A0A5K4FA67_SCHMA Loading...

Zinc finger protein GLIS1

AlphaFold DB , UniProt , Accession A0A5K4FA67, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 545 aa.

Structure Viewer

Loading PAE data...

(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	29.3	Very low	27.6	Very low	243 Å²	243	154.5 Å²	154.5	100%	1.197	80%	0.795	S	S	*	*				0	107.3	0	-76	174.7	173.6	0	0	107.7
2	N	30.1	Very low	27.3	Very low	140 Å²	140	154.7 Å²	154.7	75%	0.749	79%	0.79	S	S	*	*			trans	13.6	136.7	157.6	-61.4	-5.6	0	0	0	120
3	W	28	Very low	27.4	Very low	238 Å²	238	157.6 Å²	157.6	90%	0.902	80%	0.798	S	S	*	*			cis	-157.1	155.7	7.7	-96.3	-8.8	0	0	0	111.2
4	S	25.9	Very low	27.4	Very low	95 Å²	95	156 Å²	156	66%	0.664	79%	0.79	S	S	*	*			trans	-94.3	146.8	176.4	43.6	0	0	0	0	112.6
5	T	27	Very low	27.4	Very low	125 Å²	125	159.2 Å²	159.2	77%	0.767	80%	0.801	S	S	*	*			trans	62.5	119	136.6	54.8	0	0	0	0	122.1
6	T	29.8	Very low	27.2	Very low	136 Å²	136	154.8 Å²	154.8	83%	0.834	79%	0.789	S	S	*	*				-175.1	114.8	118.8	16.4	0	0	0	0	107.7
7	S	26.6	Very low	27.2	Very low	94 Å²	94	154.2 Å²	154.2	66%	0.657	79%	0.789	S	S	*	*				51.4	128	70.9	171.8	0	0	0	0	112.4
8	K	30.6	Very low	27	Very low	185 Å²	185	152.9 Å²	152.9	80%	0.804	78%	0.783	S	S	*	*			cis	-171.1	150.1	4.7	-104	169.5	-174.4	175.2	0	106.4
9	Y	24.1	Very low	26.9	Very low	207 Å²	207	156.2 Å²	156.2	81%	0.812	79%	0.791	S	S	*	*			trans	2.9	141.8	147.9	-79.4	-97.3	0	0	0	118.8
10	T	27.3	Very low	26.8	Very low	120 Å²	120	153.4 Å²	153.4	74%	0.736	78%	0.783	S	S	*	*				-162.2	145.4	69	43.6	0	0	0	0	115.5
11	N	24.6	Very low	26.8	Very low	117 Å²	117	154.8 Å²	154.8	63%	0.626	79%	0.786	S	S	*	*			trans	53.3	141.1	137.2	-66.3	14.1	0	0	0	119.9
12	E	24.9	Very low	26.5	Very low	156 Å²	156	151.8 Å²	151.8	73%	0.729	77%	0.769	S	S	*	*			cis	-168.2	138.8	12.9	-113.7	156.9	-144	0	0	105.2
13	H	27.6	Very low	26.1	Very low	193 Å²	193	152.5 Å²	152.5	89%	0.894	77%	0.773	S	S	*	*			trans	-134	119.1	158.5	-122.7	-53.7	0	0	0	109.8
14	I	28.1	Very low	25.8	Very low	135 Å²	135	146.6 Å²	146.6	69%	0.692	76%	0.763	S	S	*	*			trans	-58.2	132.8	175.4	-66.1	158.8	0	0	0	110.7
15	Q	26.8	Very low	25.6	Very low	204 Å²	204	150.2 Å²	150.2	95%	0.953	77%	0.769	S	S	*	*			trans	-130.1	111.2	142.8	-84	-163.1	-20.6	0	0	109.1
16	S	23.8	Very low	25.5	Very low	88 Å²	88	154.2 Å²	154.2	62%	0.615	77%	0.772	S	S	*	*			trans	-110.9	128.6	167.4	54	0	0	0	0	108.7
17	N	27.4	Very low	25.1	Very low	145 Å²	145	157.7 Å²	157.7	78%	0.775	78%	0.776	S	S	*	*			trans	-177.8	102.5	142.6	-88.1	-14.1	0	0	0	106.5
18	L	24.4	Very low	25	Very low	132 Å²	132	158.1 Å²	158.1	69%	0.691	78%	0.776	S	S	*	*				81.4	95.7	93.2	-93.1	154.1	0	0	0	113.2
19	F	24	Very low	24.6	Very low	214 Å²	214	154.1 Å²	154.1	94%	0.939	77%	0.772	S	S	*	*			trans	-144.4	103	138.4	-102.6	-79.9	0	0	0	108.4
