A0A077ZE90_TRITR Loading...

Hexosyltransferase

AlphaFold DB , UniProt , Accession A0A077ZE90, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 403 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	31.3	Very low	32.9	Very low	242 Å²	242	149.4 Å²	149.4	100%	1.192	80%	0.802	S	S	*	*				0	125.4	0	-87.1	178.3	164.2	0	0	106.7
2	L	33.8	Very low	32.3	Very low	172 Å²	172	148.3 Å²	148.3	90%	0.901	79%	0.794	S	S	*	*			trans	84.3	123.7	-157.1	-64.9	166	0	0	0	115.1
3	F	38	Very low	32.4	Very low	187 Å²	187	148.5 Å²	148.5	82%	0.82	79%	0.793	S	S	*	*			trans	160.4	111.1	147.7	-92.9	-72.7	0	0	0	107
4	N	31.7	Very low	32	Very low	131 Å²	131	149.1 Å²	149.1	70%	0.701	79%	0.785	S	S	*	*				69.4	134.3	102.7	-85	7.7	0	0	0	112.4
5	E	37.6	Very low	31.6	Very low	165 Å²	165	147.6 Å²	147.6	77%	0.771	78%	0.777	S	S	*	*			cis	-159.3	134.2	42.8	-66.4	-176.5	156.2	0	0	107.7
6	T	32	Very low	31.6	Very low	120 Å²	120	150.4 Å²	150.4	74%	0.736	78%	0.781	S	S	*	*				50.3	132.6	78.1	52.1	0	0	0	0	118.2
7	I	37.6	Very low	31.5	Very low	153 Å²	153	146.3 Å²	146.3	79%	0.785	78%	0.775	S	S	*	*			trans	130.3	92.3	154.3	-66	161.6	0	0	0	109.7
8	S	30.2	Very low	31.2	Very low	104 Å²	104	147.9 Å²	147.9	73%	0.727	78%	0.777	S	S	*	*				65.4	97.2	72	-158.3	0	0	0	0	111.6
9	C	26.1	Very low	30.9	Very low	116 Å²	116	146.5 Å²	146.5	78%	0.784	78%	0.775	S	S	*	*				94.6	159	92.7	-154.2	0	0	0	0	111.1
10	V	32.1	Very low	30.6	Very low	116 Å²	116	144.9 Å²	144.9	70%	0.703	78%	0.777	S	S	*	*			trans	111.2	97.7	158.6	-173.6	0	0	0	0	117.6
11	I	31.5	Very low	30.7	Very low	137 Å²	137	143.6 Å²	143.6	70%	0.703	78%	0.779	S	S	*	*				84	110	129.5	-63.3	177	0	0	0	118.6
12	L	26.3	Very low	30.3	Very low	136 Å²	136	143.9 Å²	143.9	71%	0.712	77%	0.767	S	S	*	*				63	121.9	73	-101.7	148.8	0	0	0	115	F14	L12-F14 HydrophobicContact CD2-CD2 3.94Å; L12-F14 HydrophobicContact CD2-CE2 3.74Å
13	I	32.7	Very low	30.2	Very low	151 Å²	151	144.6 Å²	144.6	77%	0.774	77%	0.766	S	S	*	*			trans	163.5	101.7	143.5	-82.7	152.4	0	0	0	105.9
14	F	26.9	Very low	29.6	Very low	157 Å²	157	140.7 Å²	140.7	69%	0.689	76%	0.761	S	S	*	*				90.7	125.3	70.5	-98.2	-63.3	0	0	0	114.7	L12	L12-F14 HydrophobicContact CD2-CD2 3.94Å; L12-F14 HydrophobicContact CD2-CE2 3.74Å
15	L	26.4	Very low	29.5	Very low	127 Å²	127	142.9 Å²	142.9	67%	0.665	77%	0.772	S	S	*	*			trans	77.5	116.4	149.6	-53.9	165.5	0	0	0	118.1
16	F	32	Very low	28.9	Very low	192 Å²	192	140.8 Å²	140.8	84%	0.842	77%	0.771	S	S	*	*				-172.7	128	83.5	-101.8	-82.7	0	0	0	112.1
17	A	29	Very low	28.5	Very low	81 Å²	81	139.7 Å²	139.7	67%	0.669	77%	0.767	S	S	*	*			trans	32.6	113	139.7	0	0	0	0	0	119.3
18	E	26.4	Very low	28	Very low	175 Å²	175	140 Å²	140	82%	0.818	77%	0.771	S	S	*	*				77.3	108.2	74.9	-81.3	-166.5	159.8	0	0	116.4
19	T	26	Very low	27.6	Very low	121 Å²	121	139.9 Å²	139.9	74%	0.742	78%	0.776	S	S	*	*				81.1	122.2	129.8	63.4	0	0	0	0	122
20	S	25.2	Very low	27.7	Very low	114 Å²	114	143 Å²	143	80%	0.797	78%	0.779	S	S	*	*				77.4	101.8	128.9	-171.8	0	0	0	0	119.1
21	S	31.7	Very low	27.3	Very low	119 Å²	119	146.5 Å²	146.5	83%	0.832	79%	0.788	S	S	*	*				-150	102.5	119	49.1	0	0	0	0	110.7
22	R	23.9	Very low	26.8	Very low	248 Å²	248	147.9 Å²	147.9	94%	0.936	80%	0.795	S	S	*	*			trans	-73.1	122.6	152.5	-93.6	177.7	167.4	-179.9	-3.2	106.9
23	Q	31.6	Very low	26.8	Very low	187 Å²	187	146.8 Å²	146.8	87%	0.874	80%	0.798	S	S	*	*			trans	-144.3	111.9	146.2	-102.8	178.5	5	0	0	109.5
24	S	24.8	Very low	26.4	Very low	104 Å²	104	147.9 Å²	147.9	73%	0.727	80%	0.801	S	S	*	*			trans	-68.2	130.1	160.8	50.2	0	0	0	0	109.9
25	L	29.6	Very low	26.3	Very low	177 Å²	177	146.6 Å²	146.6	93%	0.927	81%	0.811	S	S	*	*			trans	-130	123.5	151	-81.2	172.3	0	0	0	108.9
26	V	24.8	Very low	26.3	Very low	122 Å²	122	143.8 Å²	143.8	74%	0.739	81%	0.813	S	S	*	*			trans	-91.2	152.6	-176	167.7	0	0	0	0	108.8
27	S	24.5	Very low	26	Very low	96 Å²	96	140.5 Å²	140.5	67%	0.671	81%	0.813	S	S	*	*			trans	60.1	110.5	155.8	60.6	0	0	0	0	119.3
28	N	26.5	Very low	25.8	Very low	160 Å²	160	144.1 Å²	144.1	86%	0.856	82%	0.82	S	S	*	*			trans	-132.5	95.3	132.1	-91.6	-21.1	0	0	0	107.8
29	A	22.4	Very low	25.7	Very low	101 Å²	101	140.6 Å²	140.6	84%	0.835	82%	0.815	S	S	*	*			trans	-86.3	117.9	158	0	0	0	0	0	106.1
30	Q	27.3	Very low	25.6	Very low	183 Å²	183	141.9 Å²	141.9	86%	0.855	82%	0.816	S	S	*	*			trans	-122.2	141.2	168.9	-95.6	-178.7	-42.8	0	0	109.9
31	E	24.1	Very low	25.5	Very low	189 Å²	189	147.4 Å²	147.4	88%	0.883	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-67.8	155.7	-159.4	-76.6	160.6	137.3	0	0	115.2	S33	E31-S33 PolarHBondContact O-N 3.47Å
32	I	20.4	Very low	25.2	Very low	165 Å²	165	147.7 Å²	147.7	85%	0.846	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-64.5	117.8	164.7	-64.5	160.4	0	0	0	108.2
33	S	27.3	Very low	25.3	Very low	113 Å²	113	141.6 Å²	141.6	79%	0.79	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-103.7	120.7	161.5	63.5	0	0	0	0	109.8	E31	E31-S33 PolarHBondContact O-N 3.47Å
34	E	23.2	Very low	24.9	Very low	175 Å²	175	137.9 Å²	137.9	82%	0.818	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-67.3	153.5	170.5	-66.4	176.4	146.1	0	0	111.8
35	S	25.6	Very low	25.1	Very low	129 Å²	129	139.6 Å²	139.6	90%	0.902	80%	0.804	S	S	*	*			trans	79.7	123.7	169.6	79.8	0	0	0	0	117.6
36	G	26.5	Very low	24.7	Very low	69 Å²	69	138.6 Å²	138.6	71%	0.711	80%	0.799	S	S	*	*			trans	156.3	84.1	173.1	0	0	0	0	0	113.4
37	S	25.2	Very low	24.7	Very low	122 Å²	122	143.3 Å²	143.3	85%	0.853	81%	0.805	S	S	*	*			trans	-38.8	127.9	173	46.9	0	0	0	0	115.4	S39	S37-S39 PolarHBondContact O-N 3.38Å
38	I	25.7	Very low	24.4	Very low	157 Å²	157	145.9 Å²	145.9	81%	0.805	81%	0.812	S	S	*	*			trans	-86.2	100.9	170.8	-62.7	171.7	0	0	0	108.9	I40	I38-I40 HydrophobicContact CG2-CG1 4.43Å
39	S	23.9	Very low	24.4	Very low	101 Å²	101	147.4 Å²	147.4	71%	0.706	81%	0.814	S	S	*	*			trans	-76.7	112.3	164.4	162.2	0	0	0	0	109.2	S37 R41	S37-S39 PolarHBondContact O-N 3.38Å; S39-R41 PolarHBondContact O-N 3.19Å
40	I	24	Very low	24.3	Very low	149 Å²	149	147 Å²	147	76%	0.764	80%	0.804	S	S	*	*			trans	-75.5	102.5	174.7	-58.8	173.2	0	0	0	108.2	I38	I38-I40 HydrophobicContact CG2-CG1 4.43Å
41	R	22.2	Very low	24.1	Very low	230 Å²	230	147.2 Å²	147.2	87%	0.868	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-78	120.5	164.8	-87	-174.1	-176	-172.6	1.7	109.4	S39	S39-R41 PolarHBondContact O-N 3.19Å
42	T	24.9	Very low	24.1	Very low	125 Å²	125	142.5 Å²	142.5	77%	0.767	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-73.5	130.4	166.3	43.8	0	0	0	0	110.4	S44	T42-S44 PolarHBondContact O-N 3.44Å
43	P	27.2	Very low	24.1	Very low	120 Å²	120	141 Å²	141	78%	0.779	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-75.2	120	170.4	-11.6	27.7	0	0	0	110.3
44	S	22.6	Very low	24	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	79%	0.794	S	S	*	*			trans	-90	114.3	158.7	55.1	0	0	0	0	107.6	T42	T42-S44 PolarHBondContact O-N 3.44Å
45	D	28.6	Very low	24	Very low	141 Å²	141	140.1 Å²	140.1	75%	0.754	79%	0.792	S	S	*	*			trans	-128.1	103.3	164.8	-76.9	-42.1	0	0	0	108.8
46	N	21.5	Very low	23.8	Very low	155 Å²	155	141.1 Å²	141.1	83%	0.829	79%	0.787	S	S	*	*			trans	-71.8	126.3	158.8	-93.7	-22.9	0	0	0	108
47	Y	24.1	Very low	23.8	Very low	221 Å²	221	147.1 Å²	147.1	87%	0.867	80%	0.796	S	S	*	*			trans	-139.8	104.5	152.4	-98.7	-82	0	0	0	109.4
48	N	20.2	Very low	23.8	Very low	151 Å²	151	145.7 Å²	145.7	81%	0.807	79%	0.792	S	S	*	*			trans	-87.6	130.6	154.9	-79	-29.1	0	0	0	106.8
49	E	25.3	Very low	23.9	Very low	192 Å²	192	148.1 Å²	148.1	90%	0.897	80%	0.796	S	S	*	*			trans	-167.9	135.5	135.1	-113.4	175.3	-172.8	0	0	112.8
50	S	19.9	Very low	23.8	Very low	91 Å²	91	151.6 Å²	151.6	64%	0.636	81%	0.807	S	S	*	*			trans	-73.3	145.7	170	45.6	0	0	0	0	113.3
51	F	24	Very low	24.2	Very low	188 Å²	188	149 Å²	149	83%	0.825	80%	0.802	S	S	*	*				165.6	139.3	114.2	-110.8	-94.7	0	0	0	114.7
52	S	23.1	Very low	24.6	Very low	90 Å²	90	148 Å²	148	63%	0.629	81%	0.807	S	S	*	*			trans	61.6	112.1	145.3	55.6	0	0	0	0	123.8
53	T	20.3	Very low	24.9	Very low	135 Å²	135	147.4 Å²	147.4	83%	0.828	80%	0.804	S	S	*	*				26.4	115.3	124.6	48.9	0	0	0	0	120.3
54	V	25.8	Very low	25.1	Very low	145 Å²	145	150.6 Å²	150.6	88%	0.879	81%	0.81	S	S	*	*			trans	-141.1	135.2	141.7	178.5	0	0	0	0	110.1
55	T	23	Very low	25.7	Very low	124 Å²	124	155.1 Å²	155.1	76%	0.761	81%	0.811	S	S	*	*			trans	-72.2	144.7	-178.5	39.6	0	0	0	0	115.4
56	N	22.8	Very low	26.2	Very low	150 Å²	150	151.8 Å²	151.8	80%	0.802	80%	0.798	S	S	*	*			trans	17.6	114.9	145.7	-70.9	-21.9	0	0	0	119.6
57	H	26.5	Very low	27.1	Very low	194 Å²	194	151.4 Å²	151.4	90%	0.898	80%	0.796	S	S	*	*				-147.4	128.5	128	-105.3	-65.2	0	0	0	111
58	A	23.6	Very low	27.8	Very low	93 Å²	93	148.2 Å²	148.2	77%	0.769	79%	0.789	S	S	*	*			trans	-62.9	134.9	175.4	0	0	0	0	0	112.1
59	K	27.8	Very low	28.8	Very low	208 Å²	208	146.6 Å²	146.6	90%	0.904	78%	0.776	S	S	*	*			trans	-165.2	129	143.2	-106	168	-170.4	-177.7	0	110.4	S61	K59-S61 PolarHBondContact O-N 2.77Å
60	N	23.3	Very low	29.6	Very low	173 Å²	173	145.9 Å²	145.9	93%	0.925	77%	0.766	S	S	*	*			trans	-52.4	119.2	177.3	-73.5	-29	0	0	0	112.8
61	S	31.2	Very low	30.2	Very low	94 Å²	94	147 Å²	147	66%	0.657	77%	0.765	S	S	*	*			trans	-154.8	128.2	137.5	71.6	0	0	0	0	108	K59 T63	K59-S61 PolarHBondContact O-N 2.77Å; S61-T63 VanDerWaalsContact C-N 3.28Å; S61-T63 PolarHBondContact O-N 2.94Å; S61-T63 PolarHBondContact O-OG1 3.47Å
62	Q	30.3	Very low	30.7	Very low	211 Å²	211	145.5 Å²	145.5	99%	0.986	76%	0.761	S	S	*	*			trans	-63.8	89.1	179.3	-71.9	174	-22.1	0	0	109
63	T	32.4	Very low	31.4	Very low	112 Å²	112	148.7 Å²	148.7	69%	0.687	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-93.8	125.7	174.3	-46.5	0	0	0	0	107.3	S61 R65	S61-T63 VanDerWaalsContact C-N 3.28Å; S61-T63 PolarHBondContact O-N 2.94Å; S61-T63 PolarHBondContact O-OG1 3.47Å; T63-R65 PolarHBondContact O-N 3.01Å
64	M	31.1	Very low	32.3	Very low	186 Å²	186	146 Å²	146	92%	0.916	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-48.5	125.1	178.3	-76.7	-167.9	177.6	0	0	110.7	S66	M64-S66 PolarHBondContact O-N 3.24Å
65	R	34.2	Very low	32.5	Very low	203 Å²	203	143 Å²	143	77%	0.766	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-59	132.3	175	-70	-177	-173.7	157.7	0.5	110.1	T63	T63-R65 PolarHBondContact O-N 3.01Å
66	S	39.2	Very low	32.9	Very low	71 Å²	71	142.8 Å²	142.8	50%	0.497	74%	0.741	S	S	.	*	P	Polyproline II helix	trans	-69.1	155.6	-178	56.8	0	0	0	0	112	M64 E68	M64-S66 PolarHBondContact O-N 3.24Å; S66-E68 PolarHBondContact O-N 3.03Å; S66-E68 VanDerWaalsContact O-N 3.11Å
67	L	41.9	Very low	33.3	Very low	148 Å²	148	143.7 Å²	143.7	78%	0.775	74%	0.74	S	S	*	*	H	α-helix	trans	-60	-17.2	-176.9	-78.2	149.7	0	0	0	114.6
68	E	38.2	Very low	33.3	Very low	153 Å²	153	140.8 Å²	140.8	72%	0.715	74%	0.736	S	S	*	*	H	α-helix	trans	-74.6	-38.3	-173	-70.5	168.4	165.5	0	0	112	S66 Y70 N71	S66-E68 PolarHBondContact O-N 3.03Å; S66-E68 VanDerWaalsContact O-N 3.11Å; E68-Y70 PolarHBondContact O-N 3.4Å; E68-N71 PolarHBondContact O-N 3.32Å; E68-N71 VanDerWaalsContact O-N 3.13Å
69	E	40.6	Very low	33.7	Very low	117 Å²	117	143.5 Å²	143.5	55%	0.547	74%	0.738	S	S	.	*	H	α-helix	trans	-69.6	-22.7	179.5	-146	178	-162.8	0	0	112.3
70	Y	41.8	Very low	33.8	Very low	177 Å²	177	140.8 Å²	140.8	69%	0.694	73%	0.733	S	S	*	*	H	α-helix	trans	-76.2	-22.8	174.4	-92.2	-83.5	0	0	0	113.6	E68	E68-Y70 PolarHBondContact O-N 3.4Å
71	N	32.5	Very low	34.1	Very low	115 Å²	115	141.3 Å²	141.3	62%	0.615	74%	0.735	S	S	*	*	H	α-helix	trans	-83.5	-30.2	-178.9	-73.4	-27.7	0	0	0	112.2	E68 S74 S75	E68-N71 PolarHBondContact O-N 3.32Å; E68-N71 VanDerWaalsContact O-N 3.13Å; N71-S74 PolarHBondContact O-N 3.24Å; N71-S75 PolarHBondContact O-N 3.08Å
72	E	35.9	Very low	34	Very low	156 Å²	156	145.2 Å²	145.2	73%	0.729	74%	0.743	S	S	*	*	H	α-helix	trans	-72.3	-34.2	178.7	-77.3	-170.6	157.7	0	0	113.4	S74 S75	E72-S74 PolarHBondContact O-N 3.06Å; E72-S75 PolarHBondContact O-OG 3.24Å
73	L	37.1	Very low	33.8	Very low	158 Å²	158	145 Å²	145	83%	0.827	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-9.5	174.2	-103.8	105.4	0	0	0	114
74	S	39.1	Very low	33.9	Very low	77 Å²	77	144.8 Å²	144.8	54%	0.538	74%	0.738	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.5	-8.4	-175.5	-177.3	0	0	0	0	114.3	N71 E72 T76	N71-S74 PolarHBondContact O-N 3.24Å; E72-S74 PolarHBondContact O-N 3.06Å; S74-T76 VanDerWaalsContact C-N 3.26Å; S74-T76 PolarHBondContact O-N 3.31Å
75	S	30.6	Very low	33.8	Very low	84 Å²	84	143.6 Å²	143.6	59%	0.587	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-5.2	-176	60.9	0	0	0	0	114.2	N71 E72	N71-S75 PolarHBondContact O-N 3.08Å; E72-S75 PolarHBondContact O-OG 3.24Å
76	T	31.4	Very low	33.7	Very low	119 Å²	119	139.1 Å²	139.1	73%	0.73	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	11.4	-177.6	47.4	0	0	0	0	115.6	S74	S74-T76 VanDerWaalsContact C-N 3.26Å; S74-T76 PolarHBondContact O-N 3.31Å
77	Q	31.6	Very low	33.6	Very low	168 Å²	168	139.8 Å²	139.8	79%	0.785	74%	0.737	S	S	*	*			trans	-135.5	67.6	173.8	-69.5	-172.8	3.6	0	0	112.9	N79	Q77-N79 PolarHBondContact O-N 2.85Å
78	T	26	Very low	33.4	Very low	133 Å²	133	137.1 Å²	137.1	82%	0.816	73%	0.731	S	S	*	*			trans	-80.3	74.2	154.1	46.5	0	0	0	0	108.9
79	N	31	Very low	33.3	Very low	150 Å²	150	133.8 Å²	133.8	80%	0.802	72%	0.724	S	S	*	*			trans	-105.4	116.7	159.5	-83.9	-14.1	0	0	0	107.7	Q77	Q77-N79 PolarHBondContact O-N 2.85Å
80	D	31.2	Very low	32.9	Very low	151 Å²	151	135 Å²	135	81%	0.807	73%	0.732	S	S	*	*			trans	-43.9	136.7	175.8	-77.1	-49	0	0	0	111.6	Q82	D80-Q82 PolarHBondContact O-N 3.39Å
81	L	29.7	Very low	33.1	Very low	184 Å²	184	136.1 Å²	136.1	96%	0.963	74%	0.735	S	S	*	*			trans	-65.5	68.8	171.6	-72.6	158.9	0	0	0	109.5	Y83	L81-Y83 PolarHBondContact O-N 3.02Å
82	Q	27.3	Very low	33.7	Very low	177 Å²	177	134.9 Å²	134.9	83%	0.827	72%	0.722	S	S	*	*			trans	-71.2	125.5	164	-76.9	-166	-21.3	0	0	108.1	D80 S84	D80-Q82 PolarHBondContact O-N 3.39Å; Q82-S84 PolarHBondContact O-N 3.47Å
83	Y	27.7	Very low	33.9	Very low	207 Å²	207	134 Å²	134	81%	0.812	72%	0.722	S	S	*	*			trans	-30.7	110	171	-152	-99.4	0	0	0	110.7	L81 Q85	L81-Y83 PolarHBondContact O-N 3.02Å; Y83-Q85 PolarHBondContact O-N 3.02Å
84	S	34.1	Very low	34.1	Very low	107 Å²	107	127.3 Å²	127.3	75%	0.748	69%	0.689	S	S	*	*			trans	-56.5	109.8	160.9	49.6	0	0	0	0	106.1	Q82	Q82-S84 PolarHBondContact O-N 3.47Å
85	Q	28.2	Very low	34	Very low	160 Å²	160	133.4 Å²	133.4	75%	0.748	71%	0.705	S	S	*	*			trans	-38.9	142.2	163.4	-73	-87.5	-47.4	0	0	108.6	Y83 A87	Y83-Q85 PolarHBondContact O-N 3.02Å; Q85-A87 PolarHBondContact O-N 3.25Å
86	P	33.2	Very low	34.1	Very low	110 Å²	110	135.9 Å²	135.9	71%	0.714	71%	0.708	S	S	*	*			trans	-54.1	120.5	-177.6	4.6	-1.4	0	0	0	107.2	S88	P86-S88 PolarHBondContact O-N 3.17Å
87	A	37.5	Very low	34.3	Very low	84 Å²	84	135.3 Å²	135.3	69%	0.694	70%	0.704	S	S	*	*			trans	-45.7	123	171.8	0	0	0	0	0	106.2	Q85 S89	Q85-A87 PolarHBondContact O-N 3.25Å; A87-S89 PolarHBondContact O-N 2.85Å
88	S	37.5	Very low	34.4	Very low	93 Å²	93	132.9 Å²	132.9	65%	0.65	70%	0.7	S	S	*	*			trans	-31.7	121	169.4	166.9	0	0	0	0	108.1	P86 M90	P86-S88 PolarHBondContact O-N 3.17Å; S88-M90 PolarHBondContact O-N 2.93Å
89	S	35.6	Very low	35.2	Very low	82 Å²	82	128.7 Å²	128.7	57%	0.573	68%	0.677	S	S	*	*			trans	-68.1	66.8	-179.9	62.6	0	0	0	0	109.1	A87 R91	A87-S89 PolarHBondContact O-N 2.85Å; S89-R91 PolarHBondContact O-N 3.22Å
90	M	32.1	Very low	35.9	Very low	144 Å²	144	129.1 Å²	129.1	71%	0.709	68%	0.679	S	S	*	*			trans	-68.5	92.5	161.3	-76.1	-163.7	-178.3	0	0	105.4	S88 Y92	S88-M90 PolarHBondContact O-N 2.93Å; M90-Y92 PolarHBondContact O-N 3.09Å
91	R	46.7	Very low	36.7	Very low	200 Å²	200	129 Å²	129	76%	0.755	68%	0.679	S	S	*	*			trans	-55.9	135	168.5	-64.9	-179.5	-168.2	157.2	3.1	106.9	S89 D93	S89-R91 PolarHBondContact O-N 3.22Å; R91-D93 PolarHBondContact O-N 3.06Å
92	Y	44.5	Very low	38	Very low	88 Å²	88	127.1 Å²	127.1	35%	0.345	67%	0.666	S	S	.	*			trans	-57.4	115.7	169.5	176.4	-104.2	0	0	0	107.9	M90 P94	M90-Y92 PolarHBondContact O-N 3.09Å; Y92-P94 HydrophobicContact CD1-CB 4.31Å; Y92-P94 HydrophobicContact CD1-CG 4.01Å; Y92-P94 HydrophobicContact CE1-CB 3.58Å; Y92-P94 HydrophobicContact CE1-CG 3.72Å; Y92-P94 WeakPolarHBondContact O-CD 3.49Å
93	D	39.1	Very low	39.5	Very low	137 Å²	137	130 Å²	130	73%	0.733	67%	0.669	S	S	*	*			trans	-102.5	100.7	171.3	-171.2	11.9	0	0	0	107.5	R91 K95	R91-D93 PolarHBondContact O-N 3.06Å; D93-K95 PolarHBondContact O-N 2.86Å
94	P	42.6	Very low	41.6	Very low	19 Å²	19	122.7 Å²	122.7	12%	0.123	64%	0.644	C	S	.	*			trans	-68.3	114	176.1	12.5	-7.5	0	0	0	108.9	Y92 E96 V124	Y92-P94 HydrophobicContact CD1-CB 4.31Å; Y92-P94 HydrophobicContact CD1-CG 4.01Å; Y92-P94 HydrophobicContact CE1-CB 3.58Å; Y92-P94 HydrophobicContact CE1-CG 3.72Å; Y92-P94 WeakPolarHBondContact O-CD 3.49Å; P94-E96 PolarHBondContact O-N 3.31Å; P94-E96 VanDerWaalsContact O-N 3.16Å; P94-V124 HydrophobicContact CB-CG1 3.5Å; P94-V124 VanDerWaalsContact CB-CG1 3.5Å; P94-V124 HydrophobicContact CG-CB 4.4Å; P94-V124 HydrophobicContact CG-CG1 3.47Å; P94-V124 VanDerWaalsContact CG-CG1 3.47Å; P94-V124 HydrophobicContact CG-CG2 4.18Å
95	K	35.4	Very low	43.8	Very low	205 Å²	205	126.2 Å²	126.2	89%	0.891	65%	0.649	S	S	*	*			trans	-48.1	123.9	166.8	-69.5	-173.6	179.8	-176.9	0	109.2	D93	D93-K95 PolarHBondContact O-N 2.86Å
96	E	33.1	Very low	46.6	Very low	136 Å²	136	120 Å²	120	64%	0.636	62%	0.622	S	S	*	*			trans	-66.2	137.5	-165.6	-70.3	-175.1	135.6	0	0	113.8	P94 K122	P94-E96 PolarHBondContact O-N 3.31Å; P94-E96 VanDerWaalsContact O-N 3.16Å; E96-K122 IonicContact OE1-NZ 2.72Å; E96-K122 PolarHBondContact OE1-NZ 3.37Å
97	T	35.3	Very low	49.2	Very low	107 Å²	107	120.4 Å²	120.4	66%	0.656	63%	0.628	S	S	*	*			trans	-137.1	103.6	146.4	-45.9	0	0	0	0	106.5	S99	T97-S99 PolarHBondContact O-N 2.89Å
98	V	35.3	Very low	51.6	Low	116 Å²	116	122.5 Å²	122.5	70%	0.703	62%	0.624	S	S	*	*			trans	-82.6	96.7	170.6	-179.5	0	0	0	0	106.2
99	S	42.2	Very low	54.2	Low	46 Å²	46	123.2 Å²	123.2	32%	0.322	62%	0.624	S	S	.	*			trans	-120.9	121.5	164.3	70.5	0	0	0	0	109.5	T97 D101	T97-S99 PolarHBondContact O-N 2.89Å; S99-D101 PolarHBondContact O-N 3.35Å
100	N	44.4	Very low	57	Low	159 Å²	159	122.1 Å²	122.1	85%	0.85	61%	0.609	S	S	*	*	S	Bend	trans	-68.2	114.5	165.7	-81.5	-14.7	0	0	0	107.3	M102	N100-M102 PolarHBondContact O-N 3.39Å
101	D	49.9	Very low	60.1	Low	149 Å²	149	116.2 Å²	116.2	80%	0.797	58%	0.581	S	S	*	*	S	Bend	trans	64.3	38.7	160	-152.2	25.8	0	0	0	118.6	S99	S99-D101 PolarHBondContact O-N 3.35Å
102	M	55.7	Low	62.4	Low	143 Å²	143	107.2 Å²	107.2	70%	0.704	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-99.6	120	162.6	-126.9	165.1	70.8	0	0	109.1	N100 I104	N100-M102 PolarHBondContact O-N 3.39Å; M102-I104 PolarHBondContact O-N 2.9Å
103	R	60.2	Low	64.9	Low	237 Å²	237	106.5 Å²	106.5	89%	0.894	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-53.8	124	164.9	-78.4	-176.6	177.8	174.5	-0	107.7	E105	R103-E105 PolarHBondContact O-N 3.04Å
104	I	70.5	Confident	67.6	Low	54 Å²	54	100.4 Å²	100.4	28%	0.277	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-82.1	116.8	-178.4	-67.8	166.1	0	0	0	108.3	M102 P113 S125 C127	M102-I104 PolarHBondContact O-N 2.9Å; I104-P113 HydrophobicContact CB-CB 4.26Å; I104-P113 HydrophobicContact CG2-CB 4.31Å; I104-S125 WeakPolarHBondContact CD1-OG 3.42Å; I104-C127 VanDerWaalsContact CG2-SG 3.59Å
105	E	79.7	Confident	70.2	Confident	181 Å²	181	103.1 Å²	103.1	85%	0.846	53%	0.532	S	S	*	.			trans	-92.3	108.9	169.4	-68.7	-171.5	169.5	0	0	108.9	R103 S107	R103-E105 PolarHBondContact O-N 3.04Å; E105-S107 PolarHBondContact O-N 2.86Å
106	C	88.9	Confident	73.2	Confident	29 Å²	29	93.7 Å²	93.7	20%	0.196	49%	0.491	C	S	.	.			trans	-79.4	112.5	170.8	-54.7	0	0	0	0	108.7	T111 F112 P113 C127	C106-T111 WeakPolarHBondContact CB-OG1 3.39Å; C106-F112 VanDerWaalsContact SG-C 3.54Å; C106-P113 VanDerWaalsContact SG-CA 3.58Å; C106-P113 VanDerWaalsContact SG-N 3.41Å; C106-C127 WeakPolarHBondContact CA-SG 3.49Å; C106-C127 HydrophobicContact CB-CB 3.8Å; C106-C127 WeakPolarHBondContact CB-SG 3.34Å; C106-C127 VanDerWaalsContact SG-CA 3.57Å; C106-C127 WeakPolarHBondContact SG-CB 3.15Å; C106-C127 CovalentContact SG-SG 2.04Å; C106-C127 PolarHBondContact SG-SG 3.16Å
107	S	86.5	Confident	76.2	Confident	120 Å²	120	88.7 Å²	88.7	84%	0.839	47%	0.469	S	S	*	.			trans	-83.3	-18.4	-172.7	56.4	0	0	0	0	114.3	E105	E105-S107 PolarHBondContact O-N 2.86Å
108	Q	88.5	Confident	79.1	Confident	127 Å²	127	86.6 Å²	86.6	59%	0.593	45%	0.449	S	S	*	.	S	Bend	trans	-81.4	147.7	-177	-68.6	-176.5	-6.5	0	0	111.8	T111	Q108-T111 HydrophobicContact CB-CG2 3.57Å; Q108-T111 WeakPolarHBondContact O-CB 3.47Å; Q108-T111 PolarHBondContact O-N 3.28Å; Q108-T111 PolarHBondContact O-OG1 2.9Å
109	V	91.2	Very high	81.9	Confident	108 Å²	108	84.6 Å²	84.6	66%	0.655	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	144.9	174.1	-175.4	0	0	0	0	110	T111	V109-T111 PolarHBondContact O-N 3.32Å; V109-T111 VanDerWaalsContact O-N 3.15Å
110	H	95.1	Very high	84.3	Confident	59 Å²	59	86.9 Å²	86.9	27%	0.273	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	22.4	-179.7	-50.9	144.5	0	0	0	114.9	R129 Y130 L133 E135	H110-R129 WeakPolarHBondContact O-CA 3.48Å; H110-Y130 HydrophobicContact CB-CD2 4.11Å; H110-Y130 WeakPolarHBondContact O-CD2 3.43Å; H110-Y130 PolarHBondContact O-N 3.3Å; H110-L133 HydrophobicContact CB-CD2 4.36Å; H110-E135 IonicContact CD2-OE1 3.48Å; H110-E135 IonicContact CE1-OE1 2.87Å; H110-E135 IonicContact NE2-OE1 3.61Å; H110-E135 PolarHBondContact NE2-OE1 3.3Å
111	T	96.7	Very high	86.7	Confident	20 Å²	20	85.8 Å²	85.8	12%	0.123	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	159.3	173.2	62.2	0	0	0	0	113.5	C106 Q108 V109 F128 R129	C106-T111 WeakPolarHBondContact CB-OG1 3.39Å; Q108-T111 HydrophobicContact CB-CG2 3.57Å; Q108-T111 WeakPolarHBondContact O-CB 3.47Å; Q108-T111 PolarHBondContact O-N 3.28Å; Q108-T111 PolarHBondContact O-OG1 2.9Å; V109-T111 PolarHBondContact O-N 3.32Å; V109-T111 VanDerWaalsContact O-N 3.15Å; T111-F128 CarbonylContact C-O 3.46Å; T111-F128 WeakPolarHBondContact CA-O 3.41Å; T111-F128 WeakPolarHBondContact CB-O 3.35Å; T111-R129 HydrophobicContact CG2-CB 3.79Å; T111-R129 HydrophobicContact CG2-CG 3.79Å
112	F	96	Very high	88.8	Confident	12 Å²	12	82.9 Å²	82.9	5%	0.053	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	143.7	173.6	60.3	-83	0	0	0	110.6	C106 V114 F128 Y130 N229	C106-F112 VanDerWaalsContact SG-C 3.54Å; F112-V114 HydrophobicContact CD2-CG2 3.81Å; F112-V114 HydrophobicContact CE2-CG2 3.64Å; F112-F128 HydrophobicContact CD1-CB 4.31Å; F112-F128 WeakPolarHBondContact CD1-O 3.49Å; F112-F128 HydrophobicContact CD2-CB 4.36Å; F112-F128 HydrophobicContact CE1-CB 3.73Å; F112-F128 HydrophobicContact CE2-CB 3.81Å; F112-F128 AromaticContact CE2-CD2 3.99Å; F112-F128 HydrophobicContact CE2-CD2 3.99Å; F112-F128 HydrophobicContact CE2-CG 4.39Å; F112-F128 HydrophobicContact CZ-CB 3.45Å; F112-F128 VanDerWaalsContact CZ-CB 3.45Å; F112-F128 HydrophobicContact CZ-CD2 4.05Å; F112-F128 HydrophobicContact CZ-CG 4.29Å; F112-F128 PolarHBondContact N-O 3.41Å; F112-F128 PolarHBondContact O-N 3.29Å; F112-Y130 HydrophobicContact CD1-CD2 4.39Å; F112-Y130 HydrophobicContact CD1-CE1 4.23Å; F112-Y130 AromaticContact CD1-CE2 3.67Å; F112-Y130 HydrophobicContact CD1-CE2 3.67Å; F112-Y130 AromaticContact CD1-CZ 3.59Å; F112-Y130 HydrophobicContact CE1-CD1 4.19Å; F112-Y130 HydrophobicContact CE1-CD2 4.43Å; F112-Y130 AromaticContact CE1-CE1 3.56Å; F112-Y130 HydrophobicContact CE1-CE1 3.56Å; F112-Y130 AromaticContact CE1-CE2 3.86Å; F112-Y130 HydrophobicContact CE1-CE2 3.86Å; F112-Y130 AromaticContact CE1-CZ 3.39Å; F112-Y130 HydrophobicContact CZ-CE1 4.28Å; F112-N229 WeakPolarHBondContact CB-ND2 3.45Å; F112-N229 WeakPolarHBondContact CD1-ND2 3.25Å; F112-N229 HydrophobicContact CD2-CB 4.18Å; F112-N229 WeakPolarHBondContact CD2-ND2 3.44Å; F112-N229 HydrophobicContact CE2-CB 4.05Å; F112-N229 WeakPolarHBondContact CG-ND2 3.48Å
113	P	96.2	Very high	90.7	Very high	73 Å²	73	78.4 Å²	78.4	47%	0.474	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	143	-179.8	31.4	-34.1	0	0	0	111.1	I104 C106	I104-P113 HydrophobicContact CB-CB 4.26Å; I104-P113 HydrophobicContact CG2-CB 4.31Å; C106-P113 VanDerWaalsContact SG-CA 3.58Å; C106-P113 VanDerWaalsContact SG-N 3.41Å
114	V	96.6	Very high	92.4	Very high	9 Å²	9	68.1 Å²	68.1	6%	0.055	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	125.4	168.7	179.4	0	0	0	0	108.4	F112 L116 S126 F128 I225 V325	F112-V114 HydrophobicContact CD2-CG2 3.81Å; F112-V114 HydrophobicContact CE2-CG2 3.64Å; V114-L116 HydrophobicContact CG1-CD2 3.67Å; V114-L116 HydrophobicContact CG1-CG 4.07Å; V114-S126 PolarHBondContact N-O 2.75Å; V114-S126 PolarHBondContact O-N 3Å; V114-F128 HydrophobicContact CB-CD2 4.26Å; V114-F128 HydrophobicContact CB-CE2 4.12Å; V114-F128 HydrophobicContact CG1-CE2 4.25Å; V114-F128 HydrophobicContact CG2-CD2 3.6Å; V114-F128 HydrophobicContact CG2-CE2 3.86Å; V114-F128 HydrophobicContact CG2-CG 4.25Å; V114-I225 HydrophobicContact CG1-CG2 4.3Å; V114-I225 HydrophobicContact CG2-CG2 4.16Å; V114-V325 HydrophobicContact CG1-CG1 4.35Å
115	K	96.9	Very high	93.6	Very high	76 Å²	76	67.2 Å²	67.2	33%	0.33	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	112.4	174.6	-175	178.1	-179.6	-176	0	109.2	V124 E326	K115-V124 CarbonylContact C-O 3.55Å; K115-V124 WeakPolarHBondContact CA-O 3.49Å; K115-E326 HydrophobicContact CB-CB 4.39Å; K115-E326 HydrophobicContact CD-CB 4.42Å
116	L	97.5	Very high	94.3	Very high	7 Å²	7	59.9 Å²	59.9	4%	0.037	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.9	179.1	-57.7	178.3	0	0	0	109.6	V114 Y118 T123 V124 L222 I225 V325 F330	V114-L116 HydrophobicContact CG1-CD2 3.67Å; V114-L116 HydrophobicContact CG1-CG 4.07Å; L116-Y118 HydrophobicContact CB-CE2 3.94Å; L116-T123 CarbonylContact O-C 3.54Å; L116-T123 VanDerWaalsContact O-CA 3.29Å; L116-T123 WeakPolarHBondContact O-CA 3.46Å; L116-V124 PolarHBondContact N-O 3.39Å; L116-V124 PolarHBondContact O-N 3.11Å; L116-L222 HydrophobicContact CD1-CD2 3.69Å; L116-L222 HydrophobicContact CD2-CD2 4.3Å; L116-I225 HydrophobicContact CD2-CD1 4Å; L116-V325 HydrophobicContact CD2-CG1 3.94Å; L116-F330 HydrophobicContact CD1-CD2 4.28Å; L116-F330 HydrophobicContact CD1-CE2 4.43Å; L116-F330 HydrophobicContact CD1-CG 4.48Å; L116-F330 HydrophobicContact CD2-CD2 3.83Å; L116-F330 HydrophobicContact CD2-CE2 4.31Å
117	L	97.3	Very high	94.6	Very high	31 Å²	31	60.5 Å²	60.5	16%	0.162	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	135.5	167.1	176.2	62.5	0	0	0	109.1	T123 P329 F330	L117-T123 HydrophobicContact CD1-CG2 3.93Å; L117-P329 HydrophobicContact CD2-CG 4.2Å; L117-P329 HydrophobicContact CG-CG 4.47Å; L117-P329 CarbonylContact O-C 3.47Å; L117-P329 VanDerWaalsContact O-CA 3.29Å; L117-P329 WeakPolarHBondContact O-CA 3.29Å; L117-F330 WeakPolarHBondContact O-CB 3.29Å; L117-F330 PolarHBondContact O-N 3.48Å
118	Y	96.1	Very high	95.1	Very high	62 Å²	62	55 Å²	55	24%	0.243	30%	0.296	C	S	.	.			trans	-108.3	159.1	170.7	-71	-97.3	0	0	0	110.3	L116 S120 N121 K122 V124 F330	L116-Y118 HydrophobicContact CB-CE2 3.94Å; Y118-S120 PolarHBondContact O-N 2.88Å; Y118-N121 WeakPolarHBondContact O-CA 3.49Å; Y118-N121 PolarHBondContact O-N 3.24Å; Y118-K122 WeakPolarHBondContact CB-O 3.22Å; Y118-K122 PolarHBondContact N-O 3.43Å; Y118-V124 HydrophobicContact CD2-CG2 4.03Å; Y118-V124 HydrophobicContact CE2-CB 3.83Å; Y118-V124 HydrophobicContact CE2-CG2 3.54Å; Y118-F330 HydrophobicContact CE1-CB 4.44Å; Y118-F330 AromaticContact CE1-CD1 3.95Å; Y118-F330 HydrophobicContact CE1-CD1 3.95Å
119	R	94.3	Very high	95.5	Very high	74 Å²	74	52.5 Å²	52.5	28%	0.279	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-21.4	179.3	-74.1	-168.4	175.7	-97.5	9.5	114.5	N121 E296 F297 N298 P329	R119-N121 PolarHBondContact O-N 3.45Å; R119-E296 WeakPolarHBondContact CD-O 3.44Å; R119-E296 PolarHBondContact NE-O 3.45Å; R119-F297 VanDerWaalsContact NH2-CE2 3.27Å; R119-N298 PolarHBondContact NH1-OD1 3.18Å; R119-P329 HydrophobicContact CG-CB 3.53Å; R119-P329 HydrophobicContact CG-CG 4.22Å
120	S	93	Very high	95.9	Very high	94 Å²	94	47.5 Å²	47.5	66%	0.657	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	4.3	169.7	56.8	0	0	0	0	113.5	Y118 K122	Y118-S120 PolarHBondContact O-N 2.88Å; S120-K122 PolarHBondContact O-N 2.9Å; S120-K122 VanDerWaalsContact O-N 3.16Å; S120-K122 WeakPolarHBondContact OG-CB 3.5Å; S120-K122 PolarHBondContact OG-N 2.83Å
121	N	93.4	Very high	95.9	Very high	137 Å²	137	46.5 Å²	46.5	73%	0.733	25%	0.248	S	C	*	.	S	Bend	trans	60.7	9.6	-167.4	-61.8	-31.4	0	0	0	114.3	Y118 R119	Y118-N121 WeakPolarHBondContact O-CA 3.49Å; Y118-N121 PolarHBondContact O-N 3.24Å; R119-N121 PolarHBondContact O-N 3.45Å
122	K	94.8	Very high	96	Very high	87 Å²	87	45.9 Å²	45.9	38%	0.378	24%	0.244	S	C	.	.			trans	-69.3	131	167.8	-175.2	173.5	-174.3	169.2	0	108.7	E96 Y118 S120 V124	E96-K122 IonicContact OE1-NZ 2.72Å; E96-K122 PolarHBondContact OE1-NZ 3.37Å; Y118-K122 WeakPolarHBondContact CB-O 3.22Å; Y118-K122 PolarHBondContact N-O 3.43Å; S120-K122 PolarHBondContact O-N 2.9Å; S120-K122 VanDerWaalsContact O-N 3.16Å; S120-K122 WeakPolarHBondContact OG-CB 3.5Å; S120-K122 PolarHBondContact OG-N 2.83Å; K122-V124 HydrophobicContact CD-CG2 4.45Å; K122-V124 HydrophobicContact CG-CG2 4.37Å
123	T	95.9	Very high	96.1	Very high	50 Å²	50	46.2 Å²	46.2	31%	0.307	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.2	167.3	55.3	0	0	0	0	109.8	L116 L117	L116-T123 CarbonylContact O-C 3.54Å; L116-T123 VanDerWaalsContact O-CA 3.29Å; L116-T123 WeakPolarHBondContact O-CA 3.46Å; L117-T123 HydrophobicContact CD1-CG2 3.93Å
124	V	95.3	Very high	96.2	Very high	20 Å²	20	45 Å²	45	12%	0.121	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	139.8	173.1	176	0	0	0	0	108.6	P94 K115 L116 Y118 K122	P94-V124 HydrophobicContact CB-CG1 3.5Å; P94-V124 VanDerWaalsContact CB-CG1 3.5Å; P94-V124 HydrophobicContact CG-CB 4.4Å; P94-V124 HydrophobicContact CG-CG1 3.47Å; P94-V124 VanDerWaalsContact CG-CG1 3.47Å; P94-V124 HydrophobicContact CG-CG2 4.18Å; K115-V124 CarbonylContact C-O 3.55Å; K115-V124 WeakPolarHBondContact CA-O 3.49Å; L116-V124 PolarHBondContact N-O 3.39Å; L116-V124 PolarHBondContact O-N 3.11Å; Y118-V124 HydrophobicContact CD2-CG2 4.03Å; Y118-V124 HydrophobicContact CE2-CB 3.83Å; Y118-V124 HydrophobicContact CE2-CG2 3.54Å; K122-V124 HydrophobicContact CD-CG2 4.45Å; K122-V124 HydrophobicContact CG-CG2 4.37Å
125	S	95.1	Very high	96.1	Very high	35 Å²	35	49.5 Å²	49.5	25%	0.245	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	121.1	-164.5	-102.7	0	0	0	0	107.4	I104	I104-S125 WeakPolarHBondContact CD1-OG 3.42Å
126	S	94.3	Very high	96.2	Very high	27 Å²	27	47.7 Å²	47.7	19%	0.189	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	151.7	-172.4	-167.1	0	0	0	0	111.7	V114	V114-S126 PolarHBondContact N-O 2.75Å; V114-S126 PolarHBondContact O-N 3Å
127	C	96	Very high	96.2	Very high	43 Å²	43	47.5 Å²	47.5	29%	0.291	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	106	171.8	-73.2	0	0	0	0	109	I104 C106	I104-C127 VanDerWaalsContact CG2-SG 3.59Å; C106-C127 WeakPolarHBondContact CA-SG 3.49Å; C106-C127 HydrophobicContact CB-CB 3.8Å; C106-C127 WeakPolarHBondContact CB-SG 3.34Å; C106-C127 VanDerWaalsContact SG-CA 3.57Å; C106-C127 WeakPolarHBondContact SG-CB 3.15Å; C106-C127 CovalentContact SG-SG 2.04Å; C106-C127 PolarHBondContact SG-SG 3.16Å
