V150-C325 HydrophobicContact CG1-CB 4.34Å; V150-T384 HydrophobicContact CG1-CG2 3.94Å; V150-T384 HydrophobicContact CG2-CG2 4.04Å; V150-M386 HydrophobicContact CG2-CB 4.11Å; V150-M386 HydrophobicContact CG2-CE 4.11Å
151	F	98.9	Very high	95.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	112.6	-179.9	-54.1	-81.5	0	0	0	107.8	D123 A124 V126 A149 A163 A164 L167 T218 A219	D123-F151 CarbonylContact C-O 3.55Å; D123-F151 WeakPolarHBondContact CA-O 3.41Å; D123-F151 WeakPolarHBondContact CB-O 3.24Å; A124-F151 HydrophobicContact CB-CB 4.39Å; A124-F151 HydrophobicContact CB-CD2 4.45Å; A124-F151 PolarHBondContact N-O 3.31Å; A124-F151 PolarHBondContact O-N 2.97Å; V126-F151 HydrophobicContact CG2-CE2 4Å; A149-F151 HydrophobicContact CB-CE1 4.41Å; A149-F151 HydrophobicContact CB-CE2 3.63Å; A149-F151 HydrophobicContact CB-CZ 3.58Å; F151-A163 HydrophobicContact CD1-CB 3.54Å; F151-A163 HydrophobicContact CE1-CB 3.62Å; F151-A163 HydrophobicContact CG-CB 4.18Å; F151-A163 HydrophobicContact CZ-CB 4.31Å; F151-A164 HydrophobicContact CD2-CB 3.82Å; F151-A164 HydrophobicContact CE2-CB 3.87Å; F151-L167 HydrophobicContact CE1-CD2 3.69Å; F151-L167 HydrophobicContact CZ-CB 4.46Å; F151-L167 HydrophobicContact CZ-CD2 3.98Å; F151-T218 WeakPolarHBondContact CA-O 3.49Å; F151-A219 HydrophobicContact CD1-CB 3.7Å; F151-A219 HydrophobicContact CE1-CB 3.73Å
152	D	98.8	Very high	96.8	Very high	13 Å²	13	25.9 Å²	25.9	7%	0.07	14%	0.139	C	C	.	.			trans	-91.7	121.2	174	-172	-25.2	0	0	0	107.6	S217 T218 C325	D152-S217 CarbonylContact O-C 3.54Å; D152-S217 WeakPolarHBondContact O-CA 3.29Å; D152-S217 WeakPolarHBondContact O-CB 3.49Å; D152-S217 PolarHBondContact O-OG 3.23Å; D152-T218 HydrophobicContact CB-CG2 3.95Å; D152-T218 WeakPolarHBondContact CB-OG1 3.48Å; D152-T218 PolarHBondContact N-OG1 2.68Å; D152-T218 PolarHBondContact O-N 2.82Å; D152-C325 HydrophobicContact CB-CB 3.93Å; D152-C325 WeakPolarHBondContact OD2-CB 3.46Å
153	G	98.6	Very high	97.4	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.01	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	141.6	-172.9	0	0	0	0	0	111.8	Q122	Q122-G153 VanDerWaalsContact CB-O 3.32Å; Q122-G153 WeakPolarHBondContact CB-O 3.35Å; Q122-G153 WeakPolarHBondContact O-CA 3.37Å; Q122-G153 PolarHBondContact OE1-O 2.66Å
154	H	98.1	Very high	97.9	Very high	43 Å²	43	22 Å²	22	20%	0.199	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	151.5	176.4	62	-100.6	0	0	0	112	G156 D215 G216 L287 D295	H154-G156 PolarHBondContact O-N 3.01Å; H154-D215 WeakPolarHBondContact O-CA 3.37Å; H154-G216 VanDerWaalsContact CE1-C 3.44Å; H154-G216 PolarHBondContact N-O 2.83Å; H154-G216 WeakPolarHBondContact NE2-CA 3.21Å; H154-G216 PolarHBondContact O-N 2.99Å; H154-L287 WeakPolarHBondContact NE2-CD1 3.25Å; H154-D295 IonicContact CD2-OD1 3.3Å; H154-D295 IonicContact CE1-OD2 3.73Å; H154-D295 PolarHBondContact CE1-OD2 2.63Å; H154-D295 IonicContact NE2-OD1 3.22Å; H154-D295 PolarHBondContact NE2-OD1 2.83Å; H154-D295 IonicContact NE2-OD2 2.74Å; H154-D295 PolarHBondContact NE2-OD2 2.89Å
155	G	96.2	Very high	98.3	Very high	58 Å²	58	25.5 Å²	25.5	60%	0.598	13%	0.134	S	C	*	.	S	Bend	trans	68.4	11.9	-174.7	0	0	0	0	0	113.8
156	G	97.1	Very high	98.4	Very high	6 Å²	6	27 Å²	27	6%	0.062	14%	0.142	C	C	.	.	S	Bend	trans	131.6	159.7	-178.3	0	0	0	0	0	112.7	H154 R158 D215	H154-G156 PolarHBondContact O-N 3.01Å; G156-R158 VanDerWaalsContact C-N 3.29Å; G156-R158 PolarHBondContact O-N 3.47Å; G156-D215 WeakPolarHBondContact CA-OD1 3.41Å
157	I	97.8	Very high	98.5	Very high	68 Å²	68	27 Å²	27	35%	0.349	14%	0.143	S	C	.	.	S	Bend	trans	-75.1	-9.1	-177.2	-166	175	0	0	0	114.2	M121 Q122 A159 S160 K161	M121-I157 WeakPolarHBondContact O-CD1 3.39Å; Q122-I157 HydrophobicContact CG-CB 4.43Å; I157-A159 PolarHBondContact O-N 3.37Å; I157-S160 PolarHBondContact O-OG 3.37Å; I157-K161 HydrophobicContact CG1-CB 4.47Å; I157-K161 VanDerWaalsContact O-CB 3.24Å; I157-K161 WeakPolarHBondContact O-CB 3.36Å; I157-K161 PolarHBondContact O-N 3.43Å; I157-K161 VanDerWaalsContact O-N 3.09Å
158	R	98.6	Very high	98.4	Very high	98 Å²	98	28.2 Å²	28.2	37%	0.37	15%	0.148	S	C	.	.	H	α-helix	trans	-71	-38.3	-163.8	-64.9	172.3	-77.8	-87.8	-5.2	112.5	G156 F162 F202 W213 D215	G156-R158 VanDerWaalsContact C-N 3.29Å; G156-R158 PolarHBondContact O-N 3.47Å; R158-F162 WeakPolarHBondContact O-CB 3.38Å; R158-F162 PolarHBondContact O-N 3.36Å; R158-F202 HydrophobicContact CB-CE2 4.27Å; R158-F202 HydrophobicContact CB-CZ 4.42Å; R158-W213 HydrophobicContact CB-CE3 4.28Å; R158-W213 HydrophobicContact CB-CZ3 4.45Å; R158-W213 VanDerWaalsContact CD-CD2 3.42Å; R158-D215 HydrophobicContact CB-CB 4.43Å; R158-D215 VanDerWaalsContact CB-OD1 3.27Å; R158-D215 WeakPolarHBondContact CB-OD1 3.45Å; R158-D215 IonicContact CZ-OD1 2.74Å; R158-D215 VanDerWaalsContact CZ-OD1 3.22Å; R158-D215 IonicContact CZ-OD2 2.76Å; R158-D215 VanDerWaalsContact CZ-OD2 3.22Å; R158-D215 PolarHBondContact N-OD1 3.25Å; R158-D215 IonicContact NE-OD1 2.84Å; R158-D215 PolarHBondContact NE-OD1 3.09Å; R158-D215 IonicContact NE-OD2 3.58Å; R158-D215 PolarHBondContact NE-OD2 3.42Å; R158-D215 VanDerWaalsContact NH2-CG 3.29Å; R158-D215 IonicContact NH2-OD1 2.85Å; R158-D215 PolarHBondContact NH2-OD1 3.47Å; R158-D215 VanDerWaalsContact NH2-OD1 3.14Å; R158-D215 IonicContact NH2-OD2 3.77Å; R158-D215 PolarHBondContact NH2-OD2 2.91Å
159	A	98.8	Very high	98.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-67.7	-47.5	-179	0	0	0	0	0	112	I157 F162 A163 F202 D215	I157-A159 PolarHBondContact O-N 3.37Å; A159-F162 PolarHBondContact O-N 2.81Å; A159-A163 WeakPolarHBondContact O-CB 3.3Å; A159-A163 PolarHBondContact O-N 2.96Å; A159-F202 VanDerWaalsContact CA-CZ 3.5Å; A159-F202 HydrophobicContact CB-CD1 4.36Å; A159-F202 HydrophobicContact CB-CE1 3.66Å; A159-F202 HydrophobicContact CB-CE2 4.21Å; A159-F202 HydrophobicContact CB-CZ 3.58Å; A159-D215 HydrophobicContact CB-CB 3.83Å
160	S	98.8	Very high	98.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.6	-44.5	178.5	55.7	0	0	0	0	111.3	Q122 I157 F162 A163 A164 S217	Q122-S160 VanDerWaalsContact O-CB 3.25Å; Q122-S160 WeakPolarHBondContact O-CB 3.41Å; Q122-S160 PolarHBondContact O-OG 2.97Å; I157-S160 PolarHBondContact O-OG 3.37Å; S160-F162 PolarHBondContact O-N 3.28Å; S160-A163 PolarHBondContact O-N 2.79Å; S160-A164 WeakPolarHBondContact O-CB 3.46Å; S160-A164 PolarHBondContact O-N 2.88Å; S160-S217 VanDerWaalsContact CA-OG 3.29Å; S160-S217 WeakPolarHBondContact CA-OG 3.35Å; S160-S217 VanDerWaalsContact CB-OG 3.26Å; S160-S217 WeakPolarHBondContact CB-OG 3.4Å
161	K	98.8	Very high	98.3	Very high	112 Å²	112	31.9 Å²	31.9	49%	0.487	17%	0.165	S	C	.	.	H	α-helix	trans	-63.4	-42.1	175.5	-172.6	173	-177.3	175	0	112.2	I157 A164 Q165	I157-K161 HydrophobicContact CG1-CB 4.47Å; I157-K161 VanDerWaalsContact O-CB 3.24Å; I157-K161 WeakPolarHBondContact O-CB 3.36Å; I157-K161 PolarHBondContact O-N 3.43Å; I157-K161 VanDerWaalsContact O-N 3.09Å; K161-A164 PolarHBondContact O-N 2.87Å; K161-Q165 WeakPolarHBondContact O-CB 3.37Å; K161-Q165 VanDerWaalsContact O-CG 3.25Å; K161-Q165 WeakPolarHBondContact O-CG 3.49Å; K161-Q165 PolarHBondContact O-N 2.71Å
162	F	98.8	Very high	98.1	Very high	23 Å²	23	33.2 Å²	33.2	10%	0.101	17%	0.172	C	C	.	.	H	α-helix	trans	-63.6	-44.4	175.9	-175.8	-85.5	0	0	0	111.3	R158 A159 S160 Q165 N166 T198 E201 F202 Q205	R158-F162 WeakPolarHBondContact O-CB 3.38Å; R158-F162 PolarHBondContact O-N 3.36Å; A159-F162 PolarHBondContact O-N 2.81Å; S160-F162 PolarHBondContact O-N 3.28Å; F162-Q165 PolarHBondContact O-N 2.84Å; F162-N166 HydrophobicContact CD1-CB 4.34Å; F162-N166 WeakPolarHBondContact CD2-ND2 3.42Å; F162-N166 HydrophobicContact CE1-CB 3.96Å; F162-N166 WeakPolarHBondContact CE2-ND2 3.48Å; F162-N166 HydrophobicContact CZ-CB 4.2Å; F162-N166 WeakPolarHBondContact O-CB 3.49Å; F162-N166 PolarHBondContact O-N 3.22Å; F162-N166 PolarHBondContact O-ND2 3.44Å; F162-T198 HydrophobicContact CD1-CG2 4.24Å; F162-T198 HydrophobicContact CE1-CG2 4.04Å; F162-E201 HydrophobicContact CE1-CB 4.17Å; F162-E201 HydrophobicContact CZ-CB 3.81Å; F162-F202 HydrophobicContact CB-CD2 3.62Å; F162-F202 HydrophobicContact CB-CE2 4.06Å; F162-F202 HydrophobicContact CD1-CB 3.65Å; F162-F202 AromaticContact CD1-CD2 3.84Å; F162-F202 HydrophobicContact CD1-CD2 3.84Å; F162-F202 HydrophobicContact CD1-CG 4.12Å; F162-F202 HydrophobicContact CD2-CD2 4.04Å; F162-F202 HydrophobicContact CE1-CB 3.73Å; F162-F202 HydrophobicContact CG-CB 4.24Å; F162-F202 AromaticContact CG-CD2 3.55Å; F162-F202 HydrophobicContact CG-CD2 3.55Å; F162-F202 HydrophobicContact CG-CE2 4.42Å; F162-F202 HydrophobicContact CG-CG 4.29Å; F162-F202 HydrophobicContact CZ-CB 4.38Å; F162-Q205 VanDerWaalsContact CD2-OE1 3.28Å
163	A	98.8	Very high	97.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.7	-45.3	176.9	0	0	0	0	0	111.4	F151 A159 S160 Q165 N166 L167 I293	F151-A163 HydrophobicContact CD1-CB 3.54Å; F151-A163 HydrophobicContact CE1-CB 3.62Å; F151-A163 HydrophobicContact CG-CB 4.18Å; F151-A163 HydrophobicContact CZ-CB 4.31Å; A159-A163 WeakPolarHBondContact O-CB 3.3Å; A159-A163 PolarHBondContact O-N 2.96Å; S160-A163 PolarHBondContact O-N 2.79Å; A163-Q165 VanDerWaalsContact C-N 3.27Å; A163-Q165 PolarHBondContact O-N 2.76Å; A163-N166 PolarHBondContact O-N 3.01Å; A163-L167 WeakPolarHBondContact O-CB 3.42Å; A163-L167 PolarHBondContact O-N 3.19Å; A163-I293 HydrophobicContact CB-CD1 3.78Å
164	A	98.8	Very high	97.5	Very high	13 Å²	13	43.8 Å²	43.8	11%	0.107	21%	0.213	C	C	.	.	H	α-helix	trans	-59.2	-36.6	175.5	0	0	0	0	0	112.6	A124 V126 F151 S160 K161 H168	A124-A164 HydrophobicContact CB-CB 3.76Å; V126-A164 HydrophobicContact CG2-CB 3.95Å; V126-A164 WeakPolarHBondContact CG2-O 3.24Å; F151-A164 HydrophobicContact CD2-CB 3.82Å; F151-A164 HydrophobicContact CE2-CB 3.87Å; S160-A164 WeakPolarHBondContact O-CB 3.46Å; S160-A164 PolarHBondContact O-N 2.88Å; K161-A164 PolarHBondContact O-N 2.87Å; A164-H168 PolarHBondContact O-CE1 3.38Å; A164-H168 PolarHBondContact O-ND1 3.03Å
165	Q	98.6	Very high	97.2	Very high	98 Å²	98	42 Å²	42	46%	0.458	21%	0.205	S	C	.	.	H	α-helix	trans	-78.8	-34.9	179.4	-72.1	174.2	-11.6	0	0	113.8	K161 F162 A163 H168 Q169	K161-Q165 WeakPolarHBondContact O-CB 3.37Å; K161-Q165 VanDerWaalsContact O-CG 3.25Å; K161-Q165 WeakPolarHBondContact O-CG 3.49Å; K161-Q165 PolarHBondContact O-N 2.71Å; F162-Q165 PolarHBondContact O-N 2.84Å; A163-Q165 VanDerWaalsContact C-N 3.27Å; A163-Q165 PolarHBondContact O-N 2.76Å; Q165-H168 PolarHBondContact O-CE1 2.93Å; Q165-H168 VanDerWaalsContact O-CE1 3.22Å; Q165-Q169 VanDerWaalsContact O-CD 3.3Å; Q165-Q169 WeakPolarHBondContact O-CG 3.37Å; Q165-Q169 PolarHBondContact O-NE2 3.44Å
166	N	98.7	Very high	96.7	Very high	31 Å²	31	39.8 Å²	39.8	17%	0.166	18%	0.18	C	C	.	.	H	α-helix	trans	-113.7	-28.8	-164.8	-63.5	-78.8	0	0	0	114.5	F162 A163 H168 Q169 N170	F162-N166 HydrophobicContact CD1-CB 4.34Å; F162-N166 WeakPolarHBondContact CD2-ND2 3.42Å; F162-N166 HydrophobicContact CE1-CB 3.96Å; F162-N166 WeakPolarHBondContact CE2-ND2 3.48Å; F162-N166 HydrophobicContact CZ-CB 4.2Å; F162-N166 WeakPolarHBondContact O-CB 3.49Å; F162-N166 PolarHBondContact O-N 3.22Å; F162-N166 PolarHBondContact O-ND2 3.44Å; A163-N166 PolarHBondContact O-N 3.01Å; N166-H168 PolarHBondContact O-N 3.48Å; N166-Q169 PolarHBondContact O-N 3Å; N166-N170 WeakPolarHBondContact O-CB 3.43Å; N166-N170 PolarHBondContact O-N 3.4Å
167	L	98.6	Very high	96	Very high	1 Å²	1	45 Å²	45	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-61.9	-47.9	-172	-169.9	70.5	0	0	0	111.8	Y147 F151 A163 N170 L171 T194 F195 T198 A219	Y147-L167 WeakPolarHBondContact OH-CD2 3.37Å; F151-L167 HydrophobicContact CE1-CD2 3.69Å; F151-L167 HydrophobicContact CZ-CB 4.46Å; F151-L167 HydrophobicContact CZ-CD2 3.98Å; A163-L167 WeakPolarHBondContact O-CB 3.42Å; A163-L167 PolarHBondContact O-N 3.19Å; L167-N170 PolarHBondContact O-N 2.92Å; L167-L171 WeakPolarHBondContact O-CB 3.27Å; L167-L171 PolarHBondContact O-N 2.99Å; L167-T194 HydrophobicContact CD1-CG2 3.77Å; L167-T194 HydrophobicContact CG-CG2 4.26Å; L167-T194 VanDerWaalsContact O-CG2 3.25Å; L167-T194 WeakPolarHBondContact O-CG2 3.29Å; L167-F195 HydrophobicContact CD1-CD2 4.01Å; L167-F195 HydrophobicContact CD1-CE2 4.31Å; L167-F195 HydrophobicContact CD1-CG 4.21Å; L167-F195 HydrophobicContact CD2-CD2 4.46Å; L167-F195 HydrophobicContact CD2-CE1 4.37Å; L167-F195 HydrophobicContact CD2-CE2 3.96Å; L167-F195 HydrophobicContact CD2-CZ 3.91Å; L167-T198 HydrophobicContact CB-CG2 4.29Å; L167-T198 HydrophobicContact CD1-CG2 3.94Å; L167-T198 WeakPolarHBondContact CD1-OG1 3.39Å; L167-A219 HydrophobicContact CD2-CB 4.5Å
168	H	98.1	Very high	94.9	Very high	27 Å²	27	43.5 Å²	43.5	13%	0.125	20%	0.202	C	C	.	.	H	α-helix	trans	-68	-34.2	177.9	66.9	-83.8	0	0	0	112.4	L128 Y147 A164 Q165 N166 L171 I172	L128-H168 HydrophobicContact CD1-CB 3.95Å; Y147-H168 HydrophobicContact CD1-CB 3.8Å; Y147-H168 HydrophobicContact CE1-CB 3.64Å; Y147-H168 HydrophobicContact CG-CB 4.35Å; A164-H168 PolarHBondContact O-CE1 3.38Å; A164-H168 PolarHBondContact O-ND1 3.03Å; Q165-H168 PolarHBondContact O-CE1 2.93Å; Q165-H168 VanDerWaalsContact O-CE1 3.22Å; N166-H168 PolarHBondContact O-N 3.48Å; H168-L171 WeakPolarHBondContact O-CB 3.45Å; H168-L171 PolarHBondContact O-N 3.45Å; H168-I172 WeakPolarHBondContact O-CB 3.37Å; H168-I172 WeakPolarHBondContact O-CD1 3.35Å; H168-I172 VanDerWaalsContact O-CG1 3.24Å; H168-I172 WeakPolarHBondContact O-CG1 3.01Å; H168-I172 PolarHBondContact O-N 2.95Å
169	Q	97.8	Very high	93.6	Very high	73 Å²	73	45.9 Å²	45.9	34%	0.341	22%	0.222	S	C	.	.	H	α-helix	trans	-66.7	-42.6	175.8	-61	-172.1	12.9	0	0	111.6	Q165 N166 L171 I172 R173	Q165-Q169 VanDerWaalsContact O-CD 3.3Å; Q165-Q169 WeakPolarHBondContact O-CG 3.37Å; Q165-Q169 PolarHBondContact O-NE2 3.44Å; N166-Q169 PolarHBondContact O-N 3Å; Q169-L171 VanDerWaalsContact C-N 3.31Å; Q169-I172 PolarHBondContact O-N 3.17Å; Q169-R173 VanDerWaalsContact O-CG 3.3Å; Q169-R173 WeakPolarHBondContact O-CG 3.49Å; Q169-R173 PolarHBondContact O-N 3.35Å; Q169-R173 VanDerWaalsContact OE1-NH2 3.1Å
170	N	97.8	Very high	92.5	Very high	3 Å²	3	47 Å²	47	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-64.3	-38.9	175.1	-76.6	-14.7	0	0	0	111.5	N166 L167 R173 K174 T194 H197 T198 E201	N166-N170 WeakPolarHBondContact O-CB 3.43Å; N166-N170 PolarHBondContact O-N 3.4Å; L167-N170 PolarHBondContact O-N 2.92Å; N170-R173 PolarHBondContact O-N 2.86Å; N170-R173 PolarHBondContact OD1-NH1 3.3Å; N170-K174 WeakPolarHBondContact O-CB 3.21Å; N170-K174 WeakPolarHBondContact O-CG 3.35Å; N170-K174 PolarHBondContact O-N 2.91Å; N170-T194 HydrophobicContact CB-CG2 3.94Å; N170-H197 PolarHBondContact ND2-ND1 2.89Å; N170-T198 PolarHBondContact ND2-OG1 2.78Å; N170-E201 PolarHBondContact ND2-OE2 3.34Å
171	L	97	Very high	91.4	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-57.8	-52.8	172.7	-175.6	67.6	0	0	0	111.1	Y147 L167 H168 Q169 R173 K174 F175 L191 T194 L223	Y147-L171 HydrophobicContact CD2-CD2 3.61Å; Y147-L171 HydrophobicContact CE2-CD2 3.91Å; L167-L171 WeakPolarHBondContact O-CB 3.27Å; L167-L171 PolarHBondContact O-N 2.99Å; H168-L171 WeakPolarHBondContact O-CB 3.45Å; H168-L171 PolarHBondContact O-N 3.45Å; Q169-L171 VanDerWaalsContact C-N 3.31Å; L171-R173 VanDerWaalsContact C-N 3.34Å; L171-R173 PolarHBondContact O-N 2.99Å; L171-K174 CarbonylContact O-C 3.53Å; L171-K174 PolarHBondContact O-N 3.4Å; L171-K174 VanDerWaalsContact O-N 3.17Å; L171-F175 WeakPolarHBondContact O-CA 3.28Å; L171-F175 WeakPolarHBondContact O-CB 3.46Å; L171-F175 PolarHBondContact O-N 2.9Å; L171-L191 HydrophobicContact CD1-CD2 3.82Å; L171-L191 HydrophobicContact CD1-CG 4.29Å; L171-T194 HydrophobicContact CB-CG2 3.97Å; L171-L223 HydrophobicContact CD1-CD2 4.3Å; L171-L223 HydrophobicContact CD2-CD1 3.86Å; L171-L223 HydrophobicContact CD2-CD2 4.13Å; L171-L223 HydrophobicContact CD2-CG 4.46Å
172	I	95.4	Very high	90.9	Very high	28 Å²	28	52.3 Å²	52.3	14%	0.144	26%	0.263	C	S	.	.	H	α-helix	trans	-57	-46.7	179.7	-73	164.3	0	0	0	110.9	I131 E134 H168 Q169 K174 F175	I131-I172 HydrophobicContact CB-CD1 4.46Å; I131-I172 HydrophobicContact CD1-CD1 4.31Å; I131-I172 HydrophobicContact CD1-CG1 4.01Å; I131-I172 HydrophobicContact CG2-CD1 4.5Å; E134-I172 HydrophobicContact CB-CD1 4.09Å; E134-I172 HydrophobicContact CB-CG1 4.42Å; E134-I172 HydrophobicContact CB-CG2 3.83Å; E134-I172 VanDerWaalsContact O-CG2 3.26Å; E134-I172 WeakPolarHBondContact O-CG2 3.4Å; H168-I172 WeakPolarHBondContact O-CB 3.37Å; H168-I172 WeakPolarHBondContact O-CD1 3.35Å; H168-I172 VanDerWaalsContact O-CG1 3.24Å; H168-I172 WeakPolarHBondContact O-CG1 3.01Å; H168-I172 PolarHBondContact O-N 2.95Å; Q169-I172 PolarHBondContact O-N 3.17Å; I172-K174 VanDerWaalsContact C-N 3.31Å; I172-K174 PolarHBondContact O-N 3.36Å; I172-F175 WeakPolarHBondContact O-CB 3.37Å; I172-F175 PolarHBondContact O-N 2.75Å
173	R	93.6	Very high	90.3	Very high	148 Å²	148	52.9 Å²	52.9	56%	0.558	27%	0.269	S	S	*	.	H	α-helix	trans	-62	-37.6	178.9	-71.4	172	-169.6	136.3	6.5	112.7	Q169 N170 L171	Q169-R173 VanDerWaalsContact O-CG 3.3Å; Q169-R173 WeakPolarHBondContact O-CG 3.49Å; Q169-R173 PolarHBondContact O-N 3.35Å; Q169-R173 VanDerWaalsContact OE1-NH2 3.1Å; N170-R173 PolarHBondContact O-N 2.86Å; N170-R173 PolarHBondContact OD1-NH1 3.3Å; L171-R173 VanDerWaalsContact C-N 3.34Å; L171-R173 PolarHBondContact O-N 2.99Å
174	K	91.9	Very high	89.9	Confident	88 Å²	88	55.7 Å²	55.7	38%	0.383	28%	0.282	S	S	.	.	H	α-helix	trans	-91.3	-2	-178.8	-68	175.5	-179.3	-72.7	0	113.1	N170 L171 I172 C190 D193	N170-K174 WeakPolarHBondContact O-CB 3.21Å; N170-K174 WeakPolarHBondContact O-CG 3.35Å; N170-K174 PolarHBondContact O-N 2.91Å; L171-K174 CarbonylContact O-C 3.53Å; L171-K174 PolarHBondContact O-N 3.4Å; L171-K174 VanDerWaalsContact O-N 3.17Å; I172-K174 VanDerWaalsContact C-N 3.31Å; I172-K174 PolarHBondContact O-N 3.36Å; K174-C190 PolarHBondContact O-SG 2.93Å; K174-D193 HydrophobicContact CD-CB 4.36Å
175	F	91.6	Very high	89.6	Confident	5 Å²	5	62.3 Å²	62.3	2%	0.022	31%	0.308	C	S	.	.	S	Bend	trans	-61.3	142	-173.6	-162.6	-98	0	0	0	110	C135 I142 V145 L171 I172 K177 L223 V225	C135-F175 HydrophobicContact CB-CB 4.37Å; C135-F175 HydrophobicContact CB-CD1 3.67Å; C135-F175 HydrophobicContact CB-CE1 4.16Å; C135-F175 HydrophobicContact CB-CG 4.06Å; I142-F175 HydrophobicContact CD1-CE1 3.81Å; I142-F175 HydrophobicContact CD1-CZ 4.03Å; V145-F175 HydrophobicContact CG1-CE2 4.1Å; V145-F175 HydrophobicContact CG1-CZ 4.21Å; V145-F175 HydrophobicContact CG2-CE1 3.97Å; V145-F175 HydrophobicContact CG2-CE2 4.37Å; V145-F175 HydrophobicContact CG2-CZ 3.67Å; L171-F175 WeakPolarHBondContact O-CA 3.28Å; L171-F175 WeakPolarHBondContact O-CB 3.46Å; L171-F175 PolarHBondContact O-N 2.9Å; I172-F175 WeakPolarHBondContact O-CB 3.37Å; I172-F175 PolarHBondContact O-N 2.75Å; F175-K177 WeakPolarHBondContact O-CG 3.5Å; F175-K177 PolarHBondContact O-N 3.09Å; F175-L223 HydrophobicContact CE2-CD2 4.29Å; F175-V225 HydrophobicContact CE2-CG2 4.31Å; F175-V225 HydrophobicContact CZ-CG2 4.12Å
176	P	85.3	Confident	89.3	Confident	11 Å²	11	60.1 Å²	60.1	7%	0.071	30%	0.302	C	S	.	.			trans	-59.2	124.8	-175.2	-25.5	36	0	0	0	112.7	V180 T186 V187	P176-V180 HydrophobicContact CB-CG2 3.8Å; P176-T186 HydrophobicContact CB-CG2 3.76Å; P176-T186 HydrophobicContact CG-CG2 3.5Å; P176-T186 VanDerWaalsContact CG-CG2 3.5Å; P176-V187 HydrophobicContact CG-CG2 4.37Å
177	K	82.1	Confident	89	Confident	117 Å²	117	58.6 Å²	58.6	51%	0.509	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-111.3	141.3	177.2	-59.9	-177	-179.4	-154.8	0	110.4	R136 F175	R136-K177 PolarHBondContact O-NZ 3.17Å; F175-K177 WeakPolarHBondContact O-CG 3.5Å; F175-K177 PolarHBondContact O-N 3.09Å
178	G	75	Confident	88.9	Confident	35 Å²	35	61.6 Å²	61.6	36%	0.361	31%	0.306	S	S	.	.	S	Bend	trans	80.2	-165	179	0	0	0	0	0	114.2	S139 V180	S139-G178 WeakPolarHBondContact CA-O 3.19Å; S139-G178 WeakPolarHBondContact CB-O 3.45Å; G178-V180 WeakPolarHBondContact O-CG2 3.25Å; G178-V180 PolarHBondContact O-N 2.89Å
179	D	72.2	Confident	88.8	Confident	148 Å²	148	68.5 Å²	68.5	79%	0.791	33%	0.331	S	S	*	.			trans	-74.1	116	-176.3	-70.3	-31.3	0	0	0	111.3