20	T	26.4	Very low	24.4	Very low	100 Å²	100	154.5 Å²	154.5	61%	0.613	77%	0.773	S	S	*	*			trans	-61	152.5	156.2	34.7	0	0	0	0	109.1
21	E	25.7	Very low	24.1	Very low	184 Å²	184	154.6 Å²	154.6	86%	0.86	77%	0.774	S	S	*	*			cis	-160.4	137.8	13	-114.2	160.4	-158.1	0	0	106.3
22	Q	23.2	Very low	24.1	Very low	180 Å²	180	157.4 Å²	157.4	84%	0.841	79%	0.788	S	S	*	*			trans	-103.7	137	167.2	-73.9	179.9	-21.5	0	0	108.2
23	N	22.7	Very low	23.9	Very low	154 Å²	154	154.7 Å²	154.7	82%	0.824	79%	0.786	S	S	*	*				-171.6	149.6	127.4	-100.3	-33.4	0	0	0	114.7
24	T	21.5	Very low	23.6	Very low	114 Å²	114	153.1 Å²	153.1	70%	0.699	78%	0.784	S	S	*	*			trans	80.7	96.1	170.6	72	0	0	0	0	116.6
25	H	21.3	Very low	23.3	Very low	171 Å²	171	154.4 Å²	154.4	79%	0.792	79%	0.789	S	S	*	*				-179.8	153.6	116.9	-92.6	-68.5	0	0	0	111.2
26	Y	25.5	Very low	23.1	Very low	210 Å²	210	154.1 Å²	154.1	82%	0.824	79%	0.785	S	S	*	*			trans	82.7	97.7	165	-74.4	-82.7	0	0	0	119.5
27	F	20.7	Very low	23.1	Very low	209 Å²	209	155 Å²	155	92%	0.917	79%	0.787	S	S	*	*			trans	-90.6	137.6	137.4	-96.4	-87.4	0	0	0	107.9
28	P	24.3	Very low	22.8	Very low	102 Å²	102	156.1 Å²	156.1	66%	0.662	79%	0.785	S	S	*	*				-146.1	170.2	104	36.3	-19.7	0	0	0	115.4
29	S	21.7	Very low	22.7	Very low	102 Å²	102	157.7 Å²	157.7	71%	0.713	79%	0.788	S	S	*	*			trans	94.3	101.7	153.5	58.6	0	0	0	0	121.3
30	Y	21.2	Very low	22.7	Very low	215 Å²	215	156.9 Å²	156.9	84%	0.843	79%	0.785	S	S	*	*				46.9	121.3	127	-72.6	-85.8	0	0	0	122.5
31	T	20.9	Very low	22.5	Very low	122 Å²	122	159.5 Å²	159.5	75%	0.748	79%	0.793	S	S	*	*			trans	67	113	138.7	54.7	0	0	0	0	119.9
32	L	23.3	Very low	22.4	Very low	175 Å²	175	156.7 Å²	156.7	92%	0.916	79%	0.788	S	S	*	*				-153.5	125.4	128.5	-142	74.8	0	0	0	112.5
33	S	21.2	Very low	22.2	Very low	100 Å²	100	153.4 Å²	153.4	70%	0.699	78%	0.784	S	S	*	*			trans	-58.5	155.5	161.7	-59.2	0	0	0	0	111.7
34	N	21.6	Very low	22.3	Very low	159 Å²	159	151.4 Å²	151.4	85%	0.85	78%	0.78	S	S	*	*			trans	82.4	94.1	171.6	-59.1	-24.7	0	0	0	117.3
35	M	22.3	Very low	22.3	Very low	162 Å²	162	156.2 Å²	156.2	80%	0.798	79%	0.791	S	S	*	*			trans	-125.9	99.9	151.2	-79.4	-144.3	70.7	0	0	111.4	V37	M35-V37 HydrophobicContact CE-CB 3.64Å; M35-V37 HydrophobicContact CE-CG2 3.09Å
36	K	21.3	Very low	22.3	Very low	199 Å²	199	156.4 Å²	156.4	87%	0.865	79%	0.792	S	S	*	*			trans	-74.4	112.2	138.9	-79.5	178.2	174.3	177.1	0	107.1
37	V	25.3	Very low	22.2	Very low	107 Å²	107	154 Å²	154	65%	0.648	79%	0.794	S	S	*	*			trans	-148.2	103.3	153.6	161.2	0	0	0	0	105.1	M35	M35-V37 HydrophobicContact CE-CB 3.64Å; M35-V37 HydrophobicContact CE-CG2 3.09Å
38	F	21.2	Very low	22.3	Very low	167 Å²	167	147.7 Å²	147.7	73%	0.732	79%	0.788	S	S	*	*				56.1	108.3	87.9	-91.3	-76	0	0	0	115.6