128	F	97.2	Very high	96.2	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	150.8	172	-67.3	-12.8	0	0	0	110.1	T111 F112 V114 N212 F213 L222	T111-F128 CarbonylContact C-O 3.46Å; T111-F128 WeakPolarHBondContact CA-O 3.41Å; T111-F128 WeakPolarHBondContact CB-O 3.35Å; F112-F128 HydrophobicContact CD1-CB 4.31Å; F112-F128 WeakPolarHBondContact CD1-O 3.49Å; F112-F128 HydrophobicContact CD2-CB 4.36Å; F112-F128 HydrophobicContact CE1-CB 3.73Å; F112-F128 HydrophobicContact CE2-CB 3.81Å; F112-F128 AromaticContact CE2-CD2 3.99Å; F112-F128 HydrophobicContact CE2-CD2 3.99Å; F112-F128 HydrophobicContact CE2-CG 4.39Å; F112-F128 HydrophobicContact CZ-CB 3.45Å; F112-F128 VanDerWaalsContact CZ-CB 3.45Å; F112-F128 HydrophobicContact CZ-CD2 4.05Å; F112-F128 HydrophobicContact CZ-CG 4.29Å; F112-F128 PolarHBondContact N-O 3.41Å; F112-F128 PolarHBondContact O-N 3.29Å; V114-F128 HydrophobicContact CB-CD2 4.26Å; V114-F128 HydrophobicContact CB-CE2 4.12Å; V114-F128 HydrophobicContact CG1-CE2 4.25Å; V114-F128 HydrophobicContact CG2-CD2 3.6Å; V114-F128 HydrophobicContact CG2-CE2 3.86Å; V114-F128 HydrophobicContact CG2-CG 4.25Å; F128-N212 WeakPolarHBondContact CA-OD1 3.36Å; F128-F213 HydrophobicContact CD1-CD1 4.34Å; F128-F213 HydrophobicContact CD2-CD1 4.38Å; F128-F213 HydrophobicContact CD2-CE1 4.11Å; F128-F213 HydrophobicContact CE1-CD1 4.35Å; F128-F213 HydrophobicContact CE2-CD1 4.4Å; F128-F213 HydrophobicContact CE2-CE1 4.25Å; F128-F213 HydrophobicContact CG-CD1 4.38Å; F128-F213 HydrophobicContact CG-CE1 4.43Å; F128-F213 HydrophobicContact CZ-CD1 4.39Å; F128-L222 HydrophobicContact CE2-CB 4.12Å; F128-L222 HydrophobicContact CE2-CD2 4.18Å; F128-L222 HydrophobicContact CZ-CB 4.27Å; F128-L222 HydrophobicContact CZ-CD1 4.04Å; F128-L222 HydrophobicContact CZ-CD2 3.99Å; F128-L222 HydrophobicContact CZ-CG 4.33Å
129	R	97.3	Very high	96.2	Very high	75 Å²	75	47.8 Å²	47.8	28%	0.283	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	137.4	-175.5	-170.1	170.2	56.4	77.1	2.9	110.2	H110 T111 V131 F211 N212	H110-R129 WeakPolarHBondContact O-CA 3.48Å; T111-R129 HydrophobicContact CG2-CB 3.79Å; T111-R129 HydrophobicContact CG2-CG 3.79Å; R129-V131 PolarHBondContact O-N 2.7Å; R129-F211 WeakPolarHBondContact O-CA 3.41Å; R129-N212 HydrophobicContact CB-CB 4.06Å; R129-N212 PolarHBondContact N-OD1 2.88Å; R129-N212 PolarHBondContact O-N 3.11Å; R129-N212 VanDerWaalsContact O-N 3.12Å; R129-N212 PolarHBondContact O-OD1 2.71Å
130	Y	98	Very high	96.4	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	114.4	164.7	-48.2	-71.4	0	0	0	109.3	H110 F112 L133 V209 Q210 F211 N229 W230 Y234	H110-Y130 HydrophobicContact CB-CD2 4.11Å; H110-Y130 WeakPolarHBondContact O-CD2 3.43Å; H110-Y130 PolarHBondContact O-N 3.3Å; F112-Y130 HydrophobicContact CD1-CD2 4.39Å; F112-Y130 HydrophobicContact CD1-CE1 4.23Å; F112-Y130 AromaticContact CD1-CE2 3.67Å; F112-Y130 HydrophobicContact CD1-CE2 3.67Å; F112-Y130 AromaticContact CD1-CZ 3.59Å; F112-Y130 HydrophobicContact CE1-CD1 4.19Å; F112-Y130 HydrophobicContact CE1-CD2 4.43Å; F112-Y130 AromaticContact CE1-CE1 3.56Å; F112-Y130 HydrophobicContact CE1-CE1 3.56Å; F112-Y130 AromaticContact CE1-CE2 3.86Å; F112-Y130 HydrophobicContact CE1-CE2 3.86Å; F112-Y130 AromaticContact CE1-CZ 3.39Å; F112-Y130 HydrophobicContact CZ-CE1 4.28Å; Y130-L133 HydrophobicContact CD2-CD2 3.78Å; Y130-L133 HydrophobicContact CG-CD2 3.97Å; Y130-V209 HydrophobicContact CD1-CG1 3.9Å; Y130-V209 HydrophobicContact CE1-CG1 4.42Å; Y130-Q210 CarbonylContact C-O 3.43Å; Y130-Q210 WeakPolarHBondContact CA-O 3.44Å; Y130-F211 AromaticContact CD1-CD1 3.77Å; Y130-F211 HydrophobicContact CD1-CD1 3.77Å; Y130-F211 AromaticContact CD1-CE1 3.72Å; Y130-F211 HydrophobicContact CD1-CE1 3.72Å; Y130-F211 HydrophobicContact CE1-CD1 4.03Å; Y130-F211 AromaticContact CE1-CE1 3.69Å; Y130-F211 HydrophobicContact CE1-CE1 3.69Å; Y130-N229 PolarHBondContact OH-ND2 2.86Å; Y130-W230 HydrophobicContact CE1-CB 3.83Å; Y130-W230 HydrophobicContact CE1-CG 4.39Å; Y130-W230 WeakPolarHBondContact OH-CA 3.26Å; Y130-W230 PolarHBondContact OH-N 3.42Å; Y130-Y234 HydrophobicContact CD2-CE2 4.26Å; Y130-Y234 AromaticContact CE2-CE2 3.81Å; Y130-Y234 HydrophobicContact CE2-CE2 3.81Å
131	V	97.2	Very high	96.5	Very high	38 Å²	38	49.5 Å²	49.5	23%	0.23	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-44.5	179.6	-177.8	0	0	0	0	110.5	R129 E187 Q210 N212	R129-V131 PolarHBondContact O-N 2.7Å; V131-E187 WeakPolarHBondContact CG2-OE1 3.48Å; V131-Q210 HydrophobicContact CB-CB 4.08Å; V131-Q210 HydrophobicContact CB-CG 3.86Å; V131-Q210 HydrophobicContact CG1-CG 4.44Å; V131-Q210 HydrophobicContact CG2-CG 4.27Å; V131-Q210 PolarHBondContact N-O 3.04Å; V131-N212 HydrophobicContact CG2-CB 3.89Å
132	L	98.1	Very high	96.7	Very high	7 Å²	7	44.2 Å²	44.2	4%	0.037	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.5	172.4	-58.1	176.8	0	0	0	107.9	L198 W202 V209 Q210	L132-L198 HydrophobicContact CD1-CD2 4.07Å; L132-L198 HydrophobicContact CD1-CG 4.14Å; L132-W202 HydrophobicContact CB-CD2 4.24Å; L132-W202 HydrophobicContact CB-CG 4.02Å; L132-W202 HydrophobicContact CD1-CB 3.91Å; L132-W202 HydrophobicContact CD1-CG 4.09Å; L132-W202 HydrophobicContact CD2-CD2 4.21Å; L132-W202 HydrophobicContact CD2-CE3 4.26Å; L132-W202 HydrophobicContact CD2-CG 4.44Å; L132-W202 HydrophobicContact CG-CG 4.41Å; L132-V209 WeakPolarHBondContact O-CA 3.34Å; L132-Q210 HydrophobicContact CB-CB 3.81Å; L132-Q210 HydrophobicContact CD1-CB 4.19Å; L132-Q210 VanDerWaalsContact CD1-OE1 3.26Å; L132-Q210 HydrophobicContact CG-CB 3.96Å; L132-Q210 VanDerWaalsContact CG-OE1 3.29Å; L132-Q210 PolarHBondContact O-N 3.4Å
133	L	97.7	Very high	96.8	Very high	19 Å²	19	43.4 Å²	43.4	10%	0.099	22%	0.22	C	C	.	.			trans	-160.2	130.7	-172.2	171.7	62.3	0	0	0	110.2	H110 Y130 E135 W202 W230 Y234	H110-L133 HydrophobicContact CB-CD2 4.36Å; Y130-L133 HydrophobicContact CD2-CD2 3.78Å; Y130-L133 HydrophobicContact CG-CD2 3.97Å; L133-E135 HydrophobicContact CD2-CG 3.92Å; L133-E135 HydrophobicContact CG-CG 4.15Å; L133-W202 WeakPolarHBondContact O-CZ2 3.28Å; L133-W230 VanDerWaalsContact CD1-NE1 3.26Å; L133-Y234 HydrophobicContact CD1-CD2 4.11Å; L133-Y234 HydrophobicContact CD1-CE2 3.95Å; L133-Y234 HydrophobicContact CD2-CE1 4.38Å; L133-Y234 HydrophobicContact CD2-CE2 3.88Å; L133-Y234 WeakPolarHBondContact CD2-OH 3.4Å
134	R	97.6	Very high	96.9	Very high	49 Å²	49	47 Å²	47	19%	0.185	23%	0.233	C	C	.	.			trans	-100.6	105.2	161	-179.2	168.9	174.4	167.1	3.6	108.8	D136 F137 E206	R134-D136 VanDerWaalsContact C-N 3.3Å; R134-D136 WeakPolarHBondContact CG-OD1 3.45Å; R134-D136 IonicContact CZ-OD1 3.25Å; R134-D136 IonicContact NE-OD1 2.83Å; R134-D136 PolarHBondContact NE-OD1 3.24Å; R134-D136 IonicContact NH2-OD1 3.89Å; R134-D136 PolarHBondContact NH2-OD1 3.08Å; R134-D136 PolarHBondContact O-N 3.22Å; R134-F137 HydrophobicContact CB-CB 4.41Å; R134-F137 HydrophobicContact CG-CB 4.38Å; R134-F137 VanDerWaalsContact O-CB 3.32Å; R134-F137 WeakPolarHBondContact O-CB 3.29Å; R134-F137 PolarHBondContact O-N 3.46Å; R134-E206 IonicContact CZ-OE1 2.71Å; R134-E206 IonicContact CZ-OE2 2.88Å; R134-E206 VanDerWaalsContact NH1-CD 3.34Å; R134-E206 IonicContact NH1-OE1 3.81Å; R134-E206 PolarHBondContact NH1-OE1 3.42Å; R134-E206 IonicContact NH1-OE2 3.6Å; R134-E206 PolarHBondContact NH1-OE2 2.96Å
135	E	96.3	Very high	97	Very high	103 Å²	103	46.3 Å²	46.3	48%	0.481	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-35.9	-175.2	-70.5	-174.7	-133.9	0	0	113.3	H110 L133 F137 Q139 Y234	H110-E135 IonicContact CD2-OE1 3.48Å; H110-E135 IonicContact CE1-OE1 2.87Å; H110-E135 IonicContact NE2-OE1 3.61Å; H110-E135 PolarHBondContact NE2-OE1 3.3Å; L133-E135 HydrophobicContact CD2-CG 3.92Å; L133-E135 HydrophobicContact CG-CG 4.15Å; E135-F137 VanDerWaalsContact C-N 3.28Å; E135-F137 PolarHBondContact O-N 3.3Å; E135-Q139 PolarHBondContact O-OE1 3.25Å; E135-Y234 HydrophobicContact CB-CD1 4.36Å; E135-Y234 HydrophobicContact CB-CE1 3.96Å; E135-Y234 HydrophobicContact CG-CE1 3.92Å; E135-Y234 WeakPolarHBondContact O-CD1 3.24Å
136	D	97.2	Very high	97.1	Very high	38 Å²	38	45.7 Å²	45.7	20%	0.203	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	22.8	-177.2	68.7	9.1	0	0	0	113.6	R134 C138 Q139 K140 K141	R134-D136 VanDerWaalsContact C-N 3.3Å; R134-D136 WeakPolarHBondContact CG-OD1 3.45Å; R134-D136 IonicContact CZ-OD1 3.25Å; R134-D136 IonicContact NE-OD1 2.83Å; R134-D136 PolarHBondContact NE-OD1 3.24Å; R134-D136 IonicContact NH2-OD1 3.89Å; R134-D136 PolarHBondContact NH2-OD1 3.08Å; R134-D136 PolarHBondContact O-N 3.22Å; D136-C138 PolarHBondContact O-N 2.99Å; D136-Q139 VanDerWaalsContact C-OE1 3.31Å; D136-Q139 HydrophobicContact CB-CB 4.41Å; D136-Q139 PolarHBondContact O-N 3.15Å; D136-K140 HydrophobicContact CB-CB 4.15Å; D136-K140 HydrophobicContact CB-CD 4.33Å; D136-K140 HydrophobicContact CB-CG 3.97Å; D136-K140 PolarHBondContact O-N 3.26Å; D136-K140 WeakPolarHBondContact OD2-CD 3.41Å; D136-K140 VanDerWaalsContact OD2-CE 3.24Å; D136-K140 WeakPolarHBondContact OD2-CE 3.39Å; D136-K140 IonicContact OD2-NZ 3.64Å; D136-K140 PolarHBondContact OD2-NZ 2.94Å; D136-K141 PolarHBondContact O-N 3.08Å
137	F	97.9	Very high	97.3	Very high	3 Å²	3	44.4 Å²	44.4	1%	0.013	21%	0.213	C	C	.	.	I	π-helix	trans	-55.9	-50.9	-174	-173.4	-91.3	0	0	0	112.4	R134 E135 K141 Y142 I148 A180 V181 V182 E206 D207 W230	R134-F137 HydrophobicContact CB-CB 4.41Å; R134-F137 HydrophobicContact CG-CB 4.38Å; R134-F137 VanDerWaalsContact O-CB 3.32Å; R134-F137 WeakPolarHBondContact O-CB 3.29Å; R134-F137 PolarHBondContact O-N 3.46Å; E135-F137 VanDerWaalsContact C-N 3.28Å; E135-F137 PolarHBondContact O-N 3.3Å; F137-K141 HydrophobicContact CD2-CD 4.18Å; F137-K141 HydrophobicContact CE2-CD 4.16Å; F137-K141 VanDerWaalsContact O-CB 3.25Å; F137-K141 WeakPolarHBondContact O-CB 2.69Å; F137-K141 PolarHBondContact O-N 3.1Å; F137-Y142 AromaticContact CD1-CD2 3.85Å; F137-Y142 HydrophobicContact CD1-CD2 3.85Å; F137-Y142 HydrophobicContact CD1-CE2 4.36Å; F137-Y142 HydrophobicContact CD2-CD2 4.46Å; F137-Y142 HydrophobicContact CD2-CE2 4.34Å; F137-Y142 AromaticContact CE1-CD2 3.44Å; F137-Y142 HydrophobicContact CE1-CD2 3.44Å; F137-Y142 VanDerWaalsContact CE1-CD2 3.44Å; F137-Y142 AromaticContact CE1-CE2 3.67Å; F137-Y142 HydrophobicContact CE1-CE2 3.67Å; F137-Y142 HydrophobicContact CE2-CD2 4.11Å; F137-Y142 AromaticContact CE2-CE2 3.66Å; F137-Y142 HydrophobicContact CE2-CE2 3.66Å; F137-Y142 HydrophobicContact CG-CD2 4.34Å; F137-Y142 AromaticContact CZ-CD2 3.6Å; F137-Y142 HydrophobicContact CZ-CD2 3.6Å; F137-Y142 AromaticContact CZ-CE2 3.28Å; F137-Y142 HydrophobicContact CZ-CE2 3.28Å; F137-Y142 PolarHBondContact O-N 2.77Å; F137-I148 HydrophobicContact CE1-CD1 3.88Å; F137-A180 HydrophobicContact CE1-CB 4.23Å; F137-V181 WeakPolarHBondContact CZ-O 3.46Å; F137-V182 HydrophobicContact CZ-CB 4.43Å; F137-E206 WeakPolarHBondContact CD2-O 3.43Å; F137-E206 WeakPolarHBondContact CE2-O 3.28Å; F137-D207 HydrophobicContact CE2-CB 4.18Å; F137-W230 HydrophobicContact CB-CZ2 4.29Å; F137-W230 AromaticContact CD1-CH2 3.9Å; F137-W230 HydrophobicContact CD1-CH2 3.9Å; F137-W230 AromaticContact CD1-CZ2 4Å; F137-W230 HydrophobicContact CD1-CZ2 4Å; F137-W230 HydrophobicContact CE1-CH2 4.2Å; F137-W230 HydrophobicContact CG-CZ2 4.2Å
138	C	98.1	Very high	97.5	Very high	7 Å²	7	42.4 Å²	42.4	5%	0.047	20%	0.2	C	C	.	.	I	π-helix	trans	-92.5	-4	177.6	-68.3	0	0	0	0	113.8	D136 Y142 P143 I145 Y234 C235	D136-C138 PolarHBondContact O-N 2.99Å; C138-Y142 CarbonylContact O-C 3.49Å; C138-Y142 VanDerWaalsContact O-C 3.31Å; C138-P143 VanDerWaalsContact O-CA 3.25Å; C138-P143 WeakPolarHBondContact O-CA 3.31Å; C138-I145 HydrophobicContact CB-CG2 4.12Å; C138-I145 VanDerWaalsContact SG-CD1 3.59Å; C138-Y234 VanDerWaalsContact CB-O 3.3Å; C138-Y234 WeakPolarHBondContact CB-O 3.31Å; C138-C235 HydrophobicContact CB-CB 3.76Å; C138-C235 WeakPolarHBondContact CB-SG 3.26Å; C138-C235 WeakPolarHBondContact SG-CB 3.44Å; C138-C235 CovalentContact SG-SG 2.04Å; C138-C235 PolarHBondContact SG-SG 2.62Å
139	Q	96.7	Very high	97.5	Very high	91 Å²	91	42.2 Å²	42.2	43%	0.425	20%	0.199	S	C	.	.	I	π-helix	trans	-93.6	-46	179.8	-66.2	76.2	2.8	0	0	111.4	E135 D136 Y234	E135-Q139 PolarHBondContact O-OE1 3.25Å; D136-Q139 VanDerWaalsContact C-OE1 3.31Å; D136-Q139 HydrophobicContact CB-CB 4.41Å; D136-Q139 PolarHBondContact O-N 3.15Å; Q139-Y234 PolarHBondContact NE2-O 3.4Å; Q139-Y234 PolarHBondContact OE1-O 2.74Å
140	K	96.7	Very high	97.6	Very high	154 Å²	154	38.6 Å²	38.6	67%	0.67	19%	0.185	S	C	*	.	I	π-helix	trans	-105.4	-44.2	-178.9	-68.4	-163	-155.3	138.9	0	113.2	D136	D136-K140 HydrophobicContact CB-CB 4.15Å; D136-K140 HydrophobicContact CB-CD 4.33Å; D136-K140 HydrophobicContact CB-CG 3.97Å; D136-K140 PolarHBondContact O-N 3.26Å; D136-K140 WeakPolarHBondContact OD2-CD 3.41Å; D136-K140 VanDerWaalsContact OD2-CE 3.24Å; D136-K140 WeakPolarHBondContact OD2-CE 3.39Å; D136-K140 IonicContact OD2-NZ 3.64Å; D136-K140 PolarHBondContact OD2-NZ 2.94Å
141	K	96.5	Very high	97.7	Very high	51 Å²	51	38.5 Å²	38.5	22%	0.222	19%	0.185	C	C	.	.	I	π-helix	trans	-78.1	-40.5	-176.3	-164.3	-179.5	-175.3	161.2	0	111.7	D136 F137 Y205 E206	D136-K141 PolarHBondContact O-N 3.08Å; F137-K141 HydrophobicContact CD2-CD 4.18Å; F137-K141 HydrophobicContact CE2-CD 4.16Å; F137-K141 VanDerWaalsContact O-CB 3.25Å; F137-K141 WeakPolarHBondContact O-CB 2.69Å; F137-K141 PolarHBondContact O-N 3.1Å; K141-Y205 PolarHBondContact NZ-O 3.13Å; K141-E206 PolarHBondContact NZ-O 2.76Å; K141-E206 IonicContact NZ-OE2 2.97Å
142	Y	97.7	Very high	97.7	Very high	26 Å²	26	37.2 Å²	37.2	10%	0.102	18%	0.176	C	C	.	.	S	Bend	trans	-132.7	58.6	-177.1	-56.5	-65.3	0	0	0	114	F137 C138 E144 I145 Y174 A180	F137-Y142 AromaticContact CD1-CD2 3.85Å; F137-Y142 HydrophobicContact CD1-CD2 3.85Å; F137-Y142 HydrophobicContact CD1-CE2 4.36Å; F137-Y142 HydrophobicContact CD2-CD2 4.46Å; F137-Y142 HydrophobicContact CD2-CE2 4.34Å; F137-Y142 AromaticContact CE1-CD2 3.44Å; F137-Y142 HydrophobicContact CE1-CD2 3.44Å; F137-Y142 VanDerWaalsContact CE1-CD2 3.44Å; F137-Y142 AromaticContact CE1-CE2 3.67Å; F137-Y142 HydrophobicContact CE1-CE2 3.67Å; F137-Y142 HydrophobicContact CE2-CD2 4.11Å; F137-Y142 AromaticContact CE2-CE2 3.66Å; F137-Y142 HydrophobicContact CE2-CE2 3.66Å; F137-Y142 HydrophobicContact CG-CD2 4.34Å; F137-Y142 AromaticContact CZ-CD2 3.6Å; F137-Y142 HydrophobicContact CZ-CD2 3.6Å; F137-Y142 AromaticContact CZ-CE2 3.28Å; F137-Y142 HydrophobicContact CZ-CE2 3.28Å; F137-Y142 PolarHBondContact O-N 2.77Å; C138-Y142 CarbonylContact O-C 3.49Å; C138-Y142 VanDerWaalsContact O-C 3.31Å; Y142-E144 VanDerWaalsContact C-N 3.27Å; Y142-E144 PolarHBondContact O-N 2.96Å; Y142-I145 WeakPolarHBondContact O-CB 3.4Å; Y142-I145 PolarHBondContact O-N 2.86Å; Y142-Y174 VanDerWaalsContact C-OH 3.25Å; Y142-Y174 WeakPolarHBondContact CA-OH 3.29Å; Y142-Y174 AromaticContact CD1-CD1 3.75Å; Y142-Y174 HydrophobicContact CD1-CD1 3.75Å; Y142-Y174 AromaticContact CD1-CD2 3.33Å; Y142-Y174 HydrophobicContact CD1-CD2 3.33Å; Y142-Y174 AromaticContact CD1-CE1 3.93Å; Y142-Y174 HydrophobicContact CD1-CE1 3.93Å; Y142-Y174 AromaticContact CD1-CE2 3.55Å; Y142-Y174 HydrophobicContact CD1-CE2 3.55Å; Y142-Y174 AromaticContact CD1-CG 3.44Å; Y142-Y174 HydrophobicContact CD1-CG 3.44Å; Y142-Y174 VanDerWaalsContact CD1-CG 3.44Å; Y142-Y174 AromaticContact CD1-CZ 3.83Å; Y142-Y174 HydrophobicContact CE1-CD1 4.1Å; Y142-Y174 HydrophobicContact CE1-CD2 4.02Å; Y142-Y174 AromaticContact CE1-CG 3.74Å; Y142-Y174 HydrophobicContact CE1-CG 3.74Å; Y142-Y174 HydrophobicContact CG-CD2 4.17Å; Y142-Y174 HydrophobicContact CG-CE2 4.09Å; Y142-A180 HydrophobicContact CD1-CB 3.92Å; Y142-A180 HydrophobicContact CD2-CB 3.62Å; Y142-A180 HydrophobicContact CE1-CB 4.09Å; Y142-A180 HydrophobicContact CE2-CB 3.81Å; Y142-A180 HydrophobicContact CG-CB 3.66Å
143	P	97.2	Very high	97.7	Very high	70 Å²	70	37 Å²	37	46%	0.455	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-29.5	-173.7	22.9	-34.9	0	0	0	115.4	C138 Y174	C138-P143 VanDerWaalsContact O-CA 3.25Å; C138-P143 WeakPolarHBondContact O-CA 3.31Å; P143-Y174 WeakPolarHBondContact CD-OH 3.48Å
144	E	97.4	Very high	97.7	Very high	124 Å²	124	37.2 Å²	37.2	58%	0.579	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.5	22.8	-175.7	-61.2	-179.6	102.3	0	0	112.2	Y142 F146 Y174 K178	Y142-E144 VanDerWaalsContact C-N 3.27Å; Y142-E144 PolarHBondContact O-N 2.96Å; E144-F146 PolarHBondContact O-N 3.49Å; E144-Y174 PolarHBondContact N-OH 3.13Å; E144-K178 HydrophobicContact CB-CD 3.94Å; E144-K178 VanDerWaalsContact O-CB 3.28Å; E144-K178 WeakPolarHBondContact O-CB 3.49Å; E144-K178 IonicContact OE1-NZ 3.96Å; E144-K178 IonicContact OE2-NZ 3.98Å; E144-K178 PolarHBondContact OE2-NZ 3.2Å
145	I	97.9	Very high	97.7	Very high	7 Å²	7	35.2 Å²	35.2	4%	0.036	18%	0.175	C	C	.	.			trans	-53.3	128.4	-174.5	-169.8	164.5	0	0	0	112.4	C138 Y142 I148 A180 A238	C138-I145 HydrophobicContact CB-CG2 4.12Å; C138-I145 VanDerWaalsContact SG-CD1 3.59Å; Y142-I145 WeakPolarHBondContact O-CB 3.4Å; Y142-I145 PolarHBondContact O-N 2.86Å; I145-I148 HydrophobicContact CD1-CB 3.64Å; I145-I148 HydrophobicContact CD1-CD1 3.9Å; I145-I148 HydrophobicContact CD1-CG1 4.22Å; I145-A180 HydrophobicContact CD1-CB 3.71Å; I145-A180 HydrophobicContact CG1-CB 4.46Å; I145-A238 HydrophobicContact CG1-CB 4.26Å; I145-A238 HydrophobicContact CG2-CB 3.93Å
146	F	97.4	Very high	97.6	Very high	22 Å²	22	36.7 Å²	36.7	10%	0.096	18%	0.176	C	C	.	.	S	Bend	trans	-99.6	-44.2	174.4	179	-132.8	0	0	0	111.1	E144 K178 K239 Y240 M256 F259 R260 K263	E144-F146 PolarHBondContact O-N 3.49Å; F146-K178 HydrophobicContact CB-CB 3.71Å; F146-K178 PolarHBondContact N-O 3.48Å; F146-K239 HydrophobicContact CD2-CB 3.73Å; F146-K239 HydrophobicContact CD2-CG 3.72Å; F146-K239 HydrophobicContact CE2-CB 3.68Å; F146-K239 HydrophobicContact CE2-CG 3.89Å; F146-K239 PolarHBondContact O-N 2.98Å; F146-Y240 AromaticContact CE2-CD2 3.89Å; F146-Y240 HydrophobicContact CE2-CD2 3.89Å; F146-Y240 AromaticContact CE2-CE2 3.75Å; F146-Y240 HydrophobicContact CE2-CE2 3.75Å; F146-Y240 AromaticContact CZ-CD2 3.89Å; F146-Y240 HydrophobicContact CZ-CD2 3.89Å; F146-Y240 AromaticContact CZ-CE2 3.68Å; F146-Y240 HydrophobicContact CZ-CE2 3.68Å; F146-Y240 PolarHBondContact O-N 2.68Å; F146-M256 HydrophobicContact CD1-CE 3.63Å; F146-M256 HydrophobicContact CE1-CE 4.15Å; F146-F259 HydrophobicContact CE1-CB 3.79Å; F146-F259 HydrophobicContact CZ-CB 3.9Å; F146-R260 HydrophobicContact CE1-CG 4.12Å; F146-K263 HydrophobicContact CE2-CD 3.81Å; F146-K263 HydrophobicContact CZ-CB 4.37Å; F146-K263 HydrophobicContact CZ-CD 4.21Å
147	V	98.3	Very high	97.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	129.2	179.2	-179.1	0	0	0	0	109.3	K178 L179 A180 Y240 L242 M256 F259	V147-K178 PolarHBondContact N-O 2.89Å; V147-L179 HydrophobicContact CB-CD1 3.9Å; V147-L179 HydrophobicContact CG1-CD1 3.77Å; V147-L179 WeakPolarHBondContact O-CA 3.03Å; V147-A180 PolarHBondContact O-N 3.45Å; V147-A180 VanDerWaalsContact O-N 3.08Å; V147-Y240 WeakPolarHBondContact CA-O 3.21Å; V147-Y240 HydrophobicContact CG2-CD2 4.42Å; V147-L242 HydrophobicContact CG1-CB 4.02Å; V147-M256 HydrophobicContact CB-CE 4.07Å; V147-M256 HydrophobicContact CB-SD 4.18Å; V147-M256 HydrophobicContact CG2-CE 3.58Å; V147-M256 HydrophobicContact CG2-SD 3.86Å; V147-F259 HydrophobicContact CG1-CD2 4.37Å; V147-F259 HydrophobicContact CG1-CE2 3.86Å; V147-F259 HydrophobicContact CG2-CD2 3.56Å; V147-F259 HydrophobicContact CG2-CE2 3.89Å; V147-F259 HydrophobicContact CG2-CG 4.25Å
148	I	98.6	Very high	97.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	115.3	168.8	-177.4	57.5	0	0	0	109.3	F137 I145 I150 A180 V182 W230 A238 Y240 I241 L242	F137-I148 HydrophobicContact CE1-CD1 3.88Å; I145-I148 HydrophobicContact CD1-CB 3.64Å; I145-I148 HydrophobicContact CD1-CD1 3.9Å; I145-I148 HydrophobicContact CD1-CG1 4.22Å; I148-I150 HydrophobicContact CG1-CD1 3.79Å; I148-A180 HydrophobicContact CD1-CB 4.19Å; I148-V182 HydrophobicContact CD1-CB 4.47Å; I148-V182 HydrophobicContact CD1-CG1 4.36Å; I148-W230 HydrophobicContact CD1-CH2 4.15Å; I148-W230 HydrophobicContact CD1-CZ3 4.3Å; I148-W230 HydrophobicContact CG1-CH2 4.21Å; I148-W230 HydrophobicContact CG1-CZ3 3.89Å; I148-A238 HydrophobicContact CB-CB 4.43Å; I148-A238 HydrophobicContact CG2-CB 3.98Å; I148-Y240 PolarHBondContact N-O 2.8Å; I148-Y240 VanDerWaalsContact N-O 3.1Å; I148-I241 HydrophobicContact CG2-CB 4.16Å; I148-I241 HydrophobicContact CG2-CG1 3.66Å; I148-I241 HydrophobicContact CG2-CG2 4.2Å; I148-I241 CarbonylContact O-C 3.57Å; I148-I241 WeakPolarHBondContact O-CA 3.49Å; I148-L242 PolarHBondContact O-N 3.3Å
149	A	98.8	Very high	97.5	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	124.4	172.3	0	0	0	0	0	109.8	W168 L179 A180 V181 V182 L242	A149-W168 HydrophobicContact CB-CH2 4.31Å; A149-W168 HydrophobicContact CB-CZ3 4.07Å; A149-L179 HydrophobicContact CB-CD1 4.14Å; A149-A180 PolarHBondContact N-O 3.41Å; A149-V181 HydrophobicContact CB-CB 4.28Å; A149-V181 HydrophobicContact CB-CG2 4.19Å; A149-V181 CarbonylContact O-C 3.49Å; A149-V181 WeakPolarHBondContact O-CA 3.37Å; A149-V182 PolarHBondContact O-N 3.15Å; A149-L242 CarbonylContact C-O 3.42Å; A149-L242 VanDerWaalsContact CA-O 3.24Å; A149-L242 WeakPolarHBondContact CA-O 3.48Å
150	I	98.9	Very high	97.5	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	111.1	173.5	-47.3	-61.4	0	0	0	107.9	I148 V182 A184 W227 W230 I241 L242 K243 V244	I148-I150 HydrophobicContact CG1-CD1 3.79Å; I150-V182 HydrophobicContact CD1-CG1 3.35Å; I150-V182 HydrophobicContact CG2-CG1 4.46Å; I150-A184 HydrophobicContact CG2-CB 3.84Å; I150-W227 HydrophobicContact CB-CD2 4.38Å; I150-W227 HydrophobicContact CG1-CD2 4.12Å; I150-W227 HydrophobicContact CG1-CE3 3.82Å; I150-W227 HydrophobicContact CG1-CG 4.49Å; I150-W227 HydrophobicContact CG1-CZ3 4.43Å; I150-W227 HydrophobicContact CG2-CB 3.83Å; I150-W227 HydrophobicContact CG2-CD2 3.99Å; I150-W227 HydrophobicContact CG2-CG 3.62Å; I150-W230 HydrophobicContact CD1-CE3 4.12Å; I150-W230 HydrophobicContact CD1-CZ3 3.75Å; I150-I241 HydrophobicContact CD1-CG2 4.43Å; I150-I241 HydrophobicContact CG1-CG2 3.58Å; I150-L242 PolarHBondContact N-O 2.97Å; I150-K243 WeakPolarHBondContact O-CA 3.28Å; I150-V244 PolarHBondContact O-N 3.22Å
151	V	98.8	Very high	97.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	117.6	178.5	178.1	0	0	0	0	110	T153 I164 W168 V181 V182 F183 A184 V244 D246	V151-T153 PolarHBondContact O-N 3.04Å; V151-I164 HydrophobicContact CG1-CD1 3.89Å; V151-W168 HydrophobicContact CG2-CH2 3.6Å; V151-W168 HydrophobicContact CG2-CZ2 3.79Å; V151-V181 HydrophobicContact CG2-CG2 3.7Å; V151-V182 PolarHBondContact N-O 3.3Å; V151-F183 HydrophobicContact CB-CD1 3.62Å; V151-F183 HydrophobicContact CB-CE1 3.95Å; V151-F183 HydrophobicContact CG1-CD1 3.77Å; V151-F183 HydrophobicContact CG1-CE1 3.98Å; V151-F183 HydrophobicContact CG2-CD1 4.24Å; V151-F183 HydrophobicContact CG2-CE1 4.1Å; V151-A184 PolarHBondContact O-N 3.29Å; V151-V244 CarbonylContact C-O 3.54Å; V151-V244 VanDerWaalsContact CA-O 3.25Å; V151-V244 WeakPolarHBondContact CA-O 3.41Å; V151-D246 HydrophobicContact CG1-CB 3.9Å
152	H	98.5	Very high	97.7	Very high	10 Å²	10	36.8 Å²	36.8	5%	0.046	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	117.6	168.1	-81.3	-137.6	0	0	0	108.9	W227 V244 D246 D334	H152-W227 AromaticContact CE1-NE1 3.76Å; H152-W227 AromaticContact NE2-CD1 3.22Å; H152-W227 AromaticContact NE2-NE1 2.95Å; H152-W227 PolarHBondContact NE2-NE1 2.95Å; H152-V244 PolarHBondContact N-O 3.49Å; H152-D246 WeakPolarHBondContact O-CB 3.23Å; H152-D246 PolarHBondContact O-N 3.29Å; H152-D334 IonicContact CE1-OD2 3.58Å
153	T	98	Very high	97.7	Very high	4 Å²	4	36.6 Å²	36.6	3%	0.025	18%	0.177	C	C	.	.			trans	-141.7	155.1	-178.4	173.9	0	0	0	0	109.2	V151 N157 R161 F183 A184 V185 K223 D246	V151-T153 PolarHBondContact O-N 3.04Å; T153-N157 WeakPolarHBondContact OG1-CB 3.43Å; T153-R161 HydrophobicContact CG2-CG 4.03Å; T153-R161 PolarHBondContact OG1-NH1 3.23Å; T153-F183 HydrophobicContact CG2-CB 3.86Å; T153-F183 HydrophobicContact CG2-CD1 4.05Å; T153-F183 HydrophobicContact CG2-CG 4.4Å; T153-A184 PolarHBondContact N-O 3.09Å; T153-V185 HydrophobicContact CG2-CG1 3.54Å; T153-K223 PolarHBondContact O-NZ 2.89Å; T153-K223 VanDerWaalsContact O-NZ 3.16Å; T153-D246 WeakPolarHBondContact CA-OD2 3.24Å; T153-D246 VanDerWaalsContact CB-OD2 3.31Å; T153-D246 WeakPolarHBondContact CB-OD2 3.42Å; T153-D246 PolarHBondContact OG1-OD2 3.13Å
154	G	96.8	Very high	97.7	Very high	22 Å²	22	33.2 Å²	33.2	23%	0.227	16%	0.155	C	C	.	.			trans	-86.5	157.5	167.8	0	0	0	0	0	111.5	R156 N157 R161	G154-R156 VanDerWaalsContact C-N 3.26Å; G154-R156 PolarHBondContact O-N 2.96Å; G154-N157 WeakPolarHBondContact O-CB 3.27Å; G154-N157 PolarHBondContact O-N 3.13Å; G154-N157 VanDerWaalsContact O-N 3.09Å; G154-R161 PolarHBondContact O-NH1 3.12Å
155	L	97.3	Very high	97.7	Very high	8 Å²	8	28.4 Å²	28.4	4%	0.042	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-40.8	-177.2	-65.9	78.8	0	0	0	112.3	N157 F158 R161 G186 D188 V194 L198 D215	L155-N157 VanDerWaalsContact C-N 3.28Å; L155-N157 PolarHBondContact O-N 3.37Å; L155-F158 WeakPolarHBondContact O-CE2 3.37Å; L155-F158 WeakPolarHBondContact O-CZ 3.45Å; L155-R161 PolarHBondContact O-NH1 3.08Å; L155-R161 PolarHBondContact O-NH2 3.24Å; L155-G186 WeakPolarHBondContact CD1-O 3.36Å; L155-D188 HydrophobicContact CD1-CB 4.46Å; L155-D188 HydrophobicContact CD2-CB 4.02Å; L155-V194 HydrophobicContact CB-CG1 3.56Å; L155-V194 HydrophobicContact CD2-CG1 4.23Å; L155-L198 HydrophobicContact CD2-CD2 4.21Å; L155-L198 HydrophobicContact CG-CD2 4.28Å; L155-D215 HydrophobicContact CD1-CB 3.5Å; L155-D215 VanDerWaalsContact CD1-CB 3.5Å
156	R	96	Very high	97.7	Very high	133 Å²	133	34.8 Å²	34.8	50%	0.502	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-8.9	-177.7	-57.7	-178.4	-168	-168.6	2	114.8	G154 F158 D188 H191 V194	G154-R156 VanDerWaalsContact C-N 3.26Å; G154-R156 PolarHBondContact O-N 2.96Å; R156-F158 WeakPolarHBondContact O-CD2 3.24Å; R156-F158 PolarHBondContact O-N 3.21Å; R156-D188 IonicContact CZ-OD2 3.56Å; R156-D188 IonicContact NE-OD2 3.08Å; R156-D188 PolarHBondContact NE-OD2 3.43Å; R156-D188 IonicContact NH2-OD2 2.65Å; R156-D188 PolarHBondContact NH2-OD2 3Å; R156-H191 PolarHBondContact NH2-CD2 3.36Å; R156-H191 PolarHBondContact NH2-CE1 3.29Å; R156-H191 PolarHBondContact NH2-ND1 3.3Å; R156-H191 PolarHBondContact NH2-NE2 3.42Å; R156-H191 VanDerWaalsContact NH2-NE2 3.11Å; R156-V194 HydrophobicContact CG-CG1 3.96Å; R156-V194 HydrophobicContact CG-CG2 4.09Å
157	N	96.7	Very high	97.6	Very high	43 Å²	43	34 Å²	34	23%	0.23	16%	0.156	C	C	.	.			trans	-81	37.7	-176.1	-71.1	-19	0	0	0	113.1	T153 G154 L155 K159 R160 R161 D246	T153-N157 WeakPolarHBondContact OG1-CB 3.43Å; G154-N157 WeakPolarHBondContact O-CB 3.27Å; G154-N157 PolarHBondContact O-N 3.13Å; G154-N157 VanDerWaalsContact O-N 3.09Å; L155-N157 VanDerWaalsContact C-N 3.28Å; L155-N157 PolarHBondContact O-N 3.37Å; N157-K159 VanDerWaalsContact C-N 3.27Å; N157-K159 PolarHBondContact O-N 3.44Å; N157-R160 HydrophobicContact CB-CB 4.17Å; N157-R160 HydrophobicContact CB-CG 4.36Å; N157-R160 WeakPolarHBondContact O-CB 3.36Å; N157-R160 PolarHBondContact O-N 3.26Å; N157-R160 PolarHBondContact OD1-NH1 3.29Å; N157-R161 PolarHBondContact O-N 3.32Å; N157-D246 WeakPolarHBondContact CB-OD2 3.35Å; N157-D246 PolarHBondContact ND2-OD2 2.85Å
158	F	96.7	Very high	97.5	Very high	52 Å²	52	34.1 Å²	34.1	23%	0.228	16%	0.157	C	C	.	.	H	α-helix	trans	-49.8	-45.3	178.2	-64.1	-82.5	0	0	0	112.5	L155 R156 R160 R161 S162 V194 T197 L198 E201	L155-F158 WeakPolarHBondContact O-CE2 3.37Å; L155-F158 WeakPolarHBondContact O-CZ 3.45Å; R156-F158 WeakPolarHBondContact O-CD2 3.24Å; R156-F158 PolarHBondContact O-N 3.21Å; F158-R160 VanDerWaalsContact C-N 3.35Å; F158-R160 PolarHBondContact O-N 2.81Å; F158-R161 PolarHBondContact O-N 3.13Å; F158-S162 WeakPolarHBondContact O-CB 3.38Å; F158-S162 PolarHBondContact O-N 3.49Å; F158-V194 HydrophobicContact CE2-CG1 4.31Å; F158-V194 HydrophobicContact CZ-CG1 4.37Å; F158-T197 HydrophobicContact CD1-CG2 4.08Å; F158-T197 HydrophobicContact CD2-CG2 4.49Å; F158-T197 HydrophobicContact CE1-CG2 3.52Å; F158-T197 HydrophobicContact CE2-CG2 3.95Å; F158-T197 HydrophobicContact CZ-CG2 3.46Å; F158-T197 VanDerWaalsContact CZ-CG2 3.46Å; F158-L198 HydrophobicContact CE1-CB 4.41Å; F158-L198 HydrophobicContact CE1-CD1 4.33Å; F158-L198 HydrophobicContact CZ-CB 4.39Å; F158-E201 WeakPolarHBondContact CD1-OE2 3.27Å; F158-E201 HydrophobicContact CE1-CB 4.48Å; F158-E201 VanDerWaalsContact CE1-OE2 3.26Å; F158-E201 WeakPolarHBondContact CE1-OE2 3.44Å
159	K	96.7	Very high	97.4	Very high	149 Å²	149	34.4 Å²	34.4	65%	0.648	16%	0.159	S	C	*	.	H	α-helix	trans	-65.2	-36	179.5	-65	-175.9	179	179.1	0	112.3	N157 L163 L382	N157-K159 VanDerWaalsContact C-N 3.27Å; N157-K159 PolarHBondContact O-N 3.44Å; K159-L163 WeakPolarHBondContact O-CB 3.15Å; K159-L163 PolarHBondContact O-N 3.5Å; K159-L382 HydrophobicContact CB-CD1 3.68Å; K159-L382 HydrophobicContact CD-CD1 4.43Å
160	R	97.3	Very high	97.3	Very high	70 Å²	70	36.8 Å²	36.8	26%	0.264	17%	0.172	S	C	.	.	H	α-helix	trans	-68	-48.2	175.5	-68.7	-176.1	168.3	101.1	-1.8	110.7	N157 F158 S162 L163 I164 D246 P379 L382	N157-R160 HydrophobicContact CB-CB 4.17Å; N157-R160 HydrophobicContact CB-CG 4.36Å; N157-R160 WeakPolarHBondContact O-CB 3.36Å; N157-R160 PolarHBondContact O-N 3.26Å; N157-R160 PolarHBondContact OD1-NH1 3.29Å; F158-R160 VanDerWaalsContact C-N 3.35Å; F158-R160 PolarHBondContact O-N 2.81Å; R160-S162 PolarHBondContact O-N 3.27Å; R160-L163 WeakPolarHBondContact O-CB 3.26Å; R160-L163 PolarHBondContact O-N 3.35Å; R160-L163 VanDerWaalsContact O-N 3.15Å; R160-I164 VanDerWaalsContact O-CG1 3.29Å; R160-I164 WeakPolarHBondContact O-CG1 3.38Å; R160-I164 PolarHBondContact O-N 2.97Å; R160-D246 HydrophobicContact CB-CB 4.24Å; R160-D246 VanDerWaalsContact CD-OD1 3.25Å; R160-D246 WeakPolarHBondContact CD-OD1 3.3Å; R160-D246 IonicContact NE-OD1 2.62Å; R160-P379 PolarHBondContact NH2-O 3.24Å; R160-L382 HydrophobicContact CB-CD2 4.49Å; R160-L382 HydrophobicContact CG-CD2 3.8Å
161	R	98.1	Very high	97	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58	-46.1	175.1	-64	-167.8	-71.6	-81.9	7.8	112.2	T153 G154 L155 N157 F158 L163 I164 R165 F183 E201	T153-R161 HydrophobicContact CG2-CG 4.03Å; T153-R161 PolarHBondContact OG1-NH1 3.23Å; G154-R161 PolarHBondContact O-NH1 3.12Å; L155-R161 PolarHBondContact O-NH1 3.08Å; L155-R161 PolarHBondContact O-NH2 3.24Å; N157-R161 PolarHBondContact O-N 3.32Å; F158-R161 PolarHBondContact O-N 3.13Å; R161-L163 VanDerWaalsContact C-N 3.33Å; R161-L163 PolarHBondContact O-N 3.28Å; R161-I164 PolarHBondContact O-N 3.03Å; R161-R165 WeakPolarHBondContact O-CG 3.31Å; R161-R165 PolarHBondContact O-N 3.41Å; R161-F183 HydrophobicContact CB-CD1 4.1Å; R161-F183 HydrophobicContact CB-CE1 3.84Å; R161-F183 HydrophobicContact CB-CE2 4.32Å; R161-F183 HydrophobicContact CB-CG 4.44Å; R161-F183 HydrophobicContact CB-CZ 3.96Å; R161-F183 HydrophobicContact CG-CD1 3.49Å; R161-F183 VanDerWaalsContact CG-CD1 3.49Å; R161-F183 HydrophobicContact CG-CD2 4.44Å; R161-F183 HydrophobicContact CG-CE1 3.7Å; R161-F183 HydrophobicContact CG-CG 3.9Å; R161-F183 HydrophobicContact CG-CZ 4.28Å; R161-E201 IonicContact CZ-OE1 3.84Å; R161-E201 IonicContact CZ-OE2 3.99Å; R161-E201 VanDerWaalsContact CZ-OE2 3.23Å; R161-E201 VanDerWaalsContact NE-CD 3.33Å; R161-E201 IonicContact NE-OE1 2.79Å; R161-E201 PolarHBondContact NE-OE1 3.24Å; R161-E201 IonicContact NE-OE2 3.82Å; R161-E201 PolarHBondContact NE-OE2 3.38Å; R161-E201 IonicContact NH2-OE1 2.82Å; R161-E201 IonicContact NH2-OE2 2.93Å; R161-E201 PolarHBondContact NH2-OE2 3.01Å