180	V	75.3	Confident	88.7	Confident	25 Å²	25	65.4 Å²	65.4	15%	0.152	32%	0.318	C	S	.	.			trans	-107.8	120.4	-177.7	-171.2	0	0	0	0	109.5	P176 G178 S182 T186	P176-V180 HydrophobicContact CB-CG2 3.8Å; G178-V180 WeakPolarHBondContact O-CG2 3.25Å; G178-V180 PolarHBondContact O-N 2.89Å; V180-S182 VanDerWaalsContact C-N 3.29Å; V180-S182 WeakPolarHBondContact CG1-O 3.47Å; V180-S182 PolarHBondContact O-N 2.69Å; V180-T186 HydrophobicContact CG1-CG2 4.14Å; V180-T186 WeakPolarHBondContact CG1-OG1 3.47Å
181	I	76.1	Confident	88.7	Confident	182 Å²	182	65.3 Å²	65.3	93%	0.933	32%	0.317	S	S	*	.	S	Bend	trans	-61.2	-38.2	178.7	-57.3	169.7	0	0	0	111.4
182	S	86.7	Confident	88.7	Confident	40 Å²	40	68.6 Å²	68.6	28%	0.28	34%	0.335	S	S	.	.			trans	-138.7	98.4	177.3	-178.9	0	0	0	0	110.9	V180 E184 K185 T186	V180-S182 VanDerWaalsContact C-N 3.29Å; V180-S182 WeakPolarHBondContact CG1-O 3.47Å; V180-S182 PolarHBondContact O-N 2.69Å; S182-E184 PolarHBondContact O-N 2.77Å; S182-K185 PolarHBondContact O-N 2.91Å; S182-T186 PolarHBondContact O-N 3.04Å; S182-T186 PolarHBondContact O-OG1 2.73Å
183	V	86.8	Confident	88.9	Confident	35 Å²	35	70.9 Å²	70.9	21%	0.212	35%	0.347	C	S	.	.	H	α-helix	trans	-52.9	-44.5	178.1	177.4	0	0	0	0	110.8	I142 T186 V187	I142-V183 HydrophobicContact CD1-CG1 4.28Å; V183-T186 PolarHBondContact O-N 3.41Å; V183-V187 HydrophobicContact CG1-CG2 4.03Å; V183-V187 WeakPolarHBondContact O-CB 3.44Å; V183-V187 VanDerWaalsContact O-CG2 3.25Å; V183-V187 WeakPolarHBondContact O-CG2 3.36Å; V183-V187 PolarHBondContact O-N 3.15Å
184	E	90.3	Very high	89.1	Confident	59 Å²	59	63.9 Å²	63.9	28%	0.276	32%	0.321	S	S	.	.	H	α-helix	trans	-59.6	-52.2	-179	-175.3	-173.2	160.1	0	0	113.2	S182 T186 V187 K188 Y230 R311	S182-E184 PolarHBondContact O-N 2.77Å; E184-T186 VanDerWaalsContact C-N 3.26Å; E184-T186 PolarHBondContact O-N 2.88Å; E184-V187 PolarHBondContact O-N 3.21Å; E184-K188 HydrophobicContact CG-CD 4.18Å; E184-K188 WeakPolarHBondContact O-CB 3.44Å; E184-K188 WeakPolarHBondContact O-CG 3.39Å; E184-K188 PolarHBondContact O-N 2.9Å; E184-K188 WeakPolarHBondContact OE1-CE 3.5Å; E184-K188 IonicContact OE1-NZ 2.81Å; E184-K188 PolarHBondContact OE1-NZ 3.28Å; E184-Y230 WeakPolarHBondContact CA-OH 3.46Å; E184-Y230 HydrophobicContact CG-CE1 3.98Å; E184-R311 IonicContact OE2-CZ 2.82Å; E184-R311 IonicContact OE2-NH1 3.51Å; E184-R311 PolarHBondContact OE2-NH1 2.9Å
185	K	92.1	Very high	89.4	Confident	153 Å²	153	59.8 Å²	59.8	67%	0.665	30%	0.303	S	S	*	.	H	α-helix	trans	-62.4	-39	-177.7	-71.7	-179.2	-178.5	178.2	0	110.8	S182 R189	S182-K185 PolarHBondContact O-N 2.91Å; K185-R189 WeakPolarHBondContact O-CB 3.29Å; K185-R189 PolarHBondContact O-N 3.45Å
186	T	92.3	Very high	89.7	Confident	51 Å²	51	65 Å²	65	31%	0.313	33%	0.326	S	S	.	.	H	α-helix	trans	-73.3	-40.8	-177.9	-45.5	0	0	0	0	111.8	P176 V180 S182 V183 E184 R189 C190	P176-T186 HydrophobicContact CB-CG2 3.76Å; P176-T186 HydrophobicContact CG-CG2 3.5Å; P176-T186 VanDerWaalsContact CG-CG2 3.5Å; V180-T186 HydrophobicContact CG1-CG2 4.14Å; V180-T186 WeakPolarHBondContact CG1-OG1 3.47Å; S182-T186 PolarHBondContact O-N 3.04Å; S182-T186 PolarHBondContact O-OG1 2.73Å; V183-T186 PolarHBondContact O-N 3.41Å; E184-T186 VanDerWaalsContact C-N 3.26Å; E184-T186 PolarHBondContact O-N 2.88Å; T186-R189 PolarHBondContact O-N 2.67Å; T186-C190 VanDerWaalsContact O-CB 3.24Å; T186-C190 WeakPolarHBondContact O-CB 3.16Å; T186-C190 PolarHBondContact O-N 3.09Å
187	V	93.8	Very high	90.4	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-64.1	-43.5	174.5	172	0	0	0	0	111.1	P176 V183 E184 R189 C190 L191 L223 V225 Y230	P176-V187 HydrophobicContact CG-CG2 4.37Å; V183-V187 HydrophobicContact CG1-CG2 4.03Å; V183-V187 WeakPolarHBondContact O-CB 3.44Å; V183-V187 VanDerWaalsContact O-CG2 3.25Å; V183-V187 WeakPolarHBondContact O-CG2 3.36Å; V183-V187 PolarHBondContact O-N 3.15Å; E184-V187 PolarHBondContact O-N 3.21Å; V187-R189 PolarHBondContact O-N 2.89Å; V187-C190 WeakPolarHBondContact O-CB 3.39Å; V187-C190 PolarHBondContact O-N 3.01Å; V187-L191 HydrophobicContact CG1-CD1 4.24Å; V187-L191 PolarHBondContact O-N 3.48Å; V187-L223 HydrophobicContact CG1-CD2 3.68Å; V187-V225 HydrophobicContact CG1-CG2 4.5Å; V187-V225 HydrophobicContact CG2-CG2 4.34Å; V187-Y230 HydrophobicContact CB-CD1 4.43Å; V187-Y230 HydrophobicContact CB-CE1 4.11Å; V187-Y230 HydrophobicContact CB-CE2 4.37Å; V187-Y230 HydrophobicContact CG1-CD1 3.78Å; V187-Y230 HydrophobicContact CG1-CD2 3.72Å; V187-Y230 HydrophobicContact CG1-CE1 3.92Å; V187-Y230 HydrophobicContact CG1-CE2 3.88Å; V187-Y230 HydrophobicContact CG1-CG 3.68Å
188	K	95.9	Very high	91.2	Very high	63 Å²	63	61.7 Å²	61.7	27%	0.274	31%	0.311	S	S	.	.	H	α-helix	trans	-59	-46.7	174.7	-76.9	179.5	169.9	172.8	0	112	E184 L191 L192 Y230 I309	E184-K188 HydrophobicContact CG-CD 4.18Å; E184-K188 WeakPolarHBondContact O-CB 3.44Å; E184-K188 WeakPolarHBondContact O-CG 3.39Å; E184-K188 PolarHBondContact O-N 2.9Å; E184-K188 WeakPolarHBondContact OE1-CE 3.5Å; E184-K188 IonicContact OE1-NZ 2.81Å; E184-K188 PolarHBondContact OE1-NZ 3.28Å; K188-L191 PolarHBondContact O-N 2.85Å; K188-L192 WeakPolarHBondContact O-CG 3.45Å; K188-L192 PolarHBondContact O-N 2.67Å; K188-L192 VanDerWaalsContact O-N 3.09Å; K188-Y230 HydrophobicContact CG-CD1 4.25Å; K188-Y230 HydrophobicContact CG-CE1 4.33Å; K188-I309 HydrophobicContact CG-CG2 4.01Å; K188-I309 WeakPolarHBondContact O-CD1 3.43Å
189	R	95.6	Very high	92.3	Very high	172 Å²	172	60.4 Å²	60.4	65%	0.649	30%	0.296	S	S	*	.	H	α-helix	trans	-62.1	-44.7	176.2	-177.7	174.5	-64.6	170.1	-0.7	111.7	K185 T186 V187 L191 L192 D193	K185-R189 WeakPolarHBondContact O-CB 3.29Å; K185-R189 PolarHBondContact O-N 3.45Å; T186-R189 PolarHBondContact O-N 2.67Å; V187-R189 PolarHBondContact O-N 2.89Å; R189-L191 VanDerWaalsContact C-N 3.31Å; R189-L191 PolarHBondContact O-N 3.19Å; R189-L192 PolarHBondContact O-N 3.38Å; R189-D193 WeakPolarHBondContact O-CB 3.35Å; R189-D193 PolarHBondContact O-N 2.91Å
190	C	95.6	Very high	93.6	Very high	8 Å²	8	58.1 Å²	58.1	5%	0.054	28%	0.28	C	S	.	.	H	α-helix	trans	-55.8	-45.7	177	-177.4	0	0	0	0	111.6	K174 T186 V187 D193 T194	K174-C190 PolarHBondContact O-SG 2.93Å; T186-C190 VanDerWaalsContact O-CB 3.24Å; T186-C190 WeakPolarHBondContact O-CB 3.16Å; T186-C190 PolarHBondContact O-N 3.09Å; V187-C190 WeakPolarHBondContact O-CB 3.39Å; V187-C190 PolarHBondContact O-N 3.01Å; C190-D193 PolarHBondContact O-N 3.35Å; C190-T194 WeakPolarHBondContact O-CB 3.15Å; C190-T194 PolarHBondContact O-N 3.24Å; C190-T194 PolarHBondContact O-OG1 3.38Å
191	L	97.8	Very high	94.7	Very high	2 Å²	2	60 Å²	60	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-47.3	175.6	-76.6	165.3	0	0	0	112.1	L171 V187 K188 R189 D193 T194 F195 L223 A232 I309	L171-L191 HydrophobicContact CD1-CD2 3.82Å; L171-L191 HydrophobicContact CD1-CG 4.29Å; V187-L191 HydrophobicContact CG1-CD1 4.24Å; V187-L191 PolarHBondContact O-N 3.48Å; K188-L191 PolarHBondContact O-N 2.85Å; R189-L191 VanDerWaalsContact C-N 3.31Å; R189-L191 PolarHBondContact O-N 3.19Å; L191-D193 PolarHBondContact O-N 3.36Å; L191-T194 PolarHBondContact O-N 2.79Å; L191-F195 VanDerWaalsContact O-CD2 3.28Å; L191-F195 WeakPolarHBondContact O-CD2 3.48Å; L191-F195 PolarHBondContact O-N 3Å; L191-L223 HydrophobicContact CD1-CD2 4.26Å; L191-L223 HydrophobicContact CD2-CD2 4.2Å; L191-L223 HydrophobicContact CG-CD2 4.27Å; L191-A232 HydrophobicContact CD1-CB 4.45Å; L191-A232 HydrophobicContact CD2-CB 4.33Å; L191-I309 HydrophobicContact CB-CD1 3.65Å; L191-I309 HydrophobicContact CD1-CD1 4.32Å; L191-I309 HydrophobicContact CD1-CG2 4.25Å
192	L	98.3	Very high	95.7	Very high	71 Å²	71	51.4 Å²	51.4	37%	0.372	24%	0.243	S	C	.	.	H	α-helix	trans	-58.3	-48.1	177.3	-67.5	172.5	0	0	0	111.9	K188 R189 T194 F195 K196 V306 P307 I309	K188-L192 WeakPolarHBondContact O-CG 3.45Å; K188-L192 PolarHBondContact O-N 2.67Å; K188-L192 VanDerWaalsContact O-N 3.09Å; R189-L192 PolarHBondContact O-N 3.38Å; L192-T194 VanDerWaalsContact C-N 3.28Å; L192-T194 PolarHBondContact O-N 2.82Å; L192-F195 PolarHBondContact O-N 2.84Å; L192-K196 WeakPolarHBondContact O-CB 3.3Å; L192-K196 PolarHBondContact O-N 3.47Å; L192-K196 VanDerWaalsContact O-N 3.09Å; L192-V306 HydrophobicContact CD2-CG1 4.09Å; L192-P307 HydrophobicContact CD2-CG 4.16Å; L192-I309 HydrophobicContact CD2-CD1 3.72Å; L192-I309 HydrophobicContact CD2-CG1 4.4Å; L192-I309 HydrophobicContact CG-CD1 3.67Å
193	D	97.9	Very high	96.3	Very high	76 Å²	76	51.6 Å²	51.6	41%	0.406	24%	0.241	S	C	.	.	H	α-helix	trans	-66.1	-33.4	179.9	-68.9	-20.2	0	0	0	111.8	K174 R189 C190 L191 H197	K174-D193 HydrophobicContact CD-CB 4.36Å; R189-D193 WeakPolarHBondContact O-CB 3.35Å; R189-D193 PolarHBondContact O-N 2.91Å; C190-D193 PolarHBondContact O-N 3.35Å; L191-D193 PolarHBondContact O-N 3.36Å; D193-H197 WeakPolarHBondContact O-CB 3.27Å; D193-H197 PolarHBondContact O-N 2.92Å
194	T	98.3	Very high	96.9	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-67.3	-49.3	177.8	-65.2	0	0	0	0	111.3	L167 N170 L171 C190 L191 L192 K196 H197 T198	L167-T194 HydrophobicContact CD1-CG2 3.77Å; L167-T194 HydrophobicContact CG-CG2 4.26Å; L167-T194 VanDerWaalsContact O-CG2 3.25Å; L167-T194 WeakPolarHBondContact O-CG2 3.29Å; N170-T194 HydrophobicContact CB-CG2 3.94Å; L171-T194 HydrophobicContact CB-CG2 3.97Å; C190-T194 WeakPolarHBondContact O-CB 3.15Å; C190-T194 PolarHBondContact O-N 3.24Å; C190-T194 PolarHBondContact O-OG1 3.38Å; L191-T194 PolarHBondContact O-N 2.79Å; L192-T194 VanDerWaalsContact C-N 3.28Å; L192-T194 PolarHBondContact O-N 2.82Å; T194-K196 PolarHBondContact O-N 3.49Å; T194-H197 PolarHBondContact O-N 3.2Å; T194-T198 WeakPolarHBondContact O-CB 3.36Å; T194-T198 PolarHBondContact O-N 3.32Å; T194-T198 PolarHBondContact O-OG1 2.96Å
195	F	98.7	Very high	97.2	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.009	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-45.4	177.8	-87.9	-112.1	0	0	0	111.8	L167 L191 L192 H197 T198 D199 A219 A232 L234 P307	L167-F195 HydrophobicContact CD1-CD2 4.01Å; L167-F195 HydrophobicContact CD1-CE2 4.31Å; L167-F195 HydrophobicContact CD1-CG 4.21Å; L167-F195 HydrophobicContact CD2-CD2 4.46Å; L167-F195 HydrophobicContact CD2-CE1 4.37Å; L167-F195 HydrophobicContact CD2-CE2 3.96Å; L167-F195 HydrophobicContact CD2-CZ 3.91Å; L191-F195 VanDerWaalsContact O-CD2 3.28Å; L191-F195 WeakPolarHBondContact O-CD2 3.48Å; L191-F195 PolarHBondContact O-N 3Å; L192-F195 PolarHBondContact O-N 2.84Å; F195-H197 PolarHBondContact O-N 2.99Å; F195-T198 PolarHBondContact O-N 2.74Å; F195-D199 WeakPolarHBondContact O-CB 3.38Å; F195-D199 PolarHBondContact O-N 3.49Å; F195-A219 HydrophobicContact CE1-CB 3.68Å; F195-A219 HydrophobicContact CZ-CB 4.21Å; F195-A232 HydrophobicContact CE2-CB 3.76Å; F195-A232 HydrophobicContact CZ-CB 3.86Å; F195-L234 HydrophobicContact CD1-CB 4.37Å; F195-L234 HydrophobicContact CD1-CD2 4.12Å; F195-L234 HydrophobicContact CE1-CB 3.95Å; F195-L234 HydrophobicContact CE1-CD2 4.34Å; F195-P307 HydrophobicContact CB-CG 4.04Å; F195-P307 HydrophobicContact CD1-CB 3.88Å; F195-P307 HydrophobicContact CD1-CG 3.78Å; F195-P307 HydrophobicContact CD2-CG 3.92Å; F195-P307 HydrophobicContact CE1-CB 3.86Å; F195-P307 HydrophobicContact CE1-CG 4.14Å; F195-P307 HydrophobicContact CE2-CG 4.27Å; F195-P307 HydrophobicContact CG-CB 4.26Å; F195-P307 HydrophobicContact CG-CG 3.64Å; F195-P307 HydrophobicContact CZ-CB 4.22Å; F195-P307 HydrophobicContact CZ-CG 4.37Å
196	K	98.6	Very high	97.5	Very high	114 Å²	114	51.5 Å²	51.5	50%	0.496	24%	0.239	S	C	.	.	H	α-helix	trans	-58.3	-49.2	175.7	179.8	179.5	171.6	-176.6	0	111.4	L192 T194 D199 E200	L192-K196 WeakPolarHBondContact O-CB 3.3Å; L192-K196 PolarHBondContact O-N 3.47Å; L192-K196 VanDerWaalsContact O-N 3.09Å; T194-K196 PolarHBondContact O-N 3.49Å; K196-D199 PolarHBondContact O-N 2.87Å; K196-E200 WeakPolarHBondContact CE-OE1 3.36Å; K196-E200 IonicContact NZ-OE1 2.97Å; K196-E200 WeakPolarHBondContact O-CG 3.26Å; K196-E200 PolarHBondContact O-N 2.92Å
197	H	98.6	Very high	97.8	Very high	58 Å²	58	53.1 Å²	53.1	27%	0.269	25%	0.252	S	S	.	.	H	α-helix	trans	-63.6	-44.7	-178.6	-174.7	-130.7	0	0	0	112.2	N170 D193 T194 F195 D199 E200 E201	N170-H197 PolarHBondContact ND2-ND1 2.89Å; D193-H197 WeakPolarHBondContact O-CB 3.27Å; D193-H197 PolarHBondContact O-N 2.92Å; T194-H197 PolarHBondContact O-N 3.2Å; F195-H197 PolarHBondContact O-N 2.99Å; H197-D199 VanDerWaalsContact C-N 3.31Å; H197-D199 PolarHBondContact O-N 2.79Å; H197-E200 PolarHBondContact O-N 2.82Å; H197-E201 IonicContact CE1-OE1 2.89Å; H197-E201 PolarHBondContact CE1-OE1 2.93Å; H197-E201 IonicContact CE1-OE2 3.91Å; H197-E201 IonicContact ND1-OE2 2.68Å; H197-E201 IonicContact NE2-OE1 3.3Å; H197-E201 WeakPolarHBondContact O-CG 3.29Å; H197-E201 PolarHBondContact O-N 2.88Å
198	T	98.8	Very high	97.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.9	-37.2	177.8	-67.1	0	0	0	0	112.2	F162 L167 N170 T194 F195 F202 I293	F162-T198 HydrophobicContact CD1-CG2 4.24Å; F162-T198 HydrophobicContact CE1-CG2 4.04Å; L167-T198 HydrophobicContact CB-CG2 4.29Å; L167-T198 HydrophobicContact CD1-CG2 3.94Å; L167-T198 WeakPolarHBondContact CD1-OG1 3.39Å; N170-T198 PolarHBondContact ND2-OG1 2.78Å; T194-T198 WeakPolarHBondContact O-CB 3.36Å; T194-T198 PolarHBondContact O-N 3.32Å; T194-T198 PolarHBondContact O-OG1 2.96Å; F195-T198 PolarHBondContact O-N 2.74Å; T198-F202 WeakPolarHBondContact O-CB 3.36Å; T198-F202 PolarHBondContact O-N 3.22Å; T198-I293 HydrophobicContact CG2-CD1 4.26Å
199	D	98.8	Very high	98	Very high	8 Å²	8	57.3 Å²	57.3	4%	0.043	28%	0.282	C	S	.	.	H	α-helix	trans	-66.1	-45	174.1	-173.9	59.2	0	0	0	112.1	F195 K196 H197 E201 F202 L203 I293 G294 K299 S305	F195-D199 WeakPolarHBondContact O-CB 3.38Å; F195-D199 PolarHBondContact O-N 3.49Å; K196-D199 PolarHBondContact O-N 2.87Å; H197-D199 VanDerWaalsContact C-N 3.31Å; H197-D199 PolarHBondContact O-N 2.79Å; D199-E201 VanDerWaalsContact C-N 3.35Å; D199-E201 PolarHBondContact O-N 2.82Å; D199-F202 PolarHBondContact O-N 2.99Å; D199-L203 WeakPolarHBondContact O-CB 3.34Å; D199-L203 VanDerWaalsContact O-CG 3.23Å; D199-L203 WeakPolarHBondContact O-CG 3.47Å; D199-L203 PolarHBondContact O-N 3.03Å; D199-I293 WeakPolarHBondContact OD1-CA 3.47Å; D199-G294 PolarHBondContact OD1-N 3.06Å; D199-K299 IonicContact OD1-NZ 2.76Å; D199-K299 PolarHBondContact OD1-NZ 2.94Å; D199-K299 IonicContact OD2-NZ 3.09Å; D199-K299 PolarHBondContact OD2-NZ 3.22Å; D199-S305 VanDerWaalsContact CB-CB 3.46Å; D199-S305 WeakPolarHBondContact OD2-CB 2.91Å; D199-S305 PolarHBondContact OD2-OG 3.43Å
200	E	98.7	Very high	97.9	Very high	100 Å²	100	58.8 Å²	58.8	47%	0.467	29%	0.293	S	S	.	.	H	α-helix	trans	-60	-43.2	176.6	-72.9	171.1	173.1	0	0	112.1	K196 H197 K204	K196-E200 WeakPolarHBondContact CE-OE1 3.36Å; K196-E200 IonicContact NZ-OE1 2.97Å; K196-E200 WeakPolarHBondContact O-CG 3.26Å; K196-E200 PolarHBondContact O-N 2.92Å; H197-E200 PolarHBondContact O-N 2.82Å; E200-K204 WeakPolarHBondContact O-CB 3.46Å; E200-K204 PolarHBondContact O-N 2.78Å
201	E	98.6	Very high	97.8	Very high	65 Å²	65	64 Å²	64	30%	0.304	33%	0.327	S	S	.	.	H	α-helix	trans	-63.2	-46.3	176	-71.5	-177.6	125.9	0	0	111.8	F162 N170 H197 D199 K204 Q205	F162-E201 HydrophobicContact CE1-CB 4.17Å; F162-E201 HydrophobicContact CZ-CB 3.81Å; N170-E201 PolarHBondContact ND2-OE2 3.34Å; H197-E201 IonicContact CE1-OE1 2.89Å; H197-E201 PolarHBondContact CE1-OE1 2.93Å; H197-E201 IonicContact CE1-OE2 3.91Å; H197-E201 IonicContact ND1-OE2 2.68Å; H197-E201 IonicContact NE2-OE1 3.3Å; H197-E201 WeakPolarHBondContact O-CG 3.29Å; H197-E201 PolarHBondContact O-N 2.88Å; D199-E201 VanDerWaalsContact C-N 3.35Å; D199-E201 PolarHBondContact O-N 2.82Å; E201-K204 PolarHBondContact O-N 2.89Å; E201-Q205 PolarHBondContact O-N 3.07Å
202	F	98.8	Very high	97.7	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.009	35%	0.348	C	S	.	.	H	α-helix	trans	-64.9	-43.6	178.5	-178.3	-106.8	0	0	0	111.9	R158 A159 F162 T198 D199 K204 Q205 A206 W213 D215 I293 G294	R158-F202 HydrophobicContact CB-CE2 4.27Å; R158-F202 HydrophobicContact CB-CZ 4.42Å; A159-F202 VanDerWaalsContact CA-CZ 3.5Å; A159-F202 HydrophobicContact CB-CD1 4.36Å; A159-F202 HydrophobicContact CB-CE1 3.66Å; A159-F202 HydrophobicContact CB-CE2 4.21Å; A159-F202 HydrophobicContact CB-CZ 3.58Å; F162-F202 HydrophobicContact CB-CD2 3.62Å; F162-F202 HydrophobicContact CB-CE2 4.06Å; F162-F202 HydrophobicContact CD1-CB 3.65Å; F162-F202 AromaticContact CD1-CD2 3.84Å; F162-F202 HydrophobicContact CD1-CD2 3.84Å; F162-F202 HydrophobicContact CD1-CG 4.12Å; F162-F202 HydrophobicContact CD2-CD2 4.04Å; F162-F202 HydrophobicContact CE1-CB 3.73Å; F162-F202 HydrophobicContact CG-CB 4.24Å; F162-F202 AromaticContact CG-CD2 3.55Å; F162-F202 HydrophobicContact CG-CD2 3.55Å; F162-F202 HydrophobicContact CG-CE2 4.42Å; F162-F202 HydrophobicContact CG-CG 4.29Å; F162-F202 HydrophobicContact CZ-CB 4.38Å; T198-F202 WeakPolarHBondContact O-CB 3.36Å; T198-F202 PolarHBondContact O-N 3.22Å; D199-F202 PolarHBondContact O-N 2.99Å; F202-K204 VanDerWaalsContact C-N 3.31Å; F202-K204 PolarHBondContact O-N 3.33Å; F202-Q205 CarbonylContact O-C 3.55Å; F202-Q205 PolarHBondContact O-N 2.96Å; F202-Q205 VanDerWaalsContact O-N 3.15Å; F202-A206 HydrophobicContact CE1-CB 4.27Å; F202-A206 HydrophobicContact CZ-CB 4.4Å; F202-A206 VanDerWaalsContact O-CB 3.27Å; F202-A206 WeakPolarHBondContact O-CB 3.41Å; F202-A206 PolarHBondContact O-N 2.82Å; F202-W213 HydrophobicContact CE2-CE3 4.13Å; F202-W213 HydrophobicContact CE2-CZ3 4.4Å; F202-W213 HydrophobicContact CZ-CE3 4.37Å; F202-D215 HydrophobicContact CZ-CB 4.14Å; F202-I293 HydrophobicContact CB-CG2 4.36Å; F202-I293 HydrophobicContact CD1-CG2 4.43Å; F202-G294 VanDerWaalsContact CD1-CA 3.46Å
203	L	98.6	Very high	97.7	Very high	44 Å²	44	66.4 Å²	66.4	23%	0.23	34%	0.343	C	S	.	.	H	α-helix	trans	-63	-37.3	178.2	-71.7	175.3	0	0	0	112.2	D199 A206 S207 K299	D199-L203 WeakPolarHBondContact O-CB 3.34Å; D199-L203 VanDerWaalsContact O-CG 3.23Å; D199-L203 WeakPolarHBondContact O-CG 3.47Å; D199-L203 PolarHBondContact O-N 3.03Å; L203-A206 PolarHBondContact O-N 2.96Å; L203-S207 WeakPolarHBondContact O-CB 3.37Å; L203-S207 PolarHBondContact O-N 3.26Å; L203-S207 PolarHBondContact O-OG 3.07Å; L203-K299 HydrophobicContact CD1-CG 4.33Å
204	K	98.4	Very high	97.7	Very high	163 Å²	163	68.9 Å²	68.9	71%	0.709	35%	0.35	S	S	*	.	H	α-helix	trans	-63.1	-44.5	173	-175.7	-179	178.3	-176.6	0	111.1	E200 E201 F202 S207 S208	E200-K204 WeakPolarHBondContact O-CB 3.46Å; E200-K204 PolarHBondContact O-N 2.78Å; E201-K204 PolarHBondContact O-N 2.89Å; F202-K204 VanDerWaalsContact C-N 3.31Å; F202-K204 PolarHBondContact O-N 3.33Å; K204-S207 PolarHBondContact O-OG 2.74Å; K204-S208 PolarHBondContact O-N 3.12Å
205	Q	98.2	Very high	97.7	Very high	77 Å²	77	68.9 Å²	68.9	36%	0.36	35%	0.35	S	S	.	.	H	α-helix	trans	-67.2	-43	177	-172.9	177.1	-5.7	0	0	111.9	F162 E201 F202 S207 S208 Q209 W213	F162-Q205 VanDerWaalsContact CD2-OE1 3.28Å; E201-Q205 PolarHBondContact O-N 3.07Å; F202-Q205 CarbonylContact O-C 3.55Å; F202-Q205 PolarHBondContact O-N 2.96Å; F202-Q205 VanDerWaalsContact O-N 3.15Å; Q205-S207 PolarHBondContact O-N 3.21Å; Q205-S208 PolarHBondContact O-N 3.13Å; Q205-S208 PolarHBondContact O-OG 3.46Å; Q205-Q209 VanDerWaalsContact O-CG 3.27Å; Q205-Q209 WeakPolarHBondContact O-CG 3.45Å; Q205-W213 HydrophobicContact CG-CH2 4.21Å; Q205-W213 HydrophobicContact CG-CZ3 3.77Å
206	A	97.8	Very high	97.7	Very high	5 Å²	5	68.8 Å²	68.8	4%	0.041	35%	0.349	C	S	.	.	H	α-helix	trans	-62.9	-41.8	-179.3	0	0	0	0	0	112.5	F202 L203 S208 Q209 A212 W213	F202-A206 HydrophobicContact CE1-CB 4.27Å; F202-A206 HydrophobicContact CZ-CB 4.4Å; F202-A206 VanDerWaalsContact O-CB 3.27Å; F202-A206 WeakPolarHBondContact O-CB 3.41Å; F202-A206 PolarHBondContact O-N 2.82Å; L203-A206 PolarHBondContact O-N 2.96Å; A206-S208 VanDerWaalsContact C-N 3.33Å; A206-S208 PolarHBondContact O-N 2.67Å; A206-Q209 PolarHBondContact O-N 3.39Å; A206-A212 WeakPolarHBondContact O-CA 3.49Å; A206-W213 HydrophobicContact CB-CB 3.83Å; A206-W213 HydrophobicContact CB-CE3 4.23Å; A206-W213 PolarHBondContact O-N 3.44Å; A206-W213 VanDerWaalsContact O-N 3.09Å
207	S	97.4	Very high	97.7	Very high	84 Å²	84	63.4 Å²	63.4	59%	0.587	33%	0.326	S	S	*	.	H	α-helix	trans	-74.3	-19.6	-179.8	57.2	0	0	0	0	114	L203 K204 Q205 Q209	L203-S207 WeakPolarHBondContact O-CB 3.37Å; L203-S207 PolarHBondContact O-N 3.26Å; L203-S207 PolarHBondContact O-OG 3.07Å; K204-S207 PolarHBondContact O-OG 2.74Å; Q205-S207 PolarHBondContact O-N 3.21Å; S207-Q209 PolarHBondContact O-N 3.45Å
208	S	97.5	Very high	97.7	Very high	80 Å²	80	60.7 Å²	60.7	56%	0.559	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-7.2	176.9	79.4	0	0	0	0	113.7	K204 Q205 A206	K204-S208 PolarHBondContact O-N 3.12Å; Q205-S208 PolarHBondContact O-N 3.13Å; Q205-S208 PolarHBondContact O-OG 3.46Å; A206-S208 VanDerWaalsContact C-N 3.33Å; A206-S208 PolarHBondContact O-N 2.67Å
209	Q	96.6	Very high	97.7	Very high	72 Å²	72	60.7 Å²	60.7	34%	0.336	31%	0.314	S	S	.	.	S	Bend	trans	-93.5	155.5	-174.1	-55.7	-67.5	-33.3	0	0	111	Q205 A206 S207 P211 A212 W213	Q205-Q209 VanDerWaalsContact O-CG 3.27Å; Q205-Q209 WeakPolarHBondContact O-CG 3.45Å; A206-Q209 PolarHBondContact O-N 3.39Å; S207-Q209 PolarHBondContact O-N 3.45Å; Q209-P211 CarbonylContact C-O 3.34Å; Q209-P211 CarbonylContact O-C 3.51Å; Q209-P211 VanDerWaalsContact O-C 3.26Å; Q209-A212 WeakPolarHBondContact O-CA 3.27Å; Q209-A212 PolarHBondContact O-N 2.87Å; Q209-A212 VanDerWaalsContact O-N 3.13Å; Q209-W213 HydrophobicContact CB-CD2 4.32Å; Q209-W213 HydrophobicContact CB-CG 4.33Å; Q209-W213 HydrophobicContact CB-CZ2 4.47Å; Q209-W213 HydrophobicContact CG-CD2 3.81Å; Q209-W213 VanDerWaalsContact CG-CE2 3.41Å; Q209-W213 HydrophobicContact CG-CE3 4.3Å; Q209-W213 HydrophobicContact CG-CG 4.31Å; Q209-W213 HydrophobicContact CG-CH2 4.09Å; Q209-W213 HydrophobicContact CG-CZ2 3.56Å; Q209-W213 HydrophobicContact CG-CZ3 4.43Å
210	K	94.6	Very high	97.7	Very high	203 Å²	203	60.3 Å²	60.3	88%	0.883	31%	0.312	S	S	*	.	S	Bend	trans	-129.8	106.6	179.5	-65.8	-175.8	-177.9	179.7	0	109.6
211	P	93.5	Very high	97.7	Very high	118 Å²	118	55.6 Å²	55.6	77%	0.766	29%	0.289	S	S	*	.	S	Bend	cis	-67	155.8	-3.6	30	-35.4	0	0	0	112.9	Q209	Q209-P211 CarbonylContact C-O 3.34Å; Q209-P211 CarbonylContact O-C 3.51Å; Q209-P211 VanDerWaalsContact O-C 3.26Å
212	A	96.1	Very high	97.7	Very high	56 Å²	56	52.5 Å²	52.5	46%	0.463	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-63.1	139.4	176.5	0	0	0	0	0	110.4	A206 Q209	A206-A212 WeakPolarHBondContact O-CA 3.49Å; Q209-A212 WeakPolarHBondContact O-CA 3.27Å; Q209-A212 PolarHBondContact O-N 2.87Å; Q209-A212 VanDerWaalsContact O-N 3.13Å
213	W	97.8	Very high	97.7	Very high	66 Å²	66	52.4 Å²	52.4	25%	0.25	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-71.3	140.7	179.2	-60.4	-17.9	0	0	0	110.9	R158 F202 Q205 A206 Q209 D215	R158-W213 HydrophobicContact CB-CE3 4.28Å; R158-W213 HydrophobicContact CB-CZ3 4.45Å; R158-W213 VanDerWaalsContact CD-CD2 3.42Å; F202-W213 HydrophobicContact CE2-CE3 4.13Å; F202-W213 HydrophobicContact CE2-CZ3 4.4Å; F202-W213 HydrophobicContact CZ-CE3 4.37Å; Q205-W213 HydrophobicContact CG-CH2 4.21Å; Q205-W213 HydrophobicContact CG-CZ3 3.77Å; A206-W213 HydrophobicContact CB-CB 3.83Å; A206-W213 HydrophobicContact CB-CE3 4.23Å; A206-W213 PolarHBondContact O-N 3.44Å; A206-W213 VanDerWaalsContact O-N 3.09Å; Q209-W213 HydrophobicContact CB-CD2 4.32Å; Q209-W213 HydrophobicContact CB-CG 4.33Å; Q209-W213 HydrophobicContact CB-CZ2 4.47Å; Q209-W213 HydrophobicContact CG-CD2 3.81Å; Q209-W213 VanDerWaalsContact CG-CE2 3.41Å; Q209-W213 HydrophobicContact CG-CE3 4.3Å; Q209-W213 HydrophobicContact CG-CG 4.31Å; Q209-W213 HydrophobicContact CG-CH2 4.09Å; Q209-W213 HydrophobicContact CG-CZ2 3.56Å; Q209-W213 HydrophobicContact CG-CZ3 4.43Å; W213-D215 WeakPolarHBondContact CB-OD2 3.43Å
214	K	97.4	Very high	97.6	Very high	129 Å²	129	50.3 Å²	50.3	56%	0.561	26%	0.263	S	S	*	.			trans	-115	6.2	179.1	-64.1	-177.9	175.1	-173.3	0	112.3	Q297	K214-Q297 VanDerWaalsContact CD-OE1 3.31Å
215	D	98.3	Very high	97.5	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	23%	0.23	C	C	.	.			trans	-59.3	146.4	-179.4	-47.8	-139.5	0	0	0	110.3	H154 G156 R158 A159 F202 W213 D295	H154-D215 WeakPolarHBondContact O-CA 3.37Å; G156-D215 WeakPolarHBondContact CA-OD1 3.41Å; R158-D215 HydrophobicContact CB-CB 4.43Å; R158-D215 VanDerWaalsContact CB-OD1 3.27Å; R158-D215 WeakPolarHBondContact CB-OD1 3.45Å; R158-D215 IonicContact CZ-OD1 2.74Å; R158-D215 VanDerWaalsContact CZ-OD1 3.22Å; R158-D215 IonicContact CZ-OD2 2.76Å; R158-D215 VanDerWaalsContact CZ-OD2 3.22Å; R158-D215 PolarHBondContact N-OD1 3.25Å; R158-D215 IonicContact NE-OD1 2.84Å; R158-D215 PolarHBondContact NE-OD1 3.09Å; R158-D215 IonicContact NE-OD2 3.58Å; R158-D215 PolarHBondContact NE-OD2 3.42Å; R158-D215 VanDerWaalsContact NH2-CG 3.29Å; R158-D215 IonicContact NH2-OD1 2.85Å; R158-D215 PolarHBondContact NH2-OD1 3.47Å; R158-D215 VanDerWaalsContact NH2-OD1 3.14Å; R158-D215 IonicContact NH2-OD2 3.77Å; R158-D215 PolarHBondContact NH2-OD2 2.91Å; A159-D215 HydrophobicContact CB-CB 3.83Å; F202-D215 HydrophobicContact CZ-CB 4.14Å; W213-D215 WeakPolarHBondContact CB-OD2 3.43Å; D215-D295 PolarHBondContact O-N 2.56Å
216	G	98.6	Very high	97.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	167.6	168.2	0	0	0	0	0	110.4	H154 I293	H154-G216 VanDerWaalsContact CE1-C 3.44Å; H154-G216 PolarHBondContact N-O 2.83Å; H154-G216 WeakPolarHBondContact NE2-CA 3.21Å; H154-G216 PolarHBondContact O-N 2.99Å; G216-I293 CarbonylContact C-O 3.5Å; G216-I293 WeakPolarHBondContact CA-O 3.27Å
217	S	98.8	Very high	97.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	143.5	175.1	-171.5	0	0	0	0	111.9	D152 S160 S292 I293	D152-S217 CarbonylContact O-C 3.54Å; D152-S217 WeakPolarHBondContact O-CA 3.29Å; D152-S217 WeakPolarHBondContact O-CB 3.49Å; D152-S217 PolarHBondContact O-OG 3.23Å; S160-S217 VanDerWaalsContact CA-OG 3.29Å; S160-S217 WeakPolarHBondContact CA-OG 3.35Å; S160-S217 VanDerWaalsContact CB-OG 3.26Å; S160-S217 WeakPolarHBondContact CB-OG 3.4Å; S217-S292 WeakPolarHBondContact O-CA 3.26Å; S217-S292 WeakPolarHBondContact O-CB 3.23Å; S217-I293 PolarHBondContact N-O 3.09Å; S217-I293 PolarHBondContact O-N 3.44Å
218	T	98.8	Very high	97.1	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.012	20%	0.203	C	C	.	.			trans	-68.5	165.3	162.4	80	0	0	0	0	109.9	F151 D152 L234 D236 S237 V289	F151-T218 WeakPolarHBondContact CA-O 3.49Å; D152-T218 HydrophobicContact CB-CG2 3.95Å; D152-T218 WeakPolarHBondContact CB-OG1 3.48Å; D152-T218 PolarHBondContact N-OG1 2.68Å; D152-T218 PolarHBondContact O-N 2.82Å; T218-L234 CarbonylContact C-O 3.58Å; T218-L234 VanDerWaalsContact CA-O 3.3Å; T218-L234 WeakPolarHBondContact CA-O 3.21Å; T218-L234 VanDerWaalsContact CB-O 3.27Å; T218-L234 WeakPolarHBondContact CB-O 3.34Å; T218-D236 WeakPolarHBondContact CG2-OD1 3.37Å; T218-S237 PolarHBondContact OG1-OG 2.83Å; T218-S237 VanDerWaalsContact OG1-OG 3.06Å; T218-V289 HydrophobicContact CG2-CG1 4.22Å
219	A	98.7	Very high	97.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	109	172.1	0	0	0	0	0	109.5	F151 L167 F195 N233 L234 I293	F151-A219 HydrophobicContact CD1-CB 3.7Å; F151-A219 HydrophobicContact CE1-CB 3.73Å; L167-A219 HydrophobicContact CD2-CB 4.5Å; F195-A219 HydrophobicContact CE1-CB 3.68Å; F195-A219 HydrophobicContact CZ-CB 4.21Å; A219-N233 CarbonylContact O-C 3.59Å; A219-L234 HydrophobicContact CB-CB 4.27Å; A219-L234 PolarHBondContact N-O 3.41Å; A219-L234 WeakPolarHBondContact O-CB 3.39Å; A219-L234 PolarHBondContact O-N 2.97Å; A219-I293 HydrophobicContact CB-CD1 4.1Å
220	T	98.8	Very high	97.3	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	115.2	169	-53	0	0	0	0	108.1	A149 V150 N233 S237 A239 L323	A149-T220 VanDerWaalsContact CA-O 3.25Å; A149-T220 WeakPolarHBondContact CA-O 3.13Å; V150-T220 PolarHBondContact N-O 2.8Å; V150-T220 PolarHBondContact O-N 3.03Å; T220-N233 WeakPolarHBondContact CB-OD1 3.24Å; T220-N233 WeakPolarHBondContact CG2-OD1 3.39Å; T220-N233 PolarHBondContact OG1-OD1 2.93Å; T220-S237 WeakPolarHBondContact OG1-CB 3.38Å; T220-S237 PolarHBondContact OG1-O 2.85Å; T220-A239 HydrophobicContact CG2-CB 3.87Å; T220-L323 HydrophobicContact CG2-CD2 4.47Å
221	C	98.1	Very high	97.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	148.5	176.8	73.1	0	0	0	0	112.7	Y147 F148 A149 I231 A232	Y147-C221 HydrophobicContact CE2-CB 3.73Å; F148-C221 CarbonylContact O-C 3.54Å; F148-C221 WeakPolarHBondContact O-CA 3.25Å; A149-C221 HydrophobicContact CB-CB 3.7Å; C221-I231 WeakPolarHBondContact O-CA 3.24Å; C221-A232 PolarHBondContact N-O 3.45Å; C221-A232 PolarHBondContact O-N 3.03Å
222	V	98.8	Very high	97.7	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	111.5	172.5	178.1	0	0	0	0	107.4	F148 L229 I231 A239 I321 L323	F148-V222 PolarHBondContact N-O 2.88Å; F148-V222 PolarHBondContact O-N 3.27Å; V222-L229 HydrophobicContact CG1-CB 4.4Å; V222-L229 HydrophobicContact CG1-CD2 4.06Å; V222-I231 HydrophobicContact CG2-CG1 4.07Å; V222-A239 HydrophobicContact CG2-CB 4.34Å; V222-I321 HydrophobicContact CG1-CD1 4.12Å; V222-I321 HydrophobicContact CG2-CG2 4.4Å; V222-L323 HydrophobicContact CG2-CD1 4.05Å; V222-L323 HydrophobicContact CG2-CD2 3.93Å; V222-L323 HydrophobicContact CG2-CG 4.14Å
223	L	98.5	Very high	97.8	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	113.5	169.7	174.8	65.6	0	0	0	108.2	V145 S146 L171 F175 V187 L191 V225 Y230	V145-L223 HydrophobicContact CG1-CD1 3.53Å; S146-L223 WeakPolarHBondContact O-CA 3.39Å; L171-L223 HydrophobicContact CD1-CD2 4.3Å; L171-L223 HydrophobicContact CD2-CD1 3.86Å; L171-L223 HydrophobicContact CD2-CD2 4.13Å; L171-L223 HydrophobicContact CD2-CG 4.46Å; F175-L223 HydrophobicContact CE2-CD2 4.29Å; V187-L223 HydrophobicContact CG1-CD2 3.68Å; L191-L223 HydrophobicContact CD1-CD2 4.26Å; L191-L223 HydrophobicContact CD2-CD2 4.2Å; L191-L223 HydrophobicContact CG-CD2 4.27Å; L223-V225 HydrophobicContact CD2-CG2 4.35Å; L223-V225 HydrophobicContact CG-CG2 4.14Å; L223-Y230 PolarHBondContact N-O 3.38Å; L223-Y230 PolarHBondContact O-N 3.04Å
224	A	97.6	Very high	97.8	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	122.9	172.1	0	0	0	0	0	109.2	L107 V145 S146 I228 L229	L107-A224 HydrophobicContact CD1-CB 3.29Å; V145-A224 CarbonylContact C-O 3.42Å; V145-A224 VanDerWaalsContact CA-O 3.29Å; V145-A224 WeakPolarHBondContact CA-O 3.48Å; S146-A224 PolarHBondContact N-O 3.27Å; S146-A224 PolarHBondContact O-N 3.18Å; A224-I228 WeakPolarHBondContact CA-O 3.25Å; A224-L229 HydrophobicContact CB-CD2 3.82Å
225	V	95.3	Very high	97.9	Very high	2 Å²	2	4 Å²	4	1%	0.012	2%	0.021	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	108.1	169.1	-177	0	0	0	0	106.2	I142 R144 F175 V187 L223 N227 I228 Y230	I142-V225 HydrophobicContact CB-CG1 4.37Å; I142-V225 HydrophobicContact CD1-CG1 3.86Å; I142-V225 HydrophobicContact CG1-CG1 3.78Å; I142-V225 HydrophobicContact CG2-CG1 3.76Å; R144-V225 WeakPolarHBondContact O-CA 3.35Å; F175-V225 HydrophobicContact CE2-CG2 4.31Å; F175-V225 HydrophobicContact CZ-CG2 4.12Å; V187-V225 HydrophobicContact CG1-CG2 4.5Å; V187-V225 HydrophobicContact CG2-CG2 4.34Å; L223-V225 HydrophobicContact CD2-CG2 4.35Å; L223-V225 HydrophobicContact CG-CG2 4.14Å; V225-N227 PolarHBondContact O-N 3.01Å; V225-I228 PolarHBondContact N-O 2.78Å; V225-I228 PolarHBondContact O-N 2.96Å; V225-Y230 HydrophobicContact CB-CE2 4.1Å; V225-Y230 HydrophobicContact CG2-CD2 4.19Å; V225-Y230 HydrophobicContact CG2-CE2 4.06Å
226	D	93.8	Very high	97.8	Very high	31 Å²	31	4.8 Å²	4.8	17%	0.166	3%	0.026	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	-122	-166.1	-50.3	-44.2	0	0	0	110.4	T143 R144	T143-D226 WeakPolarHBondContact CA-OD1 3.37Å; T143-D226 WeakPolarHBondContact CB-OD1 3.37Å; T143-D226 PolarHBondContact N-OD1 3.34Å; T143-D226 PolarHBondContact OG1-OD1 3.03Å; R144-D226 PolarHBondContact N-OD1 3.46Å; R144-D226 PolarHBondContact NH2-O 3.49Å; R144-D226 PolarHBondContact O-N 3.41Å
227	N	95.6	Very high	97.8	Very high	15 Å²	15	4.8 Å²	4.8	8%	0.08	3%	0.026	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	9.6	179.2	-68.1	-20	0	0	0	113.7	V103 I104 F105 V225 Q313 L314	V103-N227 PolarHBondContact O-ND2 2.92Å; I104-N227 WeakPolarHBondContact CA-OD1 3.26Å; F105-N227 HydrophobicContact CD2-CB 4.27Å; F105-N227 VanDerWaalsContact CD2-OD1 3.3Å; F105-N227 WeakPolarHBondContact CD2-OD1 3.38Å; F105-N227 PolarHBondContact N-OD1 2.8Å; V225-N227 PolarHBondContact O-N 3.01Å; N227-Q313 PolarHBondContact O-NE2 2.92Å; N227-L314 HydrophobicContact CB-CB 4.34Å; N227-L314 WeakPolarHBondContact O-CB 3.37Å; N227-L314 PolarHBondContact O-N 2.88Å
228	I	96.9	Very high	97.8	Very high	32 Å²	32	7.2 Å²	7.2	16%	0.164	4%	0.035	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.2	178.2	-58.5	161	0	0	0	109.3	A224 V225 Y230 R311 Q313	A224-I228 WeakPolarHBondContact CA-O 3.25Å; V225-I228 PolarHBondContact N-O 2.78Å; V225-I228 PolarHBondContact O-N 2.96Å; I228-Y230 HydrophobicContact CB-CE2 4.04Å; I228-Y230 HydrophobicContact CG2-CD2 4.11Å; I228-Y230 HydrophobicContact CG2-CE1 4.49Å; I228-Y230 HydrophobicContact CG2-CE2 3.48Å; I228-Y230 VanDerWaalsContact CG2-CE2 3.48Å; I228-R311 HydrophobicContact CG2-CG 3.67Å; I228-Q313 VanDerWaalsContact CG1-OE1 3.22Å
229	L	98.3	Very high	97.8	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	3%	0.034	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	133.2	171.5	-51.6	179.2	0	0	0	110.3	V222 A224 I231 L256 R311 C312 L314 I321	V222-L229 HydrophobicContact CG1-CB 4.4Å; V222-L229 HydrophobicContact CG1-CD2 4.06Å; A224-L229 HydrophobicContact CB-CD2 3.82Å; L229-I231 HydrophobicContact CB-CD1 3.87Å; L229-L256 HydrophobicContact CD1-CD1 4.28Å; L229-R311 CarbonylContact O-C 3.56Å; L229-R311 WeakPolarHBondContact O-CA 3.38Å; L229-C312 HydrophobicContact CB-CB 4.25Å; L229-C312 HydrophobicContact CD1-CB 4.49Å; L229-C312 PolarHBondContact N-O 3.31Å; L229-C312 PolarHBondContact O-N 2.71Å; L229-L314 HydrophobicContact CD1-CD2 3.67Å; L229-L314 HydrophobicContact CD1-CG 4.24Å; L229-L314 HydrophobicContact CD2-CD1 4.12Å; L229-L314 HydrophobicContact CD2-CD2 4.34Å; L229-L314 HydrophobicContact CD2-CG 4.16Å; L229-L314 HydrophobicContact CG-CD2 4Å; L229-L314 HydrophobicContact CG-CG 3.99Å; L229-I321 HydrophobicContact CD1-CD1 3.53Å; L229-I321 HydrophobicContact CD1-CG1 4.34Å; L229-I321 HydrophobicContact CD2-CD1 4.03Å; L229-I321 HydrophobicContact CG-CD1 4.43Å
230	Y	98.5	Very high	97.8	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	3%	0.034	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	113.3	167.2	-62.1	-95.8	0	0	0	108.1	E184 V187 K188 L223 V225 I228 R310	E184-Y230 WeakPolarHBondContact CA-OH 3.46Å; E184-Y230 HydrophobicContact CG-CE1 3.98Å; V187-Y230 HydrophobicContact CB-CD1 4.43Å; V187-Y230 HydrophobicContact CB-CE1 4.11Å; V187-Y230 HydrophobicContact CB-CE2 4.37Å; V187-Y230 HydrophobicContact CG1-CD1 3.78Å; V187-Y230 HydrophobicContact CG1-CD2 3.72Å; V187-Y230 HydrophobicContact CG1-CE1 3.92Å; V187-Y230 HydrophobicContact CG1-CE2 3.88Å; V187-Y230 HydrophobicContact CG1-CG 3.68Å; K188-Y230 HydrophobicContact CG-CD1 4.25Å; K188-Y230 HydrophobicContact CG-CE1 4.33Å; L223-Y230 PolarHBondContact N-O 3.38Å; L223-Y230 PolarHBondContact O-N 3.04Å; V225-Y230 HydrophobicContact CB-CE2 4.1Å; V225-Y230 HydrophobicContact CG2-CD2 4.19Å; V225-Y230 HydrophobicContact CG2-CE2 4.06Å; I228-Y230 HydrophobicContact CB-CE2 4.04Å; I228-Y230 HydrophobicContact CG2-CD2 4.11Å; I228-Y230 HydrophobicContact CG2-CE1 4.49Å; I228-Y230 HydrophobicContact CG2-CE2 3.48Å; I228-Y230 VanDerWaalsContact CG2-CE2 3.48Å; Y230-R310 WeakPolarHBondContact CA-O 3.44Å
231	I	98.6	Very high	97.8	Very high	1 Å²	1	7.2 Å²	7.2	1%	0.005	3%	0.034	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	110.8	-177.9	-56.7	94.4	0	0	0	107.2	C221 V222 L229 A239 L256 I309 R310 C312	C221-I231 WeakPolarHBondContact O-CA 3.24Å; V222-I231 HydrophobicContact CG2-CG1 4.07Å; L229-I231 HydrophobicContact CB-CD1 3.87Å; I231-A239 HydrophobicContact CG2-CB 3.97Å; I231-L256 HydrophobicContact CB-CB 4.47Å; I231-L256 HydrophobicContact CD1-CB 3.98Å; I231-L256 HydrophobicContact CD1-CD1 3.99Å; I231-L256 HydrophobicContact CD1-CD2 4.34Å; I231-L256 HydrophobicContact CD1-CG 4.36Å; I231-L256 HydrophobicContact CG1-CB 3.86Å; I231-L256 HydrophobicContact CG1-CD1 4.01Å; I231-L256 HydrophobicContact CG2-CB 4.34Å; I231-I309 CarbonylContact O-C 3.59Å; I231-I309 VanDerWaalsContact O-CA 3.27Å; I231-I309 WeakPolarHBondContact O-CA 3.37Å; I231-R310 PolarHBondContact N-O 2.82Å; I231-R310 PolarHBondContact O-N 3.38Å; I231-C312 HydrophobicContact CD1-CB 4.16Å
232	A	98.6	Very high	97.8	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	3%	0.034	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	117	172.6	0	0	0	0	0	108.6	L191 F195 C221 P307 D308 I309	L191-A232 HydrophobicContact CD1-CB 4.45Å; L191-A232 HydrophobicContact CD2-CB 4.33Å; F195-A232 HydrophobicContact CE2-CB 3.76Å; F195-A232 HydrophobicContact CZ-CB 3.86Å; C221-A232 PolarHBondContact N-O 3.45Å; C221-A232 PolarHBondContact O-N 3.03Å; A232-P307 HydrophobicContact CB-CB 4.06Å; A232-P307 HydrophobicContact CB-CG 4.22Å; A232-D308 WeakPolarHBondContact CA-O 3.16Å; A232-I309 HydrophobicContact CB-CG1 3.99Å
233	N	98.6	Very high	97.8	Very high	1 Å²	1	10.1 Å²	10.1	1%	0.005	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	137	-178.3	-167.2	57.9	0	0	0	111.8	A219 T220 G235 S237 K258 H260 P307 D308	A219-N233 CarbonylContact O-C 3.59Å; T220-N233 WeakPolarHBondContact CB-OD1 3.24Å; T220-N233 WeakPolarHBondContact CG2-OD1 3.39Å; T220-N233 PolarHBondContact OG1-OD1 2.93Å; N233-G235 PolarHBondContact ND2-O 3.03Å; N233-G235 VanDerWaalsContact ND2-O 3.1Å; N233-S237 PolarHBondContact OD1-O 2.83Å; N233-S237 VanDerWaalsContact OD1-O 3.13Å; N233-K258 PolarHBondContact ND2-O 2.97Å; N233-H260 PolarHBondContact O-CE1 3.05Å; N233-P307 CarbonylContact O-C 3.47Å; N233-P307 WeakPolarHBondContact O-CA 2.68Å; N233-P307 WeakPolarHBondContact O-CB 3.49Å; N233-D308 PolarHBondContact N-O 2.89Å; N233-D308 PolarHBondContact O-N 3.39Å
234	L	98	Very high	97.7	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	115.7	177	-167.1	82.7	0	0	0	107.9	F195 T218 A219 R291 I293 S305 V306 P307	F195-L234 HydrophobicContact CD1-CB 4.37Å; F195-L234 HydrophobicContact CD1-CD2 4.12Å; F195-L234 HydrophobicContact CE1-CB 3.95Å; F195-L234 HydrophobicContact CE1-CD2 4.34Å; T218-L234 CarbonylContact C-O 3.58Å; T218-L234 VanDerWaalsContact CA-O 3.3Å; T218-L234 WeakPolarHBondContact CA-O 3.21Å; T218-L234 VanDerWaalsContact CB-O 3.27Å; T218-L234 WeakPolarHBondContact CB-O 3.34Å; A219-L234 HydrophobicContact CB-CB 4.27Å; A219-L234 PolarHBondContact N-O 3.41Å; A219-L234 WeakPolarHBondContact O-CB 3.39Å; A219-L234 PolarHBondContact O-N 2.97Å; L234-R291 HydrophobicContact CD1-CB 3.6Å; L234-R291 HydrophobicContact CG-CB 3.94Å; L234-I293 HydrophobicContact CD2-CG1 3.81Å; L234-S305 VanDerWaalsContact CD1-C 3.45Å; L234-V306 WeakPolarHBondContact CD1-O 3.43Å; L234-P307 HydrophobicContact CB-CB 4.42Å; L234-P307 HydrophobicContact CD1-CB 4.35Å
235	G	98.1	Very high	97.5	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.07	C	C	.	.	S	Bend	trans	94.1	-157.3	-172.3	0	0	0	0	0	113.6	N233 E259 H260 R291	N233-G235 PolarHBondContact ND2-O 3.03Å; N233-G235 VanDerWaalsContact ND2-O 3.1Å; G235-E259 CarbonylContact O-C 3.48Å; G235-H260 PolarHBondContact N-ND1 3Å; G235-H260 PolarHBondContact O-N 3.45Å; G235-H260 PolarHBondContact O-ND1 3.03Å; G235-R291 WeakPolarHBondContact CA-O 3.34Å; G235-R291 PolarHBondContact N-O 3.37Å
236	D	97.7	Very high	97.4	Very high	17 Å²	17	20.9 Å²	20.9	9%	0.091	10%	0.096	C	C	.	.	S	Bend	trans	-109.9	-0.5	-168.7	54	4.6	0	0	0	114.9	T218 V289	T218-D236 WeakPolarHBondContact CG2-OD1 3.37Å; D236-V289 HydrophobicContact CB-CG1 4.33Å; D236-V289 VanDerWaalsContact CG-CG1 3.5Å; D236-V289 VanDerWaalsContact OD2-CG1 3.25Å; D236-V289 WeakPolarHBondContact OD2-CG1 3.45Å
237	S	98.4	Very high	97.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.129	C	C	.	.			trans	-60.3	154.7	160.7	-65.7	0	0	0	0	111.1	T218 T220 N233 C325	T218-S237 PolarHBondContact OG1-OG 2.83Å; T218-S237 VanDerWaalsContact OG1-OG 3.06Å; T220-S237 WeakPolarHBondContact OG1-CB 3.38Å; T220-S237 PolarHBondContact OG1-O 2.85Å; N233-S237 PolarHBondContact OD1-O 2.83Å; N233-S237 VanDerWaalsContact OD1-O 3.13Å; S237-C325 WeakPolarHBondContact OG-CA 3.27Å