162	S	97.9	Very high	96.8	Very high	33 Å²	33	45 Å²	45	23%	0.231	22%	0.218	C	C	.	.	H	α-helix	trans	-58.6	-43.2	175.5	-170.9	0	0	0	0	112.2	F158 R160 R165 K166	F158-S162 WeakPolarHBondContact O-CB 3.38Å; F158-S162 PolarHBondContact O-N 3.49Å; R160-S162 PolarHBondContact O-N 3.27Å; S162-R165 PolarHBondContact O-N 3.02Å; S162-K166 WeakPolarHBondContact O-CG 3.4Å; S162-K166 PolarHBondContact O-N 2.9Å; S162-K166 VanDerWaalsContact O-N 3.16Å
163	L	97.7	Very high	96.6	Very high	21 Å²	21	45.1 Å²	45.1	11%	0.11	22%	0.219	C	C	.	.	H	α-helix	trans	-63.3	-44.1	175.7	-179.7	63	0	0	0	111.6	K159 R160 R161 R165 K166 T167 L382 Q385 Y386	K159-L163 WeakPolarHBondContact O-CB 3.15Å; K159-L163 PolarHBondContact O-N 3.5Å; R160-L163 WeakPolarHBondContact O-CB 3.26Å; R160-L163 PolarHBondContact O-N 3.35Å; R160-L163 VanDerWaalsContact O-N 3.15Å; R161-L163 VanDerWaalsContact C-N 3.33Å; R161-L163 PolarHBondContact O-N 3.28Å; L163-R165 PolarHBondContact O-N 3.47Å; L163-K166 CarbonylContact O-C 3.6Å; L163-K166 PolarHBondContact O-N 3.04Å; L163-T167 HydrophobicContact CD1-CG2 3.61Å; L163-T167 HydrophobicContact CG-CG2 4.14Å; L163-T167 WeakPolarHBondContact O-CB 3.42Å; L163-T167 VanDerWaalsContact O-CG2 3.27Å; L163-T167 WeakPolarHBondContact O-CG2 3.47Å; L163-T167 PolarHBondContact O-N 3Å; L163-T167 PolarHBondContact O-OG1 2.83Å; L163-L382 HydrophobicContact CB-CD2 4.45Å; L163-L382 HydrophobicContact CD2-CB 4.02Å; L163-L382 HydrophobicContact CD2-CD2 3.65Å; L163-L382 HydrophobicContact CD2-CG 4.44Å; L163-Q385 HydrophobicContact CD2-CB 3.72Å; L163-Y386 HydrophobicContact CD1-CD2 3.78Å; L163-Y386 HydrophobicContact CD1-CG 4.31Å
164	I	98.1	Very high	96.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.4	-45.2	178.5	-70.4	170.5	0	0	0	111	V151 R160 R161 K166 T167 W168 A169 F183 D246	V151-I164 HydrophobicContact CG1-CD1 3.89Å; R160-I164 VanDerWaalsContact O-CG1 3.29Å; R160-I164 WeakPolarHBondContact O-CG1 3.38Å; R160-I164 PolarHBondContact O-N 2.97Å; R161-I164 PolarHBondContact O-N 3.03Å; I164-K166 VanDerWaalsContact C-N 3.26Å; I164-K166 PolarHBondContact O-N 3.01Å; I164-T167 CarbonylContact O-C 3.59Å; I164-T167 PolarHBondContact O-N 3.07Å; I164-T167 VanDerWaalsContact O-N 3.09Å; I164-T167 PolarHBondContact O-OG1 2.9Å; I164-W168 HydrophobicContact CD1-CZ2 4.25Å; I164-W168 HydrophobicContact CG1-CZ2 4.29Å; I164-W168 HydrophobicContact CG2-CD2 4.35Å; I164-W168 HydrophobicContact CG2-CH2 4.27Å; I164-W168 HydrophobicContact CG2-CZ2 3.62Å; I164-A169 HydrophobicContact CG2-CB 3.47Å; I164-A169 VanDerWaalsContact CG2-CB 3.47Å; I164-A169 PolarHBondContact O-N 3.1Å; I164-A169 VanDerWaalsContact O-N 3.13Å; I164-F183 HydrophobicContact CB-CE1 4.11Å; I164-F183 HydrophobicContact CB-CZ 4.13Å; I164-F183 HydrophobicContact CD1-CE1 4.12Å; I164-F183 HydrophobicContact CG2-CE1 3.87Å; I164-F183 HydrophobicContact CG2-CZ 3.82Å; I164-D246 HydrophobicContact CD1-CB 4.1Å
165	R	98	Very high	96.4	Very high	23 Å²	23	52 Å²	52	9%	0.087	24%	0.241	C	C	.	.	H	α-helix	trans	-60.9	-30.7	173.9	-67.1	-176.8	-170.2	100.7	-1.5	113.5	R161 S162 L163 N170 F183 E201 D207	R161-R165 WeakPolarHBondContact O-CG 3.31Å; R161-R165 PolarHBondContact O-N 3.41Å; S162-R165 PolarHBondContact O-N 3.02Å; L163-R165 PolarHBondContact O-N 3.47Å; R165-N170 WeakPolarHBondContact O-CA 3.43Å; R165-N170 WeakPolarHBondContact O-CB 3.26Å; R165-N170 PolarHBondContact O-ND2 2.85Å; R165-N170 VanDerWaalsContact O-ND2 3.08Å; R165-F183 HydrophobicContact CG-CE2 3.99Å; R165-F183 HydrophobicContact CG-CZ 4.05Å; R165-E201 IonicContact CZ-OE1 2.68Å; R165-E201 VanDerWaalsContact CZ-OE1 3.25Å; R165-E201 IonicContact NH1-OE1 3.42Å; R165-E201 PolarHBondContact NH1-OE1 3.4Å; R165-E201 IonicContact NH2-OE1 2.97Å; R165-E201 PolarHBondContact NH2-OE1 3.29Å; R165-D207 IonicContact CZ-OD1 2.7Å; R165-D207 IonicContact CZ-OD2 3.48Å; R165-D207 IonicContact NE-OD1 3.79Å; R165-D207 PolarHBondContact NE-OD1 3.08Å; R165-D207 IonicContact NE-OD2 3.79Å; R165-D207 PolarHBondContact NE-OD2 3.12Å; R165-D207 IonicContact NH2-OD1 3.18Å; R165-D207 PolarHBondContact NH2-OD1 3.41Å; R165-D207 IonicContact NH2-OD2 3.23Å
166	K	96.8	Very high	96.1	Very high	140 Å²	140	55.1 Å²	55.1	61%	0.609	26%	0.255	S	S	*	.	H	α-helix	trans	-87.7	-9.2	177.7	-68.3	175.5	-175.8	179.4	0	113.3	S162 L163 I164	S162-K166 WeakPolarHBondContact O-CG 3.4Å; S162-K166 PolarHBondContact O-N 2.9Å; S162-K166 VanDerWaalsContact O-N 3.16Å; L163-K166 CarbonylContact O-C 3.6Å; L163-K166 PolarHBondContact O-N 3.04Å; I164-K166 VanDerWaalsContact C-N 3.26Å; I164-K166 PolarHBondContact O-N 3.01Å
167	T	96	Very high	96	Very high	5 Å²	5	49 Å²	49	3%	0.031	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-116.3	-172.7	59.7	0	0	0	0	111.3	L163 I164 A169 N170 F173 Y386 W389	L163-T167 HydrophobicContact CD1-CG2 3.61Å; L163-T167 HydrophobicContact CG-CG2 4.14Å; L163-T167 WeakPolarHBondContact O-CB 3.42Å; L163-T167 VanDerWaalsContact O-CG2 3.27Å; L163-T167 WeakPolarHBondContact O-CG2 3.47Å; L163-T167 PolarHBondContact O-N 3Å; L163-T167 PolarHBondContact O-OG1 2.83Å; I164-T167 CarbonylContact O-C 3.59Å; I164-T167 PolarHBondContact O-N 3.07Å; I164-T167 VanDerWaalsContact O-N 3.09Å; I164-T167 PolarHBondContact O-OG1 2.9Å; T167-A169 VanDerWaalsContact C-N 3.26Å; T167-A169 PolarHBondContact O-N 2.79Å; T167-N170 WeakPolarHBondContact O-CB 3.12Å; T167-N170 PolarHBondContact O-N 3.07Å; T167-F173 WeakPolarHBondContact O-CE2 3.27Å; T167-Y386 HydrophobicContact CG2-CD2 3.9Å; T167-Y386 HydrophobicContact CG2-CE2 4.43Å; T167-W389 VanDerWaalsContact C-CE2 3.46Å; T167-W389 HydrophobicContact CG2-CB 3.9Å; T167-W389 VanDerWaalsContact CG2-CD1 3.48Å; T167-W389 HydrophobicContact CG2-CD2 4.44Å; T167-W389 HydrophobicContact CG2-CG 3.65Å; T167-W389 VanDerWaalsContact O-CZ2 3.24Å; T167-W389 WeakPolarHBondContact O-CZ2 3.34Å
168	W	95.3	Very high	96.1	Very high	3 Å²	3	49.8 Å²	49.8	1%	0.011	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-22.5	-167.4	66.5	-99.4	0	0	0	113.5	A149 V151 I164 F173 V244 V250 T252 W389	A149-W168 HydrophobicContact CB-CH2 4.31Å; A149-W168 HydrophobicContact CB-CZ3 4.07Å; V151-W168 HydrophobicContact CG2-CH2 3.6Å; V151-W168 HydrophobicContact CG2-CZ2 3.79Å; I164-W168 HydrophobicContact CD1-CZ2 4.25Å; I164-W168 HydrophobicContact CG1-CZ2 4.29Å; I164-W168 HydrophobicContact CG2-CD2 4.35Å; I164-W168 HydrophobicContact CG2-CH2 4.27Å; I164-W168 HydrophobicContact CG2-CZ2 3.62Å; W168-F173 VanDerWaalsContact O-CD2 3.27Å; W168-F173 WeakPolarHBondContact O-CD2 3.27Å; W168-F173 WeakPolarHBondContact O-CE2 3.26Å; W168-V244 HydrophobicContact CH2-CB 4.29Å; W168-V244 HydrophobicContact CH2-CG2 4.15Å; W168-V244 HydrophobicContact CZ2-CB 4.47Å; W168-V244 HydrophobicContact CZ2-CG1 4.32Å; W168-V250 HydrophobicContact CB-CB 4.15Å; W168-V250 WeakPolarHBondContact CB-O 3.35Å; W168-V250 HydrophobicContact CD2-CB 3.66Å; W168-V250 HydrophobicContact CD2-CG2 3.8Å; W168-V250 HydrophobicContact CE3-CB 3.76Å; W168-V250 HydrophobicContact CE3-CG1 4.21Å; W168-V250 HydrophobicContact CE3-CG2 3.94Å; W168-V250 HydrophobicContact CG-CB 3.85Å; W168-V250 HydrophobicContact CG-CG2 4.34Å; W168-V250 HydrophobicContact CH2-CG2 4.21Å; W168-V250 HydrophobicContact CZ2-CG2 4.06Å; W168-V250 HydrophobicContact CZ3-CB 4.39Å; W168-V250 HydrophobicContact CZ3-CG2 4.14Å; W168-T252 WeakPolarHBondContact CA-OG1 3.47Å; W168-T252 WeakPolarHBondContact CB-OG1 3.33Å; W168-T252 PolarHBondContact O-OG1 3.32Å; W168-W389 HydrophobicContact CB-CE3 3.94Å; W168-W389 HydrophobicContact CB-CH2 4.2Å; W168-W389 HydrophobicContact CB-CZ3 3.65Å
169	A	96.8	Very high	96.1	Very high	7 Å²	7	47.6 Å²	47.6	6%	0.058	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	30.7	177.9	0	0	0	0	0	112.6	I164 T167 V181	I164-A169 HydrophobicContact CG2-CB 3.47Å; I164-A169 VanDerWaalsContact CG2-CB 3.47Å; I164-A169 PolarHBondContact O-N 3.1Å; I164-A169 VanDerWaalsContact O-N 3.13Å; T167-A169 VanDerWaalsContact C-N 3.26Å; T167-A169 PolarHBondContact O-N 2.79Å; A169-V181 HydrophobicContact CB-CB 3.79Å; A169-V181 HydrophobicContact CB-CG1 3.76Å; A169-V181 HydrophobicContact CB-CG2 3.95Å
170	N	96.2	Very high	96.2	Very high	49 Å²	49	40.7 Å²	40.7	26%	0.262	19%	0.194	S	C	.	.			trans	-59.5	138.5	176.3	-173.2	-84.1	0	0	0	112.2	R165 T167 E172 F173	R165-N170 WeakPolarHBondContact O-CA 3.43Å; R165-N170 WeakPolarHBondContact O-CB 3.26Å; R165-N170 PolarHBondContact O-ND2 2.85Å; R165-N170 VanDerWaalsContact O-ND2 3.08Å; T167-N170 WeakPolarHBondContact O-CB 3.12Å; T167-N170 PolarHBondContact O-N 3.07Å; N170-E172 PolarHBondContact O-N 3.18Å; N170-E172 VanDerWaalsContact O-N 3.15Å; N170-E172 VanDerWaalsContact OD1-CB 3.24Å; N170-E172 WeakPolarHBondContact OD1-CB 3.44Å; N170-E172 WeakPolarHBondContact OD1-CG 3.47Å; N170-E172 PolarHBondContact OD1-N 2.6Å; N170-F173 HydrophobicContact CB-CD2 4Å; N170-F173 HydrophobicContact CB-CE2 4.08Å; N170-F173 VanDerWaalsContact O-CB 3.27Å; N170-F173 WeakPolarHBondContact O-CB 3.14Å; N170-F173 WeakPolarHBondContact O-CD2 3.48Å; N170-F173 PolarHBondContact O-N 3.39Å
171	S	94.1	Very high	96.3	Very high	73 Å²	73	37.8 Å²	37.8	51%	0.51	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.9	-176.7	51.7	0	0	0	0	113.8	F173 Y174	S171-F173 PolarHBondContact O-N 3.03Å; S171-Y174 WeakPolarHBondContact O-CB 3.5Å; S171-Y174 PolarHBondContact O-N 3.25Å
172	E	93.8	Very high	96.3	Very high	100 Å²	100	37.9 Å²	37.9	47%	0.467	19%	0.185	S	C	.	.	H	α-helix	trans	-64.3	-22.8	173.9	-65.1	-60.1	127.7	0	0	112.4	N170 Y174 K175	N170-E172 PolarHBondContact O-N 3.18Å; N170-E172 VanDerWaalsContact O-N 3.15Å; N170-E172 VanDerWaalsContact OD1-CB 3.24Å; N170-E172 WeakPolarHBondContact OD1-CB 3.44Å; N170-E172 WeakPolarHBondContact OD1-CG 3.47Å; N170-E172 PolarHBondContact OD1-N 2.6Å; E172-Y174 PolarHBondContact O-N 2.93Å; E172-K175 VanDerWaalsContact CD-NZ 3.28Å; E172-K175 PolarHBondContact O-N 3.29Å; E172-K175 IonicContact OE1-NZ 2.96Å; E172-K175 PolarHBondContact OE1-NZ 3.15Å; E172-K175 WeakPolarHBondContact OE2-CD 3.39Å; E172-K175 IonicContact OE2-NZ 2.77Å; E172-K175 PolarHBondContact OE2-NZ 3.31Å
173	F	94.8	Very high	96.3	Very high	13 Å²	13	36.3 Å²	36.3	6%	0.057	17%	0.174	C	C	.	.	H	α-helix	trans	-68.1	-17.5	172.8	-66.8	-44	0	0	0	113.5	T167 W168 N170 S171 F177 K178 L179 T252 F253 W389 Y402	T167-F173 WeakPolarHBondContact O-CE2 3.27Å; W168-F173 VanDerWaalsContact O-CD2 3.27Å; W168-F173 WeakPolarHBondContact O-CD2 3.27Å; W168-F173 WeakPolarHBondContact O-CE2 3.26Å; N170-F173 HydrophobicContact CB-CD2 4Å; N170-F173 HydrophobicContact CB-CE2 4.08Å; N170-F173 VanDerWaalsContact O-CB 3.27Å; N170-F173 WeakPolarHBondContact O-CB 3.14Å; N170-F173 WeakPolarHBondContact O-CD2 3.48Å; N170-F173 PolarHBondContact O-N 3.39Å; S171-F173 PolarHBondContact O-N 3.03Å; F173-F177 HydrophobicContact CB-CD2 4.02Å; F173-F177 AromaticContact CD1-CD2 3.62Å; F173-F177 HydrophobicContact CD1-CD2 3.62Å; F173-F177 AromaticContact CD1-CE2 3.54Å; F173-F177 HydrophobicContact CD1-CE2 3.54Å; F173-F177 HydrophobicContact CE1-CD2 4.44Å; F173-F177 AromaticContact CE1-CE2 3.94Å; F173-F177 HydrophobicContact CE1-CE2 3.94Å; F173-F177 HydrophobicContact CG-CD2 4.11Å; F173-F177 HydrophobicContact CG-CE2 4.42Å; F173-F177 WeakPolarHBondContact O-CA 3.37Å; F173-F177 WeakPolarHBondContact O-CB 3.41Å; F173-F177 PolarHBondContact O-N 2.89Å; F173-K178 PolarHBondContact O-N 2.71Å; F173-L179 HydrophobicContact CB-CD2 4.43Å; F173-T252 HydrophobicContact CD1-CG2 4.5Å; F173-T252 HydrophobicContact CD2-CG2 3.99Å; F173-T252 HydrophobicContact CE2-CG2 4.25Å; F173-T252 HydrophobicContact CG-CG2 4.12Å; F173-F253 AromaticContact CE1-CE1 3.86Å; F173-F253 HydrophobicContact CE1-CE1 3.86Å; F173-F253 AromaticContact CE1-CZ 3.82Å; F173-F253 HydrophobicContact CE1-CZ 3.82Å; F173-F253 HydrophobicContact CZ-CE1 4.35Å; F173-F253 AromaticContact CZ-CZ 3.89Å; F173-F253 HydrophobicContact CZ-CZ 3.89Å; F173-W389 AromaticContact CE2-CH2 3.55Å; F173-W389 HydrophobicContact CE2-CH2 3.55Å; F173-W389 AromaticContact CE2-CZ2 3.62Å; F173-W389 HydrophobicContact CE2-CZ2 3.62Å; F173-W389 AromaticContact CZ-CH2 3.49Å; F173-W389 HydrophobicContact CZ-CH2 3.49Å; F173-W389 VanDerWaalsContact CZ-CH2 3.49Å; F173-W389 AromaticContact CZ-CZ2 3.52Å; F173-W389 HydrophobicContact CZ-CZ2 3.52Å; F173-Y402 HydrophobicContact CE1-CE1 4.37Å
174	Y	96.2	Very high	96.4	Very high	29 Å²	29	35.3 Å²	35.3	11%	0.114	17%	0.169	C	C	.	.	H	α-helix	trans	-64.6	-49	170.2	177.9	-108	0	0	0	111.1	Y142 P143 E144 S171 E172 K176 K178 L179	Y142-Y174 VanDerWaalsContact C-OH 3.25Å; Y142-Y174 WeakPolarHBondContact CA-OH 3.29Å; Y142-Y174 AromaticContact CD1-CD1 3.75Å; Y142-Y174 HydrophobicContact CD1-CD1 3.75Å; Y142-Y174 AromaticContact CD1-CD2 3.33Å; Y142-Y174 HydrophobicContact CD1-CD2 3.33Å; Y142-Y174 AromaticContact CD1-CE1 3.93Å; Y142-Y174 HydrophobicContact CD1-CE1 3.93Å; Y142-Y174 AromaticContact CD1-CE2 3.55Å; Y142-Y174 HydrophobicContact CD1-CE2 3.55Å; Y142-Y174 AromaticContact CD1-CG 3.44Å; Y142-Y174 HydrophobicContact CD1-CG 3.44Å; Y142-Y174 VanDerWaalsContact CD1-CG 3.44Å; Y142-Y174 AromaticContact CD1-CZ 3.83Å; Y142-Y174 HydrophobicContact CE1-CD1 4.1Å; Y142-Y174 HydrophobicContact CE1-CD2 4.02Å; Y142-Y174 AromaticContact CE1-CG 3.74Å; Y142-Y174 HydrophobicContact CE1-CG 3.74Å; Y142-Y174 HydrophobicContact CG-CD2 4.17Å; Y142-Y174 HydrophobicContact CG-CE2 4.09Å; P143-Y174 WeakPolarHBondContact CD-OH 3.48Å; E144-Y174 PolarHBondContact N-OH 3.13Å; S171-Y174 WeakPolarHBondContact O-CB 3.5Å; S171-Y174 PolarHBondContact O-N 3.25Å; E172-Y174 PolarHBondContact O-N 2.93Å; Y174-K176 PolarHBondContact O-N 2.91Å; Y174-K176 VanDerWaalsContact O-N 3.07Å; Y174-K178 HydrophobicContact CE2-CB 4.38Å; Y174-K178 HydrophobicContact CE2-CD 4.27Å; Y174-K178 WeakPolarHBondContact O-CA 3.49Å; Y174-K178 WeakPolarHBondContact O-CD 3.19Å; Y174-K178 PolarHBondContact O-N 2.84Å; Y174-L179 VanDerWaalsContact CA-O 3.26Å; Y174-L179 WeakPolarHBondContact CA-O 3.45Å; Y174-L179 WeakPolarHBondContact CB-O 3.19Å; Y174-L179 PolarHBondContact N-O 3.25Å
175	K	93.6	Very high	96.4	Very high	140 Å²	140	35.3 Å²	35.3	61%	0.609	17%	0.169	S	C	*	.	H	α-helix	trans	-54.7	-36.8	-179.1	-65.8	177.3	-172	156.4	0	111.6	E172	E172-K175 VanDerWaalsContact CD-NZ 3.28Å; E172-K175 PolarHBondContact O-N 3.29Å; E172-K175 IonicContact OE1-NZ 2.96Å; E172-K175 PolarHBondContact OE1-NZ 3.15Å; E172-K175 WeakPolarHBondContact OE2-CD 3.39Å; E172-K175 IonicContact OE2-NZ 2.77Å; E172-K175 PolarHBondContact OE2-NZ 3.31Å
176	K	91.5	Very high	96.4	Very high	75 Å²	75	34.2 Å²	34.2	33%	0.326	17%	0.165	S	C	.	.	H	α-helix	trans	-95.3	-44.1	-172	-171.6	161	-172.4	132.9	0	115.7	Y174 R260 Y402	Y174-K176 PolarHBondContact O-N 2.91Å; Y174-K176 VanDerWaalsContact O-N 3.07Å; K176-R260 PolarHBondContact O-NH2 2.92Å; K176-Y402 HydrophobicContact CD-CD1 3.53Å; K176-Y402 HydrophobicContact CD-CE1 4.17Å; K176-Y402 VanDerWaalsContact CE-C 3.46Å; K176-Y402 VanDerWaalsContact CE-CA 3.48Å; K176-Y402 VanDerWaalsContact CE-CD1 3.42Å; K176-Y402 WeakPolarHBondContact CE-O 3.02Å; K176-Y402 VanDerWaalsContact NZ-C 3.32Å; K176-Y402 PolarHBondContact NZ-O 3.47Å
177	F	94.7	Very high	96.5	Very high	5 Å²	5	30 Å²	30	2%	0.022	15%	0.147	C	C	.	.	H	α-helix	trans	-111.7	-7.1	-173.5	-57.7	-60.6	0	0	0	112.6	F173 L179 T252 F253 M256	F173-F177 HydrophobicContact CB-CD2 4.02Å; F173-F177 AromaticContact CD1-CD2 3.62Å; F173-F177 HydrophobicContact CD1-CD2 3.62Å; F173-F177 AromaticContact CD1-CE2 3.54Å; F173-F177 HydrophobicContact CD1-CE2 3.54Å; F173-F177 HydrophobicContact CE1-CD2 4.44Å; F173-F177 AromaticContact CE1-CE2 3.94Å; F173-F177 HydrophobicContact CE1-CE2 3.94Å; F173-F177 HydrophobicContact CG-CD2 4.11Å; F173-F177 HydrophobicContact CG-CE2 4.42Å; F173-F177 WeakPolarHBondContact O-CA 3.37Å; F173-F177 WeakPolarHBondContact O-CB 3.41Å; F173-F177 PolarHBondContact O-N 2.89Å; F177-L179 HydrophobicContact CB-CB 4.29Å; F177-L179 PolarHBondContact O-N 3.07Å; F177-T252 HydrophobicContact CD2-CG2 4.3Å; F177-F253 AromaticContact CE2-CD1 3.92Å; F177-F253 HydrophobicContact CE2-CD1 3.92Å; F177-F253 AromaticContact CE2-CE1 3.9Å; F177-F253 HydrophobicContact CE2-CE1 3.9Å; F177-F253 AromaticContact CZ-CD1 3.68Å; F177-F253 HydrophobicContact CZ-CD1 3.68Å; F177-F253 AromaticContact CZ-CE1 3.97Å; F177-F253 HydrophobicContact CZ-CE1 3.97Å; F177-M256 HydrophobicContact CB-CB 4.33Å; F177-M256 HydrophobicContact CB-CE 3.67Å; F177-M256 HydrophobicContact CB-CG 3.86Å; F177-M256 HydrophobicContact CB-SD 4.48Å; F177-M256 HydrophobicContact CD1-CB 3.99Å; F177-M256 HydrophobicContact CD1-CG 4.33Å; F177-M256 HydrophobicContact CD2-CG 4.43Å; F177-M256 HydrophobicContact CG-CB 4.17Å; F177-M256 HydrophobicContact CG-CG 3.98Å; F177-M256 WeakPolarHBondContact O-CE 3.5Å
178	K	97.4	Very high	96.5	Very high	58 Å²	58	31.2 Å²	31.2	25%	0.252	15%	0.154	S	C	.	.			trans	54.5	36.3	-170.4	-48.6	-65.8	177.9	178.2	0	111.3	E144 F146 V147 F173 Y174	E144-K178 HydrophobicContact CB-CD 3.94Å; E144-K178 VanDerWaalsContact O-CB 3.28Å; E144-K178 WeakPolarHBondContact O-CB 3.49Å; E144-K178 IonicContact OE1-NZ 3.96Å; E144-K178 IonicContact OE2-NZ 3.98Å; E144-K178 PolarHBondContact OE2-NZ 3.2Å; F146-K178 HydrophobicContact CB-CB 3.71Å; F146-K178 PolarHBondContact N-O 3.48Å; V147-K178 PolarHBondContact N-O 2.89Å; F173-K178 PolarHBondContact O-N 2.71Å; Y174-K178 HydrophobicContact CE2-CB 4.38Å; Y174-K178 HydrophobicContact CE2-CD 4.27Å; Y174-K178 WeakPolarHBondContact O-CA 3.49Å; Y174-K178 WeakPolarHBondContact O-CD 3.19Å; Y174-K178 PolarHBondContact O-N 2.84Å
179	L	98	Very high	96.4	Very high	6 Å²	6	35 Å²	35	3%	0.031	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	127.7	173.1	173.8	65.2	0	0	0	108.9	V147 A149 F173 Y174 F177 T252 M256	V147-L179 HydrophobicContact CB-CD1 3.9Å; V147-L179 HydrophobicContact CG1-CD1 3.77Å; V147-L179 WeakPolarHBondContact O-CA 3.03Å; A149-L179 HydrophobicContact CB-CD1 4.14Å; F173-L179 HydrophobicContact CB-CD2 4.43Å; Y174-L179 VanDerWaalsContact CA-O 3.26Å; Y174-L179 WeakPolarHBondContact CA-O 3.45Å; Y174-L179 WeakPolarHBondContact CB-O 3.19Å; Y174-L179 PolarHBondContact N-O 3.25Å; F177-L179 HydrophobicContact CB-CB 4.29Å; F177-L179 PolarHBondContact O-N 3.07Å; L179-T252 HydrophobicContact CD2-CG2 3.52Å; L179-M256 HydrophobicContact CB-CE 4.26Å; L179-M256 HydrophobicContact CB-SD 4.32Å; L179-M256 HydrophobicContact CD1-SD 4.4Å; L179-M256 HydrophobicContact CD2-SD 4.48Å
180	A	98.2	Very high	96.3	Very high	4 Å²	4	41.5 Å²	41.5	3%	0.033	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	161.8	167	0	0	0	0	0	110	F137 Y142 I145 V147 I148 A149	F137-A180 HydrophobicContact CE1-CB 4.23Å; Y142-A180 HydrophobicContact CD1-CB 3.92Å; Y142-A180 HydrophobicContact CD2-CB 3.62Å; Y142-A180 HydrophobicContact CE1-CB 4.09Å; Y142-A180 HydrophobicContact CE2-CB 3.81Å; Y142-A180 HydrophobicContact CG-CB 3.66Å; I145-A180 HydrophobicContact CD1-CB 3.71Å; I145-A180 HydrophobicContact CG1-CB 4.46Å; V147-A180 PolarHBondContact O-N 3.45Å; V147-A180 VanDerWaalsContact O-N 3.08Å; I148-A180 HydrophobicContact CD1-CB 4.19Å; A149-A180 PolarHBondContact N-O 3.41Å
181	V	98.6	Very high	96.2	Very high	9 Å²	9	42.4 Å²	42.4	6%	0.055	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	142.5	179	62.6	0	0	0	0	110.5	F137 A149 V151 A169 F183	F137-V181 WeakPolarHBondContact CZ-O 3.46Å; A149-V181 HydrophobicContact CB-CB 4.28Å; A149-V181 HydrophobicContact CB-CG2 4.19Å; A149-V181 CarbonylContact O-C 3.49Å; A149-V181 WeakPolarHBondContact O-CA 3.37Å; V151-V181 HydrophobicContact CG2-CG2 3.7Å; A169-V181 HydrophobicContact CB-CB 3.79Å; A169-V181 HydrophobicContact CB-CG1 3.76Å; A169-V181 HydrophobicContact CB-CG2 3.95Å; V181-F183 HydrophobicContact CG1-CE2 4.48Å; V181-F183 HydrophobicContact CG2-CE1 4.47Å; V181-F183 HydrophobicContact CG2-CE2 4.49Å; V181-F183 HydrophobicContact CG2-CZ 4.25Å
182	V	98.6	Very high	96.1	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.6	167.6	76.3	0	0	0	0	109.4	F137 I148 A149 I150 V151 D207 V209 W230	F137-V182 HydrophobicContact CZ-CB 4.43Å; I148-V182 HydrophobicContact CD1-CB 4.47Å; I148-V182 HydrophobicContact CD1-CG1 4.36Å; A149-V182 PolarHBondContact O-N 3.15Å; I150-V182 HydrophobicContact CD1-CG1 3.35Å; I150-V182 HydrophobicContact CG2-CG1 4.46Å; V151-V182 PolarHBondContact N-O 3.3Å; V182-D207 CarbonylContact C-O 3.58Å; V182-D207 VanDerWaalsContact CA-O 3.26Å; V182-D207 WeakPolarHBondContact CA-O 3.39Å; V182-D207 WeakPolarHBondContact CG2-O 3.42Å; V182-V209 HydrophobicContact CG2-CB 4.16Å; V182-V209 HydrophobicContact CG2-CG2 3.46Å; V182-V209 VanDerWaalsContact CG2-CG2 3.46Å; V182-W230 HydrophobicContact CB-CH2 4.05Å; V182-W230 HydrophobicContact CB-CZ3 4.45Å; V182-W230 HydrophobicContact CG1-CE3 4.4Å; V182-W230 HydrophobicContact CG1-CH2 3.83Å; V182-W230 HydrophobicContact CG1-CZ3 3.73Å; V182-W230 HydrophobicContact CG2-CH2 4.16Å; V182-W230 HydrophobicContact CG2-CZ2 4.21Å
183	F	98.9	Very high	96.2	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.3	178.6	-63	-77.3	0	0	0	109.7	V151 T153 R161 I164 R165 V181 D207 I208 V209	V151-F183 HydrophobicContact CB-CD1 3.62Å; V151-F183 HydrophobicContact CB-CE1 3.95Å; V151-F183 HydrophobicContact CG1-CD1 3.77Å; V151-F183 HydrophobicContact CG1-CE1 3.98Å; V151-F183 HydrophobicContact CG2-CD1 4.24Å; V151-F183 HydrophobicContact CG2-CE1 4.1Å; T153-F183 HydrophobicContact CG2-CB 3.86Å; T153-F183 HydrophobicContact CG2-CD1 4.05Å; T153-F183 HydrophobicContact CG2-CG 4.4Å; R161-F183 HydrophobicContact CB-CD1 4.1Å; R161-F183 HydrophobicContact CB-CE1 3.84Å; R161-F183 HydrophobicContact CB-CE2 4.32Å; R161-F183 HydrophobicContact CB-CG 4.44Å; R161-F183 HydrophobicContact CB-CZ 3.96Å; R161-F183 HydrophobicContact CG-CD1 3.49Å; R161-F183 VanDerWaalsContact CG-CD1 3.49Å; R161-F183 HydrophobicContact CG-CD2 4.44Å; R161-F183 HydrophobicContact CG-CE1 3.7Å; R161-F183 HydrophobicContact CG-CG 3.9Å; R161-F183 HydrophobicContact CG-CZ 4.28Å; I164-F183 HydrophobicContact CB-CE1 4.11Å; I164-F183 HydrophobicContact CB-CZ 4.13Å; I164-F183 HydrophobicContact CD1-CE1 4.12Å; I164-F183 HydrophobicContact CG2-CE1 3.87Å; I164-F183 HydrophobicContact CG2-CZ 3.82Å; R165-F183 HydrophobicContact CG-CE2 3.99Å; R165-F183 HydrophobicContact CG-CZ 4.05Å; V181-F183 HydrophobicContact CG1-CE2 4.48Å; V181-F183 HydrophobicContact CG2-CE1 4.47Å; V181-F183 HydrophobicContact CG2-CE2 4.49Å; V181-F183 HydrophobicContact CG2-CZ 4.25Å; F183-D207 WeakPolarHBondContact CD2-O 3.47Å; F183-D207 PolarHBondContact N-O 2.74Å; F183-I208 HydrophobicContact CB-CG1 4Å; F183-I208 HydrophobicContact CD2-CG1 4.41Å; F183-I208 WeakPolarHBondContact O-CA 3.47Å; F183-V209 PolarHBondContact O-N 2.89Å
184	A	98.8	Very high	96.2	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.008	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	117.8	-179.5	0	0	0	0	0	110.6	I150 V151 T153 F211 K223	I150-A184 HydrophobicContact CG2-CB 3.84Å; V151-A184 PolarHBondContact O-N 3.29Å; T153-A184 PolarHBondContact N-O 3.09Å; A184-F211 HydrophobicContact CB-CE2 4.06Å; A184-K223 HydrophobicContact CB-CD 4.41Å; A184-K223 HydrophobicContact CB-CG 4.37Å
185	V	98.6	Very high	96.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	152.5	-175.4	-62.5	0	0	0	0	111.5	T153 L198 I208 V209 Q210 F211	T153-V185 HydrophobicContact CG2-CG1 3.54Å; V185-L198 HydrophobicContact CG2-CD2 3.88Å; V185-I208 HydrophobicContact CG2-CG2 3.54Å; V185-V209 PolarHBondContact N-O 3.16Å; V185-V209 VanDerWaalsContact N-O 3.08Å; V185-Q210 HydrophobicContact CG2-CB 3.73Å; V185-Q210 HydrophobicContact CG2-CG 3.95Å; V185-Q210 CarbonylContact O-C 3.5Å; V185-Q210 VanDerWaalsContact O-CA 3.32Å; V185-Q210 WeakPolarHBondContact O-CA 3.29Å; V185-F211 VanDerWaalsContact O-CD2 3.31Å; V185-F211 WeakPolarHBondContact O-CD2 3.32Å; V185-F211 PolarHBondContact O-N 2.98Å
186	G	98.2	Very high	96.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	-150.1	167.7	0	0	0	0	0	112	L155 Q210 F211 F213 D215	L155-G186 WeakPolarHBondContact CD1-O 3.36Å; G186-Q210 WeakPolarHBondContact O-CG 3.14Å; G186-Q210 PolarHBondContact O-NE2 3.45Å; G186-F211 CarbonylContact C-O 3.48Å; G186-F213 CarbonylContact C-O 3.46Å; G186-F213 WeakPolarHBondContact CA-O 3.01Å; G186-D215 PolarHBondContact N-OD2 3.06Å
187	E	97.7	Very high	96.6	Very high	51 Å²	51	38.8 Å²	38.8	24%	0.238	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	157	175.3	-71.9	175.3	157.7	0	0	111.9	V131 F213 T214 D215	V131-E187 WeakPolarHBondContact CG2-OE1 3.48Å; E187-F213 PolarHBondContact N-O 2.93Å; E187-T214 CarbonylContact O-C 3.59Å; E187-T214 WeakPolarHBondContact O-CA 3.41Å; E187-D215 PolarHBondContact O-N 2.85Å
188	D	96.2	Very high	96.8	Very high	31 Å²	31	38.6 Å²	38.6	17%	0.166	22%	0.221	C	C	.	.			trans	-123.8	84.8	167.5	-178	-7.7	0	0	0	108.3	L155 R156 Q190 H191	L155-D188 HydrophobicContact CD1-CB 4.46Å; L155-D188 HydrophobicContact CD2-CB 4.02Å; R156-D188 IonicContact CZ-OD2 3.56Å; R156-D188 IonicContact NE-OD2 3.08Å; R156-D188 PolarHBondContact NE-OD2 3.43Å; R156-D188 IonicContact NH2-OD2 2.65Å; R156-D188 PolarHBondContact NH2-OD2 3Å; D188-Q190 PolarHBondContact O-N 3.46Å; D188-Q190 VanDerWaalsContact O-N 3.12Å; D188-Q190 PolarHBondContact OD1-N 3.03Å; D188-H191 PolarHBondContact O-N 2.97Å; D188-H191 VanDerWaalsContact O-N 3.09Å; D188-H191 IonicContact OD1-CG 3.42Å; D188-H191 PolarHBondContact OD1-N 3.21Å; D188-H191 IonicContact OD1-ND1 3.7Å; D188-H191 PolarHBondContact OD1-ND1 3.25Å; D188-H191 IonicContact OD2-CG 3.93Å; D188-H191 IonicContact OD2-ND1 3.58Å; D188-H191 PolarHBondContact OD2-ND1 3.42Å
189	P	93.2	Very high	96.8	Very high	83 Å²	83	38.6 Å²	38.6	54%	0.539	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-21.3	-176.9	-23.8	34.4	0	0	0	113.6	H191	P189-H191 VanDerWaalsContact C-N 3.31Å
190	Q	94.2	Very high	96.8	Very high	142 Å²	142	45.2 Å²	45.2	66%	0.664	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78	-18.8	-179.7	-64.8	176.6	1.5	0	0	112.1	D188	D188-Q190 PolarHBondContact O-N 3.46Å; D188-Q190 VanDerWaalsContact O-N 3.12Å; D188-Q190 PolarHBondContact OD1-N 3.03Å
191	H	94.7	Very high	96.8	Very high	69 Å²	69	45.9 Å²	45.9	32%	0.319	25%	0.249	S	C	.	.			trans	-134.8	75.5	-174.3	-53.9	79.3	0	0	0	112.4	R156 D188 P189 S193 V194	R156-H191 PolarHBondContact NH2-CD2 3.36Å; R156-H191 PolarHBondContact NH2-CE1 3.29Å; R156-H191 PolarHBondContact NH2-ND1 3.3Å; R156-H191 PolarHBondContact NH2-NE2 3.42Å; R156-H191 VanDerWaalsContact NH2-NE2 3.11Å; D188-H191 PolarHBondContact O-N 2.97Å; D188-H191 VanDerWaalsContact O-N 3.09Å; D188-H191 IonicContact OD1-CG 3.42Å; D188-H191 PolarHBondContact OD1-N 3.21Å; D188-H191 IonicContact OD1-ND1 3.7Å; D188-H191 PolarHBondContact OD1-ND1 3.25Å; D188-H191 IonicContact OD2-CG 3.93Å; D188-H191 IonicContact OD2-ND1 3.58Å; D188-H191 PolarHBondContact OD2-ND1 3.42Å; P189-H191 VanDerWaalsContact C-N 3.31Å; H191-S193 PolarHBondContact O-N 3.1Å; H191-S193 VanDerWaalsContact O-N 3.09Å; H191-V194 HydrophobicContact CB-CB 4.49Å; H191-V194 HydrophobicContact CB-CG2 3.79Å; H191-V194 WeakPolarHBondContact O-CB 3.28Å; H191-V194 PolarHBondContact O-N 3.43Å
192	P	92.5	Very high	96.8	Very high	97 Å²	97	47.9 Å²	47.9	63%	0.63	26%	0.256	S	S	*	.	H	α-helix	trans	-57.5	-27.5	-177.6	-26.4	35.3	0	0	0	115	V194 Q195 A196	P192-V194 PolarHBondContact O-N 3.35Å; P192-Q195 VanDerWaalsContact O-CB 3.32Å; P192-Q195 WeakPolarHBondContact O-CB 3.37Å; P192-Q195 PolarHBondContact O-N 3.25Å; P192-Q195 VanDerWaalsContact O-N 3.09Å; P192-A196 PolarHBondContact O-N 3.46Å
193	S	95.1	Very high	96.8	Very high	88 Å²	88	53.2 Å²	53.2	62%	0.615	28%	0.28	S	S	*	.	H	α-helix	trans	-63.2	-28.3	176.4	59	0	0	0	0	113.2	H191 Q195 A196 T197	H191-S193 PolarHBondContact O-N 3.1Å; H191-S193 VanDerWaalsContact O-N 3.09Å; S193-Q195 VanDerWaalsContact C-N 3.32Å; S193-A196 PolarHBondContact O-N 3.33Å; S193-T197 PolarHBondContact O-N 3.3Å; S193-T197 PolarHBondContact O-OG1 3.37Å; S193-T197 VanDerWaalsContact O-OG1 3.14Å
194	V	95.8	Very high	96.8	Very high	16 Å²	16	57.8 Å²	57.8	10%	0.097	31%	0.309	C	S	.	.	H	α-helix	trans	-66.9	-38.1	174.8	-179.4	0	0	0	0	110	L155 R156 F158 H191 P192 T197 L198	L155-V194 HydrophobicContact CB-CG1 3.56Å; L155-V194 HydrophobicContact CD2-CG1 4.23Å; R156-V194 HydrophobicContact CG-CG1 3.96Å; R156-V194 HydrophobicContact CG-CG2 4.09Å; F158-V194 HydrophobicContact CE2-CG1 4.31Å; F158-V194 HydrophobicContact CZ-CG1 4.37Å; H191-V194 HydrophobicContact CB-CB 4.49Å; H191-V194 HydrophobicContact CB-CG2 3.79Å; H191-V194 WeakPolarHBondContact O-CB 3.28Å; H191-V194 PolarHBondContact O-N 3.43Å; P192-V194 PolarHBondContact O-N 3.35Å; V194-T197 PolarHBondContact O-N 3.09Å; V194-L198 PolarHBondContact O-N 2.79Å
195	Q	97.4	Very high	96.7	Very high	49 Å²	49	62.4 Å²	62.4	23%	0.229	33%	0.327	C	S	.	.	H	α-helix	trans	-62.2	-45.4	177.2	-175.2	59.8	30.8	0	0	111.8	P192 S193 T197 L198 Q199	P192-Q195 VanDerWaalsContact O-CB 3.32Å; P192-Q195 WeakPolarHBondContact O-CB 3.37Å; P192-Q195 PolarHBondContact O-N 3.25Å; P192-Q195 VanDerWaalsContact O-N 3.09Å; S193-Q195 VanDerWaalsContact C-N 3.32Å; Q195-T197 PolarHBondContact O-N 2.9Å; Q195-L198 PolarHBondContact O-N 3.36Å; Q195-Q199 WeakPolarHBondContact O-CB 3.41Å; Q195-Q199 PolarHBondContact O-N 2.96Å
196	A	96.1	Very high	96.6	Very high	56 Å²	56	65.7 Å²	65.7	46%	0.463	34%	0.342	S	S	.	.	H	α-helix	trans	-62.5	-28.7	177.6	0	0	0	0	0	112.9	P192 S193 R200	P192-A196 PolarHBondContact O-N 3.46Å; S193-A196 PolarHBondContact O-N 3.33Å; A196-R200 WeakPolarHBondContact O-CG 3.37Å; A196-R200 PolarHBondContact O-N 3.39Å; A196-R200 PolarHBondContact O-NE 2.68Å
197	T	96.6	Very high	96.6	Very high	48 Å²	48	66.2 Å²	66.2	29%	0.294	35%	0.345	S	S	.	.	H	α-helix	trans	-77.8	-40	175.3	-53.3	0	0	0	0	111.6	F158 S193 V194 Q195 R200 E201	F158-T197 HydrophobicContact CD1-CG2 4.08Å; F158-T197 HydrophobicContact CD2-CG2 4.49Å; F158-T197 HydrophobicContact CE1-CG2 3.52Å; F158-T197 HydrophobicContact CE2-CG2 3.95Å; F158-T197 HydrophobicContact CZ-CG2 3.46Å; F158-T197 VanDerWaalsContact CZ-CG2 3.46Å; S193-T197 PolarHBondContact O-N 3.3Å; S193-T197 PolarHBondContact O-OG1 3.37Å; S193-T197 VanDerWaalsContact O-OG1 3.14Å; V194-T197 PolarHBondContact O-N 3.09Å; Q195-T197 PolarHBondContact O-N 2.9Å; T197-R200 PolarHBondContact O-N 2.98Å; T197-R200 PolarHBondContact OG1-NH2 3.15Å; T197-R200 VanDerWaalsContact OG1-NH2 3.07Å; T197-E201 PolarHBondContact O-N 3.48Å; T197-E201 VanDerWaalsContact O-N 3.11Å
198	L	98.2	Very high	96.7	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-63.7	-40.1	174.6	-169.2	73.9	0	0	0	112	L132 L155 F158 V185 V194 Q195 E201 W202 I208	L132-L198 HydrophobicContact CD1-CD2 4.07Å; L132-L198 HydrophobicContact CD1-CG 4.14Å; L155-L198 HydrophobicContact CD2-CD2 4.21Å; L155-L198 HydrophobicContact CG-CD2 4.28Å; F158-L198 HydrophobicContact CE1-CB 4.41Å; F158-L198 HydrophobicContact CE1-CD1 4.33Å; F158-L198 HydrophobicContact CZ-CB 4.39Å; V185-L198 HydrophobicContact CG2-CD2 3.88Å; V194-L198 PolarHBondContact O-N 2.79Å; Q195-L198 PolarHBondContact O-N 3.36Å; L198-E201 WeakPolarHBondContact O-CB 3.09Å; L198-E201 PolarHBondContact O-N 2.92Å; L198-W202 WeakPolarHBondContact O-CB 3.39Å; L198-W202 PolarHBondContact O-N 2.67Å; L198-I208 HydrophobicContact CD1-CD1 3.86Å; L198-I208 HydrophobicContact CD1-CG2 4.4Å; L198-I208 HydrophobicContact CG-CD1 4.48Å
199	Q	98	Very high	96.8	Very high	58 Å²	58	62.6 Å²	62.6	27%	0.271	33%	0.327	S	S	.	.	H	α-helix	trans	-56	-51.8	174.8	179.6	62.7	37.4	0	0	111.5	Q195 E201 W202 E203	Q195-Q199 WeakPolarHBondContact O-CB 3.41Å; Q195-Q199 PolarHBondContact O-N 2.96Å; Q199-E201 VanDerWaalsContact C-N 3.31Å; Q199-E201 PolarHBondContact O-N 3.32Å; Q199-W202 PolarHBondContact O-N 3.04Å; Q199-W202 VanDerWaalsContact O-N 3.13Å; Q199-E203 WeakPolarHBondContact CG-OE1 3.09Å; Q199-E203 PolarHBondContact NE2-OE1 3.48Å; Q199-E203 WeakPolarHBondContact O-CG 3.17Å; Q199-E203 PolarHBondContact O-N 2.95Å
200	R	98.1	Very high	97.1	Very high	146 Å²	146	58.6 Å²	58.6	55%	0.551	30%	0.301	S	S	*	.	H	α-helix	trans	-61.8	-37.9	178	-71.3	179.5	-70.9	143.6	-5	112.8	A196 T197 T204	A196-R200 WeakPolarHBondContact O-CG 3.37Å; A196-R200 PolarHBondContact O-N 3.39Å; A196-R200 PolarHBondContact O-NE 2.68Å; T197-R200 PolarHBondContact O-N 2.98Å; T197-R200 PolarHBondContact OG1-NH2 3.15Å; T197-R200 VanDerWaalsContact OG1-NH2 3.07Å; R200-T204 PolarHBondContact O-N 2.82Å; R200-T204 PolarHBondContact O-OG1 3.08Å
201	E	98.4	Very high	97.3	Very high	17 Å²	17	51.9 Å²	51.9	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-45.1	173.8	-173.5	-174.6	-179	0	0	111.1	F158 R161 R165 T197 L198 Q199 T204 Y205 I208	F158-E201 WeakPolarHBondContact CD1-OE2 3.27Å; F158-E201 HydrophobicContact CE1-CB 4.48Å; F158-E201 VanDerWaalsContact CE1-OE2 3.26Å; F158-E201 WeakPolarHBondContact CE1-OE2 3.44Å; R161-E201 IonicContact CZ-OE1 3.84Å; R161-E201 IonicContact CZ-OE2 3.99Å; R161-E201 VanDerWaalsContact CZ-OE2 3.23Å; R161-E201 VanDerWaalsContact NE-CD 3.33Å; R161-E201 IonicContact NE-OE1 2.79Å; R161-E201 PolarHBondContact NE-OE1 3.24Å; R161-E201 IonicContact NE-OE2 3.82Å; R161-E201 PolarHBondContact NE-OE2 3.38Å; R161-E201 IonicContact NH2-OE1 2.82Å; R161-E201 IonicContact NH2-OE2 2.93Å; R161-E201 PolarHBondContact NH2-OE2 3.01Å; R165-E201 IonicContact CZ-OE1 2.68Å; R165-E201 VanDerWaalsContact CZ-OE1 3.25Å; R165-E201 IonicContact NH1-OE1 3.42Å; R165-E201 PolarHBondContact NH1-OE1 3.4Å; R165-E201 IonicContact NH2-OE1 2.97Å; R165-E201 PolarHBondContact NH2-OE1 3.29Å; T197-E201 PolarHBondContact O-N 3.48Å; T197-E201 VanDerWaalsContact O-N 3.11Å; L198-E201 WeakPolarHBondContact O-CB 3.09Å; L198-E201 PolarHBondContact O-N 2.92Å; Q199-E201 VanDerWaalsContact C-N 3.31Å; Q199-E201 PolarHBondContact O-N 3.32Å; E201-T204 PolarHBondContact O-N 2.83Å; E201-T204 VanDerWaalsContact O-N 3.16Å; E201-Y205 HydrophobicContact CG-CD2 3.8Å; E201-Y205 HydrophobicContact CG-CE2 4.16Å; E201-Y205 WeakPolarHBondContact O-CD2 3.32Å; E201-Y205 PolarHBondContact O-N 3.41Å; E201-I208 HydrophobicContact CB-CD1 4.12Å; E201-I208 HydrophobicContact CG-CD1 3.79Å
202	W	98.3	Very high	97.4	Very high	51 Å²	51	50.9 Å²	50.9	19%	0.193	27%	0.267	C	S	.	.	H	α-helix	trans	-63.8	-40.3	177.5	176.4	84.2	0	0	0	112.2	L132 L133 L198 Q199 T204 Y205 E206 I208	L132-W202 HydrophobicContact CB-CD2 4.24Å; L132-W202 HydrophobicContact CB-CG 4.02Å; L132-W202 HydrophobicContact CD1-CB 3.91Å; L132-W202 HydrophobicContact CD1-CG 4.09Å; L132-W202 HydrophobicContact CD2-CD2 4.21Å; L132-W202 HydrophobicContact CD2-CE3 4.26Å; L132-W202 HydrophobicContact CD2-CG 4.44Å; L132-W202 HydrophobicContact CG-CG 4.41Å; L133-W202 WeakPolarHBondContact O-CZ2 3.28Å; L198-W202 WeakPolarHBondContact O-CB 3.39Å; L198-W202 PolarHBondContact O-N 2.67Å; Q199-W202 PolarHBondContact O-N 3.04Å; Q199-W202 VanDerWaalsContact O-N 3.13Å; W202-T204 PolarHBondContact O-N 3.44Å; W202-Y205 PolarHBondContact O-N 3Å; W202-E206 WeakPolarHBondContact O-CA 3.38Å; W202-E206 WeakPolarHBondContact O-CG 3.25Å; W202-E206 PolarHBondContact O-N 3.01Å; W202-I208 HydrophobicContact CB-CB 4.43Å; W202-I208 HydrophobicContact CB-CD1 4.24Å; W202-I208 PolarHBondContact NE1-O 3.02Å
203	E	98.2	Very high	97.6	Very high	114 Å²	114	46.5 Å²	46.5	53%	0.533	24%	0.238	S	C	.	.	H	α-helix	trans	-60.9	-31.5	173.8	-73.6	164.1	-176.8	0	0	112.5	Q199	Q199-E203 WeakPolarHBondContact CG-OE1 3.09Å; Q199-E203 PolarHBondContact NE2-OE1 3.48Å; Q199-E203 WeakPolarHBondContact O-CG 3.17Å; Q199-E203 PolarHBondContact O-N 2.95Å
204	T	97.7	Very high	97.7	Very high	97 Å²	97	45.1 Å²	45.1	60%	0.595	23%	0.226	S	C	*	.	H	α-helix	trans	-80	-45.5	-179.2	-56.7	0	0	0	0	112.3	R200 E201 W202	R200-T204 PolarHBondContact O-N 2.82Å; R200-T204 PolarHBondContact O-OG1 3.08Å; E201-T204 PolarHBondContact O-N 2.83Å; E201-T204 VanDerWaalsContact O-N 3.16Å; W202-T204 PolarHBondContact O-N 3.44Å
205	Y	97.7	Very high	97.8	Very high	98 Å²	98	46.1 Å²	46.1	38%	0.384	23%	0.231	S	C	.	.	H	α-helix	trans	-109.6	-23.5	-168.8	-62.3	-75	0	0	0	114	K141 E201 W202 D207	K141-Y205 PolarHBondContact NZ-O 3.13Å; E201-Y205 HydrophobicContact CG-CD2 3.8Å; E201-Y205 HydrophobicContact CG-CE2 4.16Å; E201-Y205 WeakPolarHBondContact O-CD2 3.32Å; E201-Y205 PolarHBondContact O-N 3.41Å; W202-Y205 PolarHBondContact O-N 3Å; Y205-D207 VanDerWaalsContact CB-OD1 3.24Å; Y205-D207 WeakPolarHBondContact CB-OD1 3.44Å; Y205-D207 PolarHBondContact O-N 3.44Å; Y205-D207 VanDerWaalsContact O-N 3.13Å
206	E	97.4	Very high	97.7	Very high	69 Å²	69	45.8 Å²	45.8	32%	0.322	23%	0.231	S	C	.	.			trans	46.8	40.2	-178.2	-50.7	168.9	100.8	0	0	112.8	R134 F137 K141 W202	R134-E206 IonicContact CZ-OE1 2.71Å; R134-E206 IonicContact CZ-OE2 2.88Å; R134-E206 VanDerWaalsContact NH1-CD 3.34Å; R134-E206 IonicContact NH1-OE1 3.81Å; R134-E206 PolarHBondContact NH1-OE1 3.42Å; R134-E206 IonicContact NH1-OE2 3.6Å; R134-E206 PolarHBondContact NH1-OE2 2.96Å; F137-E206 WeakPolarHBondContact CD2-O 3.43Å; F137-E206 WeakPolarHBondContact CE2-O 3.28Å; K141-E206 PolarHBondContact NZ-O 2.76Å; K141-E206 IonicContact NZ-OE2 2.97Å; W202-E206 WeakPolarHBondContact O-CA 3.38Å; W202-E206 WeakPolarHBondContact O-CG 3.25Å; W202-E206 PolarHBondContact O-N 3.01Å
207	D	98.1	Very high	97.5	Very high	11 Å²	11	51.5 Å²	51.5	6%	0.059	24%	0.241	C	C	.	.			trans	-127.6	21	-177.5	66.1	-0.8	0	0	0	111.9	F137 R165 V182 F183 Y205	F137-D207 HydrophobicContact CE2-CB 4.18Å; R165-D207 IonicContact CZ-OD1 2.7Å; R165-D207 IonicContact CZ-OD2 3.48Å; R165-D207 IonicContact NE-OD1 3.79Å; R165-D207 PolarHBondContact NE-OD1 3.08Å; R165-D207 IonicContact NE-OD2 3.79Å; R165-D207 PolarHBondContact NE-OD2 3.12Å; R165-D207 IonicContact NH2-OD1 3.18Å; R165-D207 PolarHBondContact NH2-OD1 3.41Å; R165-D207 IonicContact NH2-OD2 3.23Å; V182-D207 CarbonylContact C-O 3.58Å; V182-D207 VanDerWaalsContact CA-O 3.26Å; V182-D207 WeakPolarHBondContact CA-O 3.39Å; V182-D207 WeakPolarHBondContact CG2-O 3.42Å; F183-D207 WeakPolarHBondContact CD2-O 3.47Å; F183-D207 PolarHBondContact N-O 2.74Å; Y205-D207 VanDerWaalsContact CB-OD1 3.24Å; Y205-D207 WeakPolarHBondContact CB-OD1 3.44Å; Y205-D207 PolarHBondContact O-N 3.44Å; Y205-D207 VanDerWaalsContact O-N 3.13Å
208	I	98.8	Very high	97.4	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	135.9	172.5	-65.9	156.1	0	0	0	108.5	F183 V185 L198 E201 W202	F183-I208 HydrophobicContact CB-CG1 4Å; F183-I208 HydrophobicContact CD2-CG1 4.41Å; F183-I208 WeakPolarHBondContact O-CA 3.47Å; V185-I208 HydrophobicContact CG2-CG2 3.54Å; L198-I208 HydrophobicContact CD1-CD1 3.86Å; L198-I208 HydrophobicContact CD1-CG2 4.4Å; L198-I208 HydrophobicContact CG-CD1 4.48Å; E201-I208 HydrophobicContact CB-CD1 4.12Å; E201-I208 HydrophobicContact CG-CD1 3.79Å; W202-I208 HydrophobicContact CB-CB 4.43Å; W202-I208 HydrophobicContact CB-CD1 4.24Å; W202-I208 PolarHBondContact NE1-O 3.02Å
209	V	98.7	Very high	97.3	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.024	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	118.1	166.2	175.7	0	0	0	0	107.4	Y130 L132 V182 F183 V185 F211 W230	Y130-V209 HydrophobicContact CD1-CG1 3.9Å; Y130-V209 HydrophobicContact CE1-CG1 4.42Å; L132-V209 WeakPolarHBondContact O-CA 3.34Å; V182-V209 HydrophobicContact CG2-CB 4.16Å; V182-V209 HydrophobicContact CG2-CG2 3.46Å; V182-V209 VanDerWaalsContact CG2-CG2 3.46Å; F183-V209 PolarHBondContact O-N 2.89Å; V185-V209 PolarHBondContact N-O 3.16Å; V185-V209 VanDerWaalsContact N-O 3.08Å; V209-F211 HydrophobicContact CG1-CD1 4.24Å; V209-F211 HydrophobicContact CG1-CE1 3.46Å; V209-F211 VanDerWaalsContact CG1-CE1 3.46Å; V209-F211 HydrophobicContact CG1-CZ 3.75Å; V209-W230 HydrophobicContact CG1-CG 4.17Å; V209-W230 HydrophobicContact CG2-CD2 4.1Å; V209-W230 HydrophobicContact CG2-CG 4.27Å; V209-W230 HydrophobicContact CG2-CZ2 3.96Å
210	Q	98.7	Very high	97.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	138.1	-178.6	-177.9	174.5	27.6	0	0	111.1	Y130 V131 L132 V185 G186	Y130-Q210 CarbonylContact C-O 3.43Å; Y130-Q210 WeakPolarHBondContact CA-O 3.44Å; V131-Q210 HydrophobicContact CB-CB 4.08Å; V131-Q210 HydrophobicContact CB-CG 3.86Å; V131-Q210 HydrophobicContact CG1-CG 4.44Å; V131-Q210 HydrophobicContact CG2-CG 4.27Å; V131-Q210 PolarHBondContact N-O 3.04Å; L132-Q210 HydrophobicContact CB-CB 3.81Å; L132-Q210 HydrophobicContact CD1-CB 4.19Å; L132-Q210 VanDerWaalsContact CD1-OE1 3.26Å; L132-Q210 HydrophobicContact CG-CB 3.96Å; L132-Q210 VanDerWaalsContact CG-OE1 3.29Å; L132-Q210 PolarHBondContact O-N 3.4Å; V185-Q210 HydrophobicContact CG2-CB 3.73Å; V185-Q210 HydrophobicContact CG2-CG 3.95Å; V185-Q210 CarbonylContact O-C 3.5Å; V185-Q210 VanDerWaalsContact O-CA 3.32Å; V185-Q210 WeakPolarHBondContact O-CA 3.29Å; G186-Q210 WeakPolarHBondContact O-CG 3.14Å; G186-Q210 PolarHBondContact O-NE2 3.45Å
211	F	98.4	Very high	97.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	148.6	177.9	-44.2	-67.3	0	0	0	112	R129 Y130 A184 V185 G186 V209 F213 K223 S226 W227	R129-F211 WeakPolarHBondContact O-CA 3.41Å; Y130-F211 AromaticContact CD1-CD1 3.77Å; Y130-F211 HydrophobicContact CD1-CD1 3.77Å; Y130-F211 AromaticContact CD1-CE1 3.72Å; Y130-F211 HydrophobicContact CD1-CE1 3.72Å; Y130-F211 HydrophobicContact CE1-CD1 4.03Å; Y130-F211 AromaticContact CE1-CE1 3.69Å; Y130-F211 HydrophobicContact CE1-CE1 3.69Å; A184-F211 HydrophobicContact CB-CE2 4.06Å; V185-F211 VanDerWaalsContact O-CD2 3.31Å; V185-F211 WeakPolarHBondContact O-CD2 3.32Å; V185-F211 PolarHBondContact O-N 2.98Å; G186-F211 CarbonylContact C-O 3.48Å; V209-F211 HydrophobicContact CG1-CD1 4.24Å; V209-F211 HydrophobicContact CG1-CE1 3.46Å; V209-F211 VanDerWaalsContact CG1-CE1 3.46Å; V209-F211 HydrophobicContact CG1-CZ 3.75Å; F211-F213 HydrophobicContact CB-CD1 3.96Å; F211-F213 HydrophobicContact CB-CE1 3.3Å; F211-F213 HydrophobicContact CB-CE2 4.13Å; F211-F213 HydrophobicContact CB-CZ 3.37Å; F211-F213 HydrophobicContact CD2-CE1 4.38Å; F211-F213 HydrophobicContact CD2-CE2 4.39Å; F211-F213 AromaticContact CD2-CZ 3.69Å; F211-F213 HydrophobicContact CD2-CZ 3.69Å; F211-F213 AromaticContact CG-CE1 4Å; F211-F213 HydrophobicContact CG-CE1 4Å; F211-F213 AromaticContact CG-CZ 3.77Å; F211-F213 HydrophobicContact CG-CZ 3.77Å; F211-F213 PolarHBondContact O-N 3.22Å; F211-K223 HydrophobicContact CD2-CG 4.23Å; F211-K223 HydrophobicContact CE2-CG 3.99Å; F211-S226 VanDerWaalsContact CD1-CB 3.46Å; F211-S226 VanDerWaalsContact CE1-CB 3.42Å; F211-W227 HydrophobicContact CZ-CB 4.08Å
212	N	96.7	Very high	97.4	Very high	48 Å²	48	43.9 Å²	43.9	26%	0.257	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	43.7	-175	72.9	-36.9	0	0	0	115.2	F128 R129 V131	F128-N212 WeakPolarHBondContact CA-OD1 3.36Å; R129-N212 HydrophobicContact CB-CB 4.06Å; R129-N212 PolarHBondContact N-OD1 2.88Å; R129-N212 PolarHBondContact O-N 3.11Å; R129-N212 VanDerWaalsContact O-N 3.12Å; R129-N212 PolarHBondContact O-OD1 2.71Å; V131-N212 HydrophobicContact CG2-CB 3.89Å
213	F	97.1	Very high	97.4	Very high	6 Å²	6	41.6 Å²	41.6	3%	0.026	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	153.3	171.1	49.2	-103.3	0	0	0	110.2	F128 G186 E187 F211 D215 N219 L222 K223 S226	F128-F213 HydrophobicContact CD1-CD1 4.34Å; F128-F213 HydrophobicContact CD2-CD1 4.38Å; F128-F213 HydrophobicContact CD2-CE1 4.11Å; F128-F213 HydrophobicContact CE1-CD1 4.35Å; F128-F213 HydrophobicContact CE2-CD1 4.4Å; F128-F213 HydrophobicContact CE2-CE1 4.25Å; F128-F213 HydrophobicContact CG-CD1 4.38Å; F128-F213 HydrophobicContact CG-CE1 4.43Å; F128-F213 HydrophobicContact CZ-CD1 4.39Å; G186-F213 CarbonylContact C-O 3.46Å; G186-F213 WeakPolarHBondContact CA-O 3.01Å; E187-F213 PolarHBondContact N-O 2.93Å; F211-F213 HydrophobicContact CB-CD1 3.96Å; F211-F213 HydrophobicContact CB-CE1 3.3Å; F211-F213 HydrophobicContact CB-CE2 4.13Å; F211-F213 HydrophobicContact CB-CZ 3.37Å; F211-F213 HydrophobicContact CD2-CE1 4.38Å; F211-F213 HydrophobicContact CD2-CE2 4.39Å; F211-F213 AromaticContact CD2-CZ 3.69Å; F211-F213 HydrophobicContact CD2-CZ 3.69Å; F211-F213 AromaticContact CG-CE1 4Å; F211-F213 HydrophobicContact CG-CE1 4Å; F211-F213 AromaticContact CG-CZ 3.77Å; F211-F213 HydrophobicContact CG-CZ 3.77Å; F211-F213 PolarHBondContact O-N 3.22Å; F213-D215 PolarHBondContact O-N 3.45Å; F213-N219 HydrophobicContact CD2-CB 4.2Å; F213-L222 HydrophobicContact CE1-CB 4.24Å; F213-L222 HydrophobicContact CE2-CB 4.37Å; F213-L222 HydrophobicContact CZ-CB 4.18Å; F213-K223 HydrophobicContact CE2-CB 4.09Å; F213-K223 HydrophobicContact CZ-CB 4.19Å; F213-S226 WeakPolarHBondContact CE1-OG 3.38Å
214	T	97.6	Very high	97.4	Very high	59 Å²	59	36.1 Å²	36.1	36%	0.362	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	129.7	-179.6	-53.3	0	0	0	0	111.2	E187 N216 N219	E187-T214 CarbonylContact O-C 3.59Å; E187-T214 WeakPolarHBondContact O-CA 3.41Å; T214-N216 PolarHBondContact O-N 2.71Å; T214-N219 PolarHBondContact O-ND2 2.93Å
215	D	97.2	Very high	97.5	Very high	36 Å²	36	31.7 Å²	31.7	19%	0.193	15%	0.148	C	C	.	.			trans	-78.6	101.8	178	-156.1	-24.6	0	0	0	110.4	L155 G186 E187 F213 K223	L155-D215 HydrophobicContact CD1-CB 3.5Å; L155-D215 VanDerWaalsContact CD1-CB 3.5Å; G186-D215 PolarHBondContact N-OD2 3.06Å; E187-D215 PolarHBondContact O-N 2.85Å; F213-D215 PolarHBondContact O-N 3.45Å; D215-K223 WeakPolarHBondContact OD1-CE 3.29Å; D215-K223 IonicContact OD1-NZ 3.2Å; D215-K223 PolarHBondContact OD1-NZ 3.1Å; D215-K223 IonicContact OD2-NZ 2.74Å; D215-K223 PolarHBondContact OD2-NZ 3.21Å
216	N	95.1	Very high	97.5	Very high	43 Å²	43	27 Å²	27	23%	0.23	13%	0.129	C	C	.	.	S	Bend	trans	-150	167.3	177.6	65.8	45.7	0	0	0	110.5	T214 H218 N219 M220	T214-N216 PolarHBondContact O-N 2.71Å; N216-H218 VanDerWaalsContact C-N 3.28Å; N216-H218 PolarHBondContact O-N 3.04Å; N216-H218 PolarHBondContact OD1-N 3.08Å; N216-N219 PolarHBondContact ND2-ND2 2.71Å; N216-N219 PolarHBondContact O-N 3.31Å; N216-N219 VanDerWaalsContact O-N 3.07Å; N216-N219 WeakPolarHBondContact OD1-CB 3.32Å; N216-N219 PolarHBondContact OD1-N 3.34Å; N216-M220 WeakPolarHBondContact O-CE 3.33Å
217	Y	92.1	Very high	97.6	Very high	176 Å²	176	23.9 Å²	23.9	69%	0.69	11%	0.114	S	C	*	.	G	3₁₀ helix	trans	-58.5	-36.2	-178.2	-75.3	-76.3	0	0	0	113.6	N219 M220	Y217-N219 PolarHBondContact O-N 2.81Å; Y217-M220 WeakPolarHBondContact O-CB 3Å; Y217-M220 VanDerWaalsContact O-CG 3.23Å; Y217-M220 WeakPolarHBondContact O-CG 3.32Å; Y217-M220 PolarHBondContact O-N 2.77Å
218	H	94.8	Very high	97.6	Very high	70 Å²	70	23.3 Å²	23.3	32%	0.324	11%	0.112	S	C	.	.	G	3₁₀ helix	trans	-73.4	-12.6	179.9	-70.4	-70.6	0	0	0	113.8	N216 W332	N216-H218 VanDerWaalsContact C-N 3.28Å; N216-H218 PolarHBondContact O-N 3.04Å; N216-H218 PolarHBondContact OD1-N 3.08Å; H218-W332 AromaticContact CE1-CE2 3.73Å; H218-W332 AromaticContact CE1-CZ2 3.85Å; H218-W332 AromaticContact ND1-CD1 3.78Å; H218-W332 AromaticContact ND1-CD2 3.42Å; H218-W332 AromaticContact ND1-CE2 3.5Å; H218-W332 AromaticContact ND1-CE3 3.88Å; H218-W332 AromaticContact ND1-CG 3.64Å; H218-W332 AromaticContact ND1-NE1 3.71Å; H218-W332 VanDerWaalsContact O-CB 3.23Å; H218-W332 WeakPolarHBondContact O-CB 3.31Å
219	N	97.3	Very high	97.6	Very high	7 Å²	7	25.1 Å²	25.1	4%	0.037	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-102.9	13	176.5	-70.9	-19.3	0	0	0	112.6	F213 T214 N216 Y217 S221 L222 K223	F213-N219 HydrophobicContact CD2-CB 4.2Å; T214-N219 PolarHBondContact O-ND2 2.93Å; N216-N219 PolarHBondContact ND2-ND2 2.71Å; N216-N219 PolarHBondContact O-N 3.31Å; N216-N219 VanDerWaalsContact O-N 3.07Å; N216-N219 WeakPolarHBondContact OD1-CB 3.32Å; N216-N219 PolarHBondContact OD1-N 3.34Å; Y217-N219 PolarHBondContact O-N 2.81Å; N219-S221 PolarHBondContact O-N 3.23Å; N219-L222 HydrophobicContact CB-CD1 4.33Å; N219-L222 WeakPolarHBondContact O-CB 3.44Å; N219-L222 PolarHBondContact O-N 2.92Å; N219-L222 VanDerWaalsContact O-N 3.15Å; N219-K223 PolarHBondContact O-N 2.02Å
220	M	97.9	Very high	97.6	Very high	28 Å²	28	25 Å²	25	14%	0.138	12%	0.12	C	C	.	.	H	α-helix	trans	-64.1	-42.4	-178.4	-71.9	-60.3	92.3	0	0	112.7	N216 Y217 L222 K223 A224 D334	N216-M220 WeakPolarHBondContact O-CE 3.33Å; Y217-M220 WeakPolarHBondContact O-CB 3Å; Y217-M220 VanDerWaalsContact O-CG 3.23Å; Y217-M220 WeakPolarHBondContact O-CG 3.32Å; Y217-M220 PolarHBondContact O-N 2.77Å; M220-L222 VanDerWaalsContact C-N 3.27Å; M220-L222 PolarHBondContact O-N 3.07Å; M220-K223 HydrophobicContact CE-CB 4.38Å; M220-K223 HydrophobicContact CE-CD 4.08Å; M220-K223 WeakPolarHBondContact O-CB 2.97Å; M220-K223 PolarHBondContact O-N 2.92Å; M220-K223 HydrophobicContact SD-CD 4.46Å; M220-A224 WeakPolarHBondContact O-CB 3.34Å; M220-A224 PolarHBondContact O-N 3.18Å; M220-D334 HydrophobicContact CB-CB 3.98Å
221	S	98.4	Very high	97.6	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.5	-36.7	172.8	-69	0	0	0	0	112.6	N219 A224 I225 F330 L331 W332 L333 D334	N219-S221 PolarHBondContact O-N 3.23Å; S221-A224 PolarHBondContact O-N 3.18Å; S221-A224 VanDerWaalsContact O-N 3.12Å; S221-I225 VanDerWaalsContact O-CG1 3.27Å; S221-I225 WeakPolarHBondContact O-CG1 3.25Å; S221-I225 PolarHBondContact O-N 3.04Å; S221-F330 VanDerWaalsContact CB-CE2 3.48Å; S221-L331 VanDerWaalsContact CB-O 3.29Å; S221-L331 WeakPolarHBondContact CB-O 3.19Å; S221-L331 PolarHBondContact OG-O 3.02Å; S221-W332 PolarHBondContact N-O 2.99Å; S221-W332 VanDerWaalsContact OG-C 3.25Å; S221-W332 PolarHBondContact OG-O 3.42Å; S221-L333 PolarHBondContact OG-O 3.2Å; S221-D334 VanDerWaalsContact OG-CA 3.32Å; S221-D334 WeakPolarHBondContact OG-CA 3.26Å; S221-D334 PolarHBondContact OG-N 2.94Å
222	L	98.5	Very high	97.6	Very high	3 Å²	3	26.3 Å²	26.3	2%	0.016	13%	0.131	C	C	.	.	H	α-helix	trans	-67.3	-43.5	176.5	-54.9	-175.9	0	0	0	111.4	L116 F128 F213 N219 M220 A224 I225 S226 F330	L116-L222 HydrophobicContact CD1-CD2 3.69Å; L116-L222 HydrophobicContact CD2-CD2 4.3Å; F128-L222 HydrophobicContact CE2-CB 4.12Å; F128-L222 HydrophobicContact CE2-CD2 4.18Å; F128-L222 HydrophobicContact CZ-CB 4.27Å; F128-L222 HydrophobicContact CZ-CD1 4.04Å; F128-L222 HydrophobicContact CZ-CD2 3.99Å; F128-L222 HydrophobicContact CZ-CG 4.33Å; F213-L222 HydrophobicContact CE1-CB 4.24Å; F213-L222 HydrophobicContact CE2-CB 4.37Å; F213-L222 HydrophobicContact CZ-CB 4.18Å; N219-L222 HydrophobicContact CB-CD1 4.33Å; N219-L222 WeakPolarHBondContact O-CB 3.44Å; N219-L222 PolarHBondContact O-N 2.92Å; N219-L222 VanDerWaalsContact O-N 3.15Å; M220-L222 VanDerWaalsContact C-N 3.27Å; M220-L222 PolarHBondContact O-N 3.07Å; L222-A224 PolarHBondContact O-N 3.44Å; L222-I225 HydrophobicContact CD2-CD1 4.39Å; L222-I225 PolarHBondContact O-N 2.97Å; L222-S226 VanDerWaalsContact O-CB 3.31Å; L222-S226 WeakPolarHBondContact O-CB 3.36Å; L222-S226 PolarHBondContact O-N 2.83Å; L222-S226 PolarHBondContact O-OG 2.84Å; L222-F330 HydrophobicContact CD2-CE2 3.59Å; L222-F330 HydrophobicContact CD2-CZ 3.74Å; L222-F330 HydrophobicContact CG-CE2 4.34Å; L222-F330 HydrophobicContact CG-CZ 4.1Å
223	K	98.8	Very high	97.6	Very high	3 Å²	3	29 Å²	29	1%	0.013	14%	0.141	C	C	.	.	H	α-helix	trans	-54.6	-40.6	169.1	-171.6	179.6	-74.3	-177.5	0	110.8	T153 A184 F211 F213 D215 N219 M220 S226 W227	T153-K223 PolarHBondContact O-NZ 2.89Å; T153-K223 VanDerWaalsContact O-NZ 3.16Å; A184-K223 HydrophobicContact CB-CD 4.41Å; A184-K223 HydrophobicContact CB-CG 4.37Å; F211-K223 HydrophobicContact CD2-CG 4.23Å; F211-K223 HydrophobicContact CE2-CG 3.99Å; F213-K223 HydrophobicContact CE2-CB 4.09Å; F213-K223 HydrophobicContact CZ-CB 4.19Å; D215-K223 WeakPolarHBondContact OD1-CE 3.29Å; D215-K223 IonicContact OD1-NZ 3.2Å; D215-K223 PolarHBondContact OD1-NZ 3.1Å; D215-K223 IonicContact OD2-NZ 2.74Å; D215-K223 PolarHBondContact OD2-NZ 3.21Å; N219-K223 PolarHBondContact O-N 2.02Å; M220-K223 HydrophobicContact CE-CB 4.38Å; M220-K223 HydrophobicContact CE-CD 4.08Å; M220-K223 WeakPolarHBondContact O-CB 2.97Å; M220-K223 PolarHBondContact O-N 2.92Å; M220-K223 HydrophobicContact SD-CD 4.46Å; K223-S226 PolarHBondContact O-N 2.87Å; K223-W227 PolarHBondContact O-N 2.83Å; K223-W227 VanDerWaalsContact O-N 3.08Å
224	A	98.8	Very high	97.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-70.7	-46.3	-178.1	0	0	0	0	0	115.1	M220 S221 L222 S226 W227 L228 D334 I338	M220-A224 WeakPolarHBondContact O-CB 3.34Å; M220-A224 PolarHBondContact O-N 3.18Å; S221-A224 PolarHBondContact O-N 3.18Å; S221-A224 VanDerWaalsContact O-N 3.12Å; L222-A224 PolarHBondContact O-N 3.44Å; A224-S226 PolarHBondContact O-N 3.43Å; A224-W227 VanDerWaalsContact CA-CD1 3.46Å; A224-W227 HydrophobicContact CB-CZ2 4.5Å; A224-W227 PolarHBondContact O-N 3.19Å; A224-L228 WeakPolarHBondContact O-CG 3.35Å; A224-L228 PolarHBondContact O-N 3.2Å; A224-L228 VanDerWaalsContact O-N 3.07Å; A224-D334 HydrophobicContact CB-CB 4.04Å; A224-I338 HydrophobicContact CB-CD1 3.88Å; A224-I338 HydrophobicContact CB-CG1 3.58Å
225	I	98.7	Very high	97.7	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-55.6	-42	170.8	-64	161.1	0	0	0	110.2	V114 L116 S221 L222 L228 N229 L322 V325 Y337 I338	V114-I225 HydrophobicContact CG1-CG2 4.3Å; V114-I225 HydrophobicContact CG2-CG2 4.16Å; L116-I225 HydrophobicContact CD2-CD1 4Å; S221-I225 VanDerWaalsContact O-CG1 3.27Å; S221-I225 WeakPolarHBondContact O-CG1 3.25Å; S221-I225 PolarHBondContact O-N 3.04Å; L222-I225 HydrophobicContact CD2-CD1 4.39Å; L222-I225 PolarHBondContact O-N 2.97Å; I225-L228 WeakPolarHBondContact O-CB 3.24Å; I225-L228 PolarHBondContact O-N 3.4Å; I225-N229 PolarHBondContact O-N 2.86Å; I225-L322 HydrophobicContact CG2-CD2 4.24Å; I225-V325 HydrophobicContact CD1-CG1 4.08Å; I225-V325 HydrophobicContact CD1-CG2 4.41Å; I225-V325 HydrophobicContact CG1-CG2 4.16Å; I225-V325 HydrophobicContact CG2-CG2 4.49Å; I225-Y337 HydrophobicContact CD1-CE1 4.03Å; I225-Y337 HydrophobicContact CG1-CE1 4.43Å; I225-I338 HydrophobicContact CG1-CD1 4.01Å
226	S	98.8	Very high	97.7	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-68.3	-42.5	-175	-57.8	0	0	0	0	113.1	F211 F213 L222 K223 A224 N229 W230	F211-S226 VanDerWaalsContact CD1-CB 3.46Å; F211-S226 VanDerWaalsContact CE1-CB 3.42Å; F213-S226 WeakPolarHBondContact CE1-OG 3.38Å; L222-S226 VanDerWaalsContact O-CB 3.31Å; L222-S226 WeakPolarHBondContact O-CB 3.36Å; L222-S226 PolarHBondContact O-N 2.83Å; L222-S226 PolarHBondContact O-OG 2.84Å; K223-S226 PolarHBondContact O-N 2.87Å; A224-S226 PolarHBondContact O-N 3.43Å; S226-N229 PolarHBondContact O-N 2.87Å; S226-W230 WeakPolarHBondContact O-CB 3.14Å; S226-W230 PolarHBondContact O-N 3.42Å
227	W	98.7	Very high	97.7	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-73.4	-28.2	174.9	71.4	-113.2	0	0	0	112.6	I150 H152 F211 K223 A224 W230 A231 I241 K243 Y311 L313	I150-W227 HydrophobicContact CB-CD2 4.38Å; I150-W227 HydrophobicContact CG1-CD2 4.12Å; I150-W227 HydrophobicContact CG1-CE3 3.82Å; I150-W227 HydrophobicContact CG1-CG 4.49Å; I150-W227 HydrophobicContact CG1-CZ3 4.43Å; I150-W227 HydrophobicContact CG2-CB 3.83Å; I150-W227 HydrophobicContact CG2-CD2 3.99Å; I150-W227 HydrophobicContact CG2-CG 3.62Å; H152-W227 AromaticContact CE1-NE1 3.76Å; H152-W227 AromaticContact NE2-CD1 3.22Å; H152-W227 AromaticContact NE2-NE1 2.95Å; H152-W227 PolarHBondContact NE2-NE1 2.95Å; F211-W227 HydrophobicContact CZ-CB 4.08Å; K223-W227 PolarHBondContact O-N 2.83Å; K223-W227 VanDerWaalsContact O-N 3.08Å; A224-W227 VanDerWaalsContact CA-CD1 3.46Å; A224-W227 HydrophobicContact CB-CZ2 4.5Å; A224-W227 PolarHBondContact O-N 3.19Å; W227-W230 PolarHBondContact O-N 2.78Å; W227-A231 VanDerWaalsContact O-CB 3.32Å; W227-A231 WeakPolarHBondContact O-CB 3.43Å; W227-A231 PolarHBondContact O-N 2.89Å; W227-I241 HydrophobicContact CE3-CG2 4.26Å; W227-I241 HydrophobicContact CH2-CG2 4.36Å; W227-I241 HydrophobicContact CZ3-CD1 3.97Å; W227-I241 HydrophobicContact CZ3-CG2 3.71Å; W227-K243 HydrophobicContact CZ2-CB 4.4Å; W227-K243 HydrophobicContact CZ2-CG 4.34Å; W227-Y311 HydrophobicContact CH2-CE2 4.27Å; W227-Y311 HydrophobicContact CZ2-CE2 4.15Å; W227-Y311 WeakPolarHBondContact CZ2-OH 3.44Å; W227-L313 HydrophobicContact CH2-CD1 4.48Å; W227-L313 HydrophobicContact CH2-CD2 3.97Å; W227-L313 HydrophobicContact CZ3-CD2 4.37Å
228	L	98.8	Very high	98	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61	-48.6	171.6	-79.2	166.1	0	0	0	110.2	A224 I225 W230 A231 A232 L313 V318 L321 L322 I338	A224-L228 WeakPolarHBondContact O-CG 3.35Å; A224-L228 PolarHBondContact O-N 3.2Å; A224-L228 VanDerWaalsContact O-N 3.07Å; I225-L228 WeakPolarHBondContact O-CB 3.24Å; I225-L228 PolarHBondContact O-N 3.4Å; L228-W230 PolarHBondContact O-N 2.74Å; L228-A231 PolarHBondContact O-N 2.74Å; L228-A232 WeakPolarHBondContact O-CB 3.35Å; L228-A232 PolarHBondContact O-N 3.2Å; L228-L313 HydrophobicContact CD2-CD1 3.92Å; L228-V318 HydrophobicContact CB-CG1 4.19Å; L228-V318 HydrophobicContact CD2-CB 4.34Å; L228-V318 HydrophobicContact CD2-CG1 3.9Å; L228-V318 HydrophobicContact CD2-CG2 4.01Å; L228-V318 WeakPolarHBondContact O-CG1 3.43Å; L228-L321 HydrophobicContact CD2-CD1 4.49Å; L228-L322 HydrophobicContact CB-CD2 3.83Å; L228-L322 HydrophobicContact CB-CG 4.23Å; L228-I338 HydrophobicContact CD1-CD1 4.28Å; L228-I338 HydrophobicContact CD1-CG2 3.93Å
229	N	98.6	Very high	98.1	Very high	38 Å²	38	25.3 Å²	25.3	20%	0.203	13%	0.131	C	C	.	.	H	α-helix	trans	-62	-43.2	175.9	-172.7	62.6	0	0	0	111.9	F112 Y130 I225 S226 A231 A232 K233 L322	F112-N229 WeakPolarHBondContact CB-ND2 3.45Å; F112-N229 WeakPolarHBondContact CD1-ND2 3.25Å; F112-N229 HydrophobicContact CD2-CB 4.18Å; F112-N229 WeakPolarHBondContact CD2-ND2 3.44Å; F112-N229 HydrophobicContact CE2-CB 4.05Å; F112-N229 WeakPolarHBondContact CG-ND2 3.48Å; Y130-N229 PolarHBondContact OH-ND2 2.86Å; I225-N229 PolarHBondContact O-N 2.86Å; S226-N229 PolarHBondContact O-N 2.87Å; N229-A231 PolarHBondContact O-N 3.42Å; N229-A232 PolarHBondContact O-N 2.84Å; N229-K233 WeakPolarHBondContact O-CB 3.25Å; N229-K233 PolarHBondContact O-N 2.72Å; N229-L322 HydrophobicContact CB-CD1 4.48Å; N229-L322 HydrophobicContact CB-CD2 4.28Å
230	W	98.7	Very high	98.1	Very high	1 Å²	1	25.2 Å²	25.2	0%	0.004	13%	0.13	C	C	.	.	H	α-helix	trans	-59.2	-46.2	175.2	176	86.8	0	0	0	111.8	Y130 L133 F137 I148 I150 V182 V209 S226 W227 L228 K233 Y234 C235	Y130-W230 HydrophobicContact CE1-CB 3.83Å; Y130-W230 HydrophobicContact CE1-CG 4.39Å; Y130-W230 WeakPolarHBondContact OH-CA 3.26Å; Y130-W230 PolarHBondContact OH-N 3.42Å; L133-W230 VanDerWaalsContact CD1-NE1 3.26Å; F137-W230 HydrophobicContact CB-CZ2 4.29Å; F137-W230 AromaticContact CD1-CH2 3.9Å; F137-W230 HydrophobicContact CD1-CH2 3.9Å; F137-W230 AromaticContact CD1-CZ2 4Å; F137-W230 HydrophobicContact CD1-CZ2 4Å; F137-W230 HydrophobicContact CE1-CH2 4.2Å; F137-W230 HydrophobicContact CG-CZ2 4.2Å; I148-W230 HydrophobicContact CD1-CH2 4.15Å; I148-W230 HydrophobicContact CD1-CZ3 4.3Å; I148-W230 HydrophobicContact CG1-CH2 4.21Å; I148-W230 HydrophobicContact CG1-CZ3 3.89Å; I150-W230 HydrophobicContact CD1-CE3 4.12Å; I150-W230 HydrophobicContact CD1-CZ3 3.75Å; V182-W230 HydrophobicContact CB-CH2 4.05Å; V182-W230 HydrophobicContact CB-CZ3 4.45Å; V182-W230 HydrophobicContact CG1-CE3 4.4Å; V182-W230 HydrophobicContact CG1-CH2 3.83Å; V182-W230 HydrophobicContact CG1-CZ3 3.73Å; V182-W230 HydrophobicContact CG2-CH2 4.16Å; V182-W230 HydrophobicContact CG2-CZ2 4.21Å; V209-W230 HydrophobicContact CG1-CG 4.17Å; V209-W230 HydrophobicContact CG2-CD2 4.1Å; V209-W230 HydrophobicContact CG2-CG 4.27Å; V209-W230 HydrophobicContact CG2-CZ2 3.96Å; S226-W230 WeakPolarHBondContact O-CB 3.14Å; S226-W230 PolarHBondContact O-N 3.42Å; W227-W230 PolarHBondContact O-N 2.78Å; L228-W230 PolarHBondContact O-N 2.74Å; W230-K233 PolarHBondContact O-N 2.79Å; W230-Y234 AromaticContact CD1-CD2 3.29Å; W230-Y234 AromaticContact CD1-CE2 3.87Å; W230-Y234 AromaticContact CG-CD2 3.94Å; W230-Y234 HydrophobicContact CG-CD2 3.94Å; W230-Y234 AromaticContact NE1-CD2 3.56Å; W230-Y234 WeakPolarHBondContact O-CB 3.36Å; W230-Y234 WeakPolarHBondContact O-CD2 3.36Å; W230-Y234 PolarHBondContact O-N 3.4Å; W230-C235 VanDerWaalsContact CH2-SG 3.51Å
231	A	98.6	Very high	98.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-66.3	-41.6	-178.9	0	0	0	0	0	111.8	W227 L228 N229 K233 C235 I241 M315	W227-A231 VanDerWaalsContact O-CB 3.32Å; W227-A231 WeakPolarHBondContact O-CB 3.43Å; W227-A231 PolarHBondContact O-N 2.89Å; L228-A231 PolarHBondContact O-N 2.74Å; N229-A231 PolarHBondContact O-N 3.42Å; A231-K233 VanDerWaalsContact C-N 3.33Å; A231-K233 PolarHBondContact O-N 3.13Å; A231-C235 CarbonylContact O-C 3.55Å; A231-C235 VanDerWaalsContact O-CA 3.28Å; A231-C235 WeakPolarHBondContact O-CA 3.14Å; A231-C235 PolarHBondContact O-N 2.66Å; A231-I241 HydrophobicContact CB-CD1 3.53Å; A231-M315 HydrophobicContact CB-CE 4.5Å
232	A	98.2	Very high	98.1	Very high	28 Å²	28	24 Å²	24	23%	0.231	12%	0.124	C	C	.	.	H	α-helix	trans	-59.8	-43.8	174.7	0	0	0	0	0	111.9	L228 N229 V318 L322	L228-A232 WeakPolarHBondContact O-CB 3.35Å; L228-A232 PolarHBondContact O-N 3.2Å; N229-A232 PolarHBondContact O-N 2.84Å; A232-V318 HydrophobicContact CB-CG1 3.87Å; A232-L322 HydrophobicContact CB-CD1 4.21Å
233	K	97.8	Very high	98.2	Very high	106 Å²	106	23.9 Å²	23.9	46%	0.461	12%	0.124	S	C	.	.	H	α-helix	trans	-76.9	-48.9	-176.3	-175.2	170.7	-178.6	-177.5	0	113.1	N229 W230 A231	N229-K233 WeakPolarHBondContact O-CB 3.25Å; N229-K233 PolarHBondContact O-N 2.72Å; W230-K233 PolarHBondContact O-N 2.79Å; A231-K233 VanDerWaalsContact C-N 3.33Å; A231-K233 PolarHBondContact O-N 3.13Å
234	Y	98.1	Very high	98.1	Very high	11 Å²	11	23.8 Å²	23.8	4%	0.043	12%	0.123	C	C	.	.	H	α-helix	trans	-102.4	-17	-167.9	-61.8	-69.8	0	0	0	113.5	Y130 L133 E135 C138 Q139 W230 P236	Y130-Y234 HydrophobicContact CD2-CE2 4.26Å; Y130-Y234 AromaticContact CE2-CE2 3.81Å; Y130-Y234 HydrophobicContact CE2-CE2 3.81Å; L133-Y234 HydrophobicContact CD1-CD2 4.11Å; L133-Y234 HydrophobicContact CD1-CE2 3.95Å; L133-Y234 HydrophobicContact CD2-CE1 4.38Å; L133-Y234 HydrophobicContact CD2-CE2 3.88Å; L133-Y234 WeakPolarHBondContact CD2-OH 3.4Å; E135-Y234 HydrophobicContact CB-CD1 4.36Å; E135-Y234 HydrophobicContact CB-CE1 3.96Å; E135-Y234 HydrophobicContact CG-CE1 3.92Å; E135-Y234 WeakPolarHBondContact O-CD1 3.24Å; C138-Y234 VanDerWaalsContact CB-O 3.3Å; C138-Y234 WeakPolarHBondContact CB-O 3.31Å; Q139-Y234 PolarHBondContact NE2-O 3.4Å; Q139-Y234 PolarHBondContact OE1-O 2.74Å; W230-Y234 AromaticContact CD1-CD2 3.29Å; W230-Y234 AromaticContact CD1-CE2 3.87Å; W230-Y234 AromaticContact CG-CD2 3.94Å; W230-Y234 HydrophobicContact CG-CD2 3.94Å; W230-Y234 AromaticContact NE1-CD2 3.56Å; W230-Y234 WeakPolarHBondContact O-CB 3.36Å; W230-Y234 WeakPolarHBondContact O-CD2 3.36Å; W230-Y234 PolarHBondContact O-N 3.4Å; Y234-P236 VanDerWaalsContact C-CD 3.43Å