238	R	98.2	Very high	97.2	Very high	51 Å²	51	30.4 Å²	30.4	19%	0.192	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	151	-171.8	-41.8	179.9	-175.3	177.8	-8.3	114.2	S257 E259 L323 A324 F329	R238-S257 WeakPolarHBondContact CA-OG 3.4Å; R238-E259 HydrophobicContact CG-CG 3.9Å; R238-E259 IonicContact CZ-OE1 3.22Å; R238-E259 IonicContact CZ-OE2 2.67Å; R238-E259 VanDerWaalsContact CZ-OE2 3.27Å; R238-E259 IonicContact NE-OE1 3Å; R238-E259 PolarHBondContact NE-OE1 3.09Å; R238-E259 IonicContact NE-OE2 2.86Å; R238-E259 PolarHBondContact NE-OE2 3.32Å; R238-E259 VanDerWaalsContact NE-OE2 3.09Å; R238-E259 IonicContact NH1-OE1 3.02Å; R238-E259 IonicContact NH2-OE1 3.14Å; R238-E259 PolarHBondContact NH2-OE1 2.85Å; R238-E259 IonicContact NH2-OE2 3.7Å; R238-E259 PolarHBondContact NH2-OE2 2.83Å; R238-L323 WeakPolarHBondContact O-CA 3.39Å; R238-A324 PolarHBondContact N-O 3.24Å; R238-A324 PolarHBondContact O-N 3.31Å; R238-F329 HydrophobicContact CB-CD2 3.91Å; R238-F329 HydrophobicContact CB-CE2 3.48Å; R238-F329 VanDerWaalsContact CB-CE2 3.48Å; R238-F329 HydrophobicContact CB-CZ 3.97Å; R238-F329 HydrophobicContact CG-CD2 3.72Å; R238-F329 HydrophobicContact CG-CE2 3.86Å; R238-F329 HydrophobicContact CG-CG 4.31Å
239	A	98.7	Very high	97	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.9	169.7	0	0	0	0	0	110.2	T220 V222 I231 L256 S257 L322 L323	T220-A239 HydrophobicContact CG2-CB 3.87Å; V222-A239 HydrophobicContact CG2-CB 4.34Å; I231-A239 HydrophobicContact CG2-CB 3.97Å; A239-L256 HydrophobicContact CB-CB 4.16Å; A239-L256 WeakPolarHBondContact O-CA 3.22Å; A239-L256 WeakPolarHBondContact O-CB 3.43Å; A239-L256 PolarHBondContact O-N 3.31Å; A239-S257 PolarHBondContact N-OG 2.93Å; A239-S257 PolarHBondContact O-N 3.07Å; A239-L322 CarbonylContact C-O 3.58Å; A239-L322 VanDerWaalsContact CA-O 3.29Å; A239-L322 WeakPolarHBondContact CA-O 3.45Å; A239-L323 HydrophobicContact CB-CG 4.34Å
240	I	98.8	Very high	96.9	Very high	1 Å²	1	42 Å²	42	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	134.2	-176.2	-52.9	-61.6	0	0	0	109.4	A253 L254 I321 L322 F329 P334 V338	I240-A253 HydrophobicContact CG2-CB 3.82Å; I240-L254 CarbonylContact C-O 3.56Å; I240-L254 WeakPolarHBondContact CA-O 3.41Å; I240-I321 CarbonylContact O-C 3.51Å; I240-I321 WeakPolarHBondContact O-CA 3.46Å; I240-I321 WeakPolarHBondContact O-CG2 3.33Å; I240-L322 HydrophobicContact CB-CB 4.39Å; I240-L322 PolarHBondContact N-O 2.89Å; I240-L322 PolarHBondContact O-N 3.02Å; I240-F329 HydrophobicContact CG1-CE1 4.22Å; I240-F329 HydrophobicContact CG1-CZ 3.99Å; I240-P334 HydrophobicContact CD1-CB 4.01Å; I240-P334 HydrophobicContact CD1-CG 4.18Å; I240-P334 HydrophobicContact CG1-CB 4.22Å; I240-P334 HydrophobicContact CG2-CB 4.33Å; I240-V338 HydrophobicContact CG2-CG2 4.08Å
241	L	98.8	Very high	96.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	126.5	173.7	178	63.6	0	0	0	110.2	L254 L256 D318 I321 I390	L241-L254 HydrophobicContact CB-CB 4.26Å; L241-L254 HydrophobicContact CD2-CD1 4.47Å; L241-L254 PolarHBondContact N-O 3.08Å; L241-L254 PolarHBondContact O-N 3.15Å; L241-L256 HydrophobicContact CB-CD1 3.86Å; L241-L256 HydrophobicContact CB-CD2 3.87Å; L241-L256 HydrophobicContact CB-CG 3.81Å; L241-L256 HydrophobicContact CD2-CD2 4.22Å; L241-D318 HydrophobicContact CD1-CB 4.09Å; L241-D318 WeakPolarHBondContact CD2-OD1 3.13Å; L241-I321 HydrophobicContact CD1-CG1 4.02Å; L241-I390 HydrophobicContact CD1-CD1 3.96Å
242	C	98.4	Very high	96.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	112.9	167.1	177.4	0	0	0	0	109.4	R319 F320 V338	C242-R319 HydrophobicContact CB-CB 4.46Å; C242-R319 PolarHBondContact O-N 3.17Å; C242-F320 HydrophobicContact CB-CD1 3.91Å; C242-F320 HydrophobicContact CB-CD2 3.88Å; C242-F320 HydrophobicContact CB-CE1 3.65Å; C242-F320 HydrophobicContact CB-CE2 3.61Å; C242-F320 HydrophobicContact CB-CG 4.02Å; C242-F320 HydrophobicContact CB-CZ 3.48Å; C242-F320 VanDerWaalsContact CB-CZ 3.48Å; C242-F320 PolarHBondContact N-O 2.87Å; C242-V338 HydrophobicContact CB-CG1 3.97Å; C242-V338 HydrophobicContact CB-CG2 4.33Å; C242-V338 VanDerWaalsContact SG-CG1 3.59Å
243	R	97.7	Very high	96.6	Very high	61 Å²	61	47 Å²	47	23%	0.23	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	130.3	176.8	178.8	168.1	-67.4	-177.7	-4.5	110.2	N245 H251 A252 L254 Q313 T315 N317 D318	R243-N245 PolarHBondContact O-N 3.45Å; R243-H251 WeakPolarHBondContact O-CA 3.49Å; R243-A252 PolarHBondContact N-O 3.23Å; R243-A252 PolarHBondContact O-N 3Å; R243-L254 HydrophobicContact CB-CD1 3.84Å; R243-L254 HydrophobicContact CB-CG 4.47Å; R243-L254 HydrophobicContact CG-CD1 4.46Å; R243-Q313 PolarHBondContact NH2-O 2.9Å; R243-T315 PolarHBondContact NH2-OG1 2.92Å; R243-N317 HydrophobicContact CG-CB 4.14Å; R243-D318 WeakPolarHBondContact CB-OD1 3.19Å; R243-D318 IonicContact CZ-OD1 2.92Å; R243-D318 VanDerWaalsContact CZ-OD1 3.26Å; R243-D318 IonicContact CZ-OD2 2.77Å; R243-D318 IonicContact NE-OD1 2.92Å; R243-D318 PolarHBondContact NE-OD1 3.36Å; R243-D318 IonicContact NE-OD2 3.27Å; R243-D318 VanDerWaalsContact NH2-CG 3.29Å; R243-D318 IonicContact NH2-OD1 2.88Å; R243-D318 PolarHBondContact NH2-OD1 3.01Å; R243-D318 IonicContact NH2-OD2 3.28Å; R243-D318 PolarHBondContact NH2-OD2 3.31Å
244	Y	96.9	Very high	96.6	Very high	52 Å²	52	50.2 Å²	50.2	20%	0.204	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	124.8	168.5	-175.2	-104.9	0	0	0	109.8	E246 Q249 H251 N317	Y244-E246 HydrophobicContact CD1-CG 4.15Å; Y244-E246 HydrophobicContact CE1-CG 4.07Å; Y244-Q249 PolarHBondContact OH-NE2 3.33Å; Y244-Q249 PolarHBondContact OH-OE1 3.49Å; Y244-H251 AromaticContact CD2-CE1 3.79Å; Y244-H251 AromaticContact CD2-NE2 3.72Å; Y244-N317 PolarHBondContact N-O 2.75Å; Y244-N317 WeakPolarHBondContact O-CB 3.39Å
245	N	94.2	Very high	96.6	Very high	60 Å²	60	53.3 Å²	53.3	32%	0.321	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	114.8	174.6	-178.8	-24.7	0	0	0	108.6	R243 E247 S248 Q249 K250	R243-N245 PolarHBondContact O-N 3.45Å; N245-E247 VanDerWaalsContact C-N 3.34Å; N245-E247 WeakPolarHBondContact OD1-CB 3.23Å; N245-E247 PolarHBondContact OD1-N 3.02Å; N245-S248 WeakPolarHBondContact CB-OG 3.27Å; N245-S248 PolarHBondContact OD1-N 2.92Å; N245-Q249 VanDerWaalsContact O-CA 3.27Å; N245-Q249 WeakPolarHBondContact O-CA 3.46Å; N245-Q249 PolarHBondContact O-N 3.32Å; N245-K250 WeakPolarHBondContact CB-O 3.38Å; N245-K250 PolarHBondContact N-O 2.87Å; N245-K250 PolarHBondContact O-N 2.87Å
246	E	93	Very high	96.6	Very high	117 Å²	117	53.9 Å²	53.9	55%	0.547	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-32.4	-179.6	-68.4	173.2	-161.2	0	0	112.6	Y244 Q249 N317	Y244-E246 HydrophobicContact CD1-CG 4.15Å; Y244-E246 HydrophobicContact CE1-CG 4.07Å; E246-Q249 PolarHBondContact O-NE2 2.82Å; E246-N317 PolarHBondContact OE1-ND2 3.25Å; E246-N317 PolarHBondContact OE1-OD1 3.01Å
247	E	92.1	Very high	96.6	Very high	185 Å²	185	53.4 Å²	53.4	86%	0.864	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-44.1	-179.7	-61.2	176.6	179.9	0	0	111.3	N245	N245-E247 VanDerWaalsContact C-N 3.34Å; N245-E247 WeakPolarHBondContact OD1-CB 3.23Å; N245-E247 PolarHBondContact OD1-N 3.02Å
248	S	92.6	Very high	96.4	Very high	60 Å²	60	56.9 Å²	56.9	42%	0.42	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-5.8	179.6	67.9	0	0	0	0	113.7	N245 K250	N245-S248 WeakPolarHBondContact CB-OG 3.27Å; N245-S248 PolarHBondContact OD1-N 2.92Å; S248-K250 WeakPolarHBondContact O-CG 3.18Å; S248-K250 PolarHBondContact O-N 3.1Å
249	Q	93.6	Very high	96.3	Very high	128 Å²	128	57 Å²	57	60%	0.598	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	32.7	-174.6	-65.4	-74.6	-63.8	0	0	112.8	Y244 N245 E246	Y244-Q249 PolarHBondContact OH-NE2 3.33Å; Y244-Q249 PolarHBondContact OH-OE1 3.49Å; N245-Q249 VanDerWaalsContact O-CA 3.27Å; N245-Q249 WeakPolarHBondContact O-CA 3.46Å; N245-Q249 PolarHBondContact O-N 3.32Å; E246-Q249 PolarHBondContact O-NE2 2.82Å
250	K	94.8	Very high	96.2	Very high	149 Å²	149	57 Å²	57	65%	0.648	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.2	154	-175.3	-74	177.8	-176.5	-178.7	0	111.4	N245 S248	N245-K250 WeakPolarHBondContact CB-O 3.38Å; N245-K250 PolarHBondContact N-O 2.87Å; N245-K250 PolarHBondContact O-N 2.87Å; S248-K250 WeakPolarHBondContact O-CG 3.18Å; S248-K250 PolarHBondContact O-N 3.1Å
251	H	96.4	Very high	96.1	Very high	58 Å²	58	58.9 Å²	58.9	27%	0.269	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	133.8	169.5	-66.1	93.1	0	0	0	110.1	R243 Y244 L342	R243-H251 WeakPolarHBondContact O-CA 3.49Å; Y244-H251 AromaticContact CD2-CE1 3.79Å; Y244-H251 AromaticContact CD2-NE2 3.72Å; H251-L342 HydrophobicContact CB-CD1 3.45Å; H251-L342 VanDerWaalsContact CB-CD1 3.45Å; H251-L342 VanDerWaalsContact CG-CD1 3.44Å
252	A	96.7	Very high	96	Very high	32 Å²	32	58.9 Å²	58.9	26%	0.264	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	141.3	176.2	0	0	0	0	0	110.4	R243 L254	R243-A252 PolarHBondContact N-O 3.23Å; R243-A252 PolarHBondContact O-N 3Å; A252-L254 HydrophobicContact CB-CD2 4.36Å
253	A	98.1	Very high	95.9	Very high	15 Å²	15	63.1 Å²	63.1	12%	0.124	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	106.7	171.7	0	0	0	0	0	109.2	I240 P334 E335 V338	I240-A253 HydrophobicContact CG2-CB 3.82Å; A253-P334 HydrophobicContact CB-CB 4Å; A253-E335 HydrophobicContact CB-CG 4.17Å; A253-V338 HydrophobicContact CB-CB 4.26Å; A253-V338 HydrophobicContact CB-CG2 3.76Å
254	L	98.1	Very high	95.8	Very high	69 Å²	69	62.2 Å²	62.2	36%	0.361	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117.4	180	-56.3	178.7	0	0	0	109.9	I240 L241 R243 A252 L256	I240-L254 CarbonylContact C-O 3.56Å; I240-L254 WeakPolarHBondContact CA-O 3.41Å; L241-L254 HydrophobicContact CB-CB 4.26Å; L241-L254 HydrophobicContact CD2-CD1 4.47Å; L241-L254 PolarHBondContact N-O 3.08Å; L241-L254 PolarHBondContact O-N 3.15Å; R243-L254 HydrophobicContact CB-CD1 3.84Å; R243-L254 HydrophobicContact CB-CG 4.47Å; R243-L254 HydrophobicContact CG-CD1 4.46Å; A252-L254 HydrophobicContact CB-CD2 4.36Å; L254-L256 PolarHBondContact O-N 2.63Å
255	S	97.9	Very high	95.8	Very high	65 Å²	65	67.6 Å²	67.6	46%	0.455	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	116.4	177.7	-170.1	0	0	0	0	111.6	S257	S255-S257 PolarHBondContact OG-O 3.41Å
256	L	98	Very high	95.9	Very high	12 Å²	12	70.3 Å²	70.3	6%	0.063	35%	0.352	C	S	.	.			trans	-90.4	-14.9	178.8	-62.3	-177.3	0	0	0	113	L229 I231 A239 L241 L254 R310 C312 I321	L229-L256 HydrophobicContact CD1-CD1 4.28Å; I231-L256 HydrophobicContact CB-CB 4.47Å; I231-L256 HydrophobicContact CD1-CB 3.98Å; I231-L256 HydrophobicContact CD1-CD1 3.99Å; I231-L256 HydrophobicContact CD1-CD2 4.34Å; I231-L256 HydrophobicContact CD1-CG 4.36Å; I231-L256 HydrophobicContact CG1-CB 3.86Å; I231-L256 HydrophobicContact CG1-CD1 4.01Å; I231-L256 HydrophobicContact CG2-CB 4.34Å; A239-L256 HydrophobicContact CB-CB 4.16Å; A239-L256 WeakPolarHBondContact O-CA 3.22Å; A239-L256 WeakPolarHBondContact O-CB 3.43Å; A239-L256 PolarHBondContact O-N 3.31Å; L241-L256 HydrophobicContact CB-CD1 3.86Å; L241-L256 HydrophobicContact CB-CD2 3.87Å; L241-L256 HydrophobicContact CB-CG 3.81Å; L241-L256 HydrophobicContact CD2-CD2 4.22Å; L254-L256 PolarHBondContact O-N 2.63Å; L256-R310 VanDerWaalsContact O-CD 3.29Å; L256-R310 WeakPolarHBondContact O-CD 3.2Å; L256-C312 HydrophobicContact CD2-CB 3.98Å; L256-I321 HydrophobicContact CD1-CG2 4.01Å
257	S	97.2	Very high	96.2	Very high	7 Å²	7	64.9 Å²	64.9	5%	0.049	33%	0.326	C	S	.	.			trans	-120.6	165.3	178.9	65.2	0	0	0	0	112.1	R238 A239 S255	R238-S257 WeakPolarHBondContact CA-OG 3.4Å; A239-S257 PolarHBondContact N-OG 2.93Å; A239-S257 PolarHBondContact O-N 3.07Å; S255-S257 PolarHBondContact OG-O 3.41Å
258	K	94.6	Very high	96.5	Very high	72 Å²	72	61.5 Å²	61.5	31%	0.313	31%	0.305	S	S	.	.			trans	-117.8	127.2	168.3	-174.9	-171.5	172.4	-169.5	0	107.2	N233 H260	N233-K258 PolarHBondContact ND2-O 2.97Å; K258-H260 PolarHBondContact O-CE1 2.92Å; K258-H260 VanDerWaalsContact O-CE1 3.23Å; K258-H260 PolarHBondContact O-ND1 2.8Å
259	E	95.7	Very high	96.7	Very high	53 Å²	53	61.3 Å²	61.3	25%	0.248	30%	0.298	C	S	.	.			trans	-66.5	155.7	175.6	-67.4	166.2	-98.8	0	0	111.2	G235 R238 Q264	G235-E259 CarbonylContact O-C 3.48Å; R238-E259 HydrophobicContact CG-CG 3.9Å; R238-E259 IonicContact CZ-OE1 3.22Å; R238-E259 IonicContact CZ-OE2 2.67Å; R238-E259 VanDerWaalsContact CZ-OE2 3.27Å; R238-E259 IonicContact NE-OE1 3Å; R238-E259 PolarHBondContact NE-OE1 3.09Å; R238-E259 IonicContact NE-OE2 2.86Å; R238-E259 PolarHBondContact NE-OE2 3.32Å; R238-E259 VanDerWaalsContact NE-OE2 3.09Å; R238-E259 IonicContact NH1-OE1 3.02Å; R238-E259 IonicContact NH2-OE1 3.14Å; R238-E259 PolarHBondContact NH2-OE1 2.85Å; R238-E259 IonicContact NH2-OE2 3.7Å; R238-E259 PolarHBondContact NH2-OE2 2.83Å; E259-Q264 VanDerWaalsContact O-CD 3.27Å; E259-Q264 PolarHBondContact O-NE2 3.23Å; E259-Q264 PolarHBondContact O-OE1 3.22Å
260	H	97.6	Very high	96.9	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.281	C	S	.	.			trans	-126.3	95.1	179.9	-57.6	108.9	0	0	0	110.3	N233 G235 K258 E267 S290 R291 D308	N233-H260 PolarHBondContact O-CE1 3.05Å; G235-H260 PolarHBondContact N-ND1 3Å; G235-H260 PolarHBondContact O-N 3.45Å; G235-H260 PolarHBondContact O-ND1 3.03Å; K258-H260 PolarHBondContact O-CE1 2.92Å; K258-H260 VanDerWaalsContact O-CE1 3.23Å; K258-H260 PolarHBondContact O-ND1 2.8Å; H260-E267 IonicContact CD2-OE2 3.22Å; H260-S290 WeakPolarHBondContact CB-OG 3.17Å; H260-S290 PolarHBondContact O-N 3.3Å; H260-S290 PolarHBondContact O-OG 2.98Å; H260-R291 HydrophobicContact CB-CB 4.13Å; H260-R291 HydrophobicContact CB-CG 3.88Å; H260-R291 VanDerWaalsContact CD2-CZ 3.46Å; H260-R291 PolarHBondContact CD2-NE 2.96Å; H260-R291 VanDerWaalsContact CD2-NE 3.31Å; H260-D308 IonicContact NE2-OD1 3.27Å; H260-D308 IonicContact NE2-OD2 2.71Å; H260-D308 PolarHBondContact NE2-OD2 3.15Å; H260-D308 VanDerWaalsContact NE2-OD2 3.14Å
261	N	95.2	Very high	97.1	Very high	42 Å²	42	51 Å²	51	23%	0.225	25%	0.25	C	S	.	.			trans	-119.1	154.6	174.1	66.1	52.7	0	0	0	111.1	T263 Q264 E267 S290	N261-T263 PolarHBondContact O-N 3.14Å; N261-T263 VanDerWaalsContact O-N 3.13Å; N261-T263 PolarHBondContact OD1-N 3.22Å; N261-T263 PolarHBondContact OD1-OG1 2.71Å; N261-Q264 PolarHBondContact O-N 2.93Å; N261-Q264 WeakPolarHBondContact OD1-CG 3.27Å; N261-Q264 PolarHBondContact OD1-N 3.14Å; N261-Q264 VanDerWaalsContact OD1-N 3.15Å; N261-E267 WeakPolarHBondContact O-CB 3.3Å; N261-S290 PolarHBondContact N-OG 3.35Å
262	P	97.2	Very high	97.1	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-12.4	-177.1	-24.9	35	0	0	0	115.5	R268 I271 V278 G281 V283 E288	P262-R268 WeakPolarHBondContact O-CB 3.4Å; P262-I271 HydrophobicContact CB-CD1 4.01Å; P262-I271 HydrophobicContact CG-CD1 4.5Å; P262-V278 HydrophobicContact CB-CB 4.48Å; P262-V278 HydrophobicContact CB-CG1 3.76Å; P262-V278 HydrophobicContact CB-CG2 3.85Å; P262-G281 WeakPolarHBondContact CB-O 3.37Å; P262-G281 WeakPolarHBondContact CG-O 3.15Å; P262-V283 HydrophobicContact CB-CG2 4.05Å; P262-V283 HydrophobicContact CG-CG2 3.47Å; P262-V283 VanDerWaalsContact CG-CG2 3.47Å; P262-E288 WeakPolarHBondContact CD-O 3.39Å
263	T	95.8	Very high	97.2	Very high	89 Å²	89	58.7 Å²	58.7	55%	0.546	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-20.3	178.5	64.9	0	0	0	0	112.6	N261	N261-T263 PolarHBondContact O-N 3.14Å; N261-T263 VanDerWaalsContact O-N 3.13Å; N261-T263 PolarHBondContact OD1-N 3.22Å; N261-T263 PolarHBondContact OD1-OG1 2.71Å
264	Q	97	Very high	97.1	Very high	42 Å²	42	60.2 Å²	60.2	20%	0.196	29%	0.29	C	S	.	.	S	Bend	trans	-61.9	136.7	173.8	-74.6	179.9	11.9	0	0	111.4	E259 N261 E266 E267 R268	E259-Q264 VanDerWaalsContact O-CD 3.27Å; E259-Q264 PolarHBondContact O-NE2 3.23Å; E259-Q264 PolarHBondContact O-OE1 3.22Å; N261-Q264 PolarHBondContact O-N 2.93Å; N261-Q264 WeakPolarHBondContact OD1-CG 3.27Å; N261-Q264 PolarHBondContact OD1-N 3.14Å; N261-Q264 VanDerWaalsContact OD1-N 3.15Å; Q264-E266 PolarHBondContact O-N 3.1Å; Q264-E267 HydrophobicContact CB-CB 4.16Å; Q264-E267 HydrophobicContact CB-CG 3.82Å; Q264-E267 PolarHBondContact O-N 2.75Å; Q264-E267 VanDerWaalsContact O-N 3.13Å; Q264-R268 WeakPolarHBondContact O-CB 3.5Å; Q264-R268 PolarHBondContact O-N 2.81Å
265	Y	96.6	Very high	97.1	Very high	165 Å²	165	60 Å²	60	65%	0.647	31%	0.306	S	S	*	.	H	α-helix	trans	-51.9	-55.1	-173.7	179.3	-99.5	0	0	0	113.3	E267 R268 M269	Y265-E267 VanDerWaalsContact C-N 3.31Å; Y265-E267 PolarHBondContact O-N 3.34Å; Y265-R268 PolarHBondContact O-N 3.46Å; Y265-M269 HydrophobicContact CD1-CG 4.42Å; Y265-M269 HydrophobicContact CD2-CG 4.32Å; Y265-M269 HydrophobicContact CE1-CG 4.09Å; Y265-M269 HydrophobicContact CE2-CG 3.99Å; Y265-M269 HydrophobicContact CE2-SD 4.32Å; Y265-M269 WeakPolarHBondContact O-CB 3.4Å; Y265-M269 VanDerWaalsContact O-CG 3.24Å; Y265-M269 WeakPolarHBondContact O-CG 3.35Å; Y265-M269 PolarHBondContact O-N 2.88Å
266	E	96.8	Very high	97	Very high	117 Å²	117	57.4 Å²	57.4	55%	0.547	29%	0.288	S	S	.	.	H	α-helix	trans	-60.7	-39.5	-179.5	-64	-58.4	148.2	0	0	112.7	Q264 R270	Q264-E266 PolarHBondContact O-N 3.1Å; E266-R270 PolarHBondContact O-N 2.82Å; E266-R270 VanDerWaalsContact O-N 3.07Å
267	E	98.2	Very high	96.9	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.009	30%	0.301	C	S	.	.	H	α-helix	trans	-69.8	-46.9	-179.2	-55.7	-60.4	106.5	0	0	110.8	H260 N261 Q264 Y265 M269 R270 I271 S290 R291	H260-E267 IonicContact CD2-OE2 3.22Å; N261-E267 WeakPolarHBondContact O-CB 3.3Å; Q264-E267 HydrophobicContact CB-CB 4.16Å; Q264-E267 HydrophobicContact CB-CG 3.82Å; Q264-E267 PolarHBondContact O-N 2.75Å; Q264-E267 VanDerWaalsContact O-N 3.13Å; Y265-E267 VanDerWaalsContact C-N 3.31Å; Y265-E267 PolarHBondContact O-N 3.34Å; E267-M269 PolarHBondContact O-N 2.79Å; E267-R270 PolarHBondContact O-N 2.82Å; E267-R270 IonicContact OE1-CZ 3.94Å; E267-R270 IonicContact OE1-NH1 3.99Å; E267-R270 PolarHBondContact OE1-NH1 3.13Å; E267-R270 IonicContact OE2-CZ 2.67Å; E267-R270 VanDerWaalsContact OE2-CZ 3.27Å; E267-R270 IonicContact OE2-NH1 3.31Å; E267-R270 PolarHBondContact OE2-NH1 2.61Å; E267-R270 IonicContact OE2-NH2 3.93Å; E267-R270 PolarHBondContact OE2-NH2 3Å; E267-I271 WeakPolarHBondContact O-CD1 3.44Å; E267-I271 WeakPolarHBondContact O-CG1 3.38Å; E267-I271 PolarHBondContact O-N 3.36Å; E267-S290 WeakPolarHBondContact CG-OG 3.39Å; E267-S290 WeakPolarHBondContact OE2-CB 3.04Å; E267-S290 PolarHBondContact OE2-OG 2.97Å; E267-R291 IonicContact OE1-CZ 2.91Å; E267-R291 IonicContact OE1-NE 2.98Å; E267-R291 PolarHBondContact OE1-NE 3.02Å; E267-R291 IonicContact OE1-NH2 2.67Å; E267-R291 PolarHBondContact OE1-NH2 3.36Å; E267-R291 WeakPolarHBondContact OE2-CG 3.37Å; E267-R291 IonicContact OE2-CZ 2.69Å; E267-R291 IonicContact OE2-NE 2.69Å; E267-R291 PolarHBondContact OE2-NE 3.46Å; E267-R291 IonicContact OE2-NH2 3Å
268	R	97.8	Very high	96.9	Very high	114 Å²	114	60.1 Å²	60.1	43%	0.43	30%	0.303	S	S	.	.	H	α-helix	trans	-60	-45.4	176.7	-170.6	173.5	-175.8	-170.3	3.2	111.6	P262 Q264 Y265 R270 I271 Q272 V278	P262-R268 WeakPolarHBondContact O-CB 3.4Å; Q264-R268 WeakPolarHBondContact O-CB 3.5Å; Q264-R268 PolarHBondContact O-N 2.81Å; Y265-R268 PolarHBondContact O-N 3.46Å; R268-R270 VanDerWaalsContact C-N 3.34Å; R268-R270 PolarHBondContact O-N 2.82Å; R268-I271 PolarHBondContact O-N 3.04Å; R268-Q272 WeakPolarHBondContact O-CB 3.48Å; R268-Q272 WeakPolarHBondContact O-CG 3.26Å; R268-Q272 PolarHBondContact O-N 2.71Å; R268-V278 HydrophobicContact CG-CB 4.44Å; R268-V278 HydrophobicContact CG-CG2 4.04Å
269	M	97.7	Very high	96.9	Very high	56 Å²	56	64 Å²	64	28%	0.276	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-41.5	177.9	-73.9	-57.7	-59.6	0	0	111.5	Y265 E267 K273	Y265-M269 HydrophobicContact CD1-CG 4.42Å; Y265-M269 HydrophobicContact CD2-CG 4.32Å; Y265-M269 HydrophobicContact CE1-CG 4.09Å; Y265-M269 HydrophobicContact CE2-CG 3.99Å; Y265-M269 HydrophobicContact CE2-SD 4.32Å; Y265-M269 WeakPolarHBondContact O-CB 3.4Å; Y265-M269 VanDerWaalsContact O-CG 3.24Å; Y265-M269 WeakPolarHBondContact O-CG 3.35Å; Y265-M269 PolarHBondContact O-N 2.88Å; E267-M269 PolarHBondContact O-N 2.79Å; M269-K273 WeakPolarHBondContact O-CB 3.29Å; M269-K273 VanDerWaalsContact O-CG 3.26Å; M269-K273 WeakPolarHBondContact O-CG 3.41Å; M269-K273 PolarHBondContact O-N 3.1Å
270	R	98.1	Very high	96.9	Very high	61 Å²	61	69 Å²	69	23%	0.23	34%	0.344	C	S	.	.	H	α-helix	trans	-61.4	-47.2	174.6	-176.8	-175.5	66.1	-113.9	-0.3	111.7	E266 E267 R268 K273 A274 S290 G302	E266-R270 PolarHBondContact O-N 2.82Å; E266-R270 VanDerWaalsContact O-N 3.07Å; E267-R270 PolarHBondContact O-N 2.82Å; E267-R270 IonicContact OE1-CZ 3.94Å; E267-R270 IonicContact OE1-NH1 3.99Å; E267-R270 PolarHBondContact OE1-NH1 3.13Å; E267-R270 IonicContact OE2-CZ 2.67Å; E267-R270 VanDerWaalsContact OE2-CZ 3.27Å; E267-R270 IonicContact OE2-NH1 3.31Å; E267-R270 PolarHBondContact OE2-NH1 2.61Å; E267-R270 IonicContact OE2-NH2 3.93Å; E267-R270 PolarHBondContact OE2-NH2 3Å; R268-R270 VanDerWaalsContact C-N 3.34Å; R268-R270 PolarHBondContact O-N 2.82Å; R270-K273 PolarHBondContact O-N 2.79Å; R270-A274 WeakPolarHBondContact O-CB 3.21Å; R270-A274 PolarHBondContact O-N 3.4Å; R270-A274 VanDerWaalsContact O-N 3.1Å; R270-S290 PolarHBondContact NH2-O 2.95Å; R270-G302 PolarHBondContact NE-O 2.86Å