235	C	98.3	Very high	98	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.133	C	C	.	.			trans	-131.7	43.3	-179.4	-63.8	0	0	0	0	114.3	C138 W230 A231 N237 A238 M315	C138-C235 HydrophobicContact CB-CB 3.76Å; C138-C235 WeakPolarHBondContact CB-SG 3.26Å; C138-C235 WeakPolarHBondContact SG-CB 3.44Å; C138-C235 CovalentContact SG-SG 2.04Å; C138-C235 PolarHBondContact SG-SG 2.62Å; W230-C235 VanDerWaalsContact CH2-SG 3.51Å; A231-C235 CarbonylContact O-C 3.55Å; A231-C235 VanDerWaalsContact O-CA 3.28Å; A231-C235 WeakPolarHBondContact O-CA 3.14Å; A231-C235 PolarHBondContact O-N 2.66Å; C235-N237 PolarHBondContact O-N 3.48Å; C235-A238 PolarHBondContact O-N 2.68Å; C235-A238 VanDerWaalsContact O-N 3.12Å; C235-M315 WeakPolarHBondContact O-CE 3.19Å
236	P	96.9	Very high	97.9	Very high	69 Å²	69	26.1 Å²	26.1	45%	0.448	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-22.1	-172.8	27	-36.7	0	0	0	114.1	Y234	Y234-P236 VanDerWaalsContact C-CD 3.43Å
237	N	95.9	Very high	97.7	Very high	115 Å²	115	27.5 Å²	27.5	62%	0.615	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-13.7	-177.9	-67	-27	0	0	0	113.9	C235	C235-N237 PolarHBondContact O-N 3.48Å
238	A	97.6	Very high	97.4	Very high	2 Å²	2	27.5 Å²	27.5	2%	0.017	14%	0.143	C	C	.	.			trans	-62.6	142.3	175	0	0	0	0	0	109.8	I145 I148 C235 M315	I145-A238 HydrophobicContact CG1-CB 4.26Å; I145-A238 HydrophobicContact CG2-CB 3.93Å; I148-A238 HydrophobicContact CB-CB 4.43Å; I148-A238 HydrophobicContact CG2-CB 3.98Å; C235-A238 PolarHBondContact O-N 2.68Å; C235-A238 VanDerWaalsContact O-N 3.12Å; A238-M315 HydrophobicContact CB-CE 3.69Å; A238-M315 WeakPolarHBondContact O-CB 3.48Å; A238-M315 WeakPolarHBondContact O-CG 3.02Å
239	K	96.4	Very high	97.1	Very high	114 Å²	114	27.8 Å²	27.8	50%	0.496	14%	0.144	S	C	.	.	S	Bend	trans	-87.5	-37.8	-178.9	-62.8	-58.7	-179.4	-173.3	0	111.9	F146 M315	F146-K239 HydrophobicContact CD2-CB 3.73Å; F146-K239 HydrophobicContact CD2-CG 3.72Å; F146-K239 HydrophobicContact CE2-CB 3.68Å; F146-K239 HydrophobicContact CE2-CG 3.89Å; F146-K239 PolarHBondContact O-N 2.98Å; K239-M315 PolarHBondContact O-N 2.85Å
240	Y	97.8	Very high	96.8	Very high	6 Å²	6	26 Å²	26	2%	0.024	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	149.9	177.2	-54.2	-85.3	0	0	0	110.9	F146 V147 I148 F259 K263 Y273 L313 T314	F146-Y240 AromaticContact CE2-CD2 3.89Å; F146-Y240 HydrophobicContact CE2-CD2 3.89Å; F146-Y240 AromaticContact CE2-CE2 3.75Å; F146-Y240 HydrophobicContact CE2-CE2 3.75Å; F146-Y240 AromaticContact CZ-CD2 3.89Å; F146-Y240 HydrophobicContact CZ-CD2 3.89Å; F146-Y240 AromaticContact CZ-CE2 3.68Å; F146-Y240 HydrophobicContact CZ-CE2 3.68Å; F146-Y240 PolarHBondContact O-N 2.68Å; V147-Y240 WeakPolarHBondContact CA-O 3.21Å; V147-Y240 HydrophobicContact CG2-CD2 4.42Å; I148-Y240 PolarHBondContact N-O 2.8Å; I148-Y240 VanDerWaalsContact N-O 3.1Å; Y240-F259 AromaticContact CD1-CD1 3.84Å; Y240-F259 HydrophobicContact CD1-CD1 3.84Å; Y240-F259 AromaticContact CD1-CE1 3.96Å; Y240-F259 HydrophobicContact CD1-CE1 3.96Å; Y240-F259 HydrophobicContact CD2-CB 3.94Å; Y240-F259 AromaticContact CD2-CD1 3.8Å; Y240-F259 HydrophobicContact CD2-CD1 3.8Å; Y240-F259 HydrophobicContact CD2-CE1 4.46Å; Y240-F259 AromaticContact CD2-CG 3.92Å; Y240-F259 HydrophobicContact CD2-CG 3.92Å; Y240-F259 HydrophobicContact CE1-CD1 4.18Å; Y240-F259 HydrophobicContact CE2-CB 3.98Å; Y240-F259 HydrophobicContact CE2-CD1 4.15Å; Y240-F259 HydrophobicContact CE2-CG 4.34Å; Y240-F259 AromaticContact CG-CD1 3.64Å; Y240-F259 HydrophobicContact CG-CD1 3.64Å; Y240-F259 AromaticContact CG-CE1 3.87Å; Y240-F259 HydrophobicContact CG-CE1 3.87Å; Y240-F259 HydrophobicContact CG-CG 4.14Å; Y240-F259 HydrophobicContact CG-CZ 4.5Å; Y240-K263 PolarHBondContact OH-N 3.19Å; Y240-Y273 HydrophobicContact CD1-CE2 4.39Å; Y240-Y273 HydrophobicContact CE1-CE2 4.04Å; Y240-L313 CarbonylContact C-O 3.51Å; Y240-L313 VanDerWaalsContact CA-O 3.29Å; Y240-L313 WeakPolarHBondContact CA-O 3.32Å; Y240-T314 HydrophobicContact CD1-CG2 4.18Å; Y240-T314 HydrophobicContact CE1-CG2 3.88Å
241	I	98.6	Very high	96.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	137.9	166.2	-54.8	179.5	0	0	0	107.2	I148 I150 W227 A231 S312 L313 M315 V318	I148-I241 HydrophobicContact CG2-CB 4.16Å; I148-I241 HydrophobicContact CG2-CG1 3.66Å; I148-I241 HydrophobicContact CG2-CG2 4.2Å; I148-I241 CarbonylContact O-C 3.57Å; I148-I241 WeakPolarHBondContact O-CA 3.49Å; I150-I241 HydrophobicContact CD1-CG2 4.43Å; I150-I241 HydrophobicContact CG1-CG2 3.58Å; W227-I241 HydrophobicContact CE3-CG2 4.26Å; W227-I241 HydrophobicContact CH2-CG2 4.36Å; W227-I241 HydrophobicContact CZ3-CD1 3.97Å; W227-I241 HydrophobicContact CZ3-CG2 3.71Å; A231-I241 HydrophobicContact CB-CD1 3.53Å; I241-S312 CarbonylContact O-C 3.49Å; I241-S312 WeakPolarHBondContact O-CA 3.47Å; I241-L313 HydrophobicContact CB-CD2 3.58Å; I241-L313 HydrophobicContact CB-CG 4.09Å; I241-L313 HydrophobicContact CG2-CD2 3.93Å; I241-L313 PolarHBondContact N-O 3.25Å; I241-L313 PolarHBondContact O-N 3.13Å; I241-M315 HydrophobicContact CD1-CE 3.83Å; I241-M315 HydrophobicContact CD1-SD 4.04Å; I241-M315 HydrophobicContact CG1-CE 3.77Å; I241-M315 HydrophobicContact CG1-SD 4.46Å; I241-V318 HydrophobicContact CD1-CG2 3.55Å
242	L	98.6	Very high	96.3	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	105.1	174.6	170.3	60.3	0	0	0	108.9	V147 I148 A149 I150 V244 V250 I255 S312 F375	V147-L242 HydrophobicContact CG1-CB 4.02Å; I148-L242 PolarHBondContact O-N 3.3Å; A149-L242 CarbonylContact C-O 3.42Å; A149-L242 VanDerWaalsContact CA-O 3.24Å; A149-L242 WeakPolarHBondContact CA-O 3.48Å; I150-L242 PolarHBondContact N-O 2.97Å; L242-V244 HydrophobicContact CD1-CG2 3.81Å; L242-V244 HydrophobicContact CD2-CG2 4.1Å; L242-V244 HydrophobicContact CG-CG2 3.6Å; L242-V250 HydrophobicContact CD2-CG1 4.45Å; L242-I255 HydrophobicContact CD2-CG1 4.26Å; L242-I255 HydrophobicContact CD2-CG2 4.41Å; L242-S312 WeakPolarHBondContact CD1-OG 3.35Å; L242-F375 HydrophobicContact CD1-CE1 3.92Å; L242-F375 HydrophobicContact CD1-CZ 3.78Å
243	K	98.7	Very high	96	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.009	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	133.1	171.6	-173.8	-86.2	-162.3	-179.6	0	109.7	I150 W227 D245 G308 S310 Y311 D334	I150-K243 WeakPolarHBondContact O-CA 3.28Å; W227-K243 HydrophobicContact CZ2-CB 4.4Å; W227-K243 HydrophobicContact CZ2-CG 4.34Å; K243-D245 IonicContact NZ-OD1 2.79Å; K243-D245 PolarHBondContact NZ-OD1 2.86Å; K243-G308 PolarHBondContact NZ-O 3.5Å; K243-S310 CarbonylContact O-C 3.13Å; K243-S310 WeakPolarHBondContact O-CA 3.38Å; K243-S310 VanDerWaalsContact O-CB 3.27Å; K243-S310 WeakPolarHBondContact O-CB 3.36Å; K243-Y311 HydrophobicContact CB-CD1 4.39Å; K243-Y311 HydrophobicContact CB-CD2 3.96Å; K243-Y311 HydrophobicContact CB-CE1 4.08Å; K243-Y311 HydrophobicContact CB-CE2 3.62Å; K243-Y311 HydrophobicContact CB-CG 4.34Å; K243-Y311 HydrophobicContact CD-CD1 4.11Å; K243-Y311 HydrophobicContact CD-CE1 3.56Å; K243-Y311 HydrophobicContact CG-CE1 3.93Å; K243-Y311 HydrophobicContact CG-CE2 4.16Å; K243-Y311 PolarHBondContact N-O 3.03Å; K243-Y311 PolarHBondContact O-N 3.04Å; K243-D334 WeakPolarHBondContact CE-OD2 3.39Å; K243-D334 IonicContact NZ-OD2 3.54Å; K243-D334 PolarHBondContact NZ-OD2 3.09Å
244	V	98.2	Very high	95.6	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	141.4	179.2	-166.1	0	0	0	0	110.1	I150 V151 H152 W168 L242 V248 V250	I150-V244 PolarHBondContact O-N 3.22Å; V151-V244 CarbonylContact C-O 3.54Å; V151-V244 VanDerWaalsContact CA-O 3.25Å; V151-V244 WeakPolarHBondContact CA-O 3.41Å; H152-V244 PolarHBondContact N-O 3.49Å; W168-V244 HydrophobicContact CH2-CB 4.29Å; W168-V244 HydrophobicContact CH2-CG2 4.15Å; W168-V244 HydrophobicContact CZ2-CB 4.47Å; W168-V244 HydrophobicContact CZ2-CG1 4.32Å; L242-V244 HydrophobicContact CD1-CG2 3.81Å; L242-V244 HydrophobicContact CD2-CG2 4.1Å; L242-V244 HydrophobicContact CG-CG2 3.6Å; V244-V248 HydrophobicContact CG1-CB 3.67Å; V244-V248 HydrophobicContact CG1-CG1 3.86Å; V244-V250 HydrophobicContact CG1-CG2 3.71Å; V244-V250 HydrophobicContact CG2-CG2 4.11Å
245	D	96.8	Very high	95.4	Very high	39 Å²	39	20.5 Å²	20.5	21%	0.209	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	150.8	168.2	-63.5	-17.7	0	0	0	111	K243 D247 V248 R309	K243-D245 IonicContact NZ-OD1 2.79Å; K243-D245 PolarHBondContact NZ-OD1 2.86Å; D245-D247 WeakPolarHBondContact CB-OD1 3.22Å; D245-D247 PolarHBondContact O-N 3Å; D245-V248 HydrophobicContact CB-CG2 4.17Å; D245-V248 PolarHBondContact O-N 3.16Å; D245-V248 VanDerWaalsContact O-N 3.13Å; D245-R309 PolarHBondContact N-O 3.38Å; D245-R309 WeakPolarHBondContact OD2-CA 3.4Å
246	D	96.6	Very high	95.1	Very high	14 Å²	14	20.5 Å²	20.5	8%	0.075	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-3.5	-177.6	71.2	12.5	0	0	0	115.5	V151 H152 T153 N157 R160 I164	V151-D246 HydrophobicContact CG1-CB 3.9Å; H152-D246 WeakPolarHBondContact O-CB 3.23Å; H152-D246 PolarHBondContact O-N 3.29Å; T153-D246 WeakPolarHBondContact CA-OD2 3.24Å; T153-D246 VanDerWaalsContact CB-OD2 3.31Å; T153-D246 WeakPolarHBondContact CB-OD2 3.42Å; T153-D246 PolarHBondContact OG1-OD2 3.13Å; N157-D246 WeakPolarHBondContact CB-OD2 3.35Å; N157-D246 PolarHBondContact ND2-OD2 2.85Å; R160-D246 HydrophobicContact CB-CB 4.24Å; R160-D246 VanDerWaalsContact CD-OD1 3.25Å; R160-D246 WeakPolarHBondContact CD-OD1 3.3Å; R160-D246 IonicContact NE-OD1 2.62Å; I164-D246 HydrophobicContact CD1-CB 4.1Å
247	D	93.4	Very high	94.9	Very high	29 Å²	29	23.4 Å²	23.4	16%	0.155	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	11.8	177.5	73.9	-6.5	0	0	0	114.1	D245 H377 L378	D245-D247 WeakPolarHBondContact CB-OD1 3.22Å; D245-D247 PolarHBondContact O-N 3Å; D247-H377 VanDerWaalsContact CG-NE2 3.28Å; D247-H377 IonicContact OD1-CD2 3.54Å; D247-H377 PolarHBondContact OD1-CD2 3.4Å; D247-H377 IonicContact OD1-NE2 2.76Å; D247-H377 PolarHBondContact OD1-NE2 2.66Å; D247-H377 IonicContact OD2-CD2 2.67Å; D247-H377 IonicContact OD2-CE1 3.42Å; D247-H377 IonicContact OD2-NE2 3.41Å; D247-H377 PolarHBondContact OD2-NE2 3.05Å; D247-L378 CarbonylContact O-C 3.47Å; D247-L378 PolarHBondContact O-N 3.42Å
248	V	93.3	Very high	94.7	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.012	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	126.9	177.3	176	0	0	0	0	110.6	V244 D245 R309 F375 V376	V244-V248 HydrophobicContact CG1-CB 3.67Å; V244-V248 HydrophobicContact CG1-CG1 3.86Å; D245-V248 HydrophobicContact CB-CG2 4.17Å; D245-V248 PolarHBondContact O-N 3.16Å; D245-V248 VanDerWaalsContact O-N 3.13Å; V248-R309 HydrophobicContact CG2-CB 3.91Å; V248-R309 HydrophobicContact CG2-CG 4.41Å; V248-F375 HydrophobicContact CG1-CB 4.24Å; V248-F375 HydrophobicContact CG1-CD1 4.15Å; V248-V376 WeakPolarHBondContact CA-O 3.15Å
249	H	91.4	Very high	94.5	Very high	6 Å²	6	19.4 Å²	19.4	3%	0.028	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	135	166.3	173.5	88.2	0	0	0	110.1	F375 V376 L378 L388 W389 T392	H249-F375 WeakPolarHBondContact O-CA 3.02Å; H249-V376 HydrophobicContact CB-CB 4.25Å; H249-V376 PolarHBondContact N-O 2.7Å; H249-V376 PolarHBondContact O-N 2.75Å; H249-V376 VanDerWaalsContact O-N 3.1Å; H249-L378 HydrophobicContact CB-CD1 4.3Å; H249-L388 HydrophobicContact CB-CD2 3.95Å; H249-W389 AromaticContact CE1-CE3 3.95Å; H249-T392 PolarHBondContact NE2-OG1 3.2Å
250	V	93.8	Very high	94.2	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.9	175.7	-173.4	0	0	0	0	110.4	W168 L242 V244 T252 I255 V374 F375	W168-V250 HydrophobicContact CB-CB 4.15Å; W168-V250 WeakPolarHBondContact CB-O 3.35Å; W168-V250 HydrophobicContact CD2-CB 3.66Å; W168-V250 HydrophobicContact CD2-CG2 3.8Å; W168-V250 HydrophobicContact CE3-CB 3.76Å; W168-V250 HydrophobicContact CE3-CG1 4.21Å; W168-V250 HydrophobicContact CE3-CG2 3.94Å; W168-V250 HydrophobicContact CG-CB 3.85Å; W168-V250 HydrophobicContact CG-CG2 4.34Å; W168-V250 HydrophobicContact CH2-CG2 4.21Å; W168-V250 HydrophobicContact CZ2-CG2 4.06Å; W168-V250 HydrophobicContact CZ3-CB 4.39Å; W168-V250 HydrophobicContact CZ3-CG2 4.14Å; L242-V250 HydrophobicContact CD2-CG1 4.45Å; V244-V250 HydrophobicContact CG1-CG2 3.71Å; V244-V250 HydrophobicContact CG2-CG2 4.11Å; V250-T252 PolarHBondContact O-N 3.18Å; V250-I255 HydrophobicContact CG1-CG2 4.12Å; V250-V374 CarbonylContact C-O 3.59Å; V250-V374 VanDerWaalsContact CA-O 3.26Å; V250-V374 WeakPolarHBondContact CA-O 3.41Å; V250-V374 HydrophobicContact CG1-CG1 4.31Å; V250-F375 HydrophobicContact CG1-CD1 4.49Å; V250-F375 HydrophobicContact CG1-CE1 4.07Å; V250-F375 HydrophobicContact CG2-CD1 4.16Å; V250-F375 HydrophobicContact CG2-CE1 4.16Å
251	N	91.9	Very high	93.9	Very high	15 Å²	15	25.2 Å²	25.2	8%	0.08	11%	0.11	C	C	.	.			trans	-80.9	91.5	164.2	-177.5	-8	0	0	0	109.5	F253 G254 I255 I373 V374 T392	N251-F253 PolarHBondContact O-N 3.26Å; N251-F253 PolarHBondContact OD1-N 3.18Å; N251-G254 PolarHBondContact O-N 2.95Å; N251-G254 VanDerWaalsContact O-N 3.08Å; N251-G254 PolarHBondContact OD1-N 3.11Å; N251-I255 PolarHBondContact O-N 3.38Å; N251-I255 VanDerWaalsContact O-N 3.07Å; N251-I373 VanDerWaalsContact CB-O 3.28Å; N251-I373 WeakPolarHBondContact CB-O 3.2Å; N251-I373 PolarHBondContact ND2-O 3.19Å; N251-V374 PolarHBondContact N-O 2.87Å; N251-T392 HydrophobicContact CB-CG2 4.37Å
252	T	93.6	Very high	93.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-53.7	-40.3	-179	-56.9	0	0	0	0	112.8	W168 F173 F177 L179 V250 G254 I255 M256	W168-T252 WeakPolarHBondContact CA-OG1 3.47Å; W168-T252 WeakPolarHBondContact CB-OG1 3.33Å; W168-T252 PolarHBondContact O-OG1 3.32Å; F173-T252 HydrophobicContact CD1-CG2 4.5Å; F173-T252 HydrophobicContact CD2-CG2 3.99Å; F173-T252 HydrophobicContact CE2-CG2 4.25Å; F173-T252 HydrophobicContact CG-CG2 4.12Å; F177-T252 HydrophobicContact CD2-CG2 4.3Å; L179-T252 HydrophobicContact CD2-CG2 3.52Å; V250-T252 PolarHBondContact O-N 3.18Å; T252-G254 PolarHBondContact O-N 3.43Å; T252-I255 WeakPolarHBondContact O-CG2 3.35Å; T252-M256 HydrophobicContact CG2-CG 4.08Å; T252-M256 VanDerWaalsContact O-CB 3.31Å; T252-M256 WeakPolarHBondContact O-CB 3.08Å; T252-M256 WeakPolarHBondContact O-CG 3.4Å; T252-M256 PolarHBondContact O-N 2.91Å
253	F	91.6	Very high	92.9	Very high	8 Å²	8	33.3 Å²	33.3	4%	0.035	14%	0.144	C	C	.	.	H	α-helix	trans	-63.6	-44.2	179	-51.3	-72.9	0	0	0	111.7	F173 F177 N251 R257 W389 T392 L393 C396 C401 Y402	F173-F253 AromaticContact CE1-CE1 3.86Å; F173-F253 HydrophobicContact CE1-CE1 3.86Å; F173-F253 AromaticContact CE1-CZ 3.82Å; F173-F253 HydrophobicContact CE1-CZ 3.82Å; F173-F253 HydrophobicContact CZ-CE1 4.35Å; F173-F253 AromaticContact CZ-CZ 3.89Å; F173-F253 HydrophobicContact CZ-CZ 3.89Å; F177-F253 AromaticContact CE2-CD1 3.92Å; F177-F253 HydrophobicContact CE2-CD1 3.92Å; F177-F253 AromaticContact CE2-CE1 3.9Å; F177-F253 HydrophobicContact CE2-CE1 3.9Å; F177-F253 AromaticContact CZ-CD1 3.68Å; F177-F253 HydrophobicContact CZ-CD1 3.68Å; F177-F253 AromaticContact CZ-CE1 3.97Å; F177-F253 HydrophobicContact CZ-CE1 3.97Å; N251-F253 PolarHBondContact O-N 3.26Å; N251-F253 PolarHBondContact OD1-N 3.18Å; F253-R257 VanDerWaalsContact O-CB 3.29Å; F253-R257 WeakPolarHBondContact O-CB 3.2Å; F253-R257 PolarHBondContact O-N 3.14Å; F253-W389 HydrophobicContact CE2-CH2 4.03Å; F253-W389 HydrophobicContact CZ-CH2 4.46Å; F253-T392 HydrophobicContact CD2-CG2 4.09Å; F253-T392 HydrophobicContact CE2-CG2 4.26Å; F253-L393 HydrophobicContact CE2-CD2 4.05Å; F253-L393 HydrophobicContact CZ-CD2 3.97Å; F253-C396 VanDerWaalsContact CD1-SG 3.5Å; F253-C396 HydrophobicContact CD2-CB 3.78Å; F253-C396 WeakPolarHBondContact CE1-SG 3.38Å; F253-C396 HydrophobicContact CE2-CB 3.7Å; F253-C396 HydrophobicContact CG-CB 4.25Å; F253-C396 HydrophobicContact CZ-CB 4.12Å; F253-C396 WeakPolarHBondContact CZ-SG 3.46Å; F253-C401 HydrophobicContact CB-CB 3.71Å; F253-C401 HydrophobicContact CD1-CB 4.13Å; F253-C401 HydrophobicContact CG-CB 4.01Å; F253-Y402 AromaticContact CE1-CD1 3.9Å; F253-Y402 HydrophobicContact CE1-CD1 3.9Å; F253-Y402 HydrophobicContact CE1-CD2 4.48Å; F253-Y402 AromaticContact CE1-CE1 3.49Å; F253-Y402 HydrophobicContact CE1-CE1 3.49Å; F253-Y402 VanDerWaalsContact CE1-CE1 3.49Å; F253-Y402 HydrophobicContact CE1-CE2 4.07Å; F253-Y402 HydrophobicContact CE1-CG 4.42Å; F253-Y402 AromaticContact CE1-CZ 3.57Å; F253-Y402 AromaticContact CZ-CE1 4Å; F253-Y402 HydrophobicContact CZ-CE1 4Å; F253-Y402 HydrophobicContact CZ-CE2 4.14Å; F253-Y402 AromaticContact CZ-CZ 3.63Å
254	G	90.4	Very high	92.2	Very high	7 Å²	7	37 Å²	37	7%	0.072	18%	0.175	C	C	.	.	H	α-helix	trans	-62.2	-49.9	178.6	0	0	0	0	0	112.5	N251 T252 R257 F258	N251-G254 PolarHBondContact O-N 2.95Å; N251-G254 VanDerWaalsContact O-N 3.08Å; N251-G254 PolarHBondContact OD1-N 3.11Å; T252-G254 PolarHBondContact O-N 3.43Å; G254-R257 PolarHBondContact O-N 3.33Å; G254-F258 PolarHBondContact O-N 3.02Å
255	I	93.1	Very high	91.5	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-69.2	-37.7	-177.8	-165.3	57.2	0	0	0	112.5	L242 V250 N251 T252 F258 F259 V374 F375	L242-I255 HydrophobicContact CD2-CG1 4.26Å; L242-I255 HydrophobicContact CD2-CG2 4.41Å; V250-I255 HydrophobicContact CG1-CG2 4.12Å; N251-I255 PolarHBondContact O-N 3.38Å; N251-I255 VanDerWaalsContact O-N 3.07Å; T252-I255 WeakPolarHBondContact O-CG2 3.35Å; I255-F258 HydrophobicContact CD1-CD1 3.99Å; I255-F258 WeakPolarHBondContact O-CB 3.46Å; I255-F258 PolarHBondContact O-N 2.85Å; I255-F259 HydrophobicContact CD1-CD2 4.49Å; I255-F259 HydrophobicContact CD1-CE1 4.4Å; I255-F259 HydrophobicContact CD1-CE2 3.95Å; I255-F259 HydrophobicContact CD1-CZ 3.88Å; I255-F259 HydrophobicContact CG1-CD2 4.01Å; I255-F259 HydrophobicContact CG1-CE2 3.45Å; I255-F259 VanDerWaalsContact CG1-CE2 3.45Å; I255-F259 HydrophobicContact CG1-CZ 3.88Å; I255-F259 VanDerWaalsContact O-CD2 3.26Å; I255-F259 WeakPolarHBondContact O-CD2 3.35Å; I255-F259 PolarHBondContact O-N 3.46Å; I255-V374 HydrophobicContact CB-CG1 3.66Å; I255-V374 HydrophobicContact CD1-CG1 4.2Å; I255-V374 HydrophobicContact CG1-CG1 4.25Å; I255-F375 HydrophobicContact CD1-CE2 4.29Å; I255-F375 HydrophobicContact CD1-CZ 3.99Å; I255-F375 HydrophobicContact CG1-CZ 4.31Å
256	M	93.4	Very high	90.1	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-69.8	-37.8	178.1	-65.1	-48.5	-69.5	0	0	111.8	F146 V147 F177 L179 T252 F258 F259 R260	F146-M256 HydrophobicContact CD1-CE 3.63Å; F146-M256 HydrophobicContact CE1-CE 4.15Å; V147-M256 HydrophobicContact CB-CE 4.07Å; V147-M256 HydrophobicContact CB-SD 4.18Å; V147-M256 HydrophobicContact CG2-CE 3.58Å; V147-M256 HydrophobicContact CG2-SD 3.86Å; F177-M256 HydrophobicContact CB-CB 4.33Å; F177-M256 HydrophobicContact CB-CE 3.67Å; F177-M256 HydrophobicContact CB-CG 3.86Å; F177-M256 HydrophobicContact CB-SD 4.48Å; F177-M256 HydrophobicContact CD1-CB 3.99Å; F177-M256 HydrophobicContact CD1-CG 4.33Å; F177-M256 HydrophobicContact CD2-CG 4.43Å; F177-M256 HydrophobicContact CG-CB 4.17Å; F177-M256 HydrophobicContact CG-CG 3.98Å; F177-M256 WeakPolarHBondContact O-CE 3.5Å; L179-M256 HydrophobicContact CB-CE 4.26Å; L179-M256 HydrophobicContact CB-SD 4.32Å; L179-M256 HydrophobicContact CD1-SD 4.4Å; L179-M256 HydrophobicContact CD2-SD 4.48Å; T252-M256 HydrophobicContact CG2-CG 4.08Å; T252-M256 VanDerWaalsContact O-CB 3.31Å; T252-M256 WeakPolarHBondContact O-CB 3.08Å; T252-M256 WeakPolarHBondContact O-CG 3.4Å; T252-M256 PolarHBondContact O-N 2.91Å; M256-F258 VanDerWaalsContact C-N 3.31Å; M256-F258 PolarHBondContact O-N 2.78Å; M256-F259 PolarHBondContact O-N 3.42Å; M256-F259 HydrophobicContact SD-CD2 4.12Å; M256-R260 WeakPolarHBondContact O-CG 3.12Å; M256-R260 PolarHBondContact O-N 3.07Å
257	R	91.2	Very high	88.9	Confident	131 Å²	131	51.3 Å²	51.3	49%	0.494	25%	0.25	S	S	.	.	H	α-helix	trans	-61	-42	170.8	-175.9	177.7	67.8	155.3	0.5	111.4	F253 G254 R260 K261	F253-R257 VanDerWaalsContact O-CB 3.29Å; F253-R257 WeakPolarHBondContact O-CB 3.2Å; F253-R257 PolarHBondContact O-N 3.14Å; G254-R257 PolarHBondContact O-N 3.33Å; R257-R260 PolarHBondContact O-N 3.18Å; R257-K261 WeakPolarHBondContact O-CG 3.04Å; R257-K261 PolarHBondContact O-N 3.34Å; R257-K261 VanDerWaalsContact O-N 3.12Å
258	F	91.6	Very high	87.7	Confident	33 Å²	33	52.2 Å²	52.2	15%	0.145	26%	0.259	C	S	.	.	H	α-helix	trans	-58.6	-52.6	175.5	169.7	-97.1	0	0	0	111.5	G254 I255 M256 R260 K261 R262 Y273 I353 M356	G254-F258 PolarHBondContact O-N 3.02Å; I255-F258 HydrophobicContact CD1-CD1 3.99Å; I255-F258 WeakPolarHBondContact O-CB 3.46Å; I255-F258 PolarHBondContact O-N 2.85Å; M256-F258 VanDerWaalsContact C-N 3.31Å; M256-F258 PolarHBondContact O-N 2.78Å; F258-R260 PolarHBondContact O-N 3.31Å; F258-K261 PolarHBondContact O-N 3.34Å; F258-R262 HydrophobicContact CD1-CG 4.34Å; F258-R262 HydrophobicContact CD2-CG 4.37Å; F258-R262 HydrophobicContact CE1-CG 3.92Å; F258-R262 HydrophobicContact CE2-CG 3.94Å; F258-R262 HydrophobicContact CZ-CG 3.7Å; F258-R262 WeakPolarHBondContact O-CG 3.28Å; F258-R262 PolarHBondContact O-N 2.65Å; F258-Y273 AromaticContact CE1-CD1 3.91Å; F258-Y273 HydrophobicContact CE1-CD1 3.91Å; F258-Y273 HydrophobicContact CE1-CE1 4.44Å; F258-Y273 AromaticContact CE1-CG 3.9Å; F258-Y273 HydrophobicContact CE1-CG 3.9Å; F258-Y273 AromaticContact CZ-CD1 3.43Å; F258-Y273 HydrophobicContact CZ-CD1 3.43Å; F258-Y273 VanDerWaalsContact CZ-CD1 3.43Å; F258-Y273 AromaticContact CZ-CE1 3.95Å; F258-Y273 HydrophobicContact CZ-CE1 3.95Å; F258-Y273 AromaticContact CZ-CG 3.89Å; F258-Y273 HydrophobicContact CZ-CG 3.89Å; F258-I353 HydrophobicContact CE2-CG2 3.78Å; F258-I353 HydrophobicContact CZ-CG2 3.85Å; F258-M356 HydrophobicContact CB-CE 4.01Å; F258-M356 HydrophobicContact CD2-CE 4.32Å; F258-M356 HydrophobicContact CD2-SD 4.06Å; F258-M356 HydrophobicContact CE2-SD 4.44Å; F258-M356 HydrophobicContact CG-CE 4.16Å; F258-M356 HydrophobicContact CG-SD 4.44Å
259	F	93.2	Very high	87.3	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.7	-37.9	-179.8	-68.3	-47.7	0	0	0	113.7	F146 V147 Y240 I255 M256 R262 K263 S312	F146-F259 HydrophobicContact CE1-CB 3.79Å; F146-F259 HydrophobicContact CZ-CB 3.9Å; V147-F259 HydrophobicContact CG1-CD2 4.37Å; V147-F259 HydrophobicContact CG1-CE2 3.86Å; V147-F259 HydrophobicContact CG2-CD2 3.56Å; V147-F259 HydrophobicContact CG2-CE2 3.89Å; V147-F259 HydrophobicContact CG2-CG 4.25Å; Y240-F259 AromaticContact CD1-CD1 3.84Å; Y240-F259 HydrophobicContact CD1-CD1 3.84Å; Y240-F259 AromaticContact CD1-CE1 3.96Å; Y240-F259 HydrophobicContact CD1-CE1 3.96Å; Y240-F259 HydrophobicContact CD2-CB 3.94Å; Y240-F259 AromaticContact CD2-CD1 3.8Å; Y240-F259 HydrophobicContact CD2-CD1 3.8Å; Y240-F259 HydrophobicContact CD2-CE1 4.46Å; Y240-F259 AromaticContact CD2-CG 3.92Å; Y240-F259 HydrophobicContact CD2-CG 3.92Å; Y240-F259 HydrophobicContact CE1-CD1 4.18Å; Y240-F259 HydrophobicContact CE2-CB 3.98Å; Y240-F259 HydrophobicContact CE2-CD1 4.15Å; Y240-F259 HydrophobicContact CE2-CG 4.34Å; Y240-F259 AromaticContact CG-CD1 3.64Å; Y240-F259 HydrophobicContact CG-CD1 3.64Å; Y240-F259 AromaticContact CG-CE1 3.87Å; Y240-F259 HydrophobicContact CG-CE1 3.87Å; Y240-F259 HydrophobicContact CG-CG 4.14Å; Y240-F259 HydrophobicContact CG-CZ 4.5Å; I255-F259 HydrophobicContact CD1-CD2 4.49Å; I255-F259 HydrophobicContact CD1-CE1 4.4Å; I255-F259 HydrophobicContact CD1-CE2 3.95Å; I255-F259 HydrophobicContact CD1-CZ 3.88Å; I255-F259 HydrophobicContact CG1-CD2 4.01Å; I255-F259 HydrophobicContact CG1-CE2 3.45Å; I255-F259 VanDerWaalsContact CG1-CE2 3.45Å; I255-F259 HydrophobicContact CG1-CZ 3.88Å; I255-F259 VanDerWaalsContact O-CD2 3.26Å; I255-F259 WeakPolarHBondContact O-CD2 3.35Å; I255-F259 PolarHBondContact O-N 3.46Å; M256-F259 PolarHBondContact O-N 3.42Å; M256-F259 HydrophobicContact SD-CD2 4.12Å; F259-R262 PolarHBondContact O-N 3.4Å; F259-K263 WeakPolarHBondContact O-CB 3.46Å; F259-K263 PolarHBondContact O-N 3.15Å; F259-S312 VanDerWaalsContact CZ-CB 3.49Å; F259-S312 VanDerWaalsContact CZ-OG 3.29Å; F259-S312 WeakPolarHBondContact CZ-OG 3.32Å
260	R	91.8	Very high	87.5	Confident	107 Å²	107	57.8 Å²	57.8	40%	0.404	29%	0.287	S	S	.	.	H	α-helix	trans	-61.8	-45.5	175.4	-75.4	176.4	175.7	167.3	-4	111.9	F146 K176 M256 R257 F258 R262 K263 A264	F146-R260 HydrophobicContact CE1-CG 4.12Å; K176-R260 PolarHBondContact O-NH2 2.92Å; M256-R260 WeakPolarHBondContact O-CG 3.12Å; M256-R260 PolarHBondContact O-N 3.07Å; R257-R260 PolarHBondContact O-N 3.18Å; F258-R260 PolarHBondContact O-N 3.31Å; R260-R262 VanDerWaalsContact C-N 3.34Å; R260-R262 PolarHBondContact O-N 2.8Å; R260-K263 PolarHBondContact O-N 2.92Å; R260-A264 PolarHBondContact O-N 3.29Å; R260-A264 VanDerWaalsContact O-N 3.1Å
261	K	90.5	Very high	87.6	Confident	135 Å²	135	57.8 Å²	57.8	59%	0.587	29%	0.287	S	S	*	.	H	α-helix	trans	-61.1	-42.3	174.8	-72.9	-175.2	176.5	-168.3	0	111.7	R257 F258 A264 L265	R257-K261 WeakPolarHBondContact O-CG 3.04Å; R257-K261 PolarHBondContact O-N 3.34Å; R257-K261 VanDerWaalsContact O-N 3.12Å; F258-K261 PolarHBondContact O-N 3.34Å; K261-A264 PolarHBondContact O-N 3.29Å; K261-L265 PolarHBondContact O-N 2.54Å
262	R	90.1	Very high	87.9	Confident	50 Å²	50	57.1 Å²	57.1	19%	0.189	28%	0.283	C	S	.	.	H	α-helix	trans	-63.1	-42.9	176.7	-67.6	-57.2	-60.1	171.2	0.5	112.4	F258 F259 R260 A264 L265 Y273	F258-R262 HydrophobicContact CD1-CG 4.34Å; F258-R262 HydrophobicContact CD2-CG 4.37Å; F258-R262 HydrophobicContact CE1-CG 3.92Å; F258-R262 HydrophobicContact CE2-CG 3.94Å; F258-R262 HydrophobicContact CZ-CG 3.7Å; F258-R262 WeakPolarHBondContact O-CG 3.28Å; F258-R262 PolarHBondContact O-N 2.65Å; F259-R262 PolarHBondContact O-N 3.4Å; R260-R262 VanDerWaalsContact C-N 3.34Å; R260-R262 PolarHBondContact O-N 2.8Å; R262-A264 VanDerWaalsContact C-N 3.31Å; R262-A264 PolarHBondContact O-N 3.19Å; R262-L265 PolarHBondContact O-N 3.12Å; R262-Y273 HydrophobicContact CG-CE1 4.22Å; R262-Y273 VanDerWaalsContact NE-CE1 3.35Å; R262-Y273 PolarHBondContact NE-OH 3.11Å; R262-Y273 PolarHBondContact NH2-OH 2.82Å
263	K	87.1	Confident	88.1	Confident	121 Å²	121	57.1 Å²	57.1	53%	0.526	28%	0.283	S	S	.	.	H	α-helix	trans	-59.5	-41.7	176.2	-176.1	-174.3	177.6	-176.1	0	111.7	F146 Y240 F259 R260 L265 E266	F146-K263 HydrophobicContact CE2-CD 3.81Å; F146-K263 HydrophobicContact CZ-CB 4.37Å; F146-K263 HydrophobicContact CZ-CD 4.21Å; Y240-K263 PolarHBondContact OH-N 3.19Å; F259-K263 WeakPolarHBondContact O-CB 3.46Å; F259-K263 PolarHBondContact O-N 3.15Å; R260-K263 PolarHBondContact O-N 2.92Å; K263-L265 PolarHBondContact O-N 3.05Å; K263-E266 PolarHBondContact O-N 2.92Å; K263-E266 VanDerWaalsContact O-N 3.09Å
264	A	83	Confident	88.3	Confident	79 Å²	79	56.7 Å²	56.7	65%	0.653	28%	0.281	S	S	*	.	H	α-helix	trans	-67.1	-19.1	-179.1	0	0	0	0	0	114.2	R260 K261 R262 E266	R260-A264 PolarHBondContact O-N 3.29Å; R260-A264 VanDerWaalsContact O-N 3.1Å; K261-A264 PolarHBondContact O-N 3.29Å; R262-A264 VanDerWaalsContact C-N 3.31Å; R262-A264 PolarHBondContact O-N 3.19Å; A264-E266 PolarHBondContact O-N 2.8Å
265	L	83.3	Confident	88.7	Confident	111 Å²	111	58.2 Å²	58.2	58%	0.581	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-4.8	174.2	-64.5	172.5	0	0	0	112.8	K261 R262 K263 S267	K261-L265 PolarHBondContact O-N 2.54Å; R262-L265 PolarHBondContact O-N 3.12Å; K263-L265 PolarHBondContact O-N 3.05Å; L265-S267 PolarHBondContact O-N 3.39Å
266	E	68.4	Low	88.9	Confident	179 Å²	179	58.5 Å²	58.5	84%	0.836	29%	0.287	S	S	*	.			trans	56.5	-16.2	178	-63.7	-172.9	172.2	0	0	116.9	K263 A264 S268	K263-E266 PolarHBondContact O-N 2.92Å; K263-E266 VanDerWaalsContact O-N 3.09Å; A264-E266 PolarHBondContact O-N 2.8Å; E266-S268 PolarHBondContact O-N 3.47Å
267	S	71.3	Confident	89.1	Confident	64 Å²	64	63.1 Å²	63.1	45%	0.448	31%	0.305	S	S	.	.			trans	-71.4	100.1	164.5	74.4	0	0	0	0	108.4	L265 P269	L265-S267 PolarHBondContact O-N 3.39Å; S267-P269 WeakPolarHBondContact O-CD 3.3Å
268	S	67	Low	89.4	Confident	48 Å²	48	63.4 Å²	63.4	34%	0.336	31%	0.306	S	S	.	.			trans	-101.9	73.5	164.1	-177.1	0	0	0	0	108.8	E266 Q316	E266-S268 PolarHBondContact O-N 3.47Å; S268-Q316 PolarHBondContact O-OE1 3.46Å; S268-Q316 PolarHBondContact OG-OE1 2.96Å
269	P	85.1	Confident	89.6	Confident	41 Å²	41	69.6 Å²	69.6	27%	0.266	34%	0.335	S	S	.	.			trans	-66.6	154.5	171.9	31.5	-35.1	0	0	0	109.3	S267 A271 T314 I351	S267-P269 WeakPolarHBondContact O-CD 3.3Å; P269-A271 HydrophobicContact CG-CB 4.18Å; P269-A271 PolarHBondContact O-N 3.39Å; P269-T314 VanDerWaalsContact O-CG2 3.28Å; P269-T314 WeakPolarHBondContact O-CG2 3.39Å; P269-T314 PolarHBondContact O-OG1 2.04Å; P269-I351 HydrophobicContact CG-CD1 4.42Å
270	K	95.5	Very high	89.8	Confident	84 Å²	84	70.8 Å²	70.8	37%	0.365	35%	0.345	S	S	.	.	S	Bend	trans	-58.7	103.6	164.2	-60.3	-175.2	-71	-172	0	108.6	Q316 A317 P320 V348 K349	K270-Q316 HydrophobicContact CG-CB 4.3Å; K270-A317 HydrophobicContact CB-CB 4.14Å; K270-P320 HydrophobicContact CD-CB 4.35Å; K270-P320 HydrophobicContact CD-CG 3.73Å; K270-V348 HydrophobicContact CB-CG2 4.25Å; K270-K349 PolarHBondContact O-N 2.93Å
271	A	97	Very high	90.1	Very high	0 Å²	0	75.6 Å²	75.6	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	149.3	-172.5	0	0	0	0	0	113.4	P269 Y273 L313 T314 K349 I351	P269-A271 HydrophobicContact CG-CB 4.18Å; P269-A271 PolarHBondContact O-N 3.39Å; A271-Y273 HydrophobicContact CB-CE2 4.49Å; A271-L313 VanDerWaalsContact O-CA 3.3Å; A271-L313 WeakPolarHBondContact O-CA 3.49Å; A271-T314 PolarHBondContact N-OG1 2.93Å; A271-T314 PolarHBondContact O-N 2.91Å; A271-T314 VanDerWaalsContact O-N 3.11Å; A271-K349 CarbonylContact C-O 3.51Å; A271-K349 WeakPolarHBondContact CA-O 3.38Å; A271-K349 HydrophobicContact CB-CB 4.33Å; A271-I351 HydrophobicContact CB-CD1 3.7Å; A271-I351 HydrophobicContact CB-CG1 4.16Å
272	F	98.3	Very high	90.5	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	147.5	158.9	-71.7	-76.1	0	0	0	110.9	Y311 S312 L313 L321 I338 T339 A343 V348 K349 I351	F272-Y311 AromaticContact CD1-CD2 3.91Å; F272-Y311 HydrophobicContact CD1-CD2 3.91Å; F272-Y311 HydrophobicContact CD1-CE2 4.48Å; F272-Y311 AromaticContact CE1-CD2 3.86Å; F272-Y311 HydrophobicContact CE1-CD2 3.86Å; F272-Y311 AromaticContact CE1-CE2 3.98Å; F272-Y311 HydrophobicContact CE1-CE2 3.98Å; F272-S312 CarbonylContact C-O 3.31Å; F272-S312 VanDerWaalsContact CA-O 3.23Å; F272-S312 WeakPolarHBondContact CA-O 3.37Å; F272-L313 HydrophobicContact CD1-CB 3.71Å; F272-L313 HydrophobicContact CE1-CB 3.8Å; F272-L313 HydrophobicContact CE1-CD1 3.95Å; F272-L313 HydrophobicContact CE1-CD2 4.38Å; F272-L313 HydrophobicContact CE1-CG 4.28Å; F272-L313 HydrophobicContact CZ-CD1 4.38Å; F272-L321 HydrophobicContact CE1-CD1 4.44Å; F272-L321 HydrophobicContact CE2-CD1 4.08Å; F272-L321 HydrophobicContact CE2-CD2 4.13Å; F272-L321 HydrophobicContact CZ-CD1 3.55Å; F272-L321 HydrophobicContact CZ-CD2 4.2Å; F272-I338 HydrophobicContact CZ-CG2 4.3Å; F272-T339 HydrophobicContact CD1-CG2 4.12Å; F272-T339 HydrophobicContact CE1-CG2 3.73Å; F272-T339 HydrophobicContact CE2-CG2 4.46Å; F272-T339 HydrophobicContact CZ-CG2 3.91Å; F272-A343 HydrophobicContact CD2-CB 4.23Å; F272-A343 HydrophobicContact CE2-CB 3.82Å; F272-V348 HydrophobicContact CD2-CG1 3.54Å; F272-V348 HydrophobicContact CE2-CB 4.39Å; F272-V348 HydrophobicContact CE2-CG1 3.69Å; F272-V348 HydrophobicContact CG-CG1 4.48Å; F272-K349 PolarHBondContact N-O 2.94Å; F272-I351 PolarHBondContact O-N 3.32Å
273	Y	96.6	Very high	90.8	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	112.5	168.3	-56.6	-88.5	0	0	0	108.2	Y240 F258 R262 A271 S312 T314 I351	Y240-Y273 HydrophobicContact CD1-CE2 4.39Å; Y240-Y273 HydrophobicContact CE1-CE2 4.04Å; F258-Y273 AromaticContact CE1-CD1 3.91Å; F258-Y273 HydrophobicContact CE1-CD1 3.91Å; F258-Y273 HydrophobicContact CE1-CE1 4.44Å; F258-Y273 AromaticContact CE1-CG 3.9Å; F258-Y273 HydrophobicContact CE1-CG 3.9Å; F258-Y273 AromaticContact CZ-CD1 3.43Å; F258-Y273 HydrophobicContact CZ-CD1 3.43Å; F258-Y273 VanDerWaalsContact CZ-CD1 3.43Å; F258-Y273 AromaticContact CZ-CE1 3.95Å; F258-Y273 HydrophobicContact CZ-CE1 3.95Å; F258-Y273 AromaticContact CZ-CG 3.89Å; F258-Y273 HydrophobicContact CZ-CG 3.89Å; R262-Y273 HydrophobicContact CG-CE1 4.22Å; R262-Y273 VanDerWaalsContact NE-CE1 3.35Å; R262-Y273 PolarHBondContact NE-OH 3.11Å; R262-Y273 PolarHBondContact NH2-OH 2.82Å; A271-Y273 HydrophobicContact CB-CE2 4.49Å; Y273-S312 PolarHBondContact N-O 3.29Å; Y273-S312 PolarHBondContact O-N 3.14Å; Y273-T314 HydrophobicContact CE2-CG2 4.13Å; Y273-I351 WeakPolarHBondContact CA-O 3.37Å; Y273-I351 HydrophobicContact CD1-CB 3.55Å; Y273-I351 HydrophobicContact CD1-CD1 4.03Å; Y273-I351 HydrophobicContact CD1-CG1 4.35Å; Y273-I351 HydrophobicContact CD1-CG2 3.62Å; Y273-I351 HydrophobicContact CE1-CB 3.78Å; Y273-I351 HydrophobicContact CE1-CD1 3.32Å; Y273-I351 HydrophobicContact CE1-CG1 4.11Å; Y273-I351 HydrophobicContact CE1-CG2 3.75Å; Y273-I351 HydrophobicContact CG-CB 4.44Å
274	C	97.3	Very high	91.3	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	176.2	-172.2	62.3	0	0	0	0	113.7	V276 C306 I351 I353 Y357	C274-V276 PolarHBondContact O-N 3.19Å; C274-C306 HydrophobicContact CB-CB 3.42Å; C274-C306 VanDerWaalsContact CB-CB 3.42Å; C274-C306 WeakPolarHBondContact CB-SG 3.48Å; C274-C306 WeakPolarHBondContact SG-CA 3.12Å; C274-C306 WeakPolarHBondContact SG-CB 3.34Å; C274-C306 CovalentContact SG-SG 2.02Å; C274-C306 PolarHBondContact SG-SG 3.09Å; C274-I351 PolarHBondContact N-O 2.82Å; C274-I353 VanDerWaalsContact N-CG1 3.35Å; C274-I353 WeakPolarHBondContact O-CG1 3.48Å; C274-I353 PolarHBondContact O-N 2.83Å; C274-Y357 WeakPolarHBondContact CA-OH 3.37Å
275	F	97	Very high	91.9	Very high	39 Å²	39	70 Å²	70	17%	0.171	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	115.8	157.4	-174.9	-75	0	0	0	108.6	W277 C306 S307 N354 Y357	F275-W277 HydrophobicContact CD1-CD2 4.16Å; F275-W277 AromaticContact CD1-CE2 3.83Å; F275-W277 HydrophobicContact CD1-CG 4.4Å; F275-W277 HydrophobicContact CD1-CZ2 4.2Å; F275-W277 AromaticContact CD1-NE1 3.88Å; F275-W277 AromaticContact CE1-CD2 3.67Å; F275-W277 HydrophobicContact CE1-CD2 3.67Å; F275-W277 AromaticContact CE1-CE2 3.48Å; F275-W277 VanDerWaalsContact CE1-CE2 3.48Å; F275-W277 AromaticContact CE1-CE3 3.91Å; F275-W277 HydrophobicContact CE1-CE3 3.91Å; F275-W277 HydrophobicContact CE1-CG 4.31Å; F275-W277 AromaticContact CE1-CH2 3.81Å; F275-W277 HydrophobicContact CE1-CH2 3.81Å; F275-W277 AromaticContact CE1-CZ2 3.57Å; F275-W277 HydrophobicContact CE1-CZ2 3.57Å; F275-W277 AromaticContact CE1-CZ3 3.98Å; F275-W277 HydrophobicContact CE1-CZ3 3.98Å; F275-W277 HydrophobicContact CZ-CH2 4.16Å; F275-W277 HydrophobicContact CZ-CZ2 4.22Å; F275-W277 HydrophobicContact CZ-CZ3 4.42Å; F275-C306 CarbonylContact O-C 3.52Å; F275-C306 VanDerWaalsContact O-CA 3.32Å; F275-C306 WeakPolarHBondContact O-CA 3.47Å; F275-S307 PolarHBondContact O-N 3.2Å; F275-N354 WeakPolarHBondContact CA-OD1 3.47Å; F275-N354 HydrophobicContact CD2-CB 3.79Å; F275-N354 HydrophobicContact CE2-CB 4.02Å; F275-N354 HydrophobicContact CG-CB 4.45Å; F275-Y357 HydrophobicContact CB-CD1 3.76Å; F275-Y357 HydrophobicContact CB-CD2 3.83Å; F275-Y357 HydrophobicContact CB-CE1 3.92Å; F275-Y357 HydrophobicContact CB-CE2 4.02Å; F275-Y357 HydrophobicContact CB-CG 3.71Å; F275-Y357 HydrophobicContact CD2-CG 4.25Å; F275-Y357 HydrophobicContact CG-CG 4.46Å; F275-Y357 VanDerWaalsContact N-CZ 3.35Å
276	V	98.1	Very high	92.4	Very high	6 Å²	6	69.9 Å²	69.9	4%	0.036	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	126.6	-176.8	-180	0	0	0	0	110.2	C274 R278 T304 H350 E352 N354	C274-V276 PolarHBondContact O-N 3.19Å; V276-R278 HydrophobicContact CG1-CG 4.04Å; V276-T304 HydrophobicContact CG1-CG2 3.36Å; V276-H350 HydrophobicContact CG2-CB 4.04Å; V276-E352 HydrophobicContact CB-CG 4.09Å; V276-E352 HydrophobicContact CG2-CB 4.02Å; V276-E352 HydrophobicContact CG2-CG 3.99Å; V276-N354 PolarHBondContact N-OD1 3.36Å; V276-N354 PolarHBondContact O-ND2 2.68Å
277	W	98	Very high	93.6	Very high	98 Å²	98	67.9 Å²	67.9	37%	0.371	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	128	166	-69	111.8	0	0	0	109.5	F275 T304 F305	F275-W277 HydrophobicContact CD1-CD2 4.16Å; F275-W277 AromaticContact CD1-CE2 3.83Å; F275-W277 HydrophobicContact CD1-CG 4.4Å; F275-W277 HydrophobicContact CD1-CZ2 4.2Å; F275-W277 AromaticContact CD1-NE1 3.88Å; F275-W277 AromaticContact CE1-CD2 3.67Å; F275-W277 HydrophobicContact CE1-CD2 3.67Å; F275-W277 AromaticContact CE1-CE2 3.48Å; F275-W277 VanDerWaalsContact CE1-CE2 3.48Å; F275-W277 AromaticContact CE1-CE3 3.91Å; F275-W277 HydrophobicContact CE1-CE3 3.91Å; F275-W277 HydrophobicContact CE1-CG 4.31Å; F275-W277 AromaticContact CE1-CH2 3.81Å; F275-W277 HydrophobicContact CE1-CH2 3.81Å; F275-W277 AromaticContact CE1-CZ2 3.57Å; F275-W277 HydrophobicContact CE1-CZ2 3.57Å; F275-W277 AromaticContact CE1-CZ3 3.98Å; F275-W277 HydrophobicContact CE1-CZ3 3.98Å; F275-W277 HydrophobicContact CZ-CH2 4.16Å; F275-W277 HydrophobicContact CZ-CZ2 4.22Å; F275-W277 HydrophobicContact CZ-CZ3 4.42Å; W277-T304 WeakPolarHBondContact O-CA 3.38Å; W277-F305 HydrophobicContact CB-CD1 3.79Å; W277-F305 HydrophobicContact CB-CE1 3.36Å; W277-F305 HydrophobicContact CB-CE2 4.32Å; W277-F305 HydrophobicContact CB-CG 4.43Å; W277-F305 HydrophobicContact CB-CZ 3.66Å; W277-F305 AromaticContact CD1-CE2 3.69Å; W277-F305 AromaticContact CD1-CZ 3.64Å; W277-F305 HydrophobicContact CG-CE1 4.03Å; W277-F305 HydrophobicContact CG-CE2 4.27Å; W277-F305 AromaticContact CG-CZ 3.78Å; W277-F305 HydrophobicContact CG-CZ 3.78Å; W277-F305 PolarHBondContact N-O 3.41Å; W277-F305 PolarHBondContact O-N 2.95Å
278	R	97.8	Very high	94.6	Very high	137 Å²	137	66.6 Å²	66.6	52%	0.517	32%	0.321	S	S	.	.			trans	-115.2	138.9	173.6	-59	-178.4	-170.2	-77.7	-3.6	108.6	V276 A280 T304 E352	V276-R278 HydrophobicContact CG1-CG 4.04Å; R278-A280 PolarHBondContact O-N 3.33Å; R278-A280 VanDerWaalsContact O-N 3.07Å; R278-T304 HydrophobicContact CG-CG2 4.46Å; R278-E352 IonicContact CZ-OE2 3.44Å; R278-E352 IonicContact NE-OE2 3.54Å; R278-E352 IonicContact NH2-OE2 2.74Å; R278-E352 PolarHBondContact NH2-OE2 3.37Å; R278-E352 VanDerWaalsContact NH2-OE2 3.08Å
279	E	95.8	Very high	95.9	Very high	162 Å²	162	71.3 Å²	71.3	76%	0.757	34%	0.335	S	S	*	.	S	Bend	trans	52.2	33.2	174.6	-56.1	-175.4	110	0	0	114.6	R281 V301	E279-R281 PolarHBondContact O-N 3.4Å; E279-V301 VanDerWaalsContact C-CG1 3.48Å; E279-V301 VanDerWaalsContact CA-CG1 3.4Å; E279-V301 HydrophobicContact CB-CG1 4.05Å
280	A	97.6	Very high	96.4	Very high	25 Å²	25	75.4 Å²	75.4	21%	0.207	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-67.2	126.6	178.7	0	0	0	0	0	110.2	R278 V301 Y302 F305	R278-A280 PolarHBondContact O-N 3.33Å; R278-A280 VanDerWaalsContact O-N 3.07Å; A280-V301 WeakPolarHBondContact O-CA 3.34Å; A280-Y302 PolarHBondContact O-N 2.82Å; A280-F305 HydrophobicContact CB-CE1 3.66Å; A280-F305 HydrophobicContact CB-CZ 4.18Å
281	R	97.9	Very high	96.4	Very high	209 Å²	209	75.5 Å²	75.5	79%	0.789	34%	0.344	S	S	*	.	B	Isolated β-bridge	trans	-68.8	136.7	176.6	-70.8	-174.9	174.3	-178.1	-1.7	111.1	E279 R283 V301	E279-R281 PolarHBondContact O-N 3.4Å; R281-R283 PolarHBondContact O-N 2.79Å; R281-V301 HydrophobicContact CG-CG2 4.46Å
282	V	98.1	Very high	96.4	Very high	12 Å²	12	75.5 Å²	75.5	7%	0.073	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-64.3	131	173.8	-178.8	0	0	0	0	109	R284 V292 F297 T300 Y302	V282-R284 VanDerWaalsContact CG1-CZ 3.44Å; V282-R284 PolarHBondContact O-N 2.54Å; V282-V292 HydrophobicContact CG1-CB 3.97Å; V282-V292 HydrophobicContact CG1-CG1 4.4Å; V282-F297 HydrophobicContact CG2-CD1 3.57Å; V282-F297 HydrophobicContact CG2-CE1 3.65Å; V282-T300 WeakPolarHBondContact CG2-O 3.46Å; V282-T300 PolarHBondContact N-O 2.97Å; V282-Y302 HydrophobicContact CB-CE1 4.43Å; V282-Y302 HydrophobicContact CB-CE2 4.28Å; V282-Y302 HydrophobicContact CG1-CE1 4.26Å; V282-Y302 HydrophobicContact CG1-CE2 4.47Å; V282-Y302 HydrophobicContact CG2-CD1 3.83Å; V282-Y302 HydrophobicContact CG2-CD2 4.18Å; V282-Y302 HydrophobicContact CG2-CE1 3.65Å; V282-Y302 HydrophobicContact CG2-CE2 4Å; V282-Y302 HydrophobicContact CG2-CG 4.11Å
283	R	97.1	Very high	96.3	Very high	135 Å²	135	76.4 Å²	76.4	51%	0.509	35%	0.35	S	S	.	.			trans	-76.6	115.5	177.5	-57.2	-63.6	-177.9	167.4	-1.8	109	R281 D288 W290 Y291 V292	R281-R283 PolarHBondContact O-N 2.79Å; R283-D288 HydrophobicContact CB-CB 4.36Å; R283-D288 WeakPolarHBondContact CD-OD2 3.36Å; R283-W290 HydrophobicContact CG-CB 4.21Å; R283-Y291 WeakPolarHBondContact O-CA 3.32Å; R283-V292 PolarHBondContact O-N 3.16Å
284	R	97.2	Very high	96.3	Very high	59 Å²	59	83.2 Å²	83.2	22%	0.223	38%	0.377	C	S	.	.			trans	-111.2	2.4	-176	-60.7	-58.7	-169.6	178.9	5.4	114.4	V282 Y291 V292 S293 Y294 F297 E299	V282-R284 VanDerWaalsContact CG1-CZ 3.44Å; V282-R284 PolarHBondContact O-N 2.54Å; R284-Y291 VanDerWaalsContact C-CD2 3.44Å; R284-Y291 VanDerWaalsContact O-CE2 3.26Å; R284-Y291 WeakPolarHBondContact O-CE2 3.24Å; R284-V292 VanDerWaalsContact CD-O 3.25Å; R284-V292 WeakPolarHBondContact CD-O 3.12Å; R284-V292 PolarHBondContact NH1-O 2.9Å; R284-S293 PolarHBondContact NH1-O 2.87Å; R284-Y294 VanDerWaalsContact NH2-CD1 3.32Å; R284-F297 VanDerWaalsContact CZ-O 3.31Å; R284-F297 PolarHBondContact NH1-O 2.88Å; R284-F297 PolarHBondContact NH2-O 3.11Å; R284-E299 PolarHBondContact NH2-O 2.82Å
285	S	96	Very high	96.2	Very high	62 Å²	62	91.2 Å²	91.2	43%	0.434	42%	0.415	S	S	.	.			trans	-83.6	123.3	176.4	-162.7	0	0	0	0	109.3	N287 D288 Y291	S285-N287 VanDerWaalsContact CB-OD1 3.24Å; S285-N287 WeakPolarHBondContact CB-OD1 3.24Å; S285-N287 PolarHBondContact O-N 2.85Å; S285-N287 VanDerWaalsContact O-N 3.11Å; S285-N287 PolarHBondContact OG-OD1 2.96Å; S285-D288 VanDerWaalsContact O-CB 3.26Å; S285-D288 WeakPolarHBondContact O-CB 3.16Å; S285-D288 PolarHBondContact O-N 3.11Å; S285-Y291 WeakPolarHBondContact O-CB 3.23Å; S285-Y291 WeakPolarHBondContact O-CD2 3.43Å
286	S	92.4	Very high	96.1	Very high	107 Å²	107	92.6 Å²	92.6	75%	0.748	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.9	-177.5	54.8	0	0	0	0	114.2
287	N	94	Very high	96.1	Very high	138 Å²	138	92.3 Å²	92.3	74%	0.738	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-5.1	173	69.5	-11.5	0	0	0	113.5	S285	S285-N287 VanDerWaalsContact CB-OD1 3.24Å; S285-N287 WeakPolarHBondContact CB-OD1 3.24Å; S285-N287 PolarHBondContact O-N 2.85Å; S285-N287 VanDerWaalsContact O-N 3.11Å; S285-N287 PolarHBondContact OG-OD1 2.96Å
288	D	93.6	Very high	96	Very high	37 Å²	37	92.1 Å²	92.1	20%	0.198	43%	0.426	C	S	.	.	S	Bend	trans	-82.5	129.4	176	-163.9	-41.8	0	0	0	109.1	R283 S285 W290 Y291	R283-D288 HydrophobicContact CB-CB 4.36Å; R283-D288 WeakPolarHBondContact CD-OD2 3.36Å; S285-D288 VanDerWaalsContact O-CB 3.26Å; S285-D288 WeakPolarHBondContact O-CB 3.16Å; S285-D288 PolarHBondContact O-N 3.11Å; D288-W290 PolarHBondContact O-N 2.92Å; D288-W290 VanDerWaalsContact O-N 3.11Å; D288-W290 WeakPolarHBondContact OD1-CB 3.05Å; D288-W290 VanDerWaalsContact OD1-CE3 3.29Å; D288-W290 PolarHBondContact OD1-N 2.7Å; D288-Y291 WeakPolarHBondContact O-CB 3.26Å; D288-Y291 PolarHBondContact O-N 2.79Å
289	K	93.4	Very high	95.9	Very high	146 Å²	146	90.3 Å²	90.3	64%	0.635	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-17	176.8	68.8	179.8	-173.1	175.4	0	113.2
290	W	94.8	Very high	96	Very high	127 Å²	127	86.9 Å²	86.9	48%	0.481	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	18.5	175.2	-53.8	-62.6	0	0	0	112.4	R283 D288 V292	R283-W290 HydrophobicContact CG-CB 4.21Å; D288-W290 PolarHBondContact O-N 2.92Å; D288-W290 VanDerWaalsContact O-N 3.11Å; D288-W290 WeakPolarHBondContact OD1-CB 3.05Å; D288-W290 VanDerWaalsContact OD1-CE3 3.29Å; D288-W290 PolarHBondContact OD1-N 2.7Å; W290-V292 PolarHBondContact O-N 3.08Å
291	Y	96.6	Very high	96	Very high	86 Å²	86	87.9 Å²	87.9	34%	0.337	42%	0.417	S	S	.	.			trans	-54.5	131.8	176.3	172.2	-107.6	0	0	0	112	R283 R284 S285 D288 W332	R283-Y291 WeakPolarHBondContact O-CA 3.32Å; R284-Y291 VanDerWaalsContact C-CD2 3.44Å; R284-Y291 VanDerWaalsContact O-CE2 3.26Å; R284-Y291 WeakPolarHBondContact O-CE2 3.24Å; S285-Y291 WeakPolarHBondContact O-CB 3.23Å; S285-Y291 WeakPolarHBondContact O-CD2 3.43Å; D288-Y291 WeakPolarHBondContact O-CB 3.26Å; D288-Y291 PolarHBondContact O-N 2.79Å; Y291-W332 WeakPolarHBondContact O-CZ2 3.42Å
292	V	97.2	Very high	96	Very high	0 Å²	0	78.7 Å²	78.7	0%	0	38%	0.383	C	S	.	.			trans	-128.2	131.5	172.4	176.8	0	0	0	0	108.7	V282 R283 R284 W290 E296 F297 Y302 L331 W332 L333	V282-V292 HydrophobicContact CG1-CB 3.97Å; V282-V292 HydrophobicContact CG1-CG1 4.4Å; R283-V292 PolarHBondContact O-N 3.16Å; R284-V292 VanDerWaalsContact CD-O 3.25Å; R284-V292 WeakPolarHBondContact CD-O 3.12Å; R284-V292 PolarHBondContact NH1-O 2.9Å; W290-V292 PolarHBondContact O-N 3.08Å; V292-E296 HydrophobicContact CG1-CB 3.71Å; V292-F297 HydrophobicContact CG1-CB 3.59Å; V292-Y302 WeakPolarHBondContact CG2-OH 3.38Å; V292-L331 HydrophobicContact CG1-CD1 3.8Å; V292-L331 HydrophobicContact CG2-CD1 4.27Å; V292-W332 HydrophobicContact CG2-CZ2 4.43Å; V292-L333 HydrophobicContact CG2-CD1 3.63Å; V292-L333 HydrophobicContact CG2-CG 4.4Å
293	S	96.5	Very high	96	Very high	19 Å²	19	79.3 Å²	79.3	13%	0.133	39%	0.387	C	S	.	.			trans	-79.1	161.6	179.1	85.5	0	0	0	0	112.2	R284 E295 E296 F297	R284-S293 PolarHBondContact NH1-O 2.87Å; S293-E295 PolarHBondContact O-N 2.94Å; S293-E295 PolarHBondContact OG-N 3.25Å; S293-E296 PolarHBondContact N-OE2 3.33Å; S293-E296 PolarHBondContact O-N 3.02Å; S293-E296 PolarHBondContact OG-N 3.2Å; S293-F297 PolarHBondContact O-N 2.86Å; S293-F297 VanDerWaalsContact O-O 3.14Å
294	Y	96.3	Very high	96.1	Very high	143 Å²	143	75 Å²	75	56%	0.561	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-23.7	175.6	-78.2	-76.1	0	0	0	112.8	R284 F297 N298	R284-Y294 VanDerWaalsContact NH2-CD1 3.32Å; Y294-F297 WeakPolarHBondContact CA-O 3.38Å; Y294-F297 CarbonylContact O-C 3.36Å; Y294-N298 WeakPolarHBondContact O-CA 3.44Å; Y294-N298 PolarHBondContact O-N 2.98Å
295	E	95.3	Very high	96.2	Very high	169 Å²	169	72.9 Å²	72.9	79%	0.79	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-39.1	175.3	-60.8	170.2	-178.9	0	0	111.3	S293	S293-E295 PolarHBondContact O-N 2.94Å; S293-E295 PolarHBondContact OG-N 3.25Å
296	E	95.2	Very high	96.3	Very high	67 Å²	67	69.9 Å²	69.9	31%	0.313	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-37	177.5	-67.3	174.8	118	0	0	112.1	R119 V292 S293 L331 W332	R119-E296 WeakPolarHBondContact CD-O 3.44Å; R119-E296 PolarHBondContact NE-O 3.45Å; V292-E296 HydrophobicContact CG1-CB 3.71Å; S293-E296 PolarHBondContact N-OE2 3.33Å; S293-E296 PolarHBondContact O-N 3.02Å; S293-E296 PolarHBondContact OG-N 3.2Å; E296-L331 HydrophobicContact CB-CD1 4.35Å; E296-W332 VanDerWaalsContact OE1-CD1 3.27Å; E296-W332 PolarHBondContact OE1-NE1 3.47Å
297	F	97.1	Very high	96.5	Very high	0 Å²	0	65 Å²	65	0%	0	31%	0.313	C	S	.	.			trans	-150.4	115.3	178.2	-166.4	-96.1	0	0	0	109.3	R119 V282 R284 V292 S293 Y294 E299 V301 Y302 L331 L341	R119-F297 VanDerWaalsContact NH2-CE2 3.27Å; V282-F297 HydrophobicContact CG2-CD1 3.57Å; V282-F297 HydrophobicContact CG2-CE1 3.65Å; R284-F297 VanDerWaalsContact CZ-O 3.31Å; R284-F297 PolarHBondContact NH1-O 2.88Å; R284-F297 PolarHBondContact NH2-O 3.11Å; V292-F297 HydrophobicContact CG1-CB 3.59Å; S293-F297 PolarHBondContact O-N 2.86Å; S293-F297 VanDerWaalsContact O-O 3.14Å; Y294-F297 WeakPolarHBondContact CA-O 3.38Å; Y294-F297 CarbonylContact O-C 3.36Å; F297-E299 HydrophobicContact CD1-CB 4.23Å; F297-E299 WeakPolarHBondContact CD1-O 3.39Å; F297-E299 HydrophobicContact CE1-CB 3.56Å; F297-E299 HydrophobicContact CZ-CB 4.03Å; F297-V301 WeakPolarHBondContact CE1-O 3.44Å; F297-Y302 HydrophobicContact CD1-CD1 4.06Å; F297-Y302 AromaticContact CD1-CE1 3.91Å; F297-Y302 HydrophobicContact CD1-CE1 3.91Å; F297-Y302 HydrophobicContact CD2-CD1 4.4Å; F297-Y302 HydrophobicContact CD2-CE1 4.32Å; F297-Y302 AromaticContact CE1-CD1 3.68Å; F297-Y302 HydrophobicContact CE1-CD1 3.68Å; F297-Y302 HydrophobicContact CE1-CE1 4.04Å; F297-Y302 HydrophobicContact CE2-CD1 4.13Å; F297-Y302 HydrophobicContact CE2-CE1 4.5Å; F297-Y302 HydrophobicContact CG-CD1 4.4Å; F297-Y302 HydrophobicContact CG-CE1 4.06Å; F297-Y302 AromaticContact CZ-CD1 3.76Å; F297-Y302 HydrophobicContact CZ-CD1 3.76Å; F297-Y302 HydrophobicContact CZ-CE1 4.37Å; F297-L331 HydrophobicContact CB-CD1 4.47Å; F297-L331 HydrophobicContact CD2-CD2 4.36Å; F297-L341 HydrophobicContact CE2-CD1 4.29Å; F297-L341 HydrophobicContact CE2-CD2 4.03Å
298	N	95.6	Very high	96.5	Very high	95 Å²	95	59 Å²	59	51%	0.508	28%	0.283	S	S	.	.			trans	-87.7	-19.8	-170.6	63.5	-13	0	0	0	114.4	R119 Y294	R119-N298 PolarHBondContact NH1-OD1 3.18Å; Y294-N298 WeakPolarHBondContact O-CA 3.44Å; Y294-N298 PolarHBondContact O-N 2.98Å
299	E	96.6	Very high	96.6	Very high	98 Å²	98	59.2 Å²	59.2	46%	0.458	28%	0.282	S	S	.	.	S	Bend	trans	-78.9	163	177.4	-62.3	169.4	-113	0	0	111.6	R284 F297	R284-E299 PolarHBondContact NH2-O 2.82Å; F297-E299 HydrophobicContact CD1-CB 4.23Å; F297-E299 WeakPolarHBondContact CD1-O 3.39Å; F297-E299 HydrophobicContact CE1-CB 3.56Å; F297-E299 HydrophobicContact CZ-CB 4.03Å
300	T	97.7	Very high	96.8	Very high	91 Å²	91	52.3 Å²	52.3	56%	0.558	25%	0.251	S	S	*	.	S	Bend	trans	-91.2	-14.7	179.9	53.5	0	0	0	0	113.5	V282	V282-T300 WeakPolarHBondContact CG2-O 3.46Å; V282-T300 PolarHBondContact N-O 2.97Å
301	V	98.3	Very high	96.9	Very high	46 Å²	46	46.2 Å²	46.2	28%	0.279	23%	0.228	S	C	.	.	B	Isolated β-bridge	trans	-133.3	135.7	-174	174.6	0	0	0	0	108.9	E279 A280 R281 F297	E279-V301 VanDerWaalsContact C-CG1 3.48Å; E279-V301 VanDerWaalsContact CA-CG1 3.4Å; E279-V301 HydrophobicContact CB-CG1 4.05Å; A280-V301 WeakPolarHBondContact O-CA 3.34Å; R281-V301 HydrophobicContact CG-CG2 4.46Å; F297-V301 WeakPolarHBondContact CE1-O 3.44Å
302	Y	98.3	Very high	97	Very high	15 Å²	15	42.1 Å²	42.1	6%	0.059	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-75	151.9	174.8	-66.4	-56.1	0	0	0	111.7	A280 V282 V292 F297 L331 L333 V336	A280-Y302 PolarHBondContact O-N 2.82Å; V282-Y302 HydrophobicContact CB-CE1 4.43Å; V282-Y302 HydrophobicContact CB-CE2 4.28Å; V282-Y302 HydrophobicContact CG1-CE1 4.26Å; V282-Y302 HydrophobicContact CG1-CE2 4.47Å; V282-Y302 HydrophobicContact CG2-CD1 3.83Å; V282-Y302 HydrophobicContact CG2-CD2 4.18Å; V282-Y302 HydrophobicContact CG2-CE1 3.65Å; V282-Y302 HydrophobicContact CG2-CE2 4Å; V282-Y302 HydrophobicContact CG2-CG 4.11Å; V292-Y302 WeakPolarHBondContact CG2-OH 3.38Å; F297-Y302 HydrophobicContact CD1-CD1 4.06Å; F297-Y302 AromaticContact CD1-CE1 3.91Å; F297-Y302 HydrophobicContact CD1-CE1 3.91Å; F297-Y302 HydrophobicContact CD2-CD1 4.4Å; F297-Y302 HydrophobicContact CD2-CE1 4.32Å; F297-Y302 AromaticContact CE1-CD1 3.68Å; F297-Y302 HydrophobicContact CE1-CD1 3.68Å; F297-Y302 HydrophobicContact CE1-CE1 4.04Å; F297-Y302 HydrophobicContact CE2-CD1 4.13Å; F297-Y302 HydrophobicContact CE2-CE1 4.5Å; F297-Y302 HydrophobicContact CG-CD1 4.4Å; F297-Y302 HydrophobicContact CG-CE1 4.06Å; F297-Y302 AromaticContact CZ-CD1 3.76Å; F297-Y302 HydrophobicContact CZ-CD1 3.76Å; F297-Y302 HydrophobicContact CZ-CE1 4.37Å; Y302-L331 HydrophobicContact CE1-CD2 3.95Å; Y302-L333 VanDerWaalsContact OH-CD1 3.31Å; Y302-L333 WeakPolarHBondContact OH-CD1 3.17Å; Y302-V336 HydrophobicContact CD1-CG1 3.41Å; Y302-V336 VanDerWaalsContact CD1-CG1 3.41Å; Y302-V336 HydrophobicContact CD1-CG2 4.35Å; Y302-V336 HydrophobicContact CD2-CG1 4.48Å; Y302-V336 HydrophobicContact CD2-CG2 4.04Å; Y302-V336 HydrophobicContact CE1-CG1 3.82Å; Y302-V336 HydrophobicContact CE1-CG2 4.44Å; Y302-V336 HydrophobicContact CE2-CG2 4.14Å; Y302-V336 HydrophobicContact CG-CG1 3.78Å; Y302-V336 HydrophobicContact CG-CG2 4.14Å
303	P	97.7	Very high	97	Very high	25 Å²	25	42.1 Å²	42.1	16%	0.162	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-59.3	164.9	165.5	29.9	-37.3	0	0	0	110.6	F305 L341	P303-F305 WeakPolarHBondContact O-CD1 3.32Å; P303-F305 PolarHBondContact O-N 3.17Å; P303-L341 HydrophobicContact CG-CD2 3.78Å; P303-L341 HydrophobicContact CG-CG 4.19Å
304	T	98.6	Very high	97.1	Very high	45 Å²	45	41.2 Å²	41.2	28%	0.276	21%	0.206	S	C	.	.	S	Bend	trans	-55	130.2	173	-64.7	0	0	0	0	110.3	V276 W277 R278 G340 H350	V276-T304 HydrophobicContact CG1-CG2 3.36Å; W277-T304 WeakPolarHBondContact O-CA 3.38Å; R278-T304 HydrophobicContact CG-CG2 4.46Å; T304-G340 WeakPolarHBondContact O-CA 3.35Å; T304-H350 HydrophobicContact CG2-CB 4.42Å; T304-H350 PolarHBondContact O-CE1 2.79Å; T304-H350 PolarHBondContact O-NE2 3.4Å
305	F	98.7	Very high	97.1	Very high	14 Å²	14	35.7 Å²	35.7	6%	0.061	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	170.3	-177.6	74	-73.6	0	0	0	111.2	W277 A280 P303 D335 V336	W277-F305 HydrophobicContact CB-CD1 3.79Å; W277-F305 HydrophobicContact CB-CE1 3.36Å; W277-F305 HydrophobicContact CB-CE2 4.32Å; W277-F305 HydrophobicContact CB-CG 4.43Å; W277-F305 HydrophobicContact CB-CZ 3.66Å; W277-F305 AromaticContact CD1-CE2 3.69Å; W277-F305 AromaticContact CD1-CZ 3.64Å; W277-F305 HydrophobicContact CG-CE1 4.03Å; W277-F305 HydrophobicContact CG-CE2 4.27Å; W277-F305 AromaticContact CG-CZ 3.78Å; W277-F305 HydrophobicContact CG-CZ 3.78Å; W277-F305 PolarHBondContact N-O 3.41Å; W277-F305 PolarHBondContact O-N 2.95Å; A280-F305 HydrophobicContact CB-CE1 3.66Å; A280-F305 HydrophobicContact CB-CZ 4.18Å; P303-F305 WeakPolarHBondContact O-CD1 3.32Å; P303-F305 PolarHBondContact O-N 3.17Å; F305-D335 HydrophobicContact CD2-CB 4.22Å; F305-D335 HydrophobicContact CE2-CB 4.49Å; F305-V336 HydrophobicContact CD1-CG2 4.46Å; F305-V336 HydrophobicContact CD2-CB 4.48Å; F305-V336 HydrophobicContact CD2-CG2 3.81Å; F305-V336 HydrophobicContact CE1-CG2 4.39Å; F305-V336 HydrophobicContact CE2-CG2 3.75Å; F305-V336 HydrophobicContact CG-CG2 4.2Å; F305-V336 HydrophobicContact CZ-CG2 4.06Å
306	C	98.5	Very high	97.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	153.3	177.7	-67.3	0	0	0	0	112.2	C274 F275 G308 Y311 D335 T339	C274-C306 HydrophobicContact CB-CB 3.42Å; C274-C306 VanDerWaalsContact CB-CB 3.42Å; C274-C306 WeakPolarHBondContact CB-SG 3.48Å; C274-C306 WeakPolarHBondContact SG-CA 3.12Å; C274-C306 WeakPolarHBondContact SG-CB 3.34Å; C274-C306 CovalentContact SG-SG 2.02Å; C274-C306 PolarHBondContact SG-SG 3.09Å; F275-C306 CarbonylContact O-C 3.52Å; F275-C306 VanDerWaalsContact O-CA 3.32Å; F275-C306 WeakPolarHBondContact O-CA 3.47Å; C306-G308 PolarHBondContact O-N 3.3Å; C306-Y311 HydrophobicContact CB-CD1 4.35Å; C306-Y311 HydrophobicContact CB-CG 4.35Å; C306-D335 WeakPolarHBondContact O-CB 3.42Å; C306-T339 HydrophobicContact CB-CG2 3.98Å; C306-T339 WeakPolarHBondContact CB-OG1 3.16Å; C306-T339 PolarHBondContact N-OG1 2.83Å
307	S	96.7	Very high	97.3	Very high	5 Å²	5	29.8 Å²	29.8	4%	0.035	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	131	168	170.1	0	0	0	0	112.2	F275 R309 S310	F275-S307 PolarHBondContact O-N 3.2Å; S307-R309 VanDerWaalsContact C-N 3.28Å; S307-R309 PolarHBondContact O-N 2.99Å; S307-R309 PolarHBondContact OG-NE 2.85Å; S307-R309 PolarHBondContact OG-NH2 3.42Å; S307-S310 PolarHBondContact O-N 3.25Å; S307-S310 VanDerWaalsContact O-O 3.1Å
308	G	94.9	Very high	97.4	Very high	10 Å²	10	29.9 Å²	29.9	10%	0.103	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	-31.7	176.4	0	0	0	0	0	116.1	K243 C306 S310 D335	K243-G308 PolarHBondContact NZ-O 3.5Å; C306-G308 PolarHBondContact O-N 3.3Å; G308-S310 VanDerWaalsContact C-N 3.3Å; G308-S310 PolarHBondContact O-N 2.92Å; G308-D335 PolarHBondContact N-OD2 3.09Å
309	R	94.4	Very high	97.5	Very high	43 Å²	43	30.2 Å²	30.2	16%	0.162	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-46.9	-47.8	178.1	-68.2	174	-75.1	179.7	-5.3	114.1	D245 V248 S307	D245-R309 PolarHBondContact N-O 3.38Å; D245-R309 WeakPolarHBondContact OD2-CA 3.4Å; V248-R309 HydrophobicContact CG2-CB 3.91Å; V248-R309 HydrophobicContact CG2-CG 4.41Å; S307-R309 VanDerWaalsContact C-N 3.28Å; S307-R309 PolarHBondContact O-N 2.99Å; S307-R309 PolarHBondContact OG-NE 2.85Å; S307-R309 PolarHBondContact OG-NH2 3.42Å
310	S	97.3	Very high	97.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	150.6	174.7	66.1	0	0	0	0	111	K243 S307 G308 Y357 F375	K243-S310 CarbonylContact O-C 3.13Å; K243-S310 WeakPolarHBondContact O-CA 3.38Å; K243-S310 VanDerWaalsContact O-CB 3.27Å; K243-S310 WeakPolarHBondContact O-CB 3.36Å; S307-S310 PolarHBondContact O-N 3.25Å; S307-S310 VanDerWaalsContact O-O 3.1Å; G308-S310 VanDerWaalsContact C-N 3.3Å; G308-S310 PolarHBondContact O-N 2.92Å; S310-Y357 PolarHBondContact O-OH 3.12Å; S310-Y357 WeakPolarHBondContact OG-CE1 3.4Å; S310-Y357 PolarHBondContact OG-OH 3.39Å; S310-F375 WeakPolarHBondContact OG-CD1 3.49Å; S310-F375 WeakPolarHBondContact OG-CE1 3.09Å; S310-F375 WeakPolarHBondContact OG-CG 3.38Å
311	Y	98.3	Very high	97.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	154.9	168.1	53	-96	0	0	0	109.2	W227 K243 F272 C306 L313 T339	W227-Y311 HydrophobicContact CH2-CE2 4.27Å; W227-Y311 HydrophobicContact CZ2-CE2 4.15Å; W227-Y311 WeakPolarHBondContact CZ2-OH 3.44Å; K243-Y311 HydrophobicContact CB-CD1 4.39Å; K243-Y311 HydrophobicContact CB-CD2 3.96Å; K243-Y311 HydrophobicContact CB-CE1 4.08Å; K243-Y311 HydrophobicContact CB-CE2 3.62Å; K243-Y311 HydrophobicContact CB-CG 4.34Å; K243-Y311 HydrophobicContact CD-CD1 4.11Å; K243-Y311 HydrophobicContact CD-CE1 3.56Å; K243-Y311 HydrophobicContact CG-CE1 3.93Å; K243-Y311 HydrophobicContact CG-CE2 4.16Å; K243-Y311 PolarHBondContact N-O 3.03Å; K243-Y311 PolarHBondContact O-N 3.04Å; F272-Y311 AromaticContact CD1-CD2 3.91Å; F272-Y311 HydrophobicContact CD1-CD2 3.91Å; F272-Y311 HydrophobicContact CD1-CE2 4.48Å; F272-Y311 AromaticContact CE1-CD2 3.86Å; F272-Y311 HydrophobicContact CE1-CD2 3.86Å; F272-Y311 AromaticContact CE1-CE2 3.98Å; F272-Y311 HydrophobicContact CE1-CE2 3.98Å; C306-Y311 HydrophobicContact CB-CD1 4.35Å; C306-Y311 HydrophobicContact CB-CG 4.35Å; Y311-L313 HydrophobicContact CD2-CD2 4.3Å; Y311-L313 HydrophobicContact CE2-CD2 4.28Å; Y311-T339 HydrophobicContact CD1-CG2 3.99Å; Y311-T339 HydrophobicContact CD2-CG2 4.09Å; Y311-T339 HydrophobicContact CE1-CG2 3.88Å; Y311-T339 HydrophobicContact CE2-CG2 3.98Å; Y311-T339 HydrophobicContact CG-CG2 4.08Å
312	S	98	Very high	97.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	154.9	172.9	-46.6	0	0	0	0	110.4	I241 L242 F259 F272 Y273	I241-S312 CarbonylContact O-C 3.49Å; I241-S312 WeakPolarHBondContact O-CA 3.47Å; L242-S312 WeakPolarHBondContact CD1-OG 3.35Å; F259-S312 VanDerWaalsContact CZ-CB 3.49Å; F259-S312 VanDerWaalsContact CZ-OG 3.29Å; F259-S312 WeakPolarHBondContact CZ-OG 3.32Å; F272-S312 CarbonylContact C-O 3.31Å; F272-S312 VanDerWaalsContact CA-O 3.23Å; F272-S312 WeakPolarHBondContact CA-O 3.37Å; Y273-S312 PolarHBondContact N-O 3.29Å; Y273-S312 PolarHBondContact O-N 3.14Å
313	L	98.1	Very high	97.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	152.3	175	64.7	165.5	0	0	0	111.4	W227 L228 Y240 I241 A271 F272 Y311 V318 L321	W227-L313 HydrophobicContact CH2-CD1 4.48Å; W227-L313 HydrophobicContact CH2-CD2 3.97Å; W227-L313 HydrophobicContact CZ3-CD2 4.37Å; L228-L313 HydrophobicContact CD2-CD1 3.92Å; Y240-L313 CarbonylContact C-O 3.51Å; Y240-L313 VanDerWaalsContact CA-O 3.29Å; Y240-L313 WeakPolarHBondContact CA-O 3.32Å; I241-L313 HydrophobicContact CB-CD2 3.58Å; I241-L313 HydrophobicContact CB-CG 4.09Å; I241-L313 HydrophobicContact CG2-CD2 3.93Å; I241-L313 PolarHBondContact N-O 3.25Å; I241-L313 PolarHBondContact O-N 3.13Å; A271-L313 VanDerWaalsContact O-CA 3.3Å; A271-L313 WeakPolarHBondContact O-CA 3.49Å; F272-L313 HydrophobicContact CD1-CB 3.71Å; F272-L313 HydrophobicContact CE1-CB 3.8Å; F272-L313 HydrophobicContact CE1-CD1 3.95Å; F272-L313 HydrophobicContact CE1-CD2 4.38Å; F272-L313 HydrophobicContact CE1-CG 4.28Å; F272-L313 HydrophobicContact CZ-CD1 4.38Å; Y311-L313 HydrophobicContact CD2-CD2 4.3Å; Y311-L313 HydrophobicContact CE2-CD2 4.28Å; L313-V318 HydrophobicContact CD1-CG2 4.04Å; L313-L321 HydrophobicContact CD1-CD1 3.91Å
314	T	97.5	Very high	97.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	140.7	168.2	53.3	0	0	0	0	110.3	Y240 P269 A271 Y273 Q316 A317	Y240-T314 HydrophobicContact CD1-CG2 4.18Å; Y240-T314 HydrophobicContact CE1-CG2 3.88Å; P269-T314 VanDerWaalsContact O-CG2 3.28Å; P269-T314 WeakPolarHBondContact O-CG2 3.39Å; P269-T314 PolarHBondContact O-OG1 2.04Å; A271-T314 PolarHBondContact N-OG1 2.93Å; A271-T314 PolarHBondContact O-N 2.91Å; A271-T314 VanDerWaalsContact O-N 3.11Å; Y273-T314 HydrophobicContact CE2-CG2 4.13Å; T314-Q316 PolarHBondContact O-N 3.19Å; T314-Q316 VanDerWaalsContact O-N 3.15Å; T314-A317 WeakPolarHBondContact O-CB 3.46Å; T314-A317 PolarHBondContact O-N 2.94Å
315	M	97	Very high	97.7	Very high	26 Å²	26	22.2 Å²	22.2	13%	0.128	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-56.4	-32.3	175	-174.3	60.2	73.2	0	0	112.7	A231 C235 A238 K239 I241 A317 V318	A231-M315 HydrophobicContact CB-CE 4.5Å; C235-M315 WeakPolarHBondContact O-CE 3.19Å; A238-M315 HydrophobicContact CB-CE 3.69Å; A238-M315 WeakPolarHBondContact O-CB 3.48Å; A238-M315 WeakPolarHBondContact O-CG 3.02Å; K239-M315 PolarHBondContact O-N 2.85Å; I241-M315 HydrophobicContact CD1-CE 3.83Å; I241-M315 HydrophobicContact CD1-SD 4.04Å; I241-M315 HydrophobicContact CG1-CE 3.77Å; I241-M315 HydrophobicContact CG1-SD 4.46Å; M315-A317 PolarHBondContact O-N 3.46Å; M315-A317 VanDerWaalsContact O-N 3.13Å; M315-V318 WeakPolarHBondContact O-CB 3.44Å; M315-V318 WeakPolarHBondContact O-CG2 3.18Å; M315-V318 PolarHBondContact O-N 3.12Å; M315-V318 HydrophobicContact SD-CB 4.34Å; M315-V318 HydrophobicContact SD-CG2 3.8Å
316	Q	96.3	Very high	97.6	Very high	113 Å²	113	26.6 Å²	26.6	53%	0.528	13%	0.133	S	C	.	.	G	3₁₀ helix	trans	-62.6	-17.3	175.3	-70.2	168.7	-40	0	0	114.5	S268 K270 T314 P320	S268-Q316 PolarHBondContact O-OE1 3.46Å; S268-Q316 PolarHBondContact OG-OE1 2.96Å; K270-Q316 HydrophobicContact CG-CB 4.3Å; T314-Q316 PolarHBondContact O-N 3.19Å; T314-Q316 VanDerWaalsContact O-N 3.15Å; Q316-P320 WeakPolarHBondContact O-CD 3.14Å