271	I	98.4	Very high	96.7	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-59.4	-48.9	179.4	-71.1	159.3	0	0	0	110.7	P262 E267 R268 A274 G275 G276 V278 V283 C301	P262-I271 HydrophobicContact CB-CD1 4.01Å; P262-I271 HydrophobicContact CG-CD1 4.5Å; E267-I271 WeakPolarHBondContact O-CD1 3.44Å; E267-I271 WeakPolarHBondContact O-CG1 3.38Å; E267-I271 PolarHBondContact O-N 3.36Å; R268-I271 PolarHBondContact O-N 3.04Å; I271-A274 PolarHBondContact O-N 3Å; I271-G275 PolarHBondContact O-N 3.42Å; I271-G276 WeakPolarHBondContact O-CA 3.23Å; I271-G276 PolarHBondContact O-N 2.99Å; I271-V278 HydrophobicContact CB-CG2 4.37Å; I271-V278 HydrophobicContact CD1-CG2 4.04Å; I271-V278 HydrophobicContact CG2-CG2 3.92Å; I271-V283 HydrophobicContact CD1-CG2 3.76Å; I271-V283 HydrophobicContact CG2-CG1 4.23Å; I271-C301 WeakPolarHBondContact CG2-O 3.27Å
272	Q	97.3	Very high	96.8	Very high	79 Å²	79	72.3 Å²	72.3	37%	0.369	36%	0.362	S	S	.	.	H	α-helix	trans	-65.9	-41.5	-179.4	-71.6	176.9	-24.6	0	0	112.7	R268 A274 G275 G276	R268-Q272 WeakPolarHBondContact O-CB 3.48Å; R268-Q272 WeakPolarHBondContact O-CG 3.26Å; R268-Q272 PolarHBondContact O-N 2.71Å; Q272-A274 PolarHBondContact O-N 2.97Å; Q272-G275 PolarHBondContact O-N 3.44Å; Q272-G276 WeakPolarHBondContact CA-O 3.19Å
273	K	97.7	Very high	96.8	Very high	172 Å²	172	72.3 Å²	72.3	75%	0.748	36%	0.362	S	S	*	.	H	α-helix	trans	-62.4	-30.3	175.2	-76.9	178.1	178.9	-179.4	0	112.8	M269 R270 G275	M269-K273 WeakPolarHBondContact O-CB 3.29Å; M269-K273 VanDerWaalsContact O-CG 3.26Å; M269-K273 WeakPolarHBondContact O-CG 3.41Å; M269-K273 PolarHBondContact O-N 3.1Å; R270-K273 PolarHBondContact O-N 2.79Å; K273-G275 PolarHBondContact O-N 3.16Å
274	A	97.4	Very high	96.8	Very high	47 Å²	47	71.7 Å²	71.7	39%	0.388	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	3.8	174.4	0	0	0	0	0	113.5	R270 I271 Q272 G276 R300	R270-A274 WeakPolarHBondContact O-CB 3.21Å; R270-A274 PolarHBondContact O-N 3.4Å; R270-A274 VanDerWaalsContact O-N 3.1Å; I271-A274 PolarHBondContact O-N 3Å; Q272-A274 PolarHBondContact O-N 2.97Å; A274-G276 VanDerWaalsContact C-N 3.3Å; A274-R300 VanDerWaalsContact O-O 3.1Å
275	G	96.4	Very high	96.8	Very high	66 Å²	66	71.2 Å²	71.2	68%	0.68	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	7.1	-177.2	0	0	0	0	0	114.5	I271 Q272 K273	I271-G275 PolarHBondContact O-N 3.42Å; Q272-G275 PolarHBondContact O-N 3.44Å; K273-G275 PolarHBondContact O-N 3.16Å
276	G	96.7	Very high	96.8	Very high	9 Å²	9	67.5 Å²	67.5	9%	0.093	36%	0.355	C	S	.	.			trans	-77.3	171	169.1	0	0	0	0	0	112.3	I271 Q272 A274	I271-G276 WeakPolarHBondContact O-CA 3.23Å; I271-G276 PolarHBondContact O-N 2.99Å; Q272-G276 WeakPolarHBondContact CA-O 3.19Å; A274-G276 VanDerWaalsContact C-N 3.3Å
277	N	95.3	Very high	96.8	Very high	61 Å²	61	62.6 Å²	62.6	33%	0.326	33%	0.333	S	S	.	.			trans	-133.4	153.3	174.6	-168	9.7	0	0	0	110.2	R279 L284	N277-R279 PolarHBondContact ND2-NE 3.49Å; N277-L284 HydrophobicContact CB-CD2 4.38Å; N277-L284 PolarHBondContact O-N 3.01Å
278	V	97	Very high	96.7	Very high	15 Å²	15	66.5 Å²	66.5	9%	0.091	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	117.3	173.4	-179.5	0	0	0	0	108.3	P262 R268 I271 R282	P262-V278 HydrophobicContact CB-CB 4.48Å; P262-V278 HydrophobicContact CB-CG1 3.76Å; P262-V278 HydrophobicContact CB-CG2 3.85Å; R268-V278 HydrophobicContact CG-CB 4.44Å; R268-V278 HydrophobicContact CG-CG2 4.04Å; I271-V278 HydrophobicContact CB-CG2 4.37Å; I271-V278 HydrophobicContact CD1-CG2 4.04Å; I271-V278 HydrophobicContact CG2-CG2 3.92Å; V278-R282 WeakPolarHBondContact CA-O 3.29Å
279	R	95.8	Very high	96.7	Very high	154 Å²	154	61.3 Å²	61.3	58%	0.581	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	131.5	178.6	-63.9	179.8	178.2	174.7	-3.2	108.4	N277 G281 R282	N277-R279 PolarHBondContact ND2-NE 3.49Å; R279-G281 PolarHBondContact O-N 2.86Å; R279-G281 VanDerWaalsContact O-N 3.11Å; R279-R282 PolarHBondContact N-O 2.77Å; R279-R282 PolarHBondContact O-N 2.76Å
280	D	94.4	Very high	96.7	Very high	158 Å²	158	58.6 Å²	58.6	85%	0.845	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	38.6	-178.9	-51	-41.4	0	0	0	113.6	R282	D280-R282 VanDerWaalsContact C-N 3.27Å; D280-R282 PolarHBondContact O-N 3.15Å
281	G	93.9	Very high	96.7	Very high	26 Å²	26	56.7 Å²	56.7	27%	0.268	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	5.8	-178.6	0	0	0	0	0	115.9	P262 R279	P262-G281 WeakPolarHBondContact CB-O 3.37Å; P262-G281 WeakPolarHBondContact CG-O 3.15Å; R279-G281 PolarHBondContact O-N 2.86Å; R279-G281 VanDerWaalsContact O-N 3.11Å
282	R	97.6	Very high	96.7	Very high	86 Å²	86	56.7 Å²	56.7	33%	0.325	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	146.7	-174.7	-63.6	166.3	-173.7	-90.9	-11.4	112.7	V278 R279 D280 L284 G285 V286 L287 E288	V278-R282 WeakPolarHBondContact CA-O 3.29Å; R279-R282 PolarHBondContact N-O 2.77Å; R279-R282 PolarHBondContact O-N 2.76Å; D280-R282 VanDerWaalsContact C-N 3.27Å; D280-R282 PolarHBondContact O-N 3.15Å; R282-L284 PolarHBondContact O-N 3.41Å; R282-G285 PolarHBondContact O-N 2.99Å; R282-G285 VanDerWaalsContact O-N 3.16Å; R282-V286 PolarHBondContact NH1-O 3.37Å; R282-L287 CarbonylContact C-O 3.44Å; R282-L287 WeakPolarHBondContact CA-O 3.33Å; R282-L287 WeakPolarHBondContact CB-O 3.17Å; R282-E288 HydrophobicContact CG-CG 4.23Å; R282-E288 VanDerWaalsContact CZ-CG 3.41Å; R282-E288 IonicContact CZ-OE1 3.65Å; R282-E288 VanDerWaalsContact NH1-CD 3.26Å; R282-E288 IonicContact NH1-OE1 2.67Å; R282-E288 PolarHBondContact NH1-OE1 2.9Å; R282-E288 VanDerWaalsContact NH2-CD 3.29Å; R282-E288 IonicContact NH2-OE1 2.65Å; R282-E288 PolarHBondContact NH2-OE1 3.46Å
283	V	96.8	Very high	96.8	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	121.9	171.9	-167.6	0	0	0	0	109	P262 I271 G285 V286 L287 Y298 V303	P262-V283 HydrophobicContact CB-CG2 4.05Å; P262-V283 HydrophobicContact CG-CG2 3.47Å; P262-V283 VanDerWaalsContact CG-CG2 3.47Å; I271-V283 HydrophobicContact CD1-CG2 3.76Å; I271-V283 HydrophobicContact CG2-CG1 4.23Å; V283-G285 PolarHBondContact O-N 3.32Å; V283-G285 VanDerWaalsContact O-N 3.07Å; V283-V286 PolarHBondContact O-N 2.81Å; V283-L287 HydrophobicContact CB-CB 4.19Å; V283-L287 PolarHBondContact N-O 2.83Å; V283-L287 PolarHBondContact O-N 3.24Å; V283-Y298 HydrophobicContact CG1-CD1 4.37Å; V283-V303 HydrophobicContact CB-CG2 4.48Å; V283-V303 HydrophobicContact CG1-CG2 4.13Å; V283-V303 HydrophobicContact CG2-CG2 4.1Å
284	L	96.2	Very high	96.8	Very high	76 Å²	76	44.8 Å²	44.8	40%	0.398	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	22	-172.7	-55.5	-179	0	0	0	114.3	N277 R282 V286 Y298 C301	N277-L284 HydrophobicContact CB-CD2 4.38Å; N277-L284 PolarHBondContact O-N 3.01Å; R282-L284 PolarHBondContact O-N 3.41Å; L284-V286 VanDerWaalsContact C-N 3.28Å; L284-Y298 HydrophobicContact CB-CE1 4.47Å; L284-Y298 HydrophobicContact CD1-CD1 4.11Å; L284-Y298 HydrophobicContact CD1-CE1 4.17Å; L284-C301 HydrophobicContact CD1-CB 4.48Å
285	G	96.1	Very high	96.9	Very high	32 Å²	32	42.7 Å²	42.7	33%	0.33	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	7.2	-175.9	0	0	0	0	0	114.8	R282 V283	R282-G285 PolarHBondContact O-N 2.99Å; R282-G285 VanDerWaalsContact O-N 3.16Å; V283-G285 PolarHBondContact O-N 3.32Å; V283-G285 VanDerWaalsContact O-N 3.07Å
286	V	96.6	Very high	96.9	Very high	87 Å²	87	41.2 Å²	41.2	53%	0.527	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-59	-174.6	-174.9	0	0	0	0	112.2	R282 V283 L284 Y298	R282-V286 PolarHBondContact NH1-O 3.37Å; V283-V286 PolarHBondContact O-N 2.81Å; L284-V286 VanDerWaalsContact C-N 3.28Å; V286-Y298 WeakPolarHBondContact CB-OH 3.27Å; V286-Y298 WeakPolarHBondContact CG1-OH 3.41Å
287	L	96.9	Very high	96.9	Very high	13 Å²	13	45.1 Å²	45.1	7%	0.068	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-87.5	128.4	-169.5	-174.5	69	0	0	0	112.6	H154 R282 V283 V289 D295 Y298 V303	H154-L287 WeakPolarHBondContact NE2-CD1 3.25Å; R282-L287 CarbonylContact C-O 3.44Å; R282-L287 WeakPolarHBondContact CA-O 3.33Å; R282-L287 WeakPolarHBondContact CB-O 3.17Å; V283-L287 HydrophobicContact CB-CB 4.19Å; V283-L287 PolarHBondContact N-O 2.83Å; V283-L287 PolarHBondContact O-N 3.24Å; L287-V289 HydrophobicContact CD1-CG2 3.97Å; L287-V289 HydrophobicContact CD2-CG2 4.17Å; L287-V289 WeakPolarHBondContact CD2-O 3.49Å; L287-V289 HydrophobicContact CG-CG2 3.97Å; L287-V289 WeakPolarHBondContact CG-O 3.16Å; L287-D295 HydrophobicContact CD2-CB 4.47Å; L287-Y298 HydrophobicContact CB-CE1 4.45Å; L287-Y298 HydrophobicContact CB-CE2 4.19Å; L287-Y298 HydrophobicContact CD2-CD2 3.9Å; L287-Y298 HydrophobicContact CD2-CE2 4.29Å; L287-Y298 HydrophobicContact CD2-CG 4.18Å; L287-V303 HydrophobicContact CD2-CG1 4.39Å; L287-V303 HydrophobicContact CD2-CG2 3.9Å
288	E	96.4	Very high	97	Very high	84 Å²	84	43 Å²	43	39%	0.393	23%	0.229	S	C	.	.	S	Bend	trans	-79.6	-24	-176.8	-63.8	-174.5	-161.4	0	0	114.2	P262 R282	P262-E288 WeakPolarHBondContact CD-O 3.39Å; R282-E288 HydrophobicContact CG-CG 4.23Å; R282-E288 VanDerWaalsContact CZ-CG 3.41Å; R282-E288 IonicContact CZ-OE1 3.65Å; R282-E288 VanDerWaalsContact NH1-CD 3.26Å; R282-E288 IonicContact NH1-OE1 2.67Å; R282-E288 PolarHBondContact NH1-OE1 2.9Å; R282-E288 VanDerWaalsContact NH2-CD 3.29Å; R282-E288 IonicContact NH2-OE1 2.65Å; R282-E288 PolarHBondContact NH2-OE1 3.46Å
289	V	97.7	Very high	97.1	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.03	23%	0.234	C	C	.	.			trans	-100.9	147	180	-65.8	0	0	0	0	111.5	T218 D236 L287	T218-V289 HydrophobicContact CG2-CG1 4.22Å; D236-V289 HydrophobicContact CB-CG1 4.33Å; D236-V289 VanDerWaalsContact CG-CG1 3.5Å; D236-V289 VanDerWaalsContact OD2-CG1 3.25Å; D236-V289 WeakPolarHBondContact OD2-CG1 3.45Å; L287-V289 HydrophobicContact CD1-CG2 3.97Å; L287-V289 HydrophobicContact CD2-CG2 4.17Å; L287-V289 WeakPolarHBondContact CD2-O 3.49Å; L287-V289 HydrophobicContact CG-CG2 3.97Å; L287-V289 WeakPolarHBondContact CG-O 3.16Å
290	S	98.1	Very high	97.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-94.1	-12.1	176.3	60.2	0	0	0	0	113.4	H260 N261 E267 R270 V303	H260-S290 WeakPolarHBondContact CB-OG 3.17Å; H260-S290 PolarHBondContact O-N 3.3Å; H260-S290 PolarHBondContact O-OG 2.98Å; N261-S290 PolarHBondContact N-OG 3.35Å; E267-S290 WeakPolarHBondContact CG-OG 3.39Å; E267-S290 WeakPolarHBondContact OE2-CB 3.04Å; E267-S290 PolarHBondContact OE2-OG 2.97Å; R270-S290 PolarHBondContact NH2-O 2.95Å; S290-V303 WeakPolarHBondContact O-CA 3.46Å
291	R	98.7	Very high	97.2	Very high	21 Å²	21	41.4 Å²	41.4	8%	0.079	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-141.3	137.8	-179.3	-53.9	-166.3	-168.8	-178.2	16.4	110.7	L234 G235 H260 E267 T304 V306 D308	L234-R291 HydrophobicContact CD1-CB 3.6Å; L234-R291 HydrophobicContact CG-CB 3.94Å; G235-R291 WeakPolarHBondContact CA-O 3.34Å; G235-R291 PolarHBondContact N-O 3.37Å; H260-R291 HydrophobicContact CB-CB 4.13Å; H260-R291 HydrophobicContact CB-CG 3.88Å; H260-R291 VanDerWaalsContact CD2-CZ 3.46Å; H260-R291 PolarHBondContact CD2-NE 2.96Å; H260-R291 VanDerWaalsContact CD2-NE 3.31Å; E267-R291 IonicContact OE1-CZ 2.91Å; E267-R291 IonicContact OE1-NE 2.98Å; E267-R291 PolarHBondContact OE1-NE 3.02Å; E267-R291 IonicContact OE1-NH2 2.67Å; E267-R291 PolarHBondContact OE1-NH2 3.36Å; E267-R291 WeakPolarHBondContact OE2-CG 3.37Å; E267-R291 IonicContact OE2-CZ 2.69Å; E267-R291 IonicContact OE2-NE 2.69Å; E267-R291 PolarHBondContact OE2-NE 3.46Å; E267-R291 IonicContact OE2-NH2 3Å; R291-T304 CarbonylContact C-O 3.49Å; R291-T304 WeakPolarHBondContact CA-O 3.18Å; R291-T304 HydrophobicContact CB-CG2 4.4Å; R291-T304 WeakPolarHBondContact CB-O 3.43Å; R291-T304 HydrophobicContact CG-CG2 3.72Å; R291-V306 WeakPolarHBondContact CD-O 3.39Å; R291-V306 PolarHBondContact NH1-O 3.34Å; R291-D308 IonicContact CZ-OD1 3.26Å; R291-D308 VanDerWaalsContact CZ-OD1 3.28Å; R291-D308 IonicContact NH1-OD1 3.8Å; R291-D308 PolarHBondContact NH1-OD1 3.48Å; R291-D308 IonicContact NH2-OD1 3.66Å; R291-D308 PolarHBondContact NH2-OD1 3.32Å; R291-D308 IonicContact NH2-OD2 3.77Å
292	S	98.6	Very high	97.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.205	C	C	.	.			trans	-167.4	158.5	-176.6	57	0	0	0	0	112.2	S217 D295 K299 V303 T304	S217-S292 WeakPolarHBondContact O-CA 3.26Å; S217-S292 WeakPolarHBondContact O-CB 3.23Å; S292-D295 WeakPolarHBondContact CB-OD2 3.24Å; S292-D295 WeakPolarHBondContact OG-CB 3.28Å; S292-D295 PolarHBondContact OG-OD2 3.49Å; S292-K299 PolarHBondContact O-NZ 2.9Å; S292-V303 WeakPolarHBondContact OG-CG1 3.34Å; S292-T304 PolarHBondContact N-O 2.77Å
293	I	98.8	Very high	97.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	140.6	159.4	-65.2	173	0	0	0	107.1	A163 T198 D199 F202 G216 S217 A219 L234	A163-I293 HydrophobicContact CB-CD1 3.78Å; T198-I293 HydrophobicContact CG2-CD1 4.26Å; D199-I293 WeakPolarHBondContact OD1-CA 3.47Å; F202-I293 HydrophobicContact CB-CG2 4.36Å; F202-I293 HydrophobicContact CD1-CG2 4.43Å; G216-I293 CarbonylContact C-O 3.5Å; G216-I293 WeakPolarHBondContact CA-O 3.27Å; S217-I293 PolarHBondContact N-O 3.09Å; S217-I293 PolarHBondContact O-N 3.44Å; A219-I293 HydrophobicContact CB-CD1 4.1Å; L234-I293 HydrophobicContact CD2-CG1 3.81Å
294	G	98.5	Very high	97.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	84.4	-140.6	-177.3	0	0	0	0	0	112.3	D199 F202 G296 K299	D199-G294 PolarHBondContact OD1-N 3.06Å; F202-G294 VanDerWaalsContact CD1-CA 3.46Å; G294-G296 PolarHBondContact O-N 3Å; G294-G296 VanDerWaalsContact O-N 3.12Å; G294-K299 WeakPolarHBondContact O-CE 3.25Å; G294-K299 PolarHBondContact O-NZ 3.01Å
295	D	98.3	Very high	97.5	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.016	19%	0.186	C	C	.	.			trans	53	38.3	178.7	-72.7	-48.5	0	0	0	114.2	H154 D215 L287 S292 Q297 Y298 K299 V303	H154-D295 IonicContact CD2-OD1 3.3Å; H154-D295 IonicContact CE1-OD2 3.73Å; H154-D295 PolarHBondContact CE1-OD2 2.63Å; H154-D295 IonicContact NE2-OD1 3.22Å; H154-D295 PolarHBondContact NE2-OD1 2.83Å; H154-D295 IonicContact NE2-OD2 2.74Å; H154-D295 PolarHBondContact NE2-OD2 2.89Å; D215-D295 PolarHBondContact O-N 2.56Å; L287-D295 HydrophobicContact CD2-CB 4.47Å; S292-D295 WeakPolarHBondContact CB-OD2 3.24Å; S292-D295 WeakPolarHBondContact OG-CB 3.28Å; S292-D295 PolarHBondContact OG-OD2 3.49Å; D295-Q297 PolarHBondContact O-N 2.89Å; D295-Y298 HydrophobicContact CB-CD2 3.96Å; D295-Y298 PolarHBondContact O-N 2.92Å; D295-K299 PolarHBondContact O-N 3.34Å; D295-V303 HydrophobicContact CB-CG1 4.47Å
296	G	97.7	Very high	97.6	Very high	35 Å²	35	37.2 Å²	37.2	36%	0.361	19%	0.192	S	C	.	.	H	α-helix	trans	-52.7	-34.5	-171	0	0	0	0	0	114.4	G294 Y298 K299	G294-G296 PolarHBondContact O-N 3Å; G294-G296 VanDerWaalsContact O-N 3.12Å; G296-Y298 PolarHBondContact O-N 3.49Å; G296-K299 PolarHBondContact O-N 2.71Å
297	Q	96.1	Very high	97.7	Very high	91 Å²	91	33.3 Å²	33.3	43%	0.425	17%	0.168	S	C	.	.	H	α-helix	trans	-64.9	-22.5	177.5	68.1	-173.3	19.8	0	0	113.9	K214 D295	K214-Q297 VanDerWaalsContact CD-OE1 3.31Å; D295-Q297 PolarHBondContact O-N 2.89Å
298	Y	97.8	Very high	97.7	Very high	18 Å²	18	34.9 Å²	34.9	7%	0.071	18%	0.176	C	C	.	.	H	α-helix	trans	-100.7	-9.1	-178.7	-58.1	-74.8	0	0	0	114	V283 L284 V286 L287 D295 G296 R300 C301 G302 V303	V283-Y298 HydrophobicContact CG1-CD1 4.37Å; L284-Y298 HydrophobicContact CB-CE1 4.47Å; L284-Y298 HydrophobicContact CD1-CD1 4.11Å; L284-Y298 HydrophobicContact CD1-CE1 4.17Å; V286-Y298 WeakPolarHBondContact CB-OH 3.27Å; V286-Y298 WeakPolarHBondContact CG1-OH 3.41Å; L287-Y298 HydrophobicContact CB-CE1 4.45Å; L287-Y298 HydrophobicContact CB-CE2 4.19Å; L287-Y298 HydrophobicContact CD2-CD2 3.9Å; L287-Y298 HydrophobicContact CD2-CE2 4.29Å; L287-Y298 HydrophobicContact CD2-CG 4.18Å; D295-Y298 HydrophobicContact CB-CD2 3.96Å; D295-Y298 PolarHBondContact O-N 2.92Å; G296-Y298 PolarHBondContact O-N 3.49Å; Y298-R300 VanDerWaalsContact C-N 3.25Å; Y298-R300 PolarHBondContact O-N 3.21Å; Y298-C301 CarbonylContact O-C 3.52Å; Y298-C301 WeakPolarHBondContact O-CA 3.44Å; Y298-C301 WeakPolarHBondContact O-CB 3.34Å; Y298-C301 PolarHBondContact O-N 3.42Å; Y298-G302 PolarHBondContact O-N 3.33Å; Y298-V303 HydrophobicContact CG-CG2 4.47Å; Y298-V303 PolarHBondContact O-N 3.48Å
299	K	97.4	Very high	97.8	Very high	46 Å²	46	32.6 Å²	32.6	20%	0.2	17%	0.167	C	C	.	.	H	α-helix	trans	-60.7	-34.8	-179.6	-62.1	-69.3	173.4	156.4	0	112.6	D199 L203 S292 G294 D295 G296 C301 G302 V303	D199-K299 IonicContact OD1-NZ 2.76Å; D199-K299 PolarHBondContact OD1-NZ 2.94Å; D199-K299 IonicContact OD2-NZ 3.09Å; D199-K299 PolarHBondContact OD2-NZ 3.22Å; L203-K299 HydrophobicContact CD1-CG 4.33Å; S292-K299 PolarHBondContact O-NZ 2.9Å; G294-K299 WeakPolarHBondContact O-CE 3.25Å; G294-K299 PolarHBondContact O-NZ 3.01Å; D295-K299 PolarHBondContact O-N 3.34Å; G296-K299 PolarHBondContact O-N 2.71Å; K299-C301 PolarHBondContact O-N 3.42Å; K299-G302 PolarHBondContact O-N 2.8Å; K299-V303 WeakPolarHBondContact CA-O 3.24Å; K299-V303 WeakPolarHBondContact CD-O 3.5Å
300	R	96.3	Very high	97.8	Very high	223 Å²	223	37.8 Å²	37.8	84%	0.842	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-15.7	174.2	-64.2	-175	-175.1	178.1	1.8	113.3	A274 Y298	A274-R300 VanDerWaalsContact O-O 3.1Å; Y298-R300 VanDerWaalsContact C-N 3.25Å; Y298-R300 PolarHBondContact O-N 3.21Å
301	C	95.9	Very high	97.7	Very high	24 Å²	24	42.7 Å²	42.7	16%	0.162	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	14.9	-179.4	-57	0	0	0	0	112.4	I271 L284 Y298 K299	I271-C301 WeakPolarHBondContact CG2-O 3.27Å; L284-C301 HydrophobicContact CD1-CB 4.48Å; Y298-C301 CarbonylContact O-C 3.52Å; Y298-C301 WeakPolarHBondContact O-CA 3.44Å; Y298-C301 WeakPolarHBondContact O-CB 3.34Å; Y298-C301 PolarHBondContact O-N 3.42Å; K299-C301 PolarHBondContact O-N 3.42Å
302	G	97.1	Very high	97.7	Very high	8 Å²	8	42.7 Å²	42.7	8%	0.082	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.5	5.7	174.1	0	0	0	0	0	115.7	R270 Y298 K299	R270-G302 PolarHBondContact NE-O 2.86Å; Y298-G302 PolarHBondContact O-N 3.33Å; K299-G302 PolarHBondContact O-N 2.8Å
303	V	98.3	Very high	97.6	Very high	5 Å²	5	46.9 Å²	46.9	3%	0.03	23%	0.227	C	C	.	.			trans	-68	135.1	163	177.2	0	0	0	0	108.6	V283 L287 S290 S292 D295 Y298 K299	V283-V303 HydrophobicContact CB-CG2 4.48Å; V283-V303 HydrophobicContact CG1-CG2 4.13Å; V283-V303 HydrophobicContact CG2-CG2 4.1Å; L287-V303 HydrophobicContact CD2-CG1 4.39Å; L287-V303 HydrophobicContact CD2-CG2 3.9Å; S290-V303 WeakPolarHBondContact O-CA 3.46Å; S292-V303 WeakPolarHBondContact OG-CG1 3.34Å; D295-V303 HydrophobicContact CB-CG1 4.47Å; Y298-V303 HydrophobicContact CG-CG2 4.47Å; Y298-V303 PolarHBondContact O-N 3.48Å; K299-V303 WeakPolarHBondContact CA-O 3.24Å; K299-V303 WeakPolarHBondContact CD-O 3.5Å
304	T	98.4	Very high	97.5	Very high	30 Å²	30	47.1 Å²	47.1	18%	0.184	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-131.6	151.5	-174.1	-174.5	0	0	0	0	112.1	R291 S292 V306	R291-T304 CarbonylContact C-O 3.49Å; R291-T304 WeakPolarHBondContact CA-O 3.18Å; R291-T304 HydrophobicContact CB-CG2 4.4Å; R291-T304 WeakPolarHBondContact CB-O 3.43Å; R291-T304 HydrophobicContact CG-CG2 3.72Å; S292-T304 PolarHBondContact N-O 2.77Å; T304-V306 HydrophobicContact CG2-CB 4.41Å; T304-V306 WeakPolarHBondContact OG1-CG2 3.45Å; T304-V306 PolarHBondContact OG1-N 3.28Å
305	S	98.3	Very high	97.4	Very high	14 Å²	14	49 Å²	49	10%	0.098	24%	0.239	C	C	.	.			trans	-93	7.2	171	44.7	0	0	0	0	113.4	D199 L234 P307	D199-S305 VanDerWaalsContact CB-CB 3.46Å; D199-S305 WeakPolarHBondContact OD2-CB 2.91Å; D199-S305 PolarHBondContact OD2-OG 3.43Å; L234-S305 VanDerWaalsContact CD1-C 3.45Å; S305-P307 VanDerWaalsContact O-CD 3.26Å; S305-P307 WeakPolarHBondContact O-CD 3.4Å
306	V	98.3	Very high	97.3	Very high	75 Å²	75	52.9 Å²	52.9	46%	0.455	27%	0.265	S	S	.	.			trans	-78.8	113.7	178	178.7	0	0	0	0	110.2	L192 L234 R291 T304	L192-V306 HydrophobicContact CD2-CG1 4.09Å; L234-V306 WeakPolarHBondContact CD1-O 3.43Å; R291-V306 WeakPolarHBondContact CD-O 3.39Å; R291-V306 PolarHBondContact NH1-O 3.34Å; T304-V306 HydrophobicContact CG2-CB 4.41Å; T304-V306 WeakPolarHBondContact OG1-CG2 3.45Å; T304-V306 PolarHBondContact OG1-N 3.28Å