317	A	98.2	Very high	97.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-83.1	-17.7	175.4	0	0	0	0	0	112.6	K270 T314 M315 P320 L321 V348	K270-A317 HydrophobicContact CB-CB 4.14Å; T314-A317 WeakPolarHBondContact O-CB 3.46Å; T314-A317 PolarHBondContact O-N 2.94Å; M315-A317 PolarHBondContact O-N 3.46Å; M315-A317 VanDerWaalsContact O-N 3.13Å; A317-P320 WeakPolarHBondContact O-CD 3.49Å; A317-L321 HydrophobicContact CB-CD1 4.32Å; A317-L321 WeakPolarHBondContact O-CB 3.28Å; A317-L321 WeakPolarHBondContact O-CD1 3.44Å; A317-L321 WeakPolarHBondContact O-CG 3.35Å; A317-L321 PolarHBondContact O-N 3.42Å; A317-L321 VanDerWaalsContact O-N 3.14Å; A317-V348 HydrophobicContact CB-CG1 4.02Å; A317-V348 HydrophobicContact CB-CG2 4.1Å
318	V	98.5	Very high	97.6	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.012	16%	0.16	C	C	.	.	H	α-helix	trans	-65.6	-52.3	-170.7	177	0	0	0	0	112.1	L228 A232 I241 L313 M315 L321 L322	L228-V318 HydrophobicContact CB-CG1 4.19Å; L228-V318 HydrophobicContact CD2-CB 4.34Å; L228-V318 HydrophobicContact CD2-CG1 3.9Å; L228-V318 HydrophobicContact CD2-CG2 4.01Å; L228-V318 WeakPolarHBondContact O-CG1 3.43Å; A232-V318 HydrophobicContact CB-CG1 3.87Å; I241-V318 HydrophobicContact CD1-CG2 3.55Å; L313-V318 HydrophobicContact CD1-CG2 4.04Å; M315-V318 WeakPolarHBondContact O-CB 3.44Å; M315-V318 WeakPolarHBondContact O-CG2 3.18Å; M315-V318 PolarHBondContact O-N 3.12Å; M315-V318 HydrophobicContact SD-CB 4.34Å; M315-V318 HydrophobicContact SD-CG2 3.8Å; V318-L321 WeakPolarHBondContact O-CB 3.36Å; V318-L321 PolarHBondContact O-N 2.83Å; V318-L322 HydrophobicContact CG1-CD1 3.95Å; V318-L322 HydrophobicContact CG1-CG 4.46Å; V318-L322 WeakPolarHBondContact O-CG 3.43Å; V318-L322 PolarHBondContact O-N 2.98Å
319	Q	98.1	Very high	97.8	Very high	101 Å²	101	33.2 Å²	33.2	47%	0.472	17%	0.167	S	C	.	.	H	α-helix	trans	-62	-47.7	-178.4	-170.6	65.1	50	0	0	112	L321 L322 D323	Q319-L321 VanDerWaalsContact C-N 3.26Å; Q319-L321 PolarHBondContact O-N 2.81Å; Q319-L322 WeakPolarHBondContact O-CB 3.25Å; Q319-L322 PolarHBondContact O-N 3.46Å; Q319-D323 PolarHBondContact NE2-OD1 3.22Å; Q319-D323 PolarHBondContact O-N 3.33Å
320	P	98.4	Very high	98	Very high	27 Å²	27	32.3 Å²	32.3	18%	0.175	17%	0.165	C	C	.	.	H	α-helix	trans	-60.3	-32	175.9	-29.8	40.9	0	0	0	114.5	K270 Q316 A317 S324 A346	K270-P320 HydrophobicContact CD-CB 4.35Å; K270-P320 HydrophobicContact CD-CG 3.73Å; Q316-P320 WeakPolarHBondContact O-CD 3.14Å; A317-P320 WeakPolarHBondContact O-CD 3.49Å; P320-S324 WeakPolarHBondContact O-CB 3.36Å; P320-S324 PolarHBondContact O-N 2.95Å; P320-S324 PolarHBondContact O-OG 3.47Å; P320-A346 HydrophobicContact CB-CB 3.97Å; P320-A346 WeakPolarHBondContact O-CB 3.36Å
321	L	98.8	Very high	98	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.8	-44.8	173	-71.8	165.6	0	0	0	111.3	L228 F272 L313 A317 V318 Q319 S324 V325 L342 A346 V348	L228-L321 HydrophobicContact CD2-CD1 4.49Å; F272-L321 HydrophobicContact CE1-CD1 4.44Å; F272-L321 HydrophobicContact CE2-CD1 4.08Å; F272-L321 HydrophobicContact CE2-CD2 4.13Å; F272-L321 HydrophobicContact CZ-CD1 3.55Å; F272-L321 HydrophobicContact CZ-CD2 4.2Å; L313-L321 HydrophobicContact CD1-CD1 3.91Å; A317-L321 HydrophobicContact CB-CD1 4.32Å; A317-L321 WeakPolarHBondContact O-CB 3.28Å; A317-L321 WeakPolarHBondContact O-CD1 3.44Å; A317-L321 WeakPolarHBondContact O-CG 3.35Å; A317-L321 PolarHBondContact O-N 3.42Å; A317-L321 VanDerWaalsContact O-N 3.14Å; V318-L321 WeakPolarHBondContact O-CB 3.36Å; V318-L321 PolarHBondContact O-N 2.83Å; Q319-L321 VanDerWaalsContact C-N 3.26Å; Q319-L321 PolarHBondContact O-N 2.81Å; L321-S324 WeakPolarHBondContact O-CB 3.22Å; L321-S324 PolarHBondContact O-N 3.47Å; L321-V325 PolarHBondContact O-N 2.82Å; L321-L342 HydrophobicContact CD2-CB 3.71Å; L321-A346 HydrophobicContact CD2-CB 4.28Å; L321-V348 HydrophobicContact CD2-CG2 4.22Å; L321-V348 HydrophobicContact CG-CG2 4.25Å
322	L	98.6	Very high	98	Very high	26 Å²	26	33.2 Å²	33.2	14%	0.136	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-45.3	176.6	-71.4	170.6	0	0	0	111.5	I225 L228 N229 A232 V318 Q319 S324 V325	I225-L322 HydrophobicContact CG2-CD2 4.24Å; L228-L322 HydrophobicContact CB-CD2 3.83Å; L228-L322 HydrophobicContact CB-CG 4.23Å; N229-L322 HydrophobicContact CB-CD1 4.48Å; N229-L322 HydrophobicContact CB-CD2 4.28Å; A232-L322 HydrophobicContact CB-CD1 4.21Å; V318-L322 HydrophobicContact CG1-CD1 3.95Å; V318-L322 HydrophobicContact CG1-CG 4.46Å; V318-L322 WeakPolarHBondContact O-CG 3.43Å; V318-L322 PolarHBondContact O-N 2.98Å; Q319-L322 WeakPolarHBondContact O-CB 3.25Å; Q319-L322 PolarHBondContact O-N 3.46Å; L322-S324 PolarHBondContact O-N 3.07Å; L322-V325 WeakPolarHBondContact O-CB 3.43Å; L322-V325 WeakPolarHBondContact O-CG2 3.31Å; L322-V325 PolarHBondContact O-N 2.96Å; L322-V325 VanDerWaalsContact O-N 3.11Å
323	D	98.1	Very high	98	Very high	84 Å²	84	33.9 Å²	33.9	45%	0.449	17%	0.172	S	C	.	.	H	α-helix	trans	-61.1	-28.5	176.8	-59	-22.2	0	0	0	111.8	Q319 V325	Q319-D323 PolarHBondContact NE2-OD1 3.22Å; Q319-D323 PolarHBondContact O-N 3.33Å; D323-V325 VanDerWaalsContact C-N 3.32Å; D323-V325 PolarHBondContact O-N 3.3Å
324	S	98.6	Very high	97.9	Very high	6 Å²	6	34.7 Å²	34.7	4%	0.042	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-12	179.7	-63.6	0	0	0	0	114.1	P320 L321 L322 E326 L327 T328 L342 A346	P320-S324 WeakPolarHBondContact O-CB 3.36Å; P320-S324 PolarHBondContact O-N 2.95Å; P320-S324 PolarHBondContact O-OG 3.47Å; L321-S324 WeakPolarHBondContact O-CB 3.22Å; L321-S324 PolarHBondContact O-N 3.47Å; L322-S324 PolarHBondContact O-N 3.07Å; S324-E326 PolarHBondContact O-N 2.98Å; S324-L327 PolarHBondContact O-N 3.5Å; S324-T328 VanDerWaalsContact O-CB 3.25Å; S324-T328 WeakPolarHBondContact O-CB 3.32Å; S324-T328 PolarHBondContact O-N 2.84Å; S324-T328 VanDerWaalsContact O-N 3.16Å; S324-T328 PolarHBondContact O-OG1 3.39Å; S324-L342 WeakPolarHBondContact O-CD2 3.4Å; S324-A346 WeakPolarHBondContact OG-CA 3.49Å; S324-A346 WeakPolarHBondContact OG-CB 3.47Å; S324-A346 PolarHBondContact OG-N 3.11Å
325	V	98.4	Very high	98	Very high	9 Å²	9	36 Å²	36	6%	0.055	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-62.1	-43.2	-177.2	174.2	0	0	0	0	111.3	V114 L116 I225 L321 L322 D323 L327 L342	V114-V325 HydrophobicContact CG1-CG1 4.35Å; L116-V325 HydrophobicContact CD2-CG1 3.94Å; I225-V325 HydrophobicContact CD1-CG1 4.08Å; I225-V325 HydrophobicContact CD1-CG2 4.41Å; I225-V325 HydrophobicContact CG1-CG2 4.16Å; I225-V325 HydrophobicContact CG2-CG2 4.49Å; L321-V325 PolarHBondContact O-N 2.82Å; L322-V325 WeakPolarHBondContact O-CB 3.43Å; L322-V325 WeakPolarHBondContact O-CG2 3.31Å; L322-V325 PolarHBondContact O-N 2.96Å; L322-V325 VanDerWaalsContact O-N 3.11Å; D323-V325 VanDerWaalsContact C-N 3.32Å; D323-V325 PolarHBondContact O-N 3.3Å; V325-L327 PolarHBondContact O-N 3.31Å; V325-L342 HydrophobicContact CG2-CD1 3.8Å; V325-L342 HydrophobicContact CG2-CD2 4.29Å
326	E	97	Very high	98	Very high	106 Å²	106	34.9 Å²	34.9	50%	0.495	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-73.6	-16.6	-179	64.4	176.2	-162	0	0	113.7	K115 S324	K115-E326 HydrophobicContact CB-CB 4.39Å; K115-E326 HydrophobicContact CD-CB 4.42Å; S324-E326 PolarHBondContact O-N 2.98Å
327	L	97.6	Very high	98.2	Very high	112 Å²	112	29.5 Å²	29.5	59%	0.586	15%	0.153	S	C	*	.	G	3₁₀ helix	trans	-99.6	-10.4	-177.4	-55.4	-179.9	0	0	0	113	S324 V325 T345	S324-L327 PolarHBondContact O-N 3.5Å; V325-L327 PolarHBondContact O-N 3.31Å; L327-T345 HydrophobicContact CB-CG2 4.19Å; L327-T345 HydrophobicContact CD1-CG2 4.5Å
328	T	98.3	Very high	98.2	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.025	15%	0.153	C	C	.	.	S	Bend	trans	-120.9	122	-168.3	-53.7	0	0	0	0	110.6	S324 F330 Y337 L341 L342 T345	S324-T328 VanDerWaalsContact O-CB 3.25Å; S324-T328 WeakPolarHBondContact O-CB 3.32Å; S324-T328 PolarHBondContact O-N 2.84Å; S324-T328 VanDerWaalsContact O-N 3.16Å; S324-T328 PolarHBondContact O-OG1 3.39Å; T328-F330 PolarHBondContact O-N 3.32Å; T328-Y337 HydrophobicContact CG2-CE2 4.06Å; T328-Y337 PolarHBondContact O-OH 3.34Å; T328-L341 HydrophobicContact CG2-CB 3.64Å; T328-L342 HydrophobicContact CG2-CD2 3.98Å; T328-T345 WeakPolarHBondContact OG1-CB 3.45Å; T328-T345 PolarHBondContact OG1-OG1 3.36Å
329	P	97.9	Very high	98.2	Very high	38 Å²	38	29.4 Å²	29.4	25%	0.247	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-53.7	126.2	176.9	-27.1	34.9	0	0	0	112.4	L117 R119 Y337	L117-P329 HydrophobicContact CD2-CG 4.2Å; L117-P329 HydrophobicContact CG-CG 4.47Å; L117-P329 CarbonylContact O-C 3.47Å; L117-P329 VanDerWaalsContact O-CA 3.29Å; L117-P329 WeakPolarHBondContact O-CA 3.29Å; R119-P329 HydrophobicContact CG-CB 3.53Å; R119-P329 HydrophobicContact CG-CG 4.22Å; P329-Y337 WeakPolarHBondContact O-CE2 3.48Å
330	F	98.2	Very high	98.2	Very high	25 Å²	25	24.7 Å²	24.7	11%	0.11	13%	0.13	C	C	.	.			trans	-62.7	138.3	-175	-179.9	-103.1	0	0	0	111.4	L116 L117 Y118 S221 L222 T328 W332 Y337	L116-F330 HydrophobicContact CD1-CD2 4.28Å; L116-F330 HydrophobicContact CD1-CE2 4.43Å; L116-F330 HydrophobicContact CD1-CG 4.48Å; L116-F330 HydrophobicContact CD2-CD2 3.83Å; L116-F330 HydrophobicContact CD2-CE2 4.31Å; L117-F330 WeakPolarHBondContact O-CB 3.29Å; L117-F330 PolarHBondContact O-N 3.48Å; Y118-F330 HydrophobicContact CE1-CB 4.44Å; Y118-F330 AromaticContact CE1-CD1 3.95Å; Y118-F330 HydrophobicContact CE1-CD1 3.95Å; S221-F330 VanDerWaalsContact CB-CE2 3.48Å; L222-F330 HydrophobicContact CD2-CE2 3.59Å; L222-F330 HydrophobicContact CD2-CZ 3.74Å; L222-F330 HydrophobicContact CG-CE2 4.34Å; L222-F330 HydrophobicContact CG-CZ 4.1Å; T328-F330 PolarHBondContact O-N 3.32Å; F330-W332 HydrophobicContact CE1-CB 4.27Å; F330-Y337 HydrophobicContact CD2-CE1 4.07Å; F330-Y337 HydrophobicContact CE2-CE1 4.48Å
331	L	98.3	Very high	98.3	Very high	3 Å²	3	24.3 Å²	24.3	2%	0.016	13%	0.127	C	C	.	.			trans	-137.1	138	169.7	-177.3	67	0	0	0	108	S221 V292 E296 F297 Y302 L333 V336 Y337 L341	S221-L331 VanDerWaalsContact CB-O 3.29Å; S221-L331 WeakPolarHBondContact CB-O 3.19Å; S221-L331 PolarHBondContact OG-O 3.02Å; V292-L331 HydrophobicContact CG1-CD1 3.8Å; V292-L331 HydrophobicContact CG2-CD1 4.27Å; E296-L331 HydrophobicContact CB-CD1 4.35Å; F297-L331 HydrophobicContact CB-CD1 4.47Å; F297-L331 HydrophobicContact CD2-CD2 4.36Å; Y302-L331 HydrophobicContact CE1-CD2 3.95Å; L331-L333 VanDerWaalsContact C-N 3.34Å; L331-L333 HydrophobicContact CD2-CB 4.38Å; L331-L333 HydrophobicContact CD2-CD1 4.43Å; L331-L333 HydrophobicContact CG-CB 4.36Å; L331-L333 PolarHBondContact O-N 2.81Å; L331-V336 HydrophobicContact CD2-CB 4.01Å; L331-V336 HydrophobicContact CD2-CG1 3.58Å; L331-Y337 HydrophobicContact CB-CD2 4.12Å; L331-Y337 HydrophobicContact CB-CG 4.48Å; L331-Y337 VanDerWaalsContact O-CB 3.28Å; L331-Y337 WeakPolarHBondContact O-CB 3.48Å; L331-L341 HydrophobicContact CB-CD1 4.11Å; L331-L341 HydrophobicContact CD2-CD1 4.2Å
332	W	97.3	Very high	98.3	Very high	15 Å²	15	24.3 Å²	24.3	6%	0.057	13%	0.127	C	C	.	.	S	Bend	trans	-77.4	-18.3	-171.7	63.1	-98.3	0	0	0	114.7	H218 S221 Y291 V292 E296 F330 D334	H218-W332 AromaticContact CE1-CE2 3.73Å; H218-W332 AromaticContact CE1-CZ2 3.85Å; H218-W332 AromaticContact ND1-CD1 3.78Å; H218-W332 AromaticContact ND1-CD2 3.42Å; H218-W332 AromaticContact ND1-CE2 3.5Å; H218-W332 AromaticContact ND1-CE3 3.88Å; H218-W332 AromaticContact ND1-CG 3.64Å; H218-W332 AromaticContact ND1-NE1 3.71Å; H218-W332 VanDerWaalsContact O-CB 3.23Å; H218-W332 WeakPolarHBondContact O-CB 3.31Å; S221-W332 PolarHBondContact N-O 2.99Å; S221-W332 VanDerWaalsContact OG-C 3.25Å; S221-W332 PolarHBondContact OG-O 3.42Å; Y291-W332 WeakPolarHBondContact O-CZ2 3.42Å; V292-W332 HydrophobicContact CG2-CZ2 4.43Å; E296-W332 VanDerWaalsContact OE1-CD1 3.27Å; E296-W332 PolarHBondContact OE1-NE1 3.47Å; F330-W332 HydrophobicContact CE1-CB 4.27Å; W332-D334 PolarHBondContact O-N 2.96Å
333	L	98.1	Very high	98.3	Very high	15 Å²	15	23.1 Å²	23.1	8%	0.079	12%	0.121	C	C	.	.			trans	-71.6	105.2	172.5	-65.8	170.7	0	0	0	109.2	S221 V292 Y302 L331 D335 V336 Y337	S221-L333 PolarHBondContact OG-O 3.2Å; V292-L333 HydrophobicContact CG2-CD1 3.63Å; V292-L333 HydrophobicContact CG2-CG 4.4Å; Y302-L333 VanDerWaalsContact OH-CD1 3.31Å; Y302-L333 WeakPolarHBondContact OH-CD1 3.17Å; L331-L333 VanDerWaalsContact C-N 3.34Å; L331-L333 HydrophobicContact CD2-CB 4.38Å; L331-L333 HydrophobicContact CD2-CD1 4.43Å; L331-L333 HydrophobicContact CG-CB 4.36Å; L331-L333 PolarHBondContact O-N 2.81Å; L333-D335 VanDerWaalsContact C-N 3.32Å; L333-D335 PolarHBondContact O-N 3.43Å; L333-V336 HydrophobicContact CB-CB 4.08Å; L333-V336 HydrophobicContact CB-CG2 4.18Å; L333-V336 HydrophobicContact CD1-CG2 4.2Å; L333-V336 PolarHBondContact O-N 3.34Å; L333-Y337 WeakPolarHBondContact O-CB 3.45Å; L333-Y337 PolarHBondContact O-N 3.46Å
334	D	97.8	Very high	98.3	Very high	16 Å²	16	26.5 Å²	26.5	9%	0.086	13%	0.131	C	C	.	.	H	α-helix	trans	-62.1	-40.2	-173.7	68.2	-42.8	0	0	0	112.5	H152 M220 S221 A224 K243 W332 I338	H152-D334 IonicContact CE1-OD2 3.58Å; M220-D334 HydrophobicContact CB-CB 3.98Å; S221-D334 VanDerWaalsContact OG-CA 3.32Å; S221-D334 WeakPolarHBondContact OG-CA 3.26Å; S221-D334 PolarHBondContact OG-N 2.94Å; A224-D334 HydrophobicContact CB-CB 4.04Å; K243-D334 WeakPolarHBondContact CE-OD2 3.39Å; K243-D334 IonicContact NZ-OD2 3.54Å; K243-D334 PolarHBondContact NZ-OD2 3.09Å; W332-D334 PolarHBondContact O-N 2.96Å; D334-I338 HydrophobicContact CB-CG1 4.45Å; D334-I338 WeakPolarHBondContact O-CA 3.48Å; D334-I338 WeakPolarHBondContact O-CB 3.48Å; D334-I338 WeakPolarHBondContact O-CG1 3.45Å; D334-I338 PolarHBondContact O-N 3.17Å
335	D	98	Very high	98.3	Very high	29 Å²	29	29.4 Å²	29.4	16%	0.155	15%	0.149	C	C	.	.	H	α-helix	trans	-63.8	-49.3	179.5	64.1	-11.9	0	0	0	111.6	F305 C306 G308 L333 T339	F305-D335 HydrophobicContact CD2-CB 4.22Å; F305-D335 HydrophobicContact CE2-CB 4.49Å; C306-D335 WeakPolarHBondContact O-CB 3.42Å; G308-D335 PolarHBondContact N-OD2 3.09Å; L333-D335 VanDerWaalsContact C-N 3.32Å; L333-D335 PolarHBondContact O-N 3.43Å; D335-T339 WeakPolarHBondContact O-CA 3.31Å; D335-T339 WeakPolarHBondContact O-CB 3.47Å; D335-T339 PolarHBondContact O-N 3.34Å; D335-T339 VanDerWaalsContact O-N 3.12Å; D335-T339 PolarHBondContact O-OG1 2.62Å
336	V	98.5	Very high	98.3	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.012	15%	0.15	C	C	.	.	H	α-helix	trans	-66.9	-44	175.2	179.9	0	0	0	0	111.9	Y302 F305 L331 L333 G340 L341	Y302-V336 HydrophobicContact CD1-CG1 3.41Å; Y302-V336 VanDerWaalsContact CD1-CG1 3.41Å; Y302-V336 HydrophobicContact CD1-CG2 4.35Å; Y302-V336 HydrophobicContact CD2-CG1 4.48Å; Y302-V336 HydrophobicContact CD2-CG2 4.04Å; Y302-V336 HydrophobicContact CE1-CG1 3.82Å; Y302-V336 HydrophobicContact CE1-CG2 4.44Å; Y302-V336 HydrophobicContact CE2-CG2 4.14Å; Y302-V336 HydrophobicContact CG-CG1 3.78Å; Y302-V336 HydrophobicContact CG-CG2 4.14Å; F305-V336 HydrophobicContact CD1-CG2 4.46Å; F305-V336 HydrophobicContact CD2-CB 4.48Å; F305-V336 HydrophobicContact CD2-CG2 3.81Å; F305-V336 HydrophobicContact CE1-CG2 4.39Å; F305-V336 HydrophobicContact CE2-CG2 3.75Å; F305-V336 HydrophobicContact CG-CG2 4.2Å; F305-V336 HydrophobicContact CZ-CG2 4.06Å; L331-V336 HydrophobicContact CD2-CB 4.01Å; L331-V336 HydrophobicContact CD2-CG1 3.58Å; L333-V336 HydrophobicContact CB-CB 4.08Å; L333-V336 HydrophobicContact CB-CG2 4.18Å; L333-V336 HydrophobicContact CD1-CG2 4.2Å; L333-V336 PolarHBondContact O-N 3.34Å; V336-G340 CarbonylContact O-C 3.55Å; V336-G340 WeakPolarHBondContact O-CA 3.32Å; V336-G340 PolarHBondContact O-N 3.5Å; V336-L341 PolarHBondContact O-N 2.89Å
337	Y	98.8	Very high	98.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.159	C	C	.	.	I	π-helix	trans	-70.8	-57.7	-175.2	-177.3	-114.5	0	0	0	111.6	I225 T328 P329 F330 L331 L333 L341 L342	I225-Y337 HydrophobicContact CD1-CE1 4.03Å; I225-Y337 HydrophobicContact CG1-CE1 4.43Å; T328-Y337 HydrophobicContact CG2-CE2 4.06Å; T328-Y337 PolarHBondContact O-OH 3.34Å; P329-Y337 WeakPolarHBondContact O-CE2 3.48Å; F330-Y337 HydrophobicContact CD2-CE1 4.07Å; F330-Y337 HydrophobicContact CE2-CE1 4.48Å; L331-Y337 HydrophobicContact CB-CD2 4.12Å; L331-Y337 HydrophobicContact CB-CG 4.48Å; L331-Y337 VanDerWaalsContact O-CB 3.28Å; L331-Y337 WeakPolarHBondContact O-CB 3.48Å; L333-Y337 WeakPolarHBondContact O-CB 3.45Å; L333-Y337 PolarHBondContact O-N 3.46Å; Y337-L341 HydrophobicContact CD2-CB 4.28Å; Y337-L341 HydrophobicContact CD2-CD1 4.05Å; Y337-L341 PolarHBondContact O-N 3.31Å; Y337-L342 HydrophobicContact CD1-CD1 4.19Å; Y337-L342 HydrophobicContact CD1-CG 4.3Å; Y337-L342 HydrophobicContact CE1-CD1 3.79Å; Y337-L342 HydrophobicContact CE1-CD2 4.14Å; Y337-L342 HydrophobicContact CE1-CG 4Å; Y337-L342 HydrophobicContact CE2-CD2 4.03Å; Y337-L342 HydrophobicContact CE2-CG 4.32Å; Y337-L342 WeakPolarHBondContact O-CG 3.23Å; Y337-L342 PolarHBondContact O-N 3.25Å
338	I	98.8	Very high	98.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.133	C	C	.	.	I	π-helix	trans	-70.1	-47.3	-175	-54.6	-64.1	0	0	0	111	A224 I225 L228 F272 D334 L342 A343	A224-I338 HydrophobicContact CB-CD1 3.88Å; A224-I338 HydrophobicContact CB-CG1 3.58Å; I225-I338 HydrophobicContact CG1-CD1 4.01Å; L228-I338 HydrophobicContact CD1-CD1 4.28Å; L228-I338 HydrophobicContact CD1-CG2 3.93Å; F272-I338 HydrophobicContact CZ-CG2 4.3Å; D334-I338 HydrophobicContact CB-CG1 4.45Å; D334-I338 WeakPolarHBondContact O-CA 3.48Å; D334-I338 WeakPolarHBondContact O-CB 3.48Å; D334-I338 WeakPolarHBondContact O-CG1 3.45Å; D334-I338 PolarHBondContact O-N 3.17Å; I338-L342 HydrophobicContact CD1-CD1 3.69Å; I338-A343 PolarHBondContact O-N 3.12Å
339	T	98.8	Very high	98.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.159	C	C	.	.	I	π-helix	trans	-95.2	-10.3	-172.2	82.7	0	0	0	0	112.7	F272 C306 Y311 D335 A343 H350	F272-T339 HydrophobicContact CD1-CG2 4.12Å; F272-T339 HydrophobicContact CE1-CG2 3.73Å; F272-T339 HydrophobicContact CE2-CG2 4.46Å; F272-T339 HydrophobicContact CZ-CG2 3.91Å; C306-T339 HydrophobicContact CB-CG2 3.98Å; C306-T339 WeakPolarHBondContact CB-OG1 3.16Å; C306-T339 PolarHBondContact N-OG1 2.83Å; Y311-T339 HydrophobicContact CD1-CG2 3.99Å; Y311-T339 HydrophobicContact CD2-CG2 4.09Å; Y311-T339 HydrophobicContact CE1-CG2 3.88Å; Y311-T339 HydrophobicContact CE2-CG2 3.98Å; Y311-T339 HydrophobicContact CG-CG2 4.08Å; D335-T339 WeakPolarHBondContact O-CA 3.31Å; D335-T339 WeakPolarHBondContact O-CB 3.47Å; D335-T339 PolarHBondContact O-N 3.34Å; D335-T339 VanDerWaalsContact O-N 3.12Å; D335-T339 PolarHBondContact O-OG1 2.62Å; T339-A343 WeakPolarHBondContact O-CB 3.33Å; T339-H350 PolarHBondContact O-CE1 3.03Å; T339-H350 PolarHBondContact O-NE2 3.21Å
340	G	98.8	Very high	98.3	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.01	16%	0.157	C	C	.	.	I	π-helix	trans	-108.6	-70.4	175.1	0	0	0	0	0	112.5	T304 V336 A343 K344	T304-G340 WeakPolarHBondContact O-CA 3.35Å; V336-G340 CarbonylContact O-C 3.55Å; V336-G340 WeakPolarHBondContact O-CA 3.32Å; V336-G340 PolarHBondContact O-N 3.5Å; G340-A343 PolarHBondContact O-N 3.47Å; G340-K344 WeakPolarHBondContact O-CB 3.37Å; G340-K344 PolarHBondContact O-N 3.38Å
341	L	98.7	Very high	98.1	Very high	20 Å²	20	32.7 Å²	32.7	11%	0.105	16%	0.162	C	C	.	.	I	π-helix	trans	-67	-54	-172.8	-64.7	170.4	0	0	0	112.3	F297 P303 T328 L331 V336 Y337 A343 K344 T345	F297-L341 HydrophobicContact CE2-CD1 4.29Å; F297-L341 HydrophobicContact CE2-CD2 4.03Å; P303-L341 HydrophobicContact CG-CD2 3.78Å; P303-L341 HydrophobicContact CG-CG 4.19Å; T328-L341 HydrophobicContact CG2-CB 3.64Å; L331-L341 HydrophobicContact CB-CD1 4.11Å; L331-L341 HydrophobicContact CD2-CD1 4.2Å; V336-L341 PolarHBondContact O-N 2.89Å; Y337-L341 HydrophobicContact CD2-CB 4.28Å; Y337-L341 HydrophobicContact CD2-CD1 4.05Å; Y337-L341 PolarHBondContact O-N 3.31Å; L341-A343 VanDerWaalsContact C-N 3.29Å; L341-A343 PolarHBondContact O-N 2.86Å; L341-K344 PolarHBondContact O-N 3.25Å; L341-T345 PolarHBondContact O-N 2.68Å; L341-T345 VanDerWaalsContact O-N 3.07Å; L341-T345 PolarHBondContact O-OG1 3.15Å
342	L	98.8	Very high	98	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63	-38.6	175.8	-61.1	-172.1	0	0	0	111.2	L321 S324 V325 T328 Y337 I338 K344 T345 A346	L321-L342 HydrophobicContact CD2-CB 3.71Å; S324-L342 WeakPolarHBondContact O-CD2 3.4Å; V325-L342 HydrophobicContact CG2-CD1 3.8Å; V325-L342 HydrophobicContact CG2-CD2 4.29Å; T328-L342 HydrophobicContact CG2-CD2 3.98Å; Y337-L342 HydrophobicContact CD1-CD1 4.19Å; Y337-L342 HydrophobicContact CD1-CG 4.3Å; Y337-L342 HydrophobicContact CE1-CD1 3.79Å; Y337-L342 HydrophobicContact CE1-CD2 4.14Å; Y337-L342 HydrophobicContact CE1-CG 4Å; Y337-L342 HydrophobicContact CE2-CD2 4.03Å; Y337-L342 HydrophobicContact CE2-CG 4.32Å; Y337-L342 WeakPolarHBondContact O-CG 3.23Å; Y337-L342 PolarHBondContact O-N 3.25Å; I338-L342 HydrophobicContact CD1-CD1 3.69Å; L342-K344 VanDerWaalsContact C-N 3.31Å; L342-K344 PolarHBondContact O-N 2.92Å; L342-T345 PolarHBondContact O-N 2.98Å; L342-A346 WeakPolarHBondContact O-CB 3.32Å; L342-A346 PolarHBondContact O-N 3.4Å
343	A	98.7	Very high	97.8	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-60.6	-41.4	177.3	0	0	0	0	0	112.2	F272 I338 T339 G340 L341 N347 V348	F272-A343 HydrophobicContact CD2-CB 4.23Å; F272-A343 HydrophobicContact CE2-CB 3.82Å; I338-A343 PolarHBondContact O-N 3.12Å; T339-A343 WeakPolarHBondContact O-CB 3.33Å; G340-A343 PolarHBondContact O-N 3.47Å; L341-A343 VanDerWaalsContact C-N 3.29Å; L341-A343 PolarHBondContact O-N 2.86Å; A343-N347 WeakPolarHBondContact O-CA 3.12Å; A343-N347 PolarHBondContact O-N 3.08Å; A343-V348 HydrophobicContact CB-CB 4.2Å; A343-V348 PolarHBondContact O-N 3.07Å
344	K	98.3	Very high	97.6	Very high	154 Å²	154	38.3 Å²	38.3	67%	0.67	19%	0.191	S	C	*	.	H	α-helix	trans	-63	-49.7	175.3	-177	179.4	177.6	-177.7	0	111	G340 L341 L342 A346 N347	G340-K344 WeakPolarHBondContact O-CB 3.37Å; G340-K344 PolarHBondContact O-N 3.38Å; L341-K344 PolarHBondContact O-N 3.25Å; L342-K344 VanDerWaalsContact C-N 3.31Å; L342-K344 PolarHBondContact O-N 2.92Å; K344-A346 PolarHBondContact O-N 3.06Å; K344-N347 PolarHBondContact O-N 3.31Å
345	T	98.5	Very high	97.2	Very high	67 Å²	67	40.9 Å²	40.9	41%	0.411	21%	0.209	S	C	.	.	H	α-helix	trans	-61.1	-42.8	177.9	-54.7	0	0	0	0	111.9	L327 T328 L341 L342 N347	L327-T345 HydrophobicContact CB-CG2 4.19Å; L327-T345 HydrophobicContact CD1-CG2 4.5Å; T328-T345 WeakPolarHBondContact OG1-CB 3.45Å; T328-T345 PolarHBondContact OG1-OG1 3.36Å; L341-T345 PolarHBondContact O-N 2.68Å; L341-T345 VanDerWaalsContact O-N 3.07Å; L341-T345 PolarHBondContact O-OG1 3.15Å; L342-T345 PolarHBondContact O-N 2.98Å; T345-N347 VanDerWaalsContact C-N 3.29Å; T345-N347 PolarHBondContact O-N 3.31Å
346	A	98.4	Very high	96.9	Very high	10 Å²	10	40.1 Å²	40.1	8%	0.083	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-3.8	-178.1	0	0	0	0	0	114.6	P320 L321 S324 L342 K344 V348	P320-A346 HydrophobicContact CB-CB 3.97Å; P320-A346 WeakPolarHBondContact O-CB 3.36Å; L321-A346 HydrophobicContact CD2-CB 4.28Å; S324-A346 WeakPolarHBondContact OG-CA 3.49Å; S324-A346 WeakPolarHBondContact OG-CB 3.47Å; S324-A346 PolarHBondContact OG-N 3.11Å; L342-A346 WeakPolarHBondContact O-CB 3.32Å; L342-A346 PolarHBondContact O-N 3.4Å; K344-A346 PolarHBondContact O-N 3.06Å; A346-V348 VanDerWaalsContact C-N 3.29Å; A346-V348 HydrophobicContact CB-CG2 3.69Å; A346-V348 PolarHBondContact O-N 3.27Å
347	N	97.7	Very high	96.5	Very high	126 Å²	126	40.7 Å²	40.7	67%	0.674	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	46.9	-170.8	-168.7	24.3	0	0	0	112.6	A343 K344 T345	A343-N347 WeakPolarHBondContact O-CA 3.12Å; A343-N347 PolarHBondContact O-N 3.08Å; K344-N347 PolarHBondContact O-N 3.31Å; T345-N347 VanDerWaalsContact C-N 3.29Å; T345-N347 PolarHBondContact O-N 3.31Å
348	V	98.3	Very high	95.8	Very high	8 Å²	8	43.7 Å²	43.7	5%	0.048	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-92.8	128	175.6	177	0	0	0	0	108.8	K270 F272 A317 L321 A343 A346	K270-V348 HydrophobicContact CB-CG2 4.25Å; F272-V348 HydrophobicContact CD2-CG1 3.54Å; F272-V348 HydrophobicContact CE2-CB 4.39Å; F272-V348 HydrophobicContact CE2-CG1 3.69Å; F272-V348 HydrophobicContact CG-CG1 4.48Å; A317-V348 HydrophobicContact CB-CG1 4.02Å; A317-V348 HydrophobicContact CB-CG2 4.1Å; L321-V348 HydrophobicContact CD2-CG2 4.22Å; L321-V348 HydrophobicContact CG-CG2 4.25Å; A343-V348 HydrophobicContact CB-CB 4.2Å; A343-V348 PolarHBondContact O-N 3.07Å; A346-V348 VanDerWaalsContact C-N 3.29Å; A346-V348 HydrophobicContact CB-CG2 3.69Å; A346-V348 PolarHBondContact O-N 3.27Å
349	K	97.3	Very high	94.6	Very high	131 Å²	131	50.9 Å²	50.9	57%	0.57	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	152	-175	-60.5	-174.4	179.6	-176.8	0	112.1	K270 A271 F272	K270-K349 PolarHBondContact O-N 2.93Å; A271-K349 CarbonylContact C-O 3.51Å; A271-K349 WeakPolarHBondContact CA-O 3.38Å; A271-K349 HydrophobicContact CB-CB 4.33Å; F272-K349 PolarHBondContact N-O 2.94Å
350	H	97.7	Very high	93.2	Very high	46 Å²	46	54.4 Å²	54.4	21%	0.213	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	122.9	165.1	-57	83.7	0	0	0	110.1	V276 T304 T339	V276-H350 HydrophobicContact CG2-CB 4.04Å; T304-H350 HydrophobicContact CG2-CB 4.42Å; T304-H350 PolarHBondContact O-CE1 2.79Å; T304-H350 PolarHBondContact O-NE2 3.4Å; T339-H350 PolarHBondContact O-CE1 3.03Å; T339-H350 PolarHBondContact O-NE2 3.21Å
351	I	95.6	Very high	91.5	Very high	42 Å²	42	56.5 Å²	56.5	22%	0.215	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	113.5	170.8	-61	172.7	0	0	0	107.4	P269 A271 F272 Y273 C274 I353	P269-I351 HydrophobicContact CG-CD1 4.42Å; A271-I351 HydrophobicContact CB-CD1 3.7Å; A271-I351 HydrophobicContact CB-CG1 4.16Å; F272-I351 PolarHBondContact O-N 3.32Å; Y273-I351 WeakPolarHBondContact CA-O 3.37Å; Y273-I351 HydrophobicContact CD1-CB 3.55Å; Y273-I351 HydrophobicContact CD1-CD1 4.03Å; Y273-I351 HydrophobicContact CD1-CG1 4.35Å; Y273-I351 HydrophobicContact CD1-CG2 3.62Å; Y273-I351 HydrophobicContact CE1-CB 3.78Å; Y273-I351 HydrophobicContact CE1-CD1 3.32Å; Y273-I351 HydrophobicContact CE1-CG1 4.11Å; Y273-I351 HydrophobicContact CE1-CG2 3.75Å; Y273-I351 HydrophobicContact CG-CB 4.44Å; C274-I351 PolarHBondContact N-O 2.82Å; I351-I353 PolarHBondContact O-N 2.83Å
352	E	95.3	Very high	89.9	Confident	102 Å²	102	59.1 Å²	59.1	48%	0.477	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	126.3	-173.8	-163.3	176	115	0	0	111.4	V276 R278 N354	V276-E352 HydrophobicContact CB-CG 4.09Å; V276-E352 HydrophobicContact CG2-CB 4.02Å; V276-E352 HydrophobicContact CG2-CG 3.99Å; R278-E352 IonicContact CZ-OE2 3.44Å; R278-E352 IonicContact NE-OE2 3.54Å; R278-E352 IonicContact NH2-OE2 2.74Å; R278-E352 PolarHBondContact NH2-OE2 3.37Å; R278-E352 VanDerWaalsContact NH2-OE2 3.08Å; E352-N354 HydrophobicContact CG-CB 4.28Å; E352-N354 WeakPolarHBondContact CG-OD1 3.48Å
353	I	93.5	Very high	87.9	Confident	11 Å²	11	65.8 Å²	65.8	6%	0.056	33%	0.331	C	S	.	.			trans	-132	36.1	172.7	55.5	162	0	0	0	110.8	F258 C274 I351 S355 M356 Y357	F258-I353 HydrophobicContact CE2-CG2 3.78Å; F258-I353 HydrophobicContact CZ-CG2 3.85Å; C274-I353 VanDerWaalsContact N-CG1 3.35Å; C274-I353 WeakPolarHBondContact O-CG1 3.48Å; C274-I353 PolarHBondContact O-N 2.83Å; I351-I353 PolarHBondContact O-N 2.83Å; I353-S355 PolarHBondContact O-N 3.09Å; I353-S355 VanDerWaalsContact O-N 3.08Å; I353-M356 HydrophobicContact CB-CG 4.33Å; I353-M356 HydrophobicContact CB-SD 3.86Å; I353-M356 HydrophobicContact CD1-SD 4.1Å; I353-M356 HydrophobicContact CG2-SD 4.11Å; I353-M356 WeakPolarHBondContact O-CB 3.49Å; I353-M356 PolarHBondContact O-N 2.98Å; I353-Y357 HydrophobicContact CD1-CE2 3.98Å; I353-Y357 HydrophobicContact CG1-CE2 3.99Å; I353-Y357 WeakPolarHBondContact O-CD2 3.42Å
354	N	93.3	Very high	85.7	Confident	39 Å²	39	68.7 Å²	68.7	21%	0.209	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-53.1	-33.4	-176.7	-69.9	29.1	0	0	0	112.7	F275 V276 E352 M356 Y357	F275-N354 WeakPolarHBondContact CA-OD1 3.47Å; F275-N354 HydrophobicContact CD2-CB 3.79Å; F275-N354 HydrophobicContact CE2-CB 4.02Å; F275-N354 HydrophobicContact CG-CB 4.45Å; V276-N354 PolarHBondContact N-OD1 3.36Å; V276-N354 PolarHBondContact O-ND2 2.68Å; E352-N354 HydrophobicContact CG-CB 4.28Å; E352-N354 WeakPolarHBondContact CG-OD1 3.48Å; N354-M356 PolarHBondContact O-N 2.91Å; N354-M356 VanDerWaalsContact O-N 3.12Å; N354-Y357 PolarHBondContact O-N 3.07Å; N354-Y357 VanDerWaalsContact O-N 3.08Å
355	S	90.2	Very high	83.5	Confident	69 Å²	69	66.5 Å²	66.5	48%	0.483	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-62.2	-16.1	177.4	58.6	0	0	0	0	114.6	I353	I353-S355 PolarHBondContact O-N 3.09Å; I353-S355 VanDerWaalsContact O-N 3.08Å
356	M	90.6	Very high	81.2	Confident	14 Å²	14	72.9 Å²	72.9	7%	0.069	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-91.6	-0.9	177.9	-60.3	176.9	66.8	0	0	113.2	F258 I353 N354 V374 F375	F258-M356 HydrophobicContact CB-CE 4.01Å; F258-M356 HydrophobicContact CD2-CE 4.32Å; F258-M356 HydrophobicContact CD2-SD 4.06Å; F258-M356 HydrophobicContact CE2-SD 4.44Å; F258-M356 HydrophobicContact CG-CE 4.16Å; F258-M356 HydrophobicContact CG-SD 4.44Å; I353-M356 HydrophobicContact CB-CG 4.33Å; I353-M356 HydrophobicContact CB-SD 3.86Å; I353-M356 HydrophobicContact CD1-SD 4.1Å; I353-M356 HydrophobicContact CG2-SD 4.11Å; I353-M356 WeakPolarHBondContact O-CB 3.49Å; I353-M356 PolarHBondContact O-N 2.98Å; N354-M356 PolarHBondContact O-N 2.91Å; N354-M356 VanDerWaalsContact O-N 3.12Å; M356-V374 HydrophobicContact CB-CB 4.23Å; M356-V374 HydrophobicContact CB-CG2 4.41Å; M356-V374 HydrophobicContact CE-CB 3.94Å; M356-V374 HydrophobicContact CE-CG2 3.22Å; M356-V374 PolarHBondContact O-N 3.23Å; M356-F375 PolarHBondContact O-N 3.29Å
357	Y	90.9	Very high	79.1	Confident	14 Å²	14	75.5 Å²	75.5	6%	0.055	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	138.8	-176.7	-74.1	-110.5	0	0	0	111.8	C274 F275 S310 I353 N354 F375	C274-Y357 WeakPolarHBondContact CA-OH 3.37Å; F275-Y357 HydrophobicContact CB-CD1 3.76Å; F275-Y357 HydrophobicContact CB-CD2 3.83Å; F275-Y357 HydrophobicContact CB-CE1 3.92Å; F275-Y357 HydrophobicContact CB-CE2 4.02Å; F275-Y357 HydrophobicContact CB-CG 3.71Å; F275-Y357 HydrophobicContact CD2-CG 4.25Å; F275-Y357 HydrophobicContact CG-CG 4.46Å; F275-Y357 VanDerWaalsContact N-CZ 3.35Å; S310-Y357 PolarHBondContact O-OH 3.12Å; S310-Y357 WeakPolarHBondContact OG-CE1 3.4Å; S310-Y357 PolarHBondContact OG-OH 3.39Å; I353-Y357 HydrophobicContact CD1-CE2 3.98Å; I353-Y357 HydrophobicContact CG1-CE2 3.99Å; I353-Y357 WeakPolarHBondContact O-CD2 3.42Å; N354-Y357 PolarHBondContact O-N 3.07Å; N354-Y357 VanDerWaalsContact O-N 3.08Å; Y357-F375 HydrophobicContact CD1-CB 3.79Å; Y357-F375 HydrophobicContact CD1-CD2 4.09Å; Y357-F375 HydrophobicContact CD1-CG 4.25Å; Y357-F375 AromaticContact CD2-CD2 3.86Å; Y357-F375 HydrophobicContact CD2-CD2 3.86Å; Y357-F375 HydrophobicContact CE1-CB 4.01Å; Y357-F375 AromaticContact CE1-CD2 3.75Å; Y357-F375 HydrophobicContact CE1-CD2 3.75Å; Y357-F375 HydrophobicContact CE1-CE2 4.47Å; Y357-F375 HydrophobicContact CE1-CG 4.01Å; Y357-F375 AromaticContact CE2-CD2 3.45Å; Y357-F375 HydrophobicContact CE2-CD2 3.45Å; Y357-F375 VanDerWaalsContact CE2-CD2 3.45Å; Y357-F375 AromaticContact CE2-CE2 3.83Å; Y357-F375 HydrophobicContact CE2-CE2 3.83Å; Y357-F375 HydrophobicContact CE2-CG 4.46Å; Y357-F375 HydrophobicContact CG-CB 4.17Å; Y357-F375 HydrophobicContact CG-CD2 4.14Å; Y357-F375 AromaticContact CZ-CD2 3.4Å; Y357-F375 AromaticContact CZ-CE2 3.76Å
358	Y	84.5	Confident	76.8	Confident	63 Å²	63	70.1 Å²	70.1	25%	0.247	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.2	174	-86.3	-113.6	0	0	0	111.2	I373 F375	Y358-I373 HydrophobicContact CD1-CD1 3.85Å; Y358-I373 HydrophobicContact CD2-CB 4.18Å; Y358-I373 HydrophobicContact CD2-CD1 3.43Å; Y358-I373 VanDerWaalsContact CD2-CD1 3.43Å; Y358-I373 HydrophobicContact CD2-CG1 3.54Å; Y358-I373 HydrophobicContact CD2-CG2 3.69Å; Y358-I373 HydrophobicContact CE1-CD1 3.72Å; Y358-I373 HydrophobicContact CE2-CB 4.44Å; Y358-I373 HydrophobicContact CE2-CD1 3.33Å; Y358-I373 HydrophobicContact CE2-CG1 3.38Å; Y358-I373 HydrophobicContact CE2-CG2 4.43Å; Y358-I373 HydrophobicContact CG-CD1 3.72Å; Y358-I373 HydrophobicContact CG-CG1 4.3Å; Y358-I373 HydrophobicContact CG-CG2 4.11Å; Y358-I373 VanDerWaalsContact CZ-CD1 3.46Å; Y358-F375 PolarHBondContact N-O 3.38Å
359	E	71.9	Confident	74.6	Confident	150 Å²	150	71.8 Å²	71.8	70%	0.701	37%	0.367	S	S	*	.	S	Bend	trans	-68.8	-37.2	-178.6	-67.5	-170.4	161.3	0	0	113
360	S	69.4	Low	72.7	Confident	75 Å²	75	71.7 Å²	71.7	52%	0.524	37%	0.373	S	S	.	.	S	Bend	trans	-151.4	154.8	177.9	61.3	0	0	0	0	109.9	D362	S360-D362 PolarHBondContact O-N 3.32Å
361	Y	64.3	Low	70.8	Confident	45 Å²	45	72.7 Å²	72.7	18%	0.176	38%	0.38	C	S	.	.			trans	-76.3	116.3	169.1	-178.9	-119.8	0	0	0	109	E363 F368 L388 K391	Y361-E363 HydrophobicContact CD1-CG 3.97Å; Y361-E363 HydrophobicContact CE1-CB 4.35Å; Y361-E363 HydrophobicContact CE1-CG 3.26Å; Y361-F368 AromaticContact CD2-CD2 3.87Å; Y361-F368 HydrophobicContact CD2-CD2 3.87Å; Y361-F368 AromaticContact CD2-CE2 3.79Å; Y361-F368 HydrophobicContact CD2-CE2 3.79Å; Y361-F368 AromaticContact CE2-CD2 3.79Å; Y361-F368 HydrophobicContact CE2-CD2 3.79Å; Y361-F368 AromaticContact CE2-CE2 3.99Å; Y361-F368 HydrophobicContact CE2-CE2 3.99Å; Y361-F368 HydrophobicContact CE2-CG 4.32Å; Y361-L388 HydrophobicContact CD1-CD1 4.43Å; Y361-L388 HydrophobicContact CD2-CD1 3.54Å; Y361-L388 HydrophobicContact CD2-CD2 4.09Å; Y361-L388 HydrophobicContact CD2-CG 4.45Å; Y361-L388 HydrophobicContact CE1-CD1 4.23Å; Y361-L388 HydrophobicContact CE2-CD1 3.32Å; Y361-L388 HydrophobicContact CG-CD1 4.12Å; Y361-L388 HydrophobicContact CG-CD2 4.19Å; Y361-K391 VanDerWaalsContact OH-CD 3.29Å; Y361-K391 WeakPolarHBondContact OH-CD 3.37Å; Y361-K391 PolarHBondContact OH-NZ 2.71Å
362	D	64.1	Low	69.3	Low	75 Å²	75	72.3 Å²	72.3	40%	0.401	38%	0.38	S	S	.	.			trans	-102.9	111.3	169.9	-176.4	-10.1	0	0	0	108.5	S360 G364 K365	S360-D362 PolarHBondContact O-N 3.32Å; D362-G364 PolarHBondContact O-N 3.48Å; D362-G364 PolarHBondContact OD1-N 2.81Å; D362-K365 HydrophobicContact CB-CB 4.31Å; D362-K365 HydrophobicContact CB-CD 4.04Å; D362-K365 HydrophobicContact CB-CG 4.06Å; D362-K365 PolarHBondContact O-N 3.36Å; D362-K365 WeakPolarHBondContact OD2-CE 3.27Å; D362-K365 WeakPolarHBondContact OD2-CG 3.37Å
363	E	58.1	Low	68.2	Low	140 Å²	140	67.6 Å²	67.6	65%	0.654	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-28.5	178.9	-78.5	176.6	-167.3	0	0	112.6	Y361	Y361-E363 HydrophobicContact CD1-CG 3.97Å; Y361-E363 HydrophobicContact CE1-CB 4.35Å; Y361-E363 HydrophobicContact CE1-CG 3.26Å
364	G	51.9	Low	67.8	Low	61 Å²	61	67.1 Å²	67.1	63%	0.629	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-17.5	-178.8	0	0	0	0	0	114.2	D362 K366	D362-G364 PolarHBondContact O-N 3.48Å; D362-G364 PolarHBondContact OD1-N 2.81Å; G364-K366 PolarHBondContact O-N 2.88Å; G364-K366 VanDerWaalsContact O-N 3.08Å
365	K	52.7	Low	67.6	Low	108 Å²	108	65.4 Å²	65.4	47%	0.47	35%	0.346	S	S	.	.			trans	-79.8	95.3	176.7	-74.3	-178.7	-173.3	177.8	0	110.2	D362 T367 F368	D362-K365 HydrophobicContact CB-CB 4.31Å; D362-K365 HydrophobicContact CB-CD 4.04Å; D362-K365 HydrophobicContact CB-CG 4.06Å; D362-K365 PolarHBondContact O-N 3.36Å; D362-K365 WeakPolarHBondContact OD2-CE 3.27Å; D362-K365 WeakPolarHBondContact OD2-CG 3.37Å; K365-T367 PolarHBondContact O-N 3.31Å; K365-F368 PolarHBondContact O-N 3.07Å
366	K	48.9	Very low	67.5	Low	201 Å²	201	62.1 Å²	62.1	87%	0.874	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-52.7	-20.5	171.2	-73.2	-176.9	177.1	178.8	0	113.5	G364 F368	G364-K366 PolarHBondContact O-N 2.88Å; G364-K366 VanDerWaalsContact O-N 3.08Å; K366-F368 VanDerWaalsContact C-N 3.26Å; K366-F368 PolarHBondContact O-N 3.2Å
367	T	54.5	Low	67.2	Low	66 Å²	66	64.1 Å²	64.1	41%	0.405	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-80.3	8.9	-175.1	58.2	0	0	0	0	115.2	K365 L369 D370	K365-T367 PolarHBondContact O-N 3.31Å; T367-L369 PolarHBondContact O-N 2.76Å; T367-D370 PolarHBondContact O-N 3.18Å
368	F	49.9	Very low	66.9	Low	13 Å²	13	64.3 Å²	64.3	6%	0.057	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-52.9	-19.8	179.8	-172	-95.6	0	0	0	114.4	Y361 K365 K366 I373 V376 L388	Y361-F368 AromaticContact CD2-CD2 3.87Å; Y361-F368 HydrophobicContact CD2-CD2 3.87Å; Y361-F368 AromaticContact CD2-CE2 3.79Å; Y361-F368 HydrophobicContact CD2-CE2 3.79Å; Y361-F368 AromaticContact CE2-CD2 3.79Å; Y361-F368 HydrophobicContact CE2-CD2 3.79Å; Y361-F368 AromaticContact CE2-CE2 3.99Å; Y361-F368 HydrophobicContact CE2-CE2 3.99Å; Y361-F368 HydrophobicContact CE2-CG 4.32Å; K365-F368 PolarHBondContact O-N 3.07Å; K366-F368 VanDerWaalsContact C-N 3.26Å; K366-F368 PolarHBondContact O-N 3.2Å; F368-I373 HydrophobicContact CB-CD1 4.36Å; F368-I373 HydrophobicContact CD2-CB 4.46Å; F368-I373 HydrophobicContact CD2-CD1 3.6Å; F368-I373 HydrophobicContact CE2-CB 4.22Å; F368-I373 HydrophobicContact CE2-CD1 4.08Å; F368-I373 HydrophobicContact CE2-CG2 4.03Å; F368-I373 HydrophobicContact CG-CD1 4.16Å; F368-I373 HydrophobicContact CZ-CB 4.49Å; F368-I373 HydrophobicContact CZ-CG2 4.46Å; F368-V376 HydrophobicContact CE2-CG2 3.92Å; F368-V376 HydrophobicContact CZ-CG2 4.35Å; F368-L388 HydrophobicContact CE1-CD1 3.94Å; F368-L388 HydrophobicContact CE2-CD1 3.89Å; F368-L388 HydrophobicContact CE2-CD2 4.39Å; F368-L388 HydrophobicContact CZ-CD1 3.51Å; F368-L388 HydrophobicContact CZ-CD2 4.2Å; F368-L388 HydrophobicContact CZ-CG 4.13Å
369	L	51.3	Low	66.4	Low	43 Å²	43	63.5 Å²	63.5	23%	0.225	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-117.1	-18.2	-176.1	-69.8	174.3	0	0	0	116.9	T367 N371 L395 K399	T367-L369 PolarHBondContact O-N 2.76Å; L369-N371 VanDerWaalsContact C-N 3.3Å; L369-N371 CarbonylContact C-O 3.59Å; L369-L395 HydrophobicContact CD1-CB 3.66Å; L369-L395 HydrophobicContact CD1-CD1 3.41Å; L369-L395 VanDerWaalsContact CD1-CD1 3.41Å; L369-L395 HydrophobicContact CD1-CD2 3.19Å; L369-L395 HydrophobicContact CD1-CG 3.47Å; L369-L395 VanDerWaalsContact CD1-CG 3.47Å; L369-L395 HydrophobicContact CD2-CB 3.6Å; L369-L395 HydrophobicContact CD2-CD1 3.55Å; L369-L395 HydrophobicContact CD2-CG 4.02Å; L369-L395 HydrophobicContact CG-CB 4.15Å; L369-L395 HydrophobicContact CG-CD1 3.57Å; L369-L395 HydrophobicContact CG-CD2 4.31Å; L369-L395 HydrophobicContact CG-CG 4.11Å; L369-K399 PolarHBondContact O-NZ 2.04Å
370	D	58.4	Low	66.7	Low	128 Å²	128	67.8 Å²	67.8	68%	0.684	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-35	-177	-62	-32.2	0	0	0	109.5	T367	T367-D370 PolarHBondContact O-N 3.18Å
371	N	57.4	Low	67.4	Low	67 Å²	67	65.9 Å²	65.9	36%	0.358	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	131.4	157.6	-127.8	-21.6	0	0	0	107.6	L369 I373	L369-N371 VanDerWaalsContact C-N 3.3Å; L369-N371 CarbonylContact C-O 3.59Å; N371-I373 PolarHBondContact O-N 3.48Å
372	P	64.4	Low	68.5	Low	35 Å²	35	66.5 Å²	66.5	23%	0.227	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	82.7	172.9	30	-33.5	0	0	0	108.1	V374	P372-V374 WeakPolarHBondContact O-CG2 3.41Å; P372-V374 PolarHBondContact O-N 3.05Å; P372-V374 VanDerWaalsContact O-N 3.11Å
373	I	72.7	Confident	69.8	Low	3 Å²	3	69.2 Å²	69.2	2%	0.015	35%	0.354	C	S	.	.			trans	-59.8	120	168.2	-57.5	-174.8	0	0	0	105.6	N251 Y358 F368 N371 V376	N251-I373 VanDerWaalsContact CB-O 3.28Å; N251-I373 WeakPolarHBondContact CB-O 3.2Å; N251-I373 PolarHBondContact ND2-O 3.19Å; Y358-I373 HydrophobicContact CD1-CD1 3.85Å; Y358-I373 HydrophobicContact CD2-CB 4.18Å; Y358-I373 HydrophobicContact CD2-CD1 3.43Å; Y358-I373 VanDerWaalsContact CD2-CD1 3.43Å; Y358-I373 HydrophobicContact CD2-CG1 3.54Å; Y358-I373 HydrophobicContact CD2-CG2 3.69Å; Y358-I373 HydrophobicContact CE1-CD1 3.72Å; Y358-I373 HydrophobicContact CE2-CB 4.44Å; Y358-I373 HydrophobicContact CE2-CD1 3.33Å; Y358-I373 HydrophobicContact CE2-CG1 3.38Å; Y358-I373 HydrophobicContact CE2-CG2 4.43Å; Y358-I373 HydrophobicContact CG-CD1 3.72Å; Y358-I373 HydrophobicContact CG-CG1 4.3Å; Y358-I373 HydrophobicContact CG-CG2 4.11Å; Y358-I373 VanDerWaalsContact CZ-CD1 3.46Å; F368-I373 HydrophobicContact CB-CD1 4.36Å; F368-I373 HydrophobicContact CD2-CB 4.46Å; F368-I373 HydrophobicContact CD2-CD1 3.6Å; F368-I373 HydrophobicContact CE2-CB 4.22Å; F368-I373 HydrophobicContact CE2-CD1 4.08Å; F368-I373 HydrophobicContact CE2-CG2 4.03Å; F368-I373 HydrophobicContact CG-CD1 4.16Å; F368-I373 HydrophobicContact CZ-CB 4.49Å; F368-I373 HydrophobicContact CZ-CG2 4.46Å; N371-I373 PolarHBondContact O-N 3.48Å; I373-V376 HydrophobicContact CG2-CG2 3.47Å; I373-V376 VanDerWaalsContact CG2-CG2 3.47Å
374	V	83.4	Confident	71.2	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.347	C	S	.	.			trans	-104.2	-41.5	179.5	173.3	0	0	0	0	110.9	V250 N251 I255 M356 P372	V250-V374 CarbonylContact C-O 3.59Å; V250-V374 VanDerWaalsContact CA-O 3.26Å; V250-V374 WeakPolarHBondContact CA-O 3.41Å; V250-V374 HydrophobicContact CG1-CG1 4.31Å; N251-V374 PolarHBondContact N-O 2.87Å; I255-V374 HydrophobicContact CB-CG1 3.66Å; I255-V374 HydrophobicContact CD1-CG1 4.2Å; I255-V374 HydrophobicContact CG1-CG1 4.25Å; M356-V374 HydrophobicContact CB-CB 4.23Å; M356-V374 HydrophobicContact CB-CG2 4.41Å; M356-V374 HydrophobicContact CE-CB 3.94Å; M356-V374 HydrophobicContact CE-CG2 3.22Å; M356-V374 PolarHBondContact O-N 3.23Å; P372-V374 WeakPolarHBondContact O-CG2 3.41Å; P372-V374 PolarHBondContact O-N 3.05Å; P372-V374 VanDerWaalsContact O-N 3.11Å
375	F	89.7	Confident	73	Confident	3 Å²	3	65.8 Å²	65.8	1%	0.013	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.8	-173.7	-56.4	-71.9	0	0	0	111	L242 V248 H249 V250 I255 S310 M356 Y357 Y358	L242-F375 HydrophobicContact CD1-CE1 3.92Å; L242-F375 HydrophobicContact CD1-CZ 3.78Å; V248-F375 HydrophobicContact CG1-CB 4.24Å; V248-F375 HydrophobicContact CG1-CD1 4.15Å; H249-F375 WeakPolarHBondContact O-CA 3.02Å; V250-F375 HydrophobicContact CG1-CD1 4.49Å; V250-F375 HydrophobicContact CG1-CE1 4.07Å; V250-F375 HydrophobicContact CG2-CD1 4.16Å; V250-F375 HydrophobicContact CG2-CE1 4.16Å; I255-F375 HydrophobicContact CD1-CE2 4.29Å; I255-F375 HydrophobicContact CD1-CZ 3.99Å; I255-F375 HydrophobicContact CG1-CZ 4.31Å; S310-F375 WeakPolarHBondContact OG-CD1 3.49Å; S310-F375 WeakPolarHBondContact OG-CE1 3.09Å; S310-F375 WeakPolarHBondContact OG-CG 3.38Å; M356-F375 PolarHBondContact O-N 3.29Å; Y357-F375 HydrophobicContact CD1-CB 3.79Å; Y357-F375 HydrophobicContact CD1-CD2 4.09Å; Y357-F375 HydrophobicContact CD1-CG 4.25Å; Y357-F375 AromaticContact CD2-CD2 3.86Å; Y357-F375 HydrophobicContact CD2-CD2 3.86Å; Y357-F375 HydrophobicContact CE1-CB 4.01Å; Y357-F375 AromaticContact CE1-CD2 3.75Å; Y357-F375 HydrophobicContact CE1-CD2 3.75Å; Y357-F375 HydrophobicContact CE1-CE2 4.47Å; Y357-F375 HydrophobicContact CE1-CG 4.01Å; Y357-F375 AromaticContact CE2-CD2 3.45Å; Y357-F375 HydrophobicContact CE2-CD2 3.45Å; Y357-F375 VanDerWaalsContact CE2-CD2 3.45Å; Y357-F375 AromaticContact CE2-CE2 3.83Å; Y357-F375 HydrophobicContact CE2-CE2 3.83Å; Y357-F375 HydrophobicContact CE2-CG 4.46Å; Y357-F375 HydrophobicContact CG-CB 4.17Å; Y357-F375 HydrophobicContact CG-CD2 4.14Å; Y357-F375 AromaticContact CZ-CD2 3.4Å; Y357-F375 AromaticContact CZ-CE2 3.76Å; Y358-F375 PolarHBondContact N-O 3.38Å
376	V	88.4	Confident	74.8	Confident	0 Å²	0	66 Å²	66	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	126.2	176	-168.8	0	0	0	0	109.6	V248 H249 F368 I373 L378 L388	V248-V376 WeakPolarHBondContact CA-O 3.15Å; H249-V376 HydrophobicContact CB-CB 4.25Å; H249-V376 PolarHBondContact N-O 2.7Å; H249-V376 PolarHBondContact O-N 2.75Å; H249-V376 VanDerWaalsContact O-N 3.1Å; F368-V376 HydrophobicContact CE2-CG2 3.92Å; F368-V376 HydrophobicContact CZ-CG2 4.35Å; I373-V376 HydrophobicContact CG2-CG2 3.47Å; I373-V376 VanDerWaalsContact CG2-CG2 3.47Å; V376-L378 HydrophobicContact CG1-CG 4.28Å; V376-L388 HydrophobicContact CB-CD2 4.28Å; V376-L388 HydrophobicContact CG1-CD2 4.45Å; V376-L388 HydrophobicContact CG2-CD2 4.31Å
377	H	85.2	Confident	76.8	Confident	56 Å²	56	59.2 Å²	59.2	26%	0.259	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	125.9	177.5	-172.6	-125.7	0	0	0	111.1	D247	D247-H377 VanDerWaalsContact CG-NE2 3.28Å; D247-H377 IonicContact OD1-CD2 3.54Å; D247-H377 PolarHBondContact OD1-CD2 3.4Å; D247-H377 IonicContact OD1-NE2 2.76Å; D247-H377 PolarHBondContact OD1-NE2 2.66Å; D247-H377 IonicContact OD2-CD2 2.67Å; D247-H377 IonicContact OD2-CE1 3.42Å; D247-H377 IonicContact OD2-NE2 3.41Å; D247-H377 PolarHBondContact OD2-NE2 3.05Å
378	L	83	Confident	78.4	Confident	18 Å²	18	56.1 Å²	56.1	9%	0.094	28%	0.281	C	S	.	.			trans	-141.7	71.3	-176.9	-71.6	178.6	0	0	0	111.9	D247 H249 V376 R380 Q385 L388	D247-L378 CarbonylContact O-C 3.47Å; D247-L378 PolarHBondContact O-N 3.42Å; H249-L378 HydrophobicContact CB-CD1 4.3Å; V376-L378 HydrophobicContact CG1-CG 4.28Å; L378-R380 PolarHBondContact O-N 2.79Å; L378-Q385 HydrophobicContact CB-CG 3.76Å; L378-Q385 HydrophobicContact CD1-CG 4.06Å; L378-Q385 PolarHBondContact O-NE2 3.3Å; L378-L388 HydrophobicContact CD1-CB 4.43Å; L378-L388 HydrophobicContact CD1-CD2 3.64Å
379	P	74.2	Confident	80.4	Confident	47 Å²	47	56 Å²	56	31%	0.305	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-30.8	-169.4	23	-32.1	0	0	0	115.5	R160	R160-P379 PolarHBondContact NH2-O 3.24Å
380	R	79.7	Confident	82.3	Confident	239 Å²	239	58.5 Å²	58.5	90%	0.902	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-7.4	-159.3	-67.2	-177.6	-175.2	167.5	1.4	116.5	L378	L378-R380 PolarHBondContact O-N 2.79Å
381	S	82	Confident	83.7	Confident	36 Å²	36	55.4 Å²	55.4	25%	0.252	27%	0.269	S	S	.	.			trans	-151.1	110.8	-173.6	-178.4	0	0	0	0	113.8	N383 K384 Q385	S381-N383 PolarHBondContact O-N 3Å; S381-N383 PolarHBondContact OG-N 2.9Å; S381-K384 PolarHBondContact O-N 2.79Å; S381-K384 PolarHBondContact OG-N 3.47Å; S381-K384 VanDerWaalsContact OG-N 3.13Å; S381-Q385 PolarHBondContact O-N 2.79Å
382	L	88.8	Confident	85.1	Confident	57 Å²	57	52.4 Å²	52.4	30%	0.298	25%	0.253	S	S	.	.	H	α-helix	trans	-57.9	-37.2	169.6	-64.1	176.7	0	0	0	111.3	K159 R160 L163 Q385 Y386	K159-L382 HydrophobicContact CB-CD1 3.68Å; K159-L382 HydrophobicContact CD-CD1 4.43Å; R160-L382 HydrophobicContact CB-CD2 4.49Å; R160-L382 HydrophobicContact CG-CD2 3.8Å; L163-L382 HydrophobicContact CB-CD2 4.45Å; L163-L382 HydrophobicContact CD2-CB 4.02Å; L163-L382 HydrophobicContact CD2-CD2 3.65Å; L163-L382 HydrophobicContact CD2-CG 4.44Å; L382-Q385 PolarHBondContact O-N 2.99Å; L382-Y386 WeakPolarHBondContact O-CB 3.5Å; L382-Y386 PolarHBondContact O-N 3.44Å
383	N	91	Very high	86.3	Confident	132 Å²	132	52.5 Å²	52.5	71%	0.706	25%	0.252	S	S	*	.	H	α-helix	trans	-63.7	-42.9	177.5	-67.6	-9.2	0	0	0	111.3	S381 Y386 A387	S381-N383 PolarHBondContact O-N 3Å; S381-N383 PolarHBondContact OG-N 2.9Å; N383-Y386 PolarHBondContact O-N 2.74Å; N383-A387 VanDerWaalsContact O-CB 3.28Å; N383-A387 WeakPolarHBondContact O-CB 3.42Å; N383-A387 PolarHBondContact O-N 2.65Å
384	K	88.2	Confident	87	Confident	120 Å²	120	58.2 Å²	58.2	52%	0.522	28%	0.279	S	S	.	.	H	α-helix	trans	-65.2	-41.1	174.7	-69.6	-172.7	176.1	-168.7	0	111.9	S381 Y386 A387 L388	S381-K384 PolarHBondContact O-N 2.79Å; S381-K384 PolarHBondContact OG-N 3.47Å; S381-K384 VanDerWaalsContact OG-N 3.13Å; K384-Y386 VanDerWaalsContact C-N 3.34Å; K384-Y386 PolarHBondContact O-N 3.12Å; K384-A387 PolarHBondContact O-N 2.9Å; K384-L388 VanDerWaalsContact O-CB 3.31Å; K384-L388 WeakPolarHBondContact O-CB 3.36Å; K384-L388 PolarHBondContact O-N 3.16Å
385	Q	88.5	Confident	86.9	Confident	9 Å²	9	60 Å²	60	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-61.2	-43.4	175.2	-71.4	-176.7	25.1	0	0	111.8	L163 L378 S381 L382 W389	L163-Q385 HydrophobicContact CD2-CB 3.72Å; L378-Q385 HydrophobicContact CB-CG 3.76Å; L378-Q385 HydrophobicContact CD1-CG 4.06Å; L378-Q385 PolarHBondContact O-NE2 3.3Å; S381-Q385 PolarHBondContact O-N 2.79Å; L382-Q385 PolarHBondContact O-N 2.99Å; Q385-W389 PolarHBondContact O-N 3.35Å
386	Y	92.1	Very high	86.6	Confident	112 Å²	112	60 Å²	60	44%	0.439	29%	0.288	S	S	.	.	H	α-helix	trans	-66.6	-45	176.7	-173.6	-106.3	0	0	0	112.3	L163 T167 L382 N383 K384 L388 W389 K390	L163-Y386 HydrophobicContact CD1-CD2 3.78Å; L163-Y386 HydrophobicContact CD1-CG 4.31Å; T167-Y386 HydrophobicContact CG2-CD2 3.9Å; T167-Y386 HydrophobicContact CG2-CE2 4.43Å; L382-Y386 WeakPolarHBondContact O-CB 3.5Å; L382-Y386 PolarHBondContact O-N 3.44Å; N383-Y386 PolarHBondContact O-N 2.74Å; K384-Y386 VanDerWaalsContact C-N 3.34Å; K384-Y386 PolarHBondContact O-N 3.12Å; Y386-L388 VanDerWaalsContact C-N 3.33Å; Y386-L388 PolarHBondContact O-N 3.25Å; Y386-W389 WeakPolarHBondContact O-CB 3.44Å; Y386-W389 PolarHBondContact O-N 3.47Å; Y386-W389 VanDerWaalsContact O-N 3.15Å; Y386-K390 HydrophobicContact CD1-CG 4.2Å; Y386-K390 HydrophobicContact CE1-CD 4.13Å; Y386-K390 HydrophobicContact CE1-CG 3.82Å; Y386-K390 WeakPolarHBondContact O-CG 3.25Å; Y386-K390 PolarHBondContact O-N 3.48Å
387	A	89.4	Confident	86.4	Confident	59 Å²	59	67.7 Å²	67.7	49%	0.488	32%	0.322	S	S	.	.	H	α-helix	trans	-60.2	-43.5	176.5	0	0	0	0	0	111.4	N383 K384 W389 K390 K391	N383-A387 VanDerWaalsContact O-CB 3.28Å; N383-A387 WeakPolarHBondContact O-CB 3.42Å; N383-A387 PolarHBondContact O-N 2.65Å; K384-A387 PolarHBondContact O-N 2.9Å; A387-W389 VanDerWaalsContact C-N 3.32Å; A387-W389 PolarHBondContact O-N 3.47Å; A387-K390 PolarHBondContact O-N 2.74Å; A387-K391 PolarHBondContact O-N 3.11Å
388	L	88.1	Confident	86.2	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-62.3	-40.6	175	-173.1	55.9	0	0	0	111.5	H249 Y361 F368 V376 L378 K384 Y386 K391 T392	H249-L388 HydrophobicContact CB-CD2 3.95Å; Y361-L388 HydrophobicContact CD1-CD1 4.43Å; Y361-L388 HydrophobicContact CD2-CD1 3.54Å; Y361-L388 HydrophobicContact CD2-CD2 4.09Å; Y361-L388 HydrophobicContact CD2-CG 4.45Å; Y361-L388 HydrophobicContact CE1-CD1 4.23Å; Y361-L388 HydrophobicContact CE2-CD1 3.32Å; Y361-L388 HydrophobicContact CG-CD1 4.12Å; Y361-L388 HydrophobicContact CG-CD2 4.19Å; F368-L388 HydrophobicContact CE1-CD1 3.94Å; F368-L388 HydrophobicContact CE2-CD1 3.89Å; F368-L388 HydrophobicContact CE2-CD2 4.39Å; F368-L388 HydrophobicContact CZ-CD1 3.51Å; F368-L388 HydrophobicContact CZ-CD2 4.2Å; F368-L388 HydrophobicContact CZ-CG 4.13Å; V376-L388 HydrophobicContact CB-CD2 4.28Å; V376-L388 HydrophobicContact CG1-CD2 4.45Å; V376-L388 HydrophobicContact CG2-CD2 4.31Å; L378-L388 HydrophobicContact CD1-CB 4.43Å; L378-L388 HydrophobicContact CD1-CD2 3.64Å; K384-L388 VanDerWaalsContact O-CB 3.31Å; K384-L388 WeakPolarHBondContact O-CB 3.36Å; K384-L388 PolarHBondContact O-N 3.16Å; Y386-L388 VanDerWaalsContact C-N 3.33Å; Y386-L388 PolarHBondContact O-N 3.25Å; L388-K391 WeakPolarHBondContact O-CB 3.34Å; L388-K391 PolarHBondContact O-N 3.22Å; L388-T392 PolarHBondContact O-N 3.23Å; L388-T392 PolarHBondContact O-OG1 2.74Å; L388-T392 VanDerWaalsContact O-OG1 3.1Å
389	W	91.5	Very high	86	Confident	10 Å²	10	75.2 Å²	75.2	4%	0.038	36%	0.363	C	S	.	.	H	α-helix	trans	-61.9	-43.5	173.8	179.3	-110.4	0	0	0	113.3	T167 W168 F173 H249 F253 Q385 Y386 A387 K391 T392 L393	T167-W389 VanDerWaalsContact C-CE2 3.46Å; T167-W389 HydrophobicContact CG2-CB 3.9Å; T167-W389 VanDerWaalsContact CG2-CD1 3.48Å; T167-W389 HydrophobicContact CG2-CD2 4.44Å; T167-W389 HydrophobicContact CG2-CG 3.65Å; T167-W389 VanDerWaalsContact O-CZ2 3.24Å; T167-W389 WeakPolarHBondContact O-CZ2 3.34Å; W168-W389 HydrophobicContact CB-CE3 3.94Å; W168-W389 HydrophobicContact CB-CH2 4.2Å; W168-W389 HydrophobicContact CB-CZ3 3.65Å; F173-W389 AromaticContact CE2-CH2 3.55Å; F173-W389 HydrophobicContact CE2-CH2 3.55Å; F173-W389 AromaticContact CE2-CZ2 3.62Å; F173-W389 HydrophobicContact CE2-CZ2 3.62Å; F173-W389 AromaticContact CZ-CH2 3.49Å; F173-W389 HydrophobicContact CZ-CH2 3.49Å; F173-W389 VanDerWaalsContact CZ-CH2 3.49Å; F173-W389 AromaticContact CZ-CZ2 3.52Å; F173-W389 HydrophobicContact CZ-CZ2 3.52Å; H249-W389 AromaticContact CE1-CE3 3.95Å; F253-W389 HydrophobicContact CE2-CH2 4.03Å; F253-W389 HydrophobicContact CZ-CH2 4.46Å; Q385-W389 PolarHBondContact O-N 3.35Å; Y386-W389 WeakPolarHBondContact O-CB 3.44Å; Y386-W389 PolarHBondContact O-N 3.47Å; Y386-W389 VanDerWaalsContact O-N 3.15Å; A387-W389 VanDerWaalsContact C-N 3.32Å; A387-W389 PolarHBondContact O-N 3.47Å; W389-K391 VanDerWaalsContact C-N 3.28Å; W389-K391 PolarHBondContact O-N 2.94Å; W389-T392 HydrophobicContact CE3-CG2 4.26Å; W389-T392 HydrophobicContact CZ3-CG2 4.09Å; W389-T392 WeakPolarHBondContact O-CB 3.36Å; W389-T392 PolarHBondContact O-N 3.26Å; W389-T392 VanDerWaalsContact O-N 3.16Å; W389-L393 HydrophobicContact CD2-CG 4.46Å; W389-L393 HydrophobicContact CH2-CD2 4.37Å; W389-L393 HydrophobicContact CZ2-CD2 3.74Å; W389-L393 HydrophobicContact CZ2-CG 4.1Å; W389-L393 PolarHBondContact O-N 2.9Å
390	K	91.6	Very high	86.3	Confident	96 Å²	96	76.8 Å²	76.8	42%	0.417	37%	0.369	S	S	.	.	H	α-helix	trans	-59.3	-41.7	175.3	-70.8	-67.3	-60.4	-164.9	0	111.5	Y386 A387 L393 Q394	Y386-K390 HydrophobicContact CD1-CG 4.2Å; Y386-K390 HydrophobicContact CE1-CD 4.13Å; Y386-K390 HydrophobicContact CE1-CG 3.82Å; Y386-K390 WeakPolarHBondContact O-CG 3.25Å; Y386-K390 PolarHBondContact O-N 3.48Å; A387-K390 PolarHBondContact O-N 2.74Å; K390-L393 PolarHBondContact O-N 2.83Å; K390-Q394 WeakPolarHBondContact O-CG 3.29Å; K390-Q394 PolarHBondContact O-N 2.98Å
391	K	87.7	Confident	86.4	Confident	62 Å²	62	67.5 Å²	67.5	27%	0.27	34%	0.34	S	S	.	.	H	α-helix	trans	-62.4	-47.1	173.4	-174.6	169.5	179.9	179.5	0	110.9	Y361 A387 L388 W389 L393 Q394 L395	Y361-K391 VanDerWaalsContact OH-CD 3.29Å; Y361-K391 WeakPolarHBondContact OH-CD 3.37Å; Y361-K391 PolarHBondContact OH-NZ 2.71Å; A387-K391 PolarHBondContact O-N 3.11Å; L388-K391 WeakPolarHBondContact O-CB 3.34Å; L388-K391 PolarHBondContact O-N 3.22Å; W389-K391 VanDerWaalsContact C-N 3.28Å; W389-K391 PolarHBondContact O-N 2.94Å; K391-L393 VanDerWaalsContact C-N 3.29Å; K391-L393 PolarHBondContact O-N 3.03Å; K391-Q394 PolarHBondContact O-N 2.88Å; K391-Q394 VanDerWaalsContact O-N 3.17Å; K391-L395 HydrophobicContact CD-CD1 4.42Å; K391-L395 HydrophobicContact CG-CD1 3.53Å; K391-L395 HydrophobicContact CG-CG 4.4Å; K391-L395 WeakPolarHBondContact O-CB 3.39Å; K391-L395 WeakPolarHBondContact O-CD1 3.11Å; K391-L395 WeakPolarHBondContact O-CG 3.37Å; K391-L395 PolarHBondContact O-N 2.59Å
392	T	87.8	Confident	85.9	Confident	4 Å²	4	69.3 Å²	69.3	3%	0.025	34%	0.342	C	S	.	.	H	α-helix	trans	-54.9	-41.8	174.3	-62.2	0	0	0	0	112.3	H249 N251 F253 L388 W389 L395 C396	H249-T392 PolarHBondContact NE2-OG1 3.2Å; N251-T392 HydrophobicContact CB-CG2 4.37Å; F253-T392 HydrophobicContact CD2-CG2 4.09Å; F253-T392 HydrophobicContact CE2-CG2 4.26Å; L388-T392 PolarHBondContact O-N 3.23Å; L388-T392 PolarHBondContact O-OG1 2.74Å; L388-T392 VanDerWaalsContact O-OG1 3.1Å; W389-T392 HydrophobicContact CE3-CG2 4.26Å; W389-T392 HydrophobicContact CZ3-CG2 4.09Å; W389-T392 WeakPolarHBondContact O-CB 3.36Å; W389-T392 PolarHBondContact O-N 3.26Å; W389-T392 VanDerWaalsContact O-N 3.16Å; T392-L395 PolarHBondContact O-N 3.15Å; T392-C396 VanDerWaalsContact O-CB 3.22Å; T392-C396 WeakPolarHBondContact O-CB 3.45Å; T392-C396 PolarHBondContact O-N 3.06Å
393	L	89.9	Confident	84.9	Confident	38 Å²	38	74.4 Å²	74.4	20%	0.199	37%	0.37	C	S	.	.	H	α-helix	trans	-66	-44.6	176	-71.8	177.4	0	0	0	113.3	F253 W389 K390 K391 L395 C396 K397	F253-L393 HydrophobicContact CE2-CD2 4.05Å; F253-L393 HydrophobicContact CZ-CD2 3.97Å; W389-L393 HydrophobicContact CD2-CG 4.46Å; W389-L393 HydrophobicContact CH2-CD2 4.37Å; W389-L393 HydrophobicContact CZ2-CD2 3.74Å; W389-L393 HydrophobicContact CZ2-CG 4.1Å; W389-L393 PolarHBondContact O-N 2.9Å; K390-L393 PolarHBondContact O-N 2.83Å; K391-L393 VanDerWaalsContact C-N 3.29Å; K391-L393 PolarHBondContact O-N 3.03Å; L393-L395 VanDerWaalsContact C-N 3.25Å; L393-L395 PolarHBondContact O-N 3.32Å; L393-C396 WeakPolarHBondContact O-CB 3.39Å; L393-C396 PolarHBondContact O-N 3.17Å; L393-K397 WeakPolarHBondContact O-CG 3.29Å; L393-K397 PolarHBondContact O-N 3.17Å
394	Q	87.1	Confident	84.6	Confident	122 Å²	122	71.6 Å²	71.6	57%	0.57	35%	0.353	S	S	*	.	H	α-helix	trans	-57.9	-43.6	176.6	-74.1	170.7	-22	0	0	110.9	K390 K391 K397 V398	K390-Q394 WeakPolarHBondContact O-CG 3.29Å; K390-Q394 PolarHBondContact O-N 2.98Å; K391-Q394 PolarHBondContact O-N 2.88Å; K391-Q394 VanDerWaalsContact O-N 3.17Å; Q394-K397 WeakPolarHBondContact O-CB 3.18Å; Q394-K397 PolarHBondContact O-N 2.89Å; Q394-V398 WeakPolarHBondContact O-CG2 3.01Å; Q394-V398 PolarHBondContact O-N 3.18Å
395	L	80.5	Confident	84.4	Confident	37 Å²	37	69 Å²	69	19%	0.194	34%	0.344	C	S	.	.	H	α-helix	trans	-73.6	-34.6	-177	-62.5	166.4	0	0	0	112	L369 K391 T392 L393 K397 V398 K399	L369-L395 HydrophobicContact CD1-CB 3.66Å; L369-L395 HydrophobicContact CD1-CD1 3.41Å; L369-L395 VanDerWaalsContact CD1-CD1 3.41Å; L369-L395 HydrophobicContact CD1-CD2 3.19Å; L369-L395 HydrophobicContact CD1-CG 3.47Å; L369-L395 VanDerWaalsContact CD1-CG 3.47Å; L369-L395 HydrophobicContact CD2-CB 3.6Å; L369-L395 HydrophobicContact CD2-CD1 3.55Å; L369-L395 HydrophobicContact CD2-CG 4.02Å; L369-L395 HydrophobicContact CG-CB 4.15Å; L369-L395 HydrophobicContact CG-CD1 3.57Å; L369-L395 HydrophobicContact CG-CD2 4.31Å; L369-L395 HydrophobicContact CG-CG 4.11Å; K391-L395 HydrophobicContact CD-CD1 4.42Å; K391-L395 HydrophobicContact CG-CD1 3.53Å; K391-L395 HydrophobicContact CG-CG 4.4Å; K391-L395 WeakPolarHBondContact O-CB 3.39Å; K391-L395 WeakPolarHBondContact O-CD1 3.11Å; K391-L395 WeakPolarHBondContact O-CG 3.37Å; K391-L395 PolarHBondContact O-N 2.59Å; T392-L395 PolarHBondContact O-N 3.15Å; L393-L395 VanDerWaalsContact C-N 3.25Å; L393-L395 PolarHBondContact O-N 3.32Å; L395-K397 VanDerWaalsContact C-N 3.33Å; L395-V398 PolarHBondContact O-N 2.82Å; L395-K399 PolarHBondContact O-N 3.48Å
396	C	83.9	Confident	84.2	Confident	3 Å²	3	72.3 Å²	72.3	2%	0.02	36%	0.361	C	S	.	.	H	α-helix	trans	-59.9	-41.9	170.6	174.9	0	0	0	0	112.2	F253 T392 L393 K399 D400 C401 Y402	F253-C396 VanDerWaalsContact CD1-SG 3.5Å; F253-C396 HydrophobicContact CD2-CB 3.78Å; F253-C396 WeakPolarHBondContact CE1-SG 3.38Å; F253-C396 HydrophobicContact CE2-CB 3.7Å; F253-C396 HydrophobicContact CG-CB 4.25Å; F253-C396 HydrophobicContact CZ-CB 4.12Å; F253-C396 WeakPolarHBondContact CZ-SG 3.46Å; T392-C396 VanDerWaalsContact O-CB 3.22Å; T392-C396 WeakPolarHBondContact O-CB 3.45Å; T392-C396 PolarHBondContact O-N 3.06Å; L393-C396 WeakPolarHBondContact O-CB 3.39Å; L393-C396 PolarHBondContact O-N 3.17Å; C396-K399 CarbonylContact O-C 3.52Å; C396-K399 PolarHBondContact O-N 3.16Å; C396-D400 WeakPolarHBondContact O-CA 3.45Å; C396-D400 PolarHBondContact O-N 3.38Å; C396-C401 HydrophobicContact CB-CB 4.35Å; C396-C401 PolarHBondContact O-N 3.27Å; C396-C401 WeakPolarHBondContact SG-CB 3.02Å; C396-Y402 WeakPolarHBondContact SG-CD2 3.48Å; C396-Y402 WeakPolarHBondContact SG-CE2 3.43Å
397	K	84.2	Confident	83.7	Confident	162 Å²	162	70 Å²	70	70%	0.704	36%	0.356	S	S	*	.	H	α-helix	trans	-62.4	-41.9	175.8	-70.7	180	179.1	-168.6	0	112.3	L393 Q394 L395 D400	L393-K397 WeakPolarHBondContact O-CG 3.29Å; L393-K397 PolarHBondContact O-N 3.17Å; Q394-K397 WeakPolarHBondContact O-CB 3.18Å; Q394-K397 PolarHBondContact O-N 2.89Å; L395-K397 VanDerWaalsContact C-N 3.33Å; K397-D400 PolarHBondContact O-N 3.16Å
398	V	81.1	Confident	83.3	Confident	124 Å²	124	70.7 Å²	70.7	75%	0.752	35%	0.348	S	S	*	.	H	α-helix	trans	-67	-38.4	179.1	175.6	0	0	0	0	111.8	Q394 L395	Q394-V398 WeakPolarHBondContact O-CG2 3.01Å; Q394-V398 PolarHBondContact O-N 3.18Å; L395-V398 PolarHBondContact O-N 2.82Å
399	K	78.4	Confident	83	Confident	109 Å²	109	75.3 Å²	75.3	47%	0.474	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	5.4	-179.2	-66.9	-166.8	177.5	-166.4	0	114.1	L369 L395 C396 C401	L369-K399 PolarHBondContact O-NZ 2.04Å; L395-K399 PolarHBondContact O-N 3.48Å; C396-K399 CarbonylContact O-C 3.52Å; C396-K399 PolarHBondContact O-N 3.16Å; K399-C401 VanDerWaalsContact C-N 3.27Å; K399-C401 PolarHBondContact O-N 2.84Å
400	D	81	Confident	82.4	Confident	80 Å²	80	79.9 Å²	79.9	43%	0.428	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.8	45	-173.7	-165.5	23.1	0	0	0	114.1	C396 K397 Y402 N403	C396-D400 WeakPolarHBondContact O-CA 3.45Å; C396-D400 PolarHBondContact O-N 3.38Å; K397-D400 PolarHBondContact O-N 3.16Å; D400-Y402 PolarHBondContact O-N 3.19Å; D400-N403 VanDerWaalsContact CG-ND2 3.29Å; D400-N403 PolarHBondContact O-N 3.33Å; D400-N403 PolarHBondContact OD1-ND2 3.37Å; D400-N403 VanDerWaalsContact OD1-ND2 3.09Å; D400-N403 WeakPolarHBondContact OD2-CB 3.02Å; D400-N403 PolarHBondContact OD2-ND2 2.87Å
401	C	80.9	Confident	81.7	Confident	44 Å²	44	78.7 Å²	78.7	30%	0.297	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	1.7	-174.6	-44.4	0	0	0	0	114.2	F253 C396 K399	F253-C401 HydrophobicContact CB-CB 3.71Å; F253-C401 HydrophobicContact CD1-CB 4.13Å; F253-C401 HydrophobicContact CG-CB 4.01Å; C396-C401 HydrophobicContact CB-CB 4.35Å; C396-C401 PolarHBondContact O-N 3.27Å; C396-C401 WeakPolarHBondContact SG-CB 3.02Å; K399-C401 VanDerWaalsContact C-N 3.27Å; K399-C401 PolarHBondContact O-N 2.84Å
402	Y	71.3	Confident	81.2	Confident	74 Å²	74	80.1 Å²	80.1	29%	0.29	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-29.6	175.8	-83.7	-65.1	0	0	0	110.7	F173 K176 F253 C396 D400	F173-Y402 HydrophobicContact CE1-CE1 4.37Å; K176-Y402 HydrophobicContact CD-CD1 3.53Å; K176-Y402 HydrophobicContact CD-CE1 4.17Å; K176-Y402 VanDerWaalsContact CE-C 3.46Å; K176-Y402 VanDerWaalsContact CE-CA 3.48Å; K176-Y402 VanDerWaalsContact CE-CD1 3.42Å; K176-Y402 WeakPolarHBondContact CE-O 3.02Å; K176-Y402 VanDerWaalsContact NZ-C 3.32Å; K176-Y402 PolarHBondContact NZ-O 3.47Å; F253-Y402 AromaticContact CE1-CD1 3.9Å; F253-Y402 HydrophobicContact CE1-CD1 3.9Å; F253-Y402 HydrophobicContact CE1-CD2 4.48Å; F253-Y402 AromaticContact CE1-CE1 3.49Å; F253-Y402 HydrophobicContact CE1-CE1 3.49Å; F253-Y402 VanDerWaalsContact CE1-CE1 3.49Å; F253-Y402 HydrophobicContact CE1-CE2 4.07Å; F253-Y402 HydrophobicContact CE1-CG 4.42Å; F253-Y402 AromaticContact CE1-CZ 3.57Å; F253-Y402 AromaticContact CZ-CE1 4Å; F253-Y402 HydrophobicContact CZ-CE1 4Å; F253-Y402 HydrophobicContact CZ-CE2 4.14Å; F253-Y402 AromaticContact CZ-CZ 3.63Å; C396-Y402 WeakPolarHBondContact SG-CD2 3.48Å; C396-Y402 WeakPolarHBondContact SG-CE2 3.43Å; D400-Y402 PolarHBondContact O-N 3.19Å
403	N	68.3	Low	80.6	Confident	164 Å²	164	87 Å²	87	88%	0.877	44%	0.437	S	S	*	.			trans	-100	0	175	-58.9	-34.5	0	0	0	110.1	D400	D400-N403 VanDerWaalsContact CG-ND2 3.29Å; D400-N403 PolarHBondContact O-N 3.33Å; D400-N403 PolarHBondContact OD1-ND2 3.37Å; D400-N403 VanDerWaalsContact OD1-ND2 3.09Å; D400-N403 WeakPolarHBondContact OD2-CB 3.02Å; D400-N403 PolarHBondContact OD2-ND2 2.87Å

Retrieved 403 of 403 residues in 72.2 ms (Link to these results)

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