307	P	98.1	Very high	97.2	Very high	4 Å²	4	53.1 Å²	53.1	3%	0.026	26%	0.258	C	S	.	.			trans	-78	153.9	179.7	34	-37.2	0	0	0	111.7	L192 F195 A232 N233 L234 S305 I309	L192-P307 HydrophobicContact CD2-CG 4.16Å; F195-P307 HydrophobicContact CB-CG 4.04Å; F195-P307 HydrophobicContact CD1-CB 3.88Å; F195-P307 HydrophobicContact CD1-CG 3.78Å; F195-P307 HydrophobicContact CD2-CG 3.92Å; F195-P307 HydrophobicContact CE1-CB 3.86Å; F195-P307 HydrophobicContact CE1-CG 4.14Å; F195-P307 HydrophobicContact CE2-CG 4.27Å; F195-P307 HydrophobicContact CG-CB 4.26Å; F195-P307 HydrophobicContact CG-CG 3.64Å; F195-P307 HydrophobicContact CZ-CB 4.22Å; F195-P307 HydrophobicContact CZ-CG 4.37Å; A232-P307 HydrophobicContact CB-CB 4.06Å; A232-P307 HydrophobicContact CB-CG 4.22Å; N233-P307 CarbonylContact O-C 3.47Å; N233-P307 WeakPolarHBondContact O-CA 2.68Å; N233-P307 WeakPolarHBondContact O-CB 3.49Å; L234-P307 HydrophobicContact CB-CB 4.42Å; L234-P307 HydrophobicContact CD1-CB 4.35Å; S305-P307 VanDerWaalsContact O-CD 3.26Å; S305-P307 WeakPolarHBondContact O-CD 3.4Å; P307-I309 HydrophobicContact CG-CG1 4.32Å
308	D	97.7	Very high	97.3	Very high	47 Å²	47	48.8 Å²	48.8	25%	0.251	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	128.7	161.9	-83.8	5.8	0	0	0	108.9	A232 N233 H260 R291	A232-D308 WeakPolarHBondContact CA-O 3.16Å; N233-D308 PolarHBondContact N-O 2.89Å; N233-D308 PolarHBondContact O-N 3.39Å; H260-D308 IonicContact NE2-OD1 3.27Å; H260-D308 IonicContact NE2-OD2 2.71Å; H260-D308 PolarHBondContact NE2-OD2 3.15Å; H260-D308 VanDerWaalsContact NE2-OD2 3.14Å; R291-D308 IonicContact CZ-OD1 3.26Å; R291-D308 VanDerWaalsContact CZ-OD1 3.28Å; R291-D308 IonicContact NH1-OD1 3.8Å; R291-D308 PolarHBondContact NH1-OD1 3.48Å; R291-D308 IonicContact NH2-OD1 3.66Å; R291-D308 PolarHBondContact NH2-OD1 3.32Å; R291-D308 IonicContact NH2-OD2 3.77Å
309	I	98.1	Very high	97.2	Very high	36 Å²	36	51.6 Å²	51.6	19%	0.185	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.5	-178.8	-54.9	173.8	0	0	0	111.1	K188 L191 L192 I231 A232 P307	K188-I309 HydrophobicContact CG-CG2 4.01Å; K188-I309 WeakPolarHBondContact O-CD1 3.43Å; L191-I309 HydrophobicContact CB-CD1 3.65Å; L191-I309 HydrophobicContact CD1-CD1 4.32Å; L191-I309 HydrophobicContact CD1-CG2 4.25Å; L192-I309 HydrophobicContact CD2-CD1 3.72Å; L192-I309 HydrophobicContact CD2-CG1 4.4Å; L192-I309 HydrophobicContact CG-CD1 3.67Å; I231-I309 CarbonylContact O-C 3.59Å; I231-I309 VanDerWaalsContact O-CA 3.27Å; I231-I309 WeakPolarHBondContact O-CA 3.37Å; A232-I309 HydrophobicContact CB-CG1 3.99Å; P307-I309 HydrophobicContact CG-CG1 4.32Å
310	R	97.4	Very high	97.3	Very high	113 Å²	113	49.4 Å²	49.4	43%	0.426	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	147.2	172.4	-69.7	-171.2	176.7	-174.9	1.2	111.4	Y230 I231 L256	Y230-R310 WeakPolarHBondContact CA-O 3.44Å; I231-R310 PolarHBondContact N-O 2.82Å; I231-R310 PolarHBondContact O-N 3.38Å; L256-R310 VanDerWaalsContact O-CD 3.29Å; L256-R310 WeakPolarHBondContact O-CD 3.2Å
311	R	96.9	Very high	97.4	Very high	103 Å²	103	38.8 Å²	38.8	39%	0.389	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	135.4	175.1	178.2	-178.4	166	160.4	3.2	109	E184 I228 L229	E184-R311 IonicContact OE2-CZ 2.82Å; E184-R311 IonicContact OE2-NH1 3.51Å; E184-R311 PolarHBondContact OE2-NH1 2.9Å; I228-R311 HydrophobicContact CG2-CG 3.67Å; L229-R311 CarbonylContact O-C 3.56Å; L229-R311 WeakPolarHBondContact O-CA 3.38Å
312	C	97.3	Very high	97.6	Very high	22 Å²	22	37.6 Å²	37.6	15%	0.149	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	134	173	-173.9	0	0	0	0	110.3	L229 I231 L256	L229-C312 HydrophobicContact CB-CB 4.25Å; L229-C312 HydrophobicContact CD1-CB 4.49Å; L229-C312 PolarHBondContact N-O 3.31Å; L229-C312 PolarHBondContact O-N 2.71Å; I231-C312 HydrophobicContact CD1-CB 4.16Å; L256-C312 HydrophobicContact CD2-CB 3.98Å
313	Q	97.3	Very high	97.6	Very high	87 Å²	87	37.2 Å²	37.2	41%	0.407	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.4	173.7	178.3	61.1	54.3	0	0	109.1	N227 I228 R243	N227-Q313 PolarHBondContact O-NE2 2.92Å; I228-Q313 VanDerWaalsContact CG1-OE1 3.22Å; R243-Q313 PolarHBondContact NH2-O 2.9Å
314	L	97	Very high	97.7	Very high	6 Å²	6	37 Å²	37	3%	0.031	19%	0.186	C	C	.	.			trans	-69.3	147	172.3	-70.3	-178.6	0	0	0	111.2	F105 L107 N227 L229 D318 I390	F105-L314 HydrophobicContact CB-CD1 4.27Å; F105-L314 HydrophobicContact CD2-CB 3.66Å; F105-L314 HydrophobicContact CD2-CD1 4.06Å; F105-L314 HydrophobicContact CE2-CB 3.86Å; L107-L314 HydrophobicContact CD2-CD1 4.31Å; N227-L314 HydrophobicContact CB-CB 4.34Å; N227-L314 WeakPolarHBondContact O-CB 3.37Å; N227-L314 PolarHBondContact O-N 2.88Å; L229-L314 HydrophobicContact CD1-CD2 3.67Å; L229-L314 HydrophobicContact CD1-CG 4.24Å; L229-L314 HydrophobicContact CD2-CD1 4.12Å; L229-L314 HydrophobicContact CD2-CD2 4.34Å; L229-L314 HydrophobicContact CD2-CG 4.16Å; L229-L314 HydrophobicContact CG-CD2 4Å; L229-L314 HydrophobicContact CG-CG 3.99Å; L314-D318 WeakPolarHBondContact CA-OD2 3.39Å; L314-D318 HydrophobicContact CD2-CB 4.16Å; L314-I390 HydrophobicContact CD2-CD1 3.75Å
315	T	95.9	Very high	97.7	Very high	38 Å²	38	35.6 Å²	35.6	23%	0.233	18%	0.177	C	C	.	.			trans	-134	159.8	-178.1	66.2	0	0	0	0	109.9	R243 N317 D318	R243-T315 PolarHBondContact NH2-OG1 2.92Å; T315-N317 PolarHBondContact O-N 3.3Å; T315-N317 PolarHBondContact OG1-N 3.02Å; T315-D318 PolarHBondContact N-OD2 3.5Å; T315-D318 WeakPolarHBondContact O-CB 3.18Å; T315-D318 PolarHBondContact O-N 3.44Å; T315-D318 PolarHBondContact OG1-OD2 3.24Å
316	P	95.7	Very high	97.6	Very high	86 Å²	86	35.8 Å²	35.8	56%	0.558	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-15.5	174.2	-25.9	36.1	0	0	0	114.8	F105 R319 H392	F105-P316 HydrophobicContact CZ-CG 4.16Å; P316-R319 PolarHBondContact O-NH1 2.64Å; P316-H392 VanDerWaalsContact C-CE1 3.45Å; P316-H392 PolarHBondContact O-CE1 2.94Å
317	N	96.1	Very high	97.6	Very high	40 Å²	40	32.2 Å²	32.2	21%	0.214	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-7.6	178.7	-73.1	-23.8	0	0	0	113.6	R243 Y244 E246 T315	R243-N317 HydrophobicContact CG-CB 4.14Å; Y244-N317 PolarHBondContact N-O 2.75Å; Y244-N317 WeakPolarHBondContact O-CB 3.39Å; E246-N317 PolarHBondContact OE1-ND2 3.25Å; E246-N317 PolarHBondContact OE1-OD1 3.01Å; T315-N317 PolarHBondContact O-N 3.3Å; T315-N317 PolarHBondContact OG1-N 3.02Å
318	D	97.5	Very high	97.6	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	134	178.2	-65.3	-43.8	0	0	0	111.7	L241 R243 L314 T315 I390 H392	L241-D318 HydrophobicContact CD1-CB 4.09Å; L241-D318 WeakPolarHBondContact CD2-OD1 3.13Å; R243-D318 WeakPolarHBondContact CB-OD1 3.19Å; R243-D318 IonicContact CZ-OD1 2.92Å; R243-D318 VanDerWaalsContact CZ-OD1 3.26Å; R243-D318 IonicContact CZ-OD2 2.77Å; R243-D318 IonicContact NE-OD1 2.92Å; R243-D318 PolarHBondContact NE-OD1 3.36Å; R243-D318 IonicContact NE-OD2 3.27Å; R243-D318 VanDerWaalsContact NH2-CG 3.29Å; R243-D318 IonicContact NH2-OD1 2.88Å; R243-D318 PolarHBondContact NH2-OD1 3.01Å; R243-D318 IonicContact NH2-OD2 3.28Å; R243-D318 PolarHBondContact NH2-OD2 3.31Å; L314-D318 WeakPolarHBondContact CA-OD2 3.39Å; L314-D318 HydrophobicContact CD2-CB 4.16Å; T315-D318 PolarHBondContact N-OD2 3.5Å; T315-D318 WeakPolarHBondContact O-CB 3.18Å; T315-D318 PolarHBondContact O-N 3.44Å; T315-D318 PolarHBondContact OG1-OD2 3.24Å; D318-I390 HydrophobicContact CB-CD1 3.63Å; D318-H392 PolarHBondContact O-CE1 3.29Å; D318-H392 VanDerWaalsContact O-CE1 3.3Å; D318-H392 PolarHBondContact O-NE2 3.11Å
319	R	97.1	Very high	97.6	Very high	76 Å²	76	30.5 Å²	30.5	29%	0.287	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-51.4	-174.5	-54.5	-57	172.4	-160.5	-8.3	112.4	C242 P316 I390	C242-R319 HydrophobicContact CB-CB 4.46Å; C242-R319 PolarHBondContact O-N 3.17Å; P316-R319 PolarHBondContact O-NH1 2.64Å; R319-I390 WeakPolarHBondContact O-CB 3.3Å; R319-I390 PolarHBondContact O-N 3.16Å; R319-I390 VanDerWaalsContact O-N 3.09Å
320	F	98.6	Very high	97.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	164.2	178	60.6	-97.6	0	0	0	111.5	C242 V338 I341 L342 L345 Y363 V387 V388	C242-F320 HydrophobicContact CB-CD1 3.91Å; C242-F320 HydrophobicContact CB-CD2 3.88Å; C242-F320 HydrophobicContact CB-CE1 3.65Å; C242-F320 HydrophobicContact CB-CE2 3.61Å; C242-F320 HydrophobicContact CB-CG 4.02Å; C242-F320 HydrophobicContact CB-CZ 3.48Å; C242-F320 VanDerWaalsContact CB-CZ 3.48Å; C242-F320 PolarHBondContact N-O 2.87Å; F320-V338 HydrophobicContact CE2-CG2 4.28Å; F320-V338 HydrophobicContact CZ-CB 4.44Å; F320-V338 HydrophobicContact CZ-CG1 4.09Å; F320-V338 HydrophobicContact CZ-CG2 4.38Å; F320-I341 HydrophobicContact CD1-CG2 4.19Å; F320-I341 HydrophobicContact CD2-CD1 4.47Å; F320-I341 HydrophobicContact CD2-CG2 4.38Å; F320-I341 HydrophobicContact CE1-CB 4.27Å; F320-I341 HydrophobicContact CE1-CG2 3.64Å; F320-I341 HydrophobicContact CE2-CB 4.14Å; F320-I341 HydrophobicContact CE2-CD1 3.68Å; F320-I341 HydrophobicContact CE2-CG2 3.87Å; F320-I341 HydrophobicContact CZ-CB 3.69Å; F320-I341 HydrophobicContact CZ-CD1 4.11Å; F320-I341 HydrophobicContact CZ-CG2 3.47Å; F320-I341 VanDerWaalsContact CZ-CG2 3.47Å; F320-L342 HydrophobicContact CE1-CD2 3.86Å; F320-L342 HydrophobicContact CE1-CG 4.03Å; F320-L342 HydrophobicContact CZ-CG 4.41Å; F320-L345 HydrophobicContact CD1-CD1 4.19Å; F320-L345 HydrophobicContact CE1-CD1 4.28Å; F320-Y363 HydrophobicContact CB-CE1 4.14Å; F320-V387 HydrophobicContact CB-CG1 3.85Å; F320-V387 HydrophobicContact CD2-CG1 3.88Å; F320-V387 HydrophobicContact CG-CG1 3.98Å; F320-V388 CarbonylContact C-O 3.47Å; F320-V388 WeakPolarHBondContact CA-O 3.17Å; F320-V388 VanDerWaalsContact CB-O 3.29Å; F320-V388 WeakPolarHBondContact CB-O 3.48Å
321	I	98.8	Very high	97.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.5	171.1	-47.4	167.7	0	0	0	108	V222 L229 I240 L241 L256 L323 V387 V388 I390	V222-I321 HydrophobicContact CG1-CD1 4.12Å; V222-I321 HydrophobicContact CG2-CG2 4.4Å; L229-I321 HydrophobicContact CD1-CD1 3.53Å; L229-I321 HydrophobicContact CD1-CG1 4.34Å; L229-I321 HydrophobicContact CD2-CD1 4.03Å; L229-I321 HydrophobicContact CG-CD1 4.43Å; I240-I321 CarbonylContact O-C 3.51Å; I240-I321 WeakPolarHBondContact O-CA 3.46Å; I240-I321 WeakPolarHBondContact O-CG2 3.33Å; L241-I321 HydrophobicContact CD1-CG1 4.02Å; L256-I321 HydrophobicContact CD1-CG2 4.01Å; I321-L323 HydrophobicContact CG2-CD1 3.94Å; I321-V387 CarbonylContact O-C 3.58Å; I321-V387 WeakPolarHBondContact O-CA 3.45Å; I321-V388 HydrophobicContact CB-CB 4.16Å; I321-V388 PolarHBondContact N-O 3.31Å; I321-V388 PolarHBondContact O-N 3.19Å; I321-I390 HydrophobicContact CG1-CD1 4.08Å
322	L	98.9	Very high	97.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	121.8	171.7	168.5	62.8	0	0	0	108.9	A239 I240 A324 L328 F329 A337 I341 V385 M386 V387	A239-L322 CarbonylContact C-O 3.58Å; A239-L322 VanDerWaalsContact CA-O 3.29Å; A239-L322 WeakPolarHBondContact CA-O 3.45Å; I240-L322 HydrophobicContact CB-CB 4.39Å; I240-L322 PolarHBondContact N-O 2.89Å; I240-L322 PolarHBondContact O-N 3.02Å; L322-A324 HydrophobicContact CD1-CB 4.33Å; L322-L328 HydrophobicContact CD1-CD2 4.42Å; L322-L328 HydrophobicContact CD2-CD2 4.18Å; L322-F329 HydrophobicContact CD2-CZ 4.23Å; L322-A337 HydrophobicContact CD2-CB 3.78Å; L322-I341 HydrophobicContact CB-CD1 4.41Å; L322-I341 HydrophobicContact CD1-CD1 4.18Å; L322-I341 HydrophobicContact CD2-CD1 4.09Å; L322-I341 HydrophobicContact CG-CD1 4.46Å; L322-V385 HydrophobicContact CD1-CG1 3.79Å; L322-M386 CarbonylContact C-O 3.6Å; L322-M386 WeakPolarHBondContact CA-O 3.33Å; L322-V387 HydrophobicContact CD1-CG2 4.25Å
323	L	98.9	Very high	97.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.8	164.6	-62.2	80.5	0	0	0	108	F148 V150 T220 V222 R238 A239 I321 M386 V388	F148-L323 HydrophobicContact CB-CD2 4.49Å; V150-L323 HydrophobicContact CG2-CB 3.85Å; T220-L323 HydrophobicContact CG2-CD2 4.47Å; V222-L323 HydrophobicContact CG2-CD1 4.05Å; V222-L323 HydrophobicContact CG2-CD2 3.93Å; V222-L323 HydrophobicContact CG2-CG 4.14Å; R238-L323 WeakPolarHBondContact O-CA 3.39Å; A239-L323 HydrophobicContact CB-CG 4.34Å; I321-L323 HydrophobicContact CG2-CD1 3.94Å; L323-M386 HydrophobicContact CB-CB 4.26Å; L323-M386 HydrophobicContact CD1-SD 4.33Å; L323-M386 PolarHBondContact N-O 3.36Å; L323-M386 PolarHBondContact O-N 2.97Å; L323-V388 HydrophobicContact CD1-CG2 4.01Å
324	A	98.8	Very high	97.7	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.008	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	154.9	174.8	0	0	0	0	0	112.4	R238 L322 L328 F329 T384	R238-A324 PolarHBondContact N-O 3.24Å; R238-A324 PolarHBondContact O-N 3.31Å; L322-A324 HydrophobicContact CD1-CB 4.33Å; A324-L328 HydrophobicContact CB-CB 3.92Å; A324-L328 HydrophobicContact CB-CD2 3.46Å; A324-L328 VanDerWaalsContact CB-CD2 3.46Å; A324-L328 HydrophobicContact CB-CG 4.32Å; A324-F329 HydrophobicContact CB-CD2 4.33Å; A324-F329 HydrophobicContact CB-CE2 3.64Å; A324-F329 HydrophobicContact CB-CZ 4.17Å; A324-T384 WeakPolarHBondContact CA-O 3.47Å; A324-T384 WeakPolarHBondContact CB-O 3.13Å
325	C	98.4	Very high	97.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.151	C	C	.	.			trans	-73.9	172.9	171.2	66.7	0	0	0	0	111.7	D123 V150 D152 S237 G327 L328 F329 N382 T384	D123-C325 PolarHBondContact OD2-SG 3.36Å; V150-C325 HydrophobicContact CG1-CB 4.34Å; D152-C325 HydrophobicContact CB-CB 3.93Å; D152-C325 WeakPolarHBondContact OD2-CB 3.46Å; S237-C325 WeakPolarHBondContact OG-CA 3.27Å; C325-G327 PolarHBondContact O-N 3.12Å; C325-L328 PolarHBondContact O-N 2.52Å; C325-F329 WeakPolarHBondContact O-CD2 3.42Å; C325-N382 PolarHBondContact SG-O 3.37Å; C325-N382 VanDerWaalsContact SG-O 3.36Å; C325-T384 PolarHBondContact N-O 3.26Å; C325-T384 PolarHBondContact SG-N 2.81Å
326	D	97.3	Very high	97.8	Very high	18 Å²	18	31.1 Å²	31.1	10%	0.096	16%	0.158	C	C	.	.	H	α-helix	trans	-68.2	-21.8	-176.1	83.7	-5.9	0	0	0	112.4	L328 F329 K330	D326-L328 CarbonylContact O-C 3.26Å; D326-L328 PolarHBondContact O-N 2.71Å; D326-L328 VanDerWaalsContact O-N 3.11Å; D326-F329 CarbonylContact O-C 3.57Å; D326-F329 PolarHBondContact O-N 3.01Å; D326-K330 WeakPolarHBondContact O-CB 3.32Å; D326-K330 VanDerWaalsContact O-CG 3.29Å; D326-K330 WeakPolarHBondContact O-CG 3.47Å; D326-K330 PolarHBondContact O-N 3.31Å; D326-K330 IonicContact OD1-NZ 3.79Å; D326-K330 PolarHBondContact OD1-NZ 2.76Å; D326-K330 WeakPolarHBondContact OD2-CE 3.5Å; D326-K330 IonicContact OD2-NZ 2.63Å; D326-K330 PolarHBondContact OD2-NZ 3.2Å
327	G	97.8	Very high	98	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-57.2	-27.2	174.6	0	0	0	0	0	113.4	C325 S379 N382	C325-G327 PolarHBondContact O-N 3.12Å; G327-S379 WeakPolarHBondContact O-CB 3.45Å; G327-S379 PolarHBondContact O-OG 3.48Å; G327-N382 WeakPolarHBondContact CA-O 3.46Å
328	L	98.5	Very high	98.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-77.6	-54.1	167.4	-179.6	69.2	0	0	0	111.2	L322 A324 C325 D326 K330 V331 F332 L370 A374 V383 V385	L322-L328 HydrophobicContact CD1-CD2 4.42Å; L322-L328 HydrophobicContact CD2-CD2 4.18Å; A324-L328 HydrophobicContact CB-CB 3.92Å; A324-L328 HydrophobicContact CB-CD2 3.46Å; A324-L328 VanDerWaalsContact CB-CD2 3.46Å; A324-L328 HydrophobicContact CB-CG 4.32Å; C325-L328 PolarHBondContact O-N 2.52Å; D326-L328 CarbonylContact O-C 3.26Å; D326-L328 PolarHBondContact O-N 2.71Å; D326-L328 VanDerWaalsContact O-N 3.11Å; L328-K330 VanDerWaalsContact C-N 3.26Å; L328-K330 PolarHBondContact O-N 3.17Å; L328-V331 WeakPolarHBondContact O-CG2 3.48Å; L328-V331 PolarHBondContact O-N 2.85Å; L328-V331 VanDerWaalsContact O-N 3.07Å; L328-F332 HydrophobicContact CD1-CB 4.33Å; L328-F332 HydrophobicContact CD1-CD2 3.65Å; L328-F332 HydrophobicContact CD1-CE2 4.25Å; L328-F332 HydrophobicContact CD1-CG 4.17Å; L328-F332 HydrophobicContact CG-CB 4.37Å; L328-F332 PolarHBondContact O-N 3.09Å; L328-L370 HydrophobicContact CD1-CD1 3.94Å; L328-L370 HydrophobicContact CD1-CD2 4.31Å; L328-L370 HydrophobicContact CD1-CG 3.83Å; L328-L370 HydrophobicContact CD2-CD2 4.16Å; L328-A374 HydrophobicContact CD1-CB 3.93Å; L328-V383 HydrophobicContact CB-CG1 4.33Å; L328-V385 HydrophobicContact CD1-CG2 4.2Å; L328-V385 HydrophobicContact CD2-CG2 4.15Å
329	F	97.4	Very high	98.1	Very high	15 Å²	15	29.5 Å²	29.5	7%	0.066	15%	0.145	C	C	.	.	H	α-helix	trans	-74.9	-10.5	-168.2	-66.7	-65.4	0	0	0	114.7	R238 I240 L322 A324 C325 D326 V331	R238-F329 HydrophobicContact CB-CD2 3.91Å; R238-F329 HydrophobicContact CB-CE2 3.48Å; R238-F329 VanDerWaalsContact CB-CE2 3.48Å; R238-F329 HydrophobicContact CB-CZ 3.97Å; R238-F329 HydrophobicContact CG-CD2 3.72Å; R238-F329 HydrophobicContact CG-CE2 3.86Å; R238-F329 HydrophobicContact CG-CG 4.31Å; I240-F329 HydrophobicContact CG1-CE1 4.22Å; I240-F329 HydrophobicContact CG1-CZ 3.99Å; L322-F329 HydrophobicContact CD2-CZ 4.23Å; A324-F329 HydrophobicContact CB-CD2 4.33Å; A324-F329 HydrophobicContact CB-CE2 3.64Å; A324-F329 HydrophobicContact CB-CZ 4.17Å; C325-F329 WeakPolarHBondContact O-CD2 3.42Å; D326-F329 CarbonylContact O-C 3.57Å; D326-F329 PolarHBondContact O-N 3.01Å; F329-V331 PolarHBondContact O-N 3.25Å
330	K	95.9	Very high	98.2	Very high	105 Å²	105	28.3 Å²	28.3	46%	0.457	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-26.8	166.2	-78.6	167.3	173.2	147.7	0	112.5	D326 L328 D381	D326-K330 WeakPolarHBondContact O-CB 3.32Å; D326-K330 VanDerWaalsContact O-CG 3.29Å; D326-K330 WeakPolarHBondContact O-CG 3.47Å; D326-K330 PolarHBondContact O-N 3.31Å; D326-K330 IonicContact OD1-NZ 3.79Å; D326-K330 PolarHBondContact OD1-NZ 2.76Å; D326-K330 WeakPolarHBondContact OD2-CE 3.5Å; D326-K330 IonicContact OD2-NZ 2.63Å; D326-K330 PolarHBondContact OD2-NZ 3.2Å; L328-K330 VanDerWaalsContact C-N 3.26Å; L328-K330 PolarHBondContact O-N 3.17Å; K330-D381 IonicContact NZ-OD2 3.84Å; K330-D381 PolarHBondContact NZ-OD2 2.99Å
331	V	98	Very high	98.2	Very high	36 Å²	36	28.3 Å²	28.3	22%	0.218	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.4	1.7	-174.3	-58.2	0	0	0	0	114.4	L328 F329 A374 R377	L328-V331 WeakPolarHBondContact O-CG2 3.48Å; L328-V331 PolarHBondContact O-N 2.85Å; L328-V331 VanDerWaalsContact O-N 3.07Å; F329-V331 PolarHBondContact O-N 3.25Å; V331-A374 HydrophobicContact CG2-CB 3.86Å; V331-R377 HydrophobicContact CB-CB 3.95Å; V331-R377 HydrophobicContact CG1-CB 4.48Å; V331-R377 HydrophobicContact CG2-CB 4.09Å; V331-R377 WeakPolarHBondContact O-CD 3.25Å; V331-R377 PolarHBondContact O-NH1 2.92Å
332	F	98.4	Very high	98.1	Very high	6 Å²	6	29.2 Å²	29.2	3%	0.026	15%	0.147	C	C	.	.			trans	-134.2	135.7	174.6	-86.1	-89.7	0	0	0	111	L328 E336 A337 L370 K373 A374 R377	L328-F332 HydrophobicContact CD1-CB 4.33Å; L328-F332 HydrophobicContact CD1-CD2 3.65Å; L328-F332 HydrophobicContact CD1-CE2 4.25Å; L328-F332 HydrophobicContact CD1-CG 4.17Å; L328-F332 HydrophobicContact CG-CB 4.37Å; L328-F332 PolarHBondContact O-N 3.09Å; F332-E336 HydrophobicContact CD1-CB 3.83Å; F332-E336 HydrophobicContact CE1-CB 4.46Å; F332-A337 HydrophobicContact CB-CB 4.37Å; F332-A337 HydrophobicContact CD1-CB 4.35Å; F332-L370 HydrophobicContact CD1-CD1 4.22Å; F332-L370 HydrophobicContact CD2-CD1 4.31Å; F332-L370 HydrophobicContact CE1-CD1 3.82Å; F332-L370 HydrophobicContact CE2-CD1 3.93Å; F332-L370 HydrophobicContact CG-CD1 4.45Å; F332-L370 HydrophobicContact CZ-CD1 3.67Å; F332-K373 HydrophobicContact CE2-CB 4.31Å; F332-K373 HydrophobicContact CE2-CG 4.2Å; F332-K373 HydrophobicContact CZ-CB 4.05Å; F332-K373 HydrophobicContact CZ-CG 3.67Å; F332-A374 HydrophobicContact CD2-CB 4.36Å; F332-A374 HydrophobicContact CE2-CB 4.22Å; F332-R377 VanDerWaalsContact CE1-CZ 3.41Å; F332-R377 VanDerWaalsContact CZ-CZ 3.48Å
333	T	98.3	Very high	98	Very high	62 Å²	62	32.1 Å²	32.1	38%	0.38	17%	0.167	S	C	.	.			trans	-74.8	156.1	160.9	69.4	0	0	0	0	110.2	E335 E336 A337	T333-E335 VanDerWaalsContact C-N 3.26Å; T333-E335 PolarHBondContact O-N 2.85Å; T333-E336 PolarHBondContact O-N 2.92Å; T333-E336 WeakPolarHBondContact OG1-CB 3.15Å; T333-E336 WeakPolarHBondContact OG1-CG 3.34Å; T333-E336 PolarHBondContact OG1-N 3.13Å; T333-E336 VanDerWaalsContact OG1-N 3.17Å; T333-A337 PolarHBondContact O-N 3.06Å
334	P	98	Very high	97.8	Very high	25 Å²	25	32.3 Å²	32.3	16%	0.162	17%	0.169	C	C	.	.	H	α-helix	trans	-53.8	-41.8	174.8	-27.7	36.8	0	0	0	113.3	I240 A253 A337 V338	I240-P334 HydrophobicContact CD1-CB 4.01Å; I240-P334 HydrophobicContact CD1-CG 4.18Å; I240-P334 HydrophobicContact CG1-CB 4.22Å; I240-P334 HydrophobicContact CG2-CB 4.33Å; A253-P334 HydrophobicContact CB-CB 4Å; P334-A337 PolarHBondContact O-N 3.27Å; P334-V338 WeakPolarHBondContact O-CG2 3.47Å; P334-V338 PolarHBondContact O-N 3.24Å
335	E	97.9	Very high	97.6	Very high	99 Å²	99	33.6 Å²	33.6	46%	0.463	18%	0.175	S	C	.	.	H	α-helix	trans	-65.9	-43.8	179.6	-66.8	71.8	-161.1	0	0	111.6	A253 T333 V338 N339	A253-E335 HydrophobicContact CB-CG 4.17Å; T333-E335 VanDerWaalsContact C-N 3.26Å; T333-E335 PolarHBondContact O-N 2.85Å; E335-V338 PolarHBondContact O-N 2.96Å; E335-N339 WeakPolarHBondContact O-CB 3.26Å; E335-N339 VanDerWaalsContact O-CG 3.24Å; E335-N339 PolarHBondContact O-N 3.11Å; E335-N339 PolarHBondContact O-ND2 3.43Å; E335-N339 VanDerWaalsContact O-ND2 3.1Å
336	E	98.3	Very high	97.3	Very high	84 Å²	84	40.3 Å²	40.3	39%	0.393	21%	0.207	S	C	.	.	H	α-helix	trans	-62.4	-43.5	175.9	-75.7	177.5	178	0	0	111.8	F332 T333 N339 F340 R377	F332-E336 HydrophobicContact CD1-CB 3.83Å; F332-E336 HydrophobicContact CE1-CB 4.46Å; T333-E336 PolarHBondContact O-N 2.92Å; T333-E336 WeakPolarHBondContact OG1-CB 3.15Å; T333-E336 WeakPolarHBondContact OG1-CG 3.34Å; T333-E336 PolarHBondContact OG1-N 3.13Å; T333-E336 VanDerWaalsContact OG1-N 3.17Å; E336-N339 PolarHBondContact O-N 3.47Å; E336-F340 VanDerWaalsContact O-CB 3.29Å; E336-F340 WeakPolarHBondContact O-CB 3.24Å; E336-F340 PolarHBondContact O-N 3.5Å; E336-R377 IonicContact OE2-CZ 3.47Å; E336-R377 IonicContact OE2-NH1 3.89Å; E336-R377 PolarHBondContact OE2-NH1 2.85Å; E336-R377 IonicContact OE2-NH2 3.28Å
337	A	98.5	Very high	97	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.6	-44	178.7	0	0	0	0	0	111.6	L322 F332 T333 P334 F340 I341 L370	L322-A337 HydrophobicContact CD2-CB 3.78Å; F332-A337 HydrophobicContact CB-CB 4.37Å; F332-A337 HydrophobicContact CD1-CB 4.35Å; T333-A337 PolarHBondContact O-N 3.06Å; P334-A337 PolarHBondContact O-N 3.27Å; A337-F340 PolarHBondContact O-N 3.09Å; A337-I341 WeakPolarHBondContact O-CG1 3.48Å; A337-I341 PolarHBondContact O-N 3.14Å; A337-L370 HydrophobicContact CB-CD2 4.3Å
338	V	98.4	Very high	96.3	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-61.9	-48.2	176.5	164.3	0	0	0	0	111.3	I240 C242 A253 F320 P334 E335 F340 I341 L342	I240-V338 HydrophobicContact CG2-CG2 4.08Å; C242-V338 HydrophobicContact CB-CG1 3.97Å; C242-V338 HydrophobicContact CB-CG2 4.33Å; C242-V338 VanDerWaalsContact SG-CG1 3.59Å; A253-V338 HydrophobicContact CB-CB 4.26Å; A253-V338 HydrophobicContact CB-CG2 3.76Å; F320-V338 HydrophobicContact CE2-CG2 4.28Å; F320-V338 HydrophobicContact CZ-CB 4.44Å; F320-V338 HydrophobicContact CZ-CG1 4.09Å; F320-V338 HydrophobicContact CZ-CG2 4.38Å; P334-V338 WeakPolarHBondContact O-CG2 3.47Å; P334-V338 PolarHBondContact O-N 3.24Å; E335-V338 PolarHBondContact O-N 2.96Å; V338-F340 VanDerWaalsContact C-N 3.3Å; V338-F340 PolarHBondContact O-N 2.69Å; V338-I341 PolarHBondContact O-N 3.02Å; V338-L342 HydrophobicContact CG1-CD1 3.88Å; V338-L342 WeakPolarHBondContact O-CG 3.33Å; V338-L342 PolarHBondContact O-N 3.22Å
339	N	98.1	Very high	95.7	Very high	91 Å²	91	57.9 Å²	57.9	49%	0.487	29%	0.287	S	S	.	.	H	α-helix	trans	-63.1	-37.7	178.7	-71.5	-31.3	0	0	0	112.1	E335 E336 L342 S343	E335-N339 WeakPolarHBondContact O-CB 3.26Å; E335-N339 VanDerWaalsContact O-CG 3.24Å; E335-N339 PolarHBondContact O-N 3.11Å; E335-N339 PolarHBondContact O-ND2 3.43Å; E335-N339 VanDerWaalsContact O-ND2 3.1Å; E336-N339 PolarHBondContact O-N 3.47Å; N339-L342 PolarHBondContact O-N 3.15Å; N339-S343 PolarHBondContact O-N 3.41Å
340	F	98.3	Very high	95	Very high	50 Å²	50	58.1 Å²	58.1	22%	0.219	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-45.9	175.3	-171.2	-81.8	0	0	0	111.6	E336 A337 V338 S343 C344 R369 L370 K373	E336-F340 VanDerWaalsContact O-CB 3.29Å; E336-F340 WeakPolarHBondContact O-CB 3.24Å; E336-F340 PolarHBondContact O-N 3.5Å; A337-F340 PolarHBondContact O-N 3.09Å; V338-F340 VanDerWaalsContact C-N 3.3Å; V338-F340 PolarHBondContact O-N 2.69Å; F340-S343 PolarHBondContact O-N 2.81Å; F340-S343 PolarHBondContact O-OG 2.98Å; F340-C344 VanDerWaalsContact CE1-SG 3.6Å; F340-C344 PolarHBondContact O-N 3.2Å; F340-C344 VanDerWaalsContact O-N 3.15Å; F340-C344 PolarHBondContact O-SG 2.97Å; F340-C344 VanDerWaalsContact O-SG 3.34Å; F340-R369 HydrophobicContact CE1-CB 3.79Å; F340-R369 HydrophobicContact CZ-CB 4.02Å; F340-L370 HydrophobicContact CB-CD1 4.32Å; F340-L370 HydrophobicContact CD1-CB 3.97Å; F340-L370 HydrophobicContact CD1-CD1 3.84Å; F340-L370 HydrophobicContact CD1-CG 4.44Å; F340-L370 HydrophobicContact CE1-CB 4.03Å; F340-L370 HydrophobicContact CE1-CD1 4.41Å; F340-L370 HydrophobicContact CG-CD1 4.1Å; F340-K373 HydrophobicContact CE2-CB 4.27Å; F340-K373 HydrophobicContact CE2-CG 4.04Å; F340-K373 HydrophobicContact CZ-CB 4.15Å; F340-K373 HydrophobicContact CZ-CG 4.41Å
341	I	98.3	Very high	94.1	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-47.9	176.8	-67.8	162.2	0	0	0	110	F320 L322 A337 V338 S343 C344 L345 A366 L370 V387	F320-I341 HydrophobicContact CD1-CG2 4.19Å; F320-I341 HydrophobicContact CD2-CD1 4.47Å; F320-I341 HydrophobicContact CD2-CG2 4.38Å; F320-I341 HydrophobicContact CE1-CB 4.27Å; F320-I341 HydrophobicContact CE1-CG2 3.64Å; F320-I341 HydrophobicContact CE2-CB 4.14Å; F320-I341 HydrophobicContact CE2-CD1 3.68Å; F320-I341 HydrophobicContact CE2-CG2 3.87Å; F320-I341 HydrophobicContact CZ-CB 3.69Å; F320-I341 HydrophobicContact CZ-CD1 4.11Å; F320-I341 HydrophobicContact CZ-CG2 3.47Å; F320-I341 VanDerWaalsContact CZ-CG2 3.47Å; L322-I341 HydrophobicContact CB-CD1 4.41Å; L322-I341 HydrophobicContact CD1-CD1 4.18Å; L322-I341 HydrophobicContact CD2-CD1 4.09Å; L322-I341 HydrophobicContact CG-CD1 4.46Å; A337-I341 WeakPolarHBondContact O-CG1 3.48Å; A337-I341 PolarHBondContact O-N 3.14Å; V338-I341 PolarHBondContact O-N 3.02Å; I341-S343 VanDerWaalsContact C-N 3.33Å; I341-S343 PolarHBondContact O-N 3.36Å; I341-C344 WeakPolarHBondContact O-CA 3.38Å; I341-C344 WeakPolarHBondContact O-CB 3.34Å; I341-C344 PolarHBondContact O-N 3.03Å; I341-L345 HydrophobicContact CG2-CD1 4.02Å; I341-L345 HydrophobicContact CG2-CG 4.27Å; I341-L345 WeakPolarHBondContact O-CG 3.35Å; I341-L345 PolarHBondContact O-N 3.37Å; I341-A366 HydrophobicContact CG2-CB 4.23Å; I341-L370 HydrophobicContact CD1-CD2 3.83Å; I341-L370 HydrophobicContact CG1-CD2 3.85Å; I341-V387 HydrophobicContact CD1-CG2 3.78Å; I341-V387 HydrophobicContact CG1-CG2 4.39Å
342	L	97.6	Very high	93.1	Very high	19 Å²	19	63.2 Å²	63.2	10%	0.099	32%	0.316	C	S	.	.	H	α-helix	trans	-55.8	-46.2	177.9	-70.9	165.1	0	0	0	111.8	H251 F320 V338 N339 C344 L345 E346	H251-L342 HydrophobicContact CB-CD1 3.45Å; H251-L342 VanDerWaalsContact CB-CD1 3.45Å; H251-L342 VanDerWaalsContact CG-CD1 3.44Å; F320-L342 HydrophobicContact CE1-CD2 3.86Å; F320-L342 HydrophobicContact CE1-CG 4.03Å; F320-L342 HydrophobicContact CZ-CG 4.41Å; V338-L342 HydrophobicContact CG1-CD1 3.88Å; V338-L342 WeakPolarHBondContact O-CG 3.33Å; V338-L342 PolarHBondContact O-N 3.22Å; N339-L342 PolarHBondContact O-N 3.15Å; L342-C344 PolarHBondContact O-N 2.98Å; L342-L345 PolarHBondContact O-N 3.13Å; L342-E346 PolarHBondContact O-N 3.45Å; L342-E346 VanDerWaalsContact O-N 3.1Å
343	S	96.6	Very high	91.9	Very high	61 Å²	61	72.4 Å²	72.4	43%	0.427	35%	0.35	S	S	.	.	H	α-helix	trans	-60.4	-32.7	177	76.4	0	0	0	0	113	N339 F340 I341 D347	N339-S343 PolarHBondContact O-N 3.41Å; F340-S343 PolarHBondContact O-N 2.81Å; F340-S343 PolarHBondContact O-OG 2.98Å; I341-S343 VanDerWaalsContact C-N 3.33Å; I341-S343 PolarHBondContact O-N 3.36Å; S343-D347 PolarHBondContact O-N 3.24Å
344	C	95.2	Very high	90.6	Very high	4 Å²	4	79.1 Å²	79.1	3%	0.027	38%	0.378	C	S	.	.	H	α-helix	trans	-74.3	-31	175.7	-67	0	0	0	0	112.3	F340 I341 L342 E346 D347 I350 A366	F340-C344 VanDerWaalsContact CE1-SG 3.6Å; F340-C344 PolarHBondContact O-N 3.2Å; F340-C344 VanDerWaalsContact O-N 3.15Å; F340-C344 PolarHBondContact O-SG 2.97Å; F340-C344 VanDerWaalsContact O-SG 3.34Å; I341-C344 WeakPolarHBondContact O-CA 3.38Å; I341-C344 WeakPolarHBondContact O-CB 3.34Å; I341-C344 PolarHBondContact O-N 3.03Å; L342-C344 PolarHBondContact O-N 2.98Å; C344-E346 VanDerWaalsContact C-N 3.32Å; C344-D347 PolarHBondContact O-N 3.32Å; C344-I350 WeakPolarHBondContact O-CD1 3.37Å; C344-A366 HydrophobicContact CB-CB 3.66Å
345	L	94.6	Very high	89.3	Confident	28 Å²	28	82.2 Å²	82.2	15%	0.147	41%	0.414	C	S	.	.	H	α-helix	trans	-75.3	-22.8	177.4	-62.9	178.5	0	0	0	112.7	F320 I341 L342 R362 Y363	F320-L345 HydrophobicContact CD1-CD1 4.19Å; F320-L345 HydrophobicContact CE1-CD1 4.28Å; I341-L345 HydrophobicContact CG2-CD1 4.02Å; I341-L345 HydrophobicContact CG2-CG 4.27Å; I341-L345 WeakPolarHBondContact O-CG 3.35Å; I341-L345 PolarHBondContact O-N 3.37Å; L342-L345 PolarHBondContact O-N 3.13Å; L345-R362 HydrophobicContact CD2-CB 4.01Å; L345-R362 VanDerWaalsContact O-CD 3.29Å; L345-R362 WeakPolarHBondContact O-CD 3.44Å; L345-R362 PolarHBondContact O-NH1 2.93Å; L345-Y363 HydrophobicContact CD1-CE1 3.86Å; L345-Y363 HydrophobicContact CD1-CE2 4.31Å; L345-Y363 HydrophobicContact CD2-CD1 3.91Å; L345-Y363 HydrophobicContact CD2-CD2 3.72Å; L345-Y363 HydrophobicContact CD2-CE1 3.95Å; L345-Y363 HydrophobicContact CD2-CE2 3.73Å; L345-Y363 HydrophobicContact CD2-CG 3.79Å
346	E	92.8	Very high	88.4	Confident	141 Å²	141	81.5 Å²	81.5	66%	0.659	41%	0.41	S	S	*	.	H	α-helix	trans	-87.5	-14.4	175.1	-68.1	170.3	-175	0	0	112.9	L342 C344 E348	L342-E346 PolarHBondContact O-N 3.45Å; L342-E346 VanDerWaalsContact O-N 3.1Å; C344-E346 VanDerWaalsContact C-N 3.32Å; E346-E348 PolarHBondContact O-N 2.75Å; E346-E348 VanDerWaalsContact O-N 3.08Å
347	D	90.5	Very high	87.9	Confident	39 Å²	39	80.3 Å²	80.3	21%	0.209	41%	0.411	C	S	.	.			trans	-74.1	99.5	-178.4	-175.5	5.7	0	0	0	112.1	S343 C344 K349 I350 R369	S343-D347 PolarHBondContact O-N 3.24Å; C344-D347 PolarHBondContact O-N 3.32Å; D347-K349 PolarHBondContact O-N 2.77Å; D347-K349 VanDerWaalsContact OD1-CB 3.27Å; D347-K349 WeakPolarHBondContact OD1-CB 3.43Å; D347-K349 PolarHBondContact OD1-N 2.85Å; D347-I350 HydrophobicContact CB-CD1 3.86Å; D347-I350 HydrophobicContact CB-CG1 4.12Å; D347-I350 PolarHBondContact O-N 3.44Å; D347-R369 IonicContact OD2-CZ 3.49Å; D347-R369 IonicContact OD2-NH1 2.74Å; D347-R369 PolarHBondContact OD2-NH1 3.28Å; D347-R369 IonicContact OD2-NH2 3.2Å; D347-R369 PolarHBondContact OD2-NH2 3.5Å
348	E	83.8	Confident	87.5	Confident	164 Å²	164	82.3 Å²	82.3	77%	0.766	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-13.9	177.7	-58.7	-167.6	150.7	0	0	113.9	E346 I350	E346-E348 PolarHBondContact O-N 2.75Å; E346-E348 VanDerWaalsContact O-N 3.08Å; E348-I350 PolarHBondContact O-N 3.32Å
349	K	85.1	Confident	87.1	Confident	185 Å²	185	84.7 Å²	84.7	80%	0.804	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-8	-179.8	-56.7	176.6	-178.6	175.1	0	112.7	D347 Q351	D347-K349 PolarHBondContact O-N 2.77Å; D347-K349 VanDerWaalsContact OD1-CB 3.27Å; D347-K349 WeakPolarHBondContact OD1-CB 3.43Å; D347-K349 PolarHBondContact OD1-N 2.85Å; K349-Q351 PolarHBondContact O-N 2.69Å
350	I	83.4	Confident	86.9	Confident	20 Å²	20	81.5 Å²	81.5	10%	0.103	43%	0.425	C	S	.	.	S	Bend	trans	-66.3	107.3	177	-66.2	169.1	0	0	0	108.8	C344 D347 E348 T352 A361 R362 A365	C344-I350 WeakPolarHBondContact O-CD1 3.37Å; D347-I350 HydrophobicContact CB-CD1 3.86Å; D347-I350 HydrophobicContact CB-CG1 4.12Å; D347-I350 PolarHBondContact O-N 3.44Å; E348-I350 PolarHBondContact O-N 3.32Å; I350-T352 PolarHBondContact O-N 3.43Å; I350-A361 HydrophobicContact CG2-CB 4.48Å; I350-R362 HydrophobicContact CB-CG 4.4Å; I350-R362 HydrophobicContact CD1-CG 4.2Å; I350-R362 HydrophobicContact CG2-CG 4.49Å; I350-A365 HydrophobicContact CD1-CB 3.84Å; I350-A365 HydrophobicContact CG1-CB 4.38Å; I350-A365 HydrophobicContact CG2-CB 3.87Å
351	Q	76.3	Confident	86.7	Confident	181 Å²	181	79.6 Å²	79.6	85%	0.846	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-62.9	133.8	-179.5	-65.7	-176.5	6.4	0	0	110.8	K349	K349-Q351 PolarHBondContact O-N 2.69Å
352	T	76.8	Confident	86.6	Confident	67 Å²	67	82.7 Å²	82.7	41%	0.411	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-89	128.6	175.5	-54.7	0	0	0	0	108.5	I350 K356	I350-T352 PolarHBondContact O-N 3.43Å; T352-K356 WeakPolarHBondContact CG2-O 3.46Å
353	R	73.6	Confident	86.5	Confident	198 Å²	198	82.6 Å²	82.6	75%	0.747	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-74.5	149	170.6	-65.3	-177	-178	179	0.8	109.4	G355 K356	R353-G355 PolarHBondContact O-N 2.97Å; R353-K356 PolarHBondContact O-N 3.45Å
354	E	69.6	Low	86.5	Confident	203 Å²	203	82.6 Å²	82.6	95%	0.949	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	128.7	176.7	-71	-177.1	162.8	0	0	111.1
355	G	71	Confident	86.6	Confident	91 Å²	91	83.3 Å²	83.3	94%	0.938	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	-0.6	177.5	0	0	0	0	0	117.1	R353	R353-G355 PolarHBondContact O-N 2.97Å
356	K	80.3	Confident	86.8	Confident	83 Å²	83	82 Å²	82	36%	0.361	42%	0.421	S	S	.	.	S	Bend	trans	-106.4	147.5	174.2	-69.1	-166.8	-178	-168.5	0	112.5	T352 R353 E364	T352-K356 WeakPolarHBondContact CG2-O 3.46Å; R353-K356 PolarHBondContact O-N 3.45Å; K356-E364 IonicContact NZ-OE1 3.84Å; K356-E364 PolarHBondContact NZ-OE1 3.45Å; K356-E364 IonicContact NZ-OE2 2.98Å; K356-E364 PolarHBondContact NZ-OE2 2.89Å
357	S	88.1	Confident	87	Confident	60 Å²	60	75.3 Å²	75.3	42%	0.42	39%	0.389	S	S	.	.			trans	-65.9	141.1	168.8	178.7	0	0	0	0	109.9	V359 D360 A361	S357-V359 PolarHBondContact O-N 3.07Å; S357-V359 VanDerWaalsContact O-N 3.15Å; S357-V359 PolarHBondContact OG-N 3.47Å; S357-D360 WeakPolarHBondContact O-CB 3.48Å; S357-D360 PolarHBondContact O-N 3.26Å; S357-A361 PolarHBondContact O-N 3.1Å; S357-A361 VanDerWaalsContact O-N 3.07Å
358	A	88.9	Confident	87.4	Confident	42 Å²	42	76.3 Å²	76.3	35%	0.347	40%	0.395	S	S	.	.	H	α-helix	trans	-54.3	-33.9	174.1	0	0	0	0	0	112.1	A361 R362	A358-A361 PolarHBondContact O-N 2.88Å; A358-R362 VanDerWaalsContact O-CG 3.3Å; A358-R362 WeakPolarHBondContact O-CG 3.41Å; A358-R362 PolarHBondContact O-N 3.28Å; A358-R362 VanDerWaalsContact O-N 3.13Å
359	V	91.1	Very high	88.1	Confident	51 Å²	51	73.2 Å²	73.2	31%	0.309	38%	0.376	S	S	.	.	H	α-helix	trans	-67.3	-44.1	177.7	-172.5	0	0	0	0	111.1	S357 A361 R362 Y363 R389	S357-V359 PolarHBondContact O-N 3.07Å; S357-V359 VanDerWaalsContact O-N 3.15Å; S357-V359 PolarHBondContact OG-N 3.47Å; V359-A361 VanDerWaalsContact C-N 3.31Å; V359-A361 PolarHBondContact O-N 3.44Å; V359-R362 PolarHBondContact O-N 2.99Å; V359-Y363 HydrophobicContact CG1-CD2 3.84Å; V359-Y363 HydrophobicContact CG1-CE2 3.74Å; V359-Y363 WeakPolarHBondContact O-CD2 2.88Å; V359-Y363 PolarHBondContact O-N 2.83Å; V359-Y363 VanDerWaalsContact O-N 3.12Å; V359-R389 VanDerWaalsContact CG1-CZ 3.47Å
360	D	93.4	Very high	88.7	Confident	24 Å²	24	64.4 Å²	64.4	13%	0.128	34%	0.338	C	S	.	.	H	α-helix	trans	-60.7	-44	177.6	-64	-13	0	0	0	110.6	K108 Y110 S357 R362 Y363 E364	K108-D360 IonicContact NZ-OD1 2.71Å; K108-D360 PolarHBondContact NZ-OD1 3.35Å; K108-D360 IonicContact NZ-OD2 3.91Å; K108-D360 PolarHBondContact NZ-OD2 3.24Å; Y110-D360 HydrophobicContact CE1-CB 4.03Å; Y110-D360 PolarHBondContact OH-OD1 3.36Å; S357-D360 WeakPolarHBondContact O-CB 3.48Å; S357-D360 PolarHBondContact O-N 3.26Å; D360-R362 VanDerWaalsContact C-N 3.28Å; D360-R362 PolarHBondContact O-N 2.92Å; D360-Y363 PolarHBondContact O-N 3.48Å; D360-E364 WeakPolarHBondContact O-CG 3.49Å; D360-E364 PolarHBondContact O-N 3.37Å
361	A	93.9	Very high	89.4	Confident	10 Å²	10	63.5 Å²	63.5	8%	0.083	33%	0.333	C	S	.	.	H	α-helix	trans	-59.1	-38.7	177.6	0	0	0	0	0	112.3	I350 S357 A358 V359 A365	I350-A361 HydrophobicContact CG2-CB 4.48Å; S357-A361 PolarHBondContact O-N 3.1Å; S357-A361 VanDerWaalsContact O-N 3.07Å; A358-A361 PolarHBondContact O-N 2.88Å; V359-A361 VanDerWaalsContact C-N 3.31Å; V359-A361 PolarHBondContact O-N 3.44Å; A361-A365 VanDerWaalsContact O-CB 3.23Å; A361-A365 WeakPolarHBondContact O-CB 3.35Å; A361-A365 PolarHBondContact O-N 3.28Å
362	R	95.6	Very high	90.5	Very high	65 Å²	65	58 Å²	58	25%	0.245	31%	0.31	C	S	.	.	H	α-helix	trans	-68.5	-41.6	177.6	-69.3	175.3	-172.4	-176.1	5	112.8	L345 I350 A358 V359 D360 A365 A366	L345-R362 HydrophobicContact CD2-CB 4.01Å; L345-R362 VanDerWaalsContact O-CD 3.29Å; L345-R362 WeakPolarHBondContact O-CD 3.44Å; L345-R362 PolarHBondContact O-NH1 2.93Å; I350-R362 HydrophobicContact CB-CG 4.4Å; I350-R362 HydrophobicContact CD1-CG 4.2Å; I350-R362 HydrophobicContact CG2-CG 4.49Å; A358-R362 VanDerWaalsContact O-CG 3.3Å; A358-R362 WeakPolarHBondContact O-CG 3.41Å; A358-R362 PolarHBondContact O-N 3.28Å; A358-R362 VanDerWaalsContact O-N 3.13Å; V359-R362 PolarHBondContact O-N 2.99Å; D360-R362 VanDerWaalsContact C-N 3.28Å; D360-R362 PolarHBondContact O-N 2.92Å; R362-A365 PolarHBondContact O-N 3.29Å; R362-A366 WeakPolarHBondContact O-CB 3.25Å; R362-A366 PolarHBondContact O-N 2.8Å
363	Y	96.9	Very high	91.5	Very high	18 Å²	18	58.5 Å²	58.5	7%	0.071	31%	0.306	C	S	.	.	H	α-helix	trans	-67.8	-40.3	176	-84.1	-83.5	0	0	0	112.5	Y110 F320 L345 V359 D360 A365 A366 C367 V387 R389	Y110-Y363 HydrophobicContact CD2-CD1 4.02Å; Y110-Y363 AromaticContact CD2-CG 3.8Å; Y110-Y363 HydrophobicContact CD2-CG 3.8Å; Y110-Y363 HydrophobicContact CE2-CD1 4.18Å; Y110-Y363 HydrophobicContact CE2-CD2 4.13Å; Y110-Y363 AromaticContact CE2-CG 3.69Å; Y110-Y363 HydrophobicContact CE2-CG 3.69Å; Y110-Y363 HydrophobicContact CG-CG 4.48Å; F320-Y363 HydrophobicContact CB-CE1 4.14Å; L345-Y363 HydrophobicContact CD1-CE1 3.86Å; L345-Y363 HydrophobicContact CD1-CE2 4.31Å; L345-Y363 HydrophobicContact CD2-CD1 3.91Å; L345-Y363 HydrophobicContact CD2-CD2 3.72Å; L345-Y363 HydrophobicContact CD2-CE1 3.95Å; L345-Y363 HydrophobicContact CD2-CE2 3.73Å; L345-Y363 HydrophobicContact CD2-CG 3.79Å; V359-Y363 HydrophobicContact CG1-CD2 3.84Å; V359-Y363 HydrophobicContact CG1-CE2 3.74Å; V359-Y363 WeakPolarHBondContact O-CD2 2.88Å; V359-Y363 PolarHBondContact O-N 2.83Å; V359-Y363 VanDerWaalsContact O-N 3.12Å; D360-Y363 PolarHBondContact O-N 3.48Å; Y363-A365 VanDerWaalsContact C-N 3.35Å; Y363-A366 PolarHBondContact O-N 3.13Å; Y363-C367 PolarHBondContact O-N 2.82Å; Y363-C367 PolarHBondContact O-SG 3Å; Y363-V387 HydrophobicContact CD1-CB 4.3Å; Y363-V387 HydrophobicContact CD1-CG1 3.57Å; Y363-V387 HydrophobicContact CE1-CG1 3.65Å; Y363-R389 HydrophobicContact CD1-CB 4.3Å; Y363-R389 HydrophobicContact CD2-CB 4.31Å; Y363-R389 HydrophobicContact CD2-CG 4.42Å; Y363-R389 HydrophobicContact CE1-CB 3.86Å; Y363-R389 HydrophobicContact CE1-CG 4.38Å; Y363-R389 HydrophobicContact CE2-CB 3.91Å; Y363-R389 HydrophobicContact CE2-CG 3.69Å
364	E	96.4	Very high	92.7	Very high	61 Å²	61	49 Å²	49	29%	0.285	27%	0.27	S	S	.	.	H	α-helix	trans	-60.9	-44.8	173	-72	178.8	-176.4	0	0	111.3	Y110 K356 D360 N368	Y110-E364 HydrophobicContact CD1-CG 3.73Å; Y110-E364 HydrophobicContact CE1-CG 4.34Å; K356-E364 IonicContact NZ-OE1 3.84Å; K356-E364 PolarHBondContact NZ-OE1 3.45Å; K356-E364 IonicContact NZ-OE2 2.98Å; K356-E364 PolarHBondContact NZ-OE2 2.89Å; D360-E364 WeakPolarHBondContact O-CG 3.49Å; D360-E364 PolarHBondContact O-N 3.37Å; E364-N368 WeakPolarHBondContact O-CB 3.39Å; E364-N368 PolarHBondContact O-N 3.15Å; E364-N368 VanDerWaalsContact O-N 3.09Å; E364-N368 PolarHBondContact O-ND2 3.25Å
365	A	96.6	Very high	94	Very high	19 Å²	19	41.7 Å²	41.7	16%	0.157	24%	0.239	C	C	.	.	H	α-helix	trans	-64.5	-40.8	176.3	0	0	0	0	0	111.9	I350 A361 R362 Y363 N368 R369	I350-A365 HydrophobicContact CD1-CB 3.84Å; I350-A365 HydrophobicContact CG1-CB 4.38Å; I350-A365 HydrophobicContact CG2-CB 3.87Å; A361-A365 VanDerWaalsContact O-CB 3.23Å; A361-A365 WeakPolarHBondContact O-CB 3.35Å; A361-A365 PolarHBondContact O-N 3.28Å; R362-A365 PolarHBondContact O-N 3.29Å; Y363-A365 VanDerWaalsContact C-N 3.35Å; A365-N368 PolarHBondContact O-N 3.49Å; A365-R369 VanDerWaalsContact O-CB 3.25Å; A365-R369 WeakPolarHBondContact O-CB 3.41Å; A365-R369 VanDerWaalsContact O-CG 3.24Å; A365-R369 WeakPolarHBondContact O-CG 3.45Å; A365-R369 PolarHBondContact O-N 3.07Å
366	A	98.1	Very high	95.3	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.8	-48.1	177.5	0	0	0	0	0	111.6	I341 C344 R362 Y363 N368 R369 L370	I341-A366 HydrophobicContact CG2-CB 4.23Å; C344-A366 HydrophobicContact CB-CB 3.66Å; R362-A366 WeakPolarHBondContact O-CB 3.25Å; R362-A366 PolarHBondContact O-N 2.8Å; Y363-A366 PolarHBondContact O-N 3.13Å; A366-N368 PolarHBondContact O-N 3.39Å; A366-R369 PolarHBondContact O-N 3.47Å; A366-L370 VanDerWaalsContact O-CB 3.23Å; A366-L370 WeakPolarHBondContact O-CB 3.4Å; A366-L370 PolarHBondContact O-N 3.28Å
367	C	98.4	Very high	96.1	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.6	-48.8	176.3	-60.1	0	0	0	0	111	A112 Y363 L370 A371 V385 V387	A112-C367 VanDerWaalsContact CB-C 3.43Å; A112-C367 HydrophobicContact CB-CB 3.69Å; Y363-C367 PolarHBondContact O-N 2.82Å; Y363-C367 PolarHBondContact O-SG 3Å; C367-L370 PolarHBondContact O-N 2.79Å; C367-A371 WeakPolarHBondContact O-CB 3.06Å; C367-A371 PolarHBondContact O-N 3.24Å; C367-V385 HydrophobicContact CB-CG1 4.48Å; C367-V387 VanDerWaalsContact SG-CG2 3.57Å
368	N	98.2	Very high	96.5	Very high	60 Å²	60	44.7 Å²	44.7	32%	0.321	23%	0.233	S	C	.	.	H	α-helix	trans	-63.4	-44.7	-178.6	-85.1	-71.3	0	0	0	113.1	A112 R114 E364 A365 A366 N372	A112-N368 HydrophobicContact CB-CB 4.38Å; R114-N368 PolarHBondContact NH1-OD1 2.89Å; R114-N368 PolarHBondContact NH2-O 3Å; R114-N368 PolarHBondContact NH2-OD1 2.74Å; E364-N368 WeakPolarHBondContact O-CB 3.39Å; E364-N368 PolarHBondContact O-N 3.15Å; E364-N368 VanDerWaalsContact O-N 3.09Å; E364-N368 PolarHBondContact O-ND2 3.25Å; A365-N368 PolarHBondContact O-N 3.49Å; A366-N368 PolarHBondContact O-N 3.39Å; N368-N372 VanDerWaalsContact O-CB 3.28Å; N368-N372 WeakPolarHBondContact O-CB 3.29Å; N368-N372 PolarHBondContact O-N 2.67Å; N368-N372 PolarHBondContact O-ND2 2.86Å
369	R	98.1	Very high	96.9	Very high	100 Å²	100	42.9 Å²	42.9	38%	0.377	22%	0.218	S	C	.	.	H	α-helix	trans	-67.4	-40.7	179.2	-73.1	177.3	177.4	-172.9	1.9	110.9	F340 D347 A365 A366 N372 K373	F340-R369 HydrophobicContact CE1-CB 3.79Å; F340-R369 HydrophobicContact CZ-CB 4.02Å; D347-R369 IonicContact OD2-CZ 3.49Å; D347-R369 IonicContact OD2-NH1 2.74Å; D347-R369 PolarHBondContact OD2-NH1 3.28Å; D347-R369 IonicContact OD2-NH2 3.2Å; D347-R369 PolarHBondContact OD2-NH2 3.5Å; A365-R369 VanDerWaalsContact O-CB 3.25Å; A365-R369 WeakPolarHBondContact O-CB 3.41Å; A365-R369 VanDerWaalsContact O-CG 3.24Å; A365-R369 WeakPolarHBondContact O-CG 3.45Å; A365-R369 PolarHBondContact O-N 3.07Å; A366-R369 PolarHBondContact O-N 3.47Å; R369-N372 PolarHBondContact O-N 2.84Å; R369-K373 VanDerWaalsContact O-CB 3.25Å; R369-K373 WeakPolarHBondContact O-CB 3.3Å; R369-K373 PolarHBondContact O-N 3.22Å
370	L	98.6	Very high	97	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.4	-47.6	179	-177.3	57.2	0	0	0	111.5	L328 F332 A337 F340 I341 A366 C367 N372 K373 A374 V385	L328-L370 HydrophobicContact CD1-CD1 3.94Å; L328-L370 HydrophobicContact CD1-CD2 4.31Å; L328-L370 HydrophobicContact CD1-CG 3.83Å; L328-L370 HydrophobicContact CD2-CD2 4.16Å; F332-L370 HydrophobicContact CD1-CD1 4.22Å; F332-L370 HydrophobicContact CD2-CD1 4.31Å; F332-L370 HydrophobicContact CE1-CD1 3.82Å; F332-L370 HydrophobicContact CE2-CD1 3.93Å; F332-L370 HydrophobicContact CG-CD1 4.45Å; F332-L370 HydrophobicContact CZ-CD1 3.67Å; A337-L370 HydrophobicContact CB-CD2 4.3Å; F340-L370 HydrophobicContact CB-CD1 4.32Å; F340-L370 HydrophobicContact CD1-CB 3.97Å; F340-L370 HydrophobicContact CD1-CD1 3.84Å; F340-L370 HydrophobicContact CD1-CG 4.44Å; F340-L370 HydrophobicContact CE1-CB 4.03Å; F340-L370 HydrophobicContact CE1-CD1 4.41Å; F340-L370 HydrophobicContact CG-CD1 4.1Å; I341-L370 HydrophobicContact CD1-CD2 3.83Å; I341-L370 HydrophobicContact CG1-CD2 3.85Å; A366-L370 VanDerWaalsContact O-CB 3.23Å; A366-L370 WeakPolarHBondContact O-CB 3.4Å; A366-L370 PolarHBondContact O-N 3.28Å; C367-L370 PolarHBondContact O-N 2.79Å; L370-N372 PolarHBondContact O-N 3.05Å; L370-K373 PolarHBondContact O-N 2.91Å; L370-K373 VanDerWaalsContact O-N 3.13Å; L370-A374 PolarHBondContact O-N 2.76Å; L370-V385 HydrophobicContact CB-CG1 4.39Å; L370-V385 HydrophobicContact CD2-CG1 3.81Å; L370-V385 HydrophobicContact CG-CG1 4.29Å; L370-V385 HydrophobicContact CG-CG2 4.41Å
371	A	98.5	Very high	97.2	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.2	-43.5	176.4	0	0	0	0	0	111.9	A112 R114 C367 K373 A374 V375 V383 V385	A112-A371 HydrophobicContact CB-CB 4.27Å; R114-A371 HydrophobicContact CG-CB 3.89Å; C367-A371 WeakPolarHBondContact O-CB 3.06Å; C367-A371 PolarHBondContact O-N 3.24Å; A371-K373 VanDerWaalsContact C-N 3.32Å; A371-K373 PolarHBondContact O-N 3.3Å; A371-A374 WeakPolarHBondContact O-CB 3.33Å; A371-A374 PolarHBondContact O-N 2.68Å; A371-V375 PolarHBondContact O-N 2.74Å; A371-V383 HydrophobicContact CB-CG1 4.2Å; A371-V385 HydrophobicContact CB-CB 4.41Å; A371-V385 HydrophobicContact CB-CG2 3.91Å
372	N	98.2	Very high	97.4	Very high	66 Å²	66	41.5 Å²	41.5	35%	0.353	21%	0.214	S	C	.	.	H	α-helix	trans	-59.8	-42.7	172.9	-80.5	-23.6	0	0	0	112.2	R114 N368 R369 L370 A374 V375 Q376	R114-N372 PolarHBondContact NE-OD1 3.31Å; R114-N372 PolarHBondContact NH2-ND2 2.7Å; R114-N372 PolarHBondContact NH2-OD1 3.24Å; R114-N372 VanDerWaalsContact NH2-OD1 3.15Å; N368-N372 VanDerWaalsContact O-CB 3.28Å; N368-N372 WeakPolarHBondContact O-CB 3.29Å; N368-N372 PolarHBondContact O-N 2.67Å; N368-N372 PolarHBondContact O-ND2 2.86Å; R369-N372 PolarHBondContact O-N 2.84Å; L370-N372 PolarHBondContact O-N 3.05Å; N372-A374 VanDerWaalsContact C-N 3.29Å; N372-A374 PolarHBondContact O-N 3.1Å; N372-V375 PolarHBondContact O-N 3.45Å; N372-Q376 WeakPolarHBondContact O-CG 3.33Å; N372-Q376 PolarHBondContact O-N 3.1Å
373	K	98.4	Very high	97.6	Very high	77 Å²	77	38.4 Å²	38.4	34%	0.335	20%	0.202	S	C	.	.	H	α-helix	trans	-67.3	-32.7	-178	-168.8	60.3	174.3	177.2	0	111.5	F332 F340 R369 L370 A371 Q376 R377	F332-K373 HydrophobicContact CE2-CB 4.31Å; F332-K373 HydrophobicContact CE2-CG 4.2Å; F332-K373 HydrophobicContact CZ-CB 4.05Å; F332-K373 HydrophobicContact CZ-CG 3.67Å; F340-K373 HydrophobicContact CE2-CB 4.27Å; F340-K373 HydrophobicContact CE2-CG 4.04Å; F340-K373 HydrophobicContact CZ-CB 4.15Å; F340-K373 HydrophobicContact CZ-CG 4.41Å; R369-K373 VanDerWaalsContact O-CB 3.25Å; R369-K373 WeakPolarHBondContact O-CB 3.3Å; R369-K373 PolarHBondContact O-N 3.22Å; L370-K373 PolarHBondContact O-N 2.91Å; L370-K373 VanDerWaalsContact O-N 3.13Å; A371-K373 VanDerWaalsContact C-N 3.32Å; A371-K373 PolarHBondContact O-N 3.3Å; K373-Q376 HydrophobicContact CD-CB 4.45Å; K373-Q376 PolarHBondContact O-N 3.47Å; K373-R377 WeakPolarHBondContact O-CB 3.46Å; K373-R377 WeakPolarHBondContact O-CG 3.47Å; K373-R377 PolarHBondContact O-N 3.44Å
374	A	98.3	Very high	97.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.9	-47.5	173.5	0	0	0	0	0	111.5	L328 V331 F332 L370 A371 N372 Q376 R377 G378 S379 V383	L328-A374 HydrophobicContact CD1-CB 3.93Å; V331-A374 HydrophobicContact CG2-CB 3.86Å; F332-A374 HydrophobicContact CD2-CB 4.36Å; F332-A374 HydrophobicContact CE2-CB 4.22Å; L370-A374 PolarHBondContact O-N 2.76Å; A371-A374 WeakPolarHBondContact O-CB 3.33Å; A371-A374 PolarHBondContact O-N 2.68Å; N372-A374 VanDerWaalsContact C-N 3.29Å; N372-A374 PolarHBondContact O-N 3.1Å; A374-Q376 VanDerWaalsContact C-N 3.35Å; A374-Q376 PolarHBondContact O-N 2.94Å; A374-R377 PolarHBondContact O-N 3.33Å; A374-R377 VanDerWaalsContact O-N 3.1Å; A374-G378 PolarHBondContact O-N 3.25Å; A374-S379 VanDerWaalsContact O-CB 3.3Å; A374-S379 WeakPolarHBondContact O-CB 3.35Å; A374-S379 PolarHBondContact O-N 3.45Å; A374-S379 VanDerWaalsContact O-N 3.1Å; A374-V383 HydrophobicContact CB-CG1 3.97Å; A374-V383 HydrophobicContact CB-CG2 4.3Å
375	V	97.8	Very high	97.7	Very high	48 Å²	48	34.7 Å²	34.7	29%	0.291	19%	0.185	S	C	.	.	H	α-helix	trans	-60.9	-44.1	174.7	179.1	0	0	0	0	111	R114 A371 N372 R377 G378 V383	R114-V375 HydrophobicContact CB-CG2 3.91Å; R114-V375 HydrophobicContact CG-CG2 4.3Å; A371-V375 PolarHBondContact O-N 2.74Å; N372-V375 PolarHBondContact O-N 3.45Å; V375-R377 PolarHBondContact O-N 3.37Å; V375-G378 PolarHBondContact O-N 2.88Å; V375-V383 HydrophobicContact CG2-CG2 4.29Å
376	Q	97.5	Very high	97.9	Very high	141 Å²	141	33.8 Å²	33.8	66%	0.659	18%	0.178	S	C	*	.	H	α-helix	trans	-63.5	-25	176	-71	173.9	2.2	0	0	114	N372 K373 A374 G378	N372-Q376 WeakPolarHBondContact O-CG 3.33Å; N372-Q376 PolarHBondContact O-N 3.1Å; K373-Q376 HydrophobicContact CD-CB 4.45Å; K373-Q376 PolarHBondContact O-N 3.47Å; A374-Q376 VanDerWaalsContact C-N 3.35Å; A374-Q376 PolarHBondContact O-N 2.94Å; Q376-G378 PolarHBondContact O-N 2.86Å
377	R	97.6	Very high	97.9	Very high	104 Å²	104	33.8 Å²	33.8	39%	0.392	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	5.9	173.5	-75	-175.6	178.1	-163.6	-0.4	112.7	V331 F332 E336 K373 A374 V375	V331-R377 HydrophobicContact CB-CB 3.95Å; V331-R377 HydrophobicContact CG1-CB 4.48Å; V331-R377 HydrophobicContact CG2-CB 4.09Å; V331-R377 WeakPolarHBondContact O-CD 3.25Å; V331-R377 PolarHBondContact O-NH1 2.92Å; F332-R377 VanDerWaalsContact CE1-CZ 3.41Å; F332-R377 VanDerWaalsContact CZ-CZ 3.48Å; E336-R377 IonicContact OE2-CZ 3.47Å; E336-R377 IonicContact OE2-NH1 3.89Å; E336-R377 PolarHBondContact OE2-NH1 2.85Å; E336-R377 IonicContact OE2-NH2 3.28Å; K373-R377 WeakPolarHBondContact O-CB 3.46Å; K373-R377 WeakPolarHBondContact O-CG 3.47Å; K373-R377 PolarHBondContact O-N 3.44Å; A374-R377 PolarHBondContact O-N 3.33Å; A374-R377 VanDerWaalsContact O-N 3.1Å; V375-R377 PolarHBondContact O-N 3.37Å
378	G	96.3	Very high	97.9	Very high	52 Å²	52	33.8 Å²	33.8	54%	0.536	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	88	22.8	177.3	0	0	0	0	0	114.1	A374 V375 Q376 A380	A374-G378 PolarHBondContact O-N 3.25Å; V375-G378 PolarHBondContact O-N 2.88Å; Q376-G378 PolarHBondContact O-N 2.86Å; G378-A380 PolarHBondContact O-N 2.97Å; G378-A380 VanDerWaalsContact O-N 3.12Å
379	S	96.7	Very high	97.9	Very high	4 Å²	4	34.4 Å²	34.4	3%	0.028	18%	0.176	C	C	.	.			trans	-66	112.1	167.6	-174.9	0	0	0	0	109.6	G327 A374 D381	G327-S379 WeakPolarHBondContact O-CB 3.45Å; G327-S379 PolarHBondContact O-OG 3.48Å; A374-S379 VanDerWaalsContact O-CB 3.3Å; A374-S379 WeakPolarHBondContact O-CB 3.35Å; A374-S379 PolarHBondContact O-N 3.45Å; A374-S379 VanDerWaalsContact O-N 3.1Å; S379-D381 PolarHBondContact O-N 3.31Å
380	A	94.4	Very high	97.8	Very high	48 Å²	48	30 Å²	30	40%	0.397	16%	0.159	S	C	.	.			trans	-87.7	13.5	176	0	0	0	0	0	112.7	E117 R118 G378	E117-A380 HydrophobicContact CB-CB 4.4Å; R118-A380 VanDerWaalsContact CD-O 3.3Å; R118-A380 WeakPolarHBondContact CD-O 3.09Å; R118-A380 WeakPolarHBondContact CG-O 3.45Å; R118-A380 PolarHBondContact NE-O 3.23Å; R118-A380 VanDerWaalsContact NE-O 3.16Å; G378-A380 PolarHBondContact O-N 2.97Å; G378-A380 VanDerWaalsContact O-N 3.12Å
381	D	96.8	Very high	97.5	Very high	8 Å²	8	30.6 Å²	30.6	4%	0.043	17%	0.166	C	C	.	.	S	Bend	trans	-105.5	171.3	-177.3	-137.2	-35.8	0	0	0	113.2	R118 K330 S379	R118-D381 VanDerWaalsContact CZ-CG 3.46Å; R118-D381 IonicContact CZ-OD1 3.85Å; R118-D381 IonicContact CZ-OD2 2.8Å; R118-D381 IonicContact NE-OD1 3.04Å; R118-D381 PolarHBondContact NE-OD1 2.94Å; R118-D381 IonicContact NH1-OD1 3.14Å; R118-D381 PolarHBondContact NH1-OD1 2.88Å; R118-D381 IonicContact NH2-OD1 2.71Å; R118-D381 PolarHBondContact NH2-OD1 2.58Å; R118-D381 IonicContact NH2-OD2 3.05Å; R118-D381 PolarHBondContact NH2-OD2 2.76Å; K330-D381 IonicContact NZ-OD2 3.84Å; K330-D381 PolarHBondContact NZ-OD2 2.99Å; S379-D381 PolarHBondContact O-N 3.31Å
382	N	98.4	Very high	96.6	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.194	C	C	.	.			trans	-62.7	142.4	156.9	-64.7	158.5	0	0	0	109.1	R114 K115 R118 E120 M121 Q122 C325 G327	R114-N382 CarbonylContact O-C 3.6Å; R114-N382 WeakPolarHBondContact O-CA 3.41Å; K115-N382 PolarHBondContact O-ND2 2.97Å; R118-N382 WeakPolarHBondContact CB-ND2 3.36Å; E120-N382 PolarHBondContact O-ND2 3.1Å; E120-N382 PolarHBondContact O-OD1 3.32Å; M121-N382 HydrophobicContact CE-CB 4.15Å; M121-N382 HydrophobicContact SD-CB 3.96Å; Q122-N382 PolarHBondContact N-OD1 3.23Å; C325-N382 PolarHBondContact SG-O 3.37Å; C325-N382 VanDerWaalsContact SG-O 3.36Å; G327-N382 WeakPolarHBondContact CA-O 3.46Å
383	V	98.6	Very high	96.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	111.2	-178.6	-175.3	0	0	0	0	109	E113 R114 L328 A371 A374 V375 V385	E113-V383 CarbonylContact C-O 3.47Å; E113-V383 VanDerWaalsContact CA-O 3.27Å; E113-V383 WeakPolarHBondContact CA-O 2.98Å; R114-V383 HydrophobicContact CB-CB 4.32Å; R114-V383 PolarHBondContact N-O 2.8Å; R114-V383 PolarHBondContact O-N 3.13Å; L328-V383 HydrophobicContact CB-CG1 4.33Å; A371-V383 HydrophobicContact CB-CG1 4.2Å; A374-V383 HydrophobicContact CB-CG1 3.97Å; A374-V383 HydrophobicContact CB-CG2 4.3Å; V375-V383 HydrophobicContact CG2-CG2 4.29Å; V383-V385 HydrophobicContact CG1-CG2 4.04Å
384	T	98.8	Very high	96.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.3	171.7	-61.1	0	0	0	0	109.7	V111 E113 M121 D123 H125 V150 A324 C325	V111-T384 HydrophobicContact CG2-CG2 4.13Å; E113-T384 HydrophobicContact CG-CG2 4.04Å; M121-T384 WeakPolarHBondContact CE-OG1 3.49Å; D123-T384 WeakPolarHBondContact CB-OG1 3.48Å; D123-T384 WeakPolarHBondContact OD2-CB 3.38Å; D123-T384 PolarHBondContact OD2-N 3.29Å; D123-T384 PolarHBondContact OD2-OG1 2.96Å; H125-T384 HydrophobicContact CB-CG2 4.36Å; V150-T384 HydrophobicContact CG1-CG2 3.94Å; V150-T384 HydrophobicContact CG2-CG2 4.04Å; A324-T384 WeakPolarHBondContact CA-O 3.47Å; A324-T384 WeakPolarHBondContact CB-O 3.13Å; C325-T384 PolarHBondContact N-O 3.26Å; C325-T384 PolarHBondContact SG-N 2.81Å
385	V	98.8	Very high	96.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	116.7	179.1	177.6	0	0	0	0	108.5	V111 A112 L322 L328 C367 L370 A371 V383 V387	V111-V385 CarbonylContact C-O 3.59Å; V111-V385 VanDerWaalsContact CA-O 3.26Å; V111-V385 WeakPolarHBondContact CA-O 3.48Å; A112-V385 PolarHBondContact N-O 2.86Å; A112-V385 PolarHBondContact O-N 3.16Å; L322-V385 HydrophobicContact CD1-CG1 3.79Å; L328-V385 HydrophobicContact CD1-CG2 4.2Å; L328-V385 HydrophobicContact CD2-CG2 4.15Å; C367-V385 HydrophobicContact CB-CG1 4.48Å; L370-V385 HydrophobicContact CB-CG1 4.39Å; L370-V385 HydrophobicContact CD2-CG1 3.81Å; L370-V385 HydrophobicContact CG-CG1 4.29Å; L370-V385 HydrophobicContact CG-CG2 4.41Å; A371-V385 HydrophobicContact CB-CB 4.41Å; A371-V385 HydrophobicContact CB-CG2 3.91Å; V383-V385 HydrophobicContact CG1-CG2 4.04Å; V385-V387 HydrophobicContact CG1-CG2 4.46Å
386	M	98.9	Very high	96.2	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	125.9	174.3	179.3	-174.1	-59.7	0	0	110.5	Y110 V111 H125 V126 I127 F148 A149 V150 L322 L323 V388	Y110-M386 CarbonylContact O-C 3.55Å; Y110-M386 WeakPolarHBondContact O-CA 3.36Å; Y110-M386 WeakPolarHBondContact O-CG 3.17Å; V111-M386 HydrophobicContact CB-CB 4.4Å; V111-M386 HydrophobicContact CG2-CB 4.27Å; H125-M386 HydrophobicContact CB-CE 3.75Å; V126-M386 WeakPolarHBondContact O-CE 3.46Å; I127-M386 HydrophobicContact CD1-CE 4.2Å; I127-M386 HydrophobicContact CD1-CG 4.45Å; I127-M386 HydrophobicContact CG1-CE 3.58Å; I127-M386 HydrophobicContact CG1-CG 4.47Å; I127-M386 HydrophobicContact CG1-SD 3.93Å; F148-M386 HydrophobicContact CB-SD 3.76Å; F148-M386 HydrophobicContact CD1-SD 4.33Å; F148-M386 HydrophobicContact CG-SD 4.49Å; A149-M386 VanDerWaalsContact O-CE 3.24Å; A149-M386 WeakPolarHBondContact O-CE 3.48Å; V150-M386 HydrophobicContact CG2-CB 4.11Å; V150-M386 HydrophobicContact CG2-CE 4.11Å; L322-M386 CarbonylContact C-O 3.6Å; L322-M386 WeakPolarHBondContact CA-O 3.33Å; L323-M386 HydrophobicContact CB-CB 4.26Å; L323-M386 HydrophobicContact CD1-SD 4.33Å; L323-M386 PolarHBondContact N-O 3.36Å; L323-M386 PolarHBondContact O-N 2.97Å; M386-V388 HydrophobicContact CG-CG2 4.45Å; M386-V388 HydrophobicContact SD-CG2 4.43Å
387	V	98.8	Very high	96.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	123.7	173.5	-177.3	0	0	0	0	109.2	G109 Y110 F320 I321 L322 I341 Y363 C367 V385	G109-V387 CarbonylContact C-O 3.45Å; Y110-V387 WeakPolarHBondContact CD2-O 3.35Å; Y110-V387 PolarHBondContact N-O 2.99Å; Y110-V387 PolarHBondContact O-N 3.07Å; F320-V387 HydrophobicContact CB-CG1 3.85Å; F320-V387 HydrophobicContact CD2-CG1 3.88Å; F320-V387 HydrophobicContact CG-CG1 3.98Å; I321-V387 CarbonylContact O-C 3.58Å; I321-V387 WeakPolarHBondContact O-CA 3.45Å; L322-V387 HydrophobicContact CD1-CG2 4.25Å; I341-V387 HydrophobicContact CD1-CG2 3.78Å; I341-V387 HydrophobicContact CG1-CG2 4.39Å; Y363-V387 HydrophobicContact CD1-CB 4.3Å; Y363-V387 HydrophobicContact CD1-CG1 3.57Å; Y363-V387 HydrophobicContact CE1-CG1 3.65Å; C367-V387 VanDerWaalsContact SG-CG2 3.57Å; V385-V387 HydrophobicContact CG1-CG2 4.46Å
388	V	98.7	Very high	96.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	108.8	173.6	-173.8	0	0	0	0	108.4	L107 K108 F148 F320 I321 L323 M386	L107-V388 HydrophobicContact CB-CG1 4.18Å; L107-V388 HydrophobicContact CD2-CG1 4.35Å; K108-V388 CarbonylContact O-C 3.53Å; K108-V388 WeakPolarHBondContact O-CA 3.37Å; F148-V388 HydrophobicContact CB-CG2 4.04Å; F148-V388 HydrophobicContact CD1-CG1 4.39Å; F148-V388 HydrophobicContact CD1-CG2 3.68Å; F148-V388 HydrophobicContact CD2-CG1 4.1Å; F148-V388 HydrophobicContact CD2-CG2 3.94Å; F148-V388 HydrophobicContact CE1-CG1 4Å; F148-V388 HydrophobicContact CE1-CG2 4.1Å; F148-V388 HydrophobicContact CE2-CG1 3.68Å; F148-V388 HydrophobicContact CE2-CG2 4.34Å; F148-V388 HydrophobicContact CG-CG1 4.43Å; F148-V388 HydrophobicContact CG-CG2 3.59Å; F148-V388 HydrophobicContact CZ-CG1 3.64Å; F148-V388 HydrophobicContact CZ-CG2 4.42Å; F320-V388 CarbonylContact C-O 3.47Å; F320-V388 WeakPolarHBondContact CA-O 3.17Å; F320-V388 VanDerWaalsContact CB-O 3.29Å; F320-V388 WeakPolarHBondContact CB-O 3.48Å; I321-V388 HydrophobicContact CB-CB 4.16Å; I321-V388 PolarHBondContact N-O 3.31Å; I321-V388 PolarHBondContact O-N 3.19Å; L323-V388 HydrophobicContact CD1-CG2 4.01Å; M386-V388 HydrophobicContact CG-CG2 4.45Å; M386-V388 HydrophobicContact SD-CG2 4.43Å
389	R	97.9	Very high	96.1	Very high	74 Å²	74	20.1 Å²	20.1	28%	0.279	11%	0.108	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	136	173.5	173.7	-177.6	173.5	-173	-3.3	109.7	L107 K108 Y110 V359 Y363	L107-R389 WeakPolarHBondContact CA-O 3.36Å; K108-R389 PolarHBondContact N-O 2.65Å; K108-R389 PolarHBondContact O-N 2.67Å; Y110-R389 HydrophobicContact CE2-CB 3.88Å; V359-R389 VanDerWaalsContact CG1-CZ 3.47Å; Y363-R389 HydrophobicContact CD1-CB 4.3Å; Y363-R389 HydrophobicContact CD2-CB 4.31Å; Y363-R389 HydrophobicContact CD2-CG 4.42Å; Y363-R389 HydrophobicContact CE1-CB 3.86Å; Y363-R389 HydrophobicContact CE1-CG 4.38Å; Y363-R389 HydrophobicContact CE2-CB 3.91Å; Y363-R389 HydrophobicContact CE2-CG 3.69Å
390	I	97.1	Very high	96	Very high	6 Å²	6	21.3 Å²	21.3	3%	0.031	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	108.8	168.7	-57.4	168.8	0	0	0	107.3	F105 L107 L241 L314 D318 R319 I321	F105-I390 HydrophobicContact CB-CG2 3.78Å; F105-I390 HydrophobicContact CD1-CG2 4.27Å; F105-I390 HydrophobicContact CG-CG2 4.09Å; L107-I390 HydrophobicContact CD2-CB 4.37Å; L107-I390 HydrophobicContact CD2-CG1 3.81Å; L107-I390 HydrophobicContact CD2-CG2 4.46Å; L241-I390 HydrophobicContact CD1-CD1 3.96Å; L314-I390 HydrophobicContact CD2-CD1 3.75Å; D318-I390 HydrophobicContact CB-CD1 3.63Å; R319-I390 WeakPolarHBondContact O-CB 3.3Å; R319-I390 PolarHBondContact O-N 3.16Å; R319-I390 VanDerWaalsContact O-N 3.09Å; I321-I390 HydrophobicContact CG1-CD1 4.08Å
391	G	90.6	Very high	96.1	Very high	14 Å²	14	19.1 Å²	19.1	14%	0.144	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	127.2	177.2	0	0	0	0	0	110.9	F105 G106	F105-G391 CarbonylContact C-O 3.46Å; F105-G391 VanDerWaalsContact CA-O 3.32Å; F105-G391 WeakPolarHBondContact CA-O 3.48Å; G106-G391 PolarHBondContact N-O 3.48Å; G106-G391 PolarHBondContact O-N 3.12Å
392	H	80.4	Confident	96.1	Very high	126 Å²	126	20.1 Å²	20.1	58%	0.583	10%	0.095	S	C	*	.			trans	-92	0	175.2	-62.7	-81.8	0	0	0	111.3	F105 P316 D318	F105-H392 AromaticContact CD1-CE1 3.88Å; F105-H392 AromaticContact CD1-ND1 3.55Å; F105-H392 AromaticContact CE1-CE1 3.68Å; F105-H392 AromaticContact CE1-ND1 3.27Å; F105-H392 VanDerWaalsContact CE1-ND1 3.27Å; F105-H392 WeakPolarHBondContact CE1-ND1 3.4Å; P316-H392 VanDerWaalsContact C-CE1 3.45Å; P316-H392 PolarHBondContact O-CE1 2.94Å; D318-H392 PolarHBondContact O-CE1 3.29Å; D318-H392 VanDerWaalsContact O-CE1 3.3Å; D318-H392 PolarHBondContact O-NE2 3.11Å

Retrieved 392 of 392 residues in 68.6 ms (Link to these results)

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