39	E	22	Very low	22.1	Very low	165 Å²	165	149.2 Å²	149.2	77%	0.771	79%	0.794	S	S	*	*			trans	37.5	114.5	134.8	-67.7	179.9	152.8	0	0	119.9
40	K	23.7	Very low	22.2	Very low	198 Å²	198	151 Å²	151	86%	0.861	80%	0.801	S	S	*	*				-177.4	99.5	123.4	-101.6	170.6	-178.5	-179.6	0	109.9
41	I	22.3	Very low	22.5	Very low	154 Å²	154	148.8 Å²	148.8	79%	0.79	80%	0.798	S	S	*	*			trans	-126.5	95.2	149.5	-60.8	-179.7	0	0	0	105.8
42	V	23	Very low	22.5	Very low	126 Å²	126	150.5 Å²	150.5	76%	0.764	80%	0.803	S	S	*	*			trans	-93.8	125.2	163.8	170.1	0	0	0	0	105.9
43	C	19.6	Very low	22.5	Very low	111 Å²	111	151 Å²	151	75%	0.75	80%	0.8	S	S	*	*			trans	-60.3	152.9	172.9	-57.2	0	0	0	0	111.8
44	P	24.1	Very low	22.7	Very low	112 Å²	112	150.4 Å²	150.4	73%	0.727	80%	0.796	S	S	*	*			trans	-122.3	111.5	147.9	33.2	-19.2	0	0	0	109.7
45	F	21.2	Very low	22.9	Very low	215 Å²	215	152 Å²	152	94%	0.943	80%	0.796	S	S	*	*			trans	-152.2	100.9	148	-98.2	-74	0	0	0	108.2
46	Q	22.7	Very low	23	Very low	174 Å²	174	153.3 Å²	153.3	81%	0.813	80%	0.797	S	S	*	*			trans	-117.9	136.8	158.8	-93	-176.6	-25.9	0	0	107.7
47	N	22	Very low	23.1	Very low	161 Å²	161	154.7 Å²	154.7	86%	0.861	80%	0.798	S	S	*	*			trans	78	101	159.5	-58.7	-14.5	0	0	0	118.1
48	G	23.4	Very low	22.9	Very low	76 Å²	76	157 Å²	157	78%	0.784	81%	0.806	S	S	*	*			trans	-162.8	89.5	162.1	0	0	0	0	0	109	V50	G48-V50 PolarHBondContact O-N 3.41Å
49	V	20.3	Very low	23.1	Very low	133 Å²	133	157.3 Å²	157.3	81%	0.806	81%	0.81	S	S	*	*			trans	-57.3	117.4	172.7	172.4	0	0	0	0	109.5
50	V	24.7	Very low	23.3	Very low	140 Å²	140	154.7 Å²	154.7	85%	0.848	81%	0.81	S	S	*	*			trans	-139.5	130.5	151.3	-177.5	0	0	0	0	108.5	G48	G48-V50 PolarHBondContact O-N 3.41Å
51	Q	25.6	Very low	23.3	Very low	168 Å²	168	152.3 Å²	152.3	79%	0.785	80%	0.801	S	S	*	*			trans	-72.4	155.5	-171	-66.3	169.3	-26.8	0	0	112.7
52	N	20.8	Very low	23.4	Very low	158 Å²	158	153 Å²	153	85%	0.845	81%	0.807	S	S	*	*			trans	-16.7	133.8	155	-71.8	-34.1	0	0	0	116.7
53	E	24.9	Very low	23.3	Very low	185 Å²	185	155.6 Å²	155.6	86%	0.864	81%	0.81	S	S	*	*				175.1	149.9	116.2	-94.7	176.4	-169.7	0	0	108
54	S	25.1	Very low	23.5	Very low	88 Å²	88	157.6 Å²	157.6	62%	0.615	81%	0.814	S	S	*	*			cis	-171.9	143.1	-36.3	48.9	0	0	0	0	105.8
55	K	25.6	Very low	23.6	Very low	192 Å²	192	159.6 Å²	159.6	84%	0.835	82%	0.819	S	S	*	*			trans	59.6	114.1	141.8	-65.9	173.2	179.3	176.4	0	120.7
56	K	25	Very low	23.7	Very low	191 Å²	191	157 Å²	157	83%	0.83	81%	0.813	S	S	*	*				169.1	108.8	108.9	-89.7	172.4	-177.6	179.3	0	105.1
57	Y	22	Very low	23.6	Very low	228 Å²	228	154.8 Å²	154.8	89%	0.894	81%	0.811	S	S	*	*				-152.7	125.6	69.1	-85.6	-96	0	0	0	110.4
58	L	21.9	Very low	23.5	Very low	155 Å²	155	152 Å²	152	81%	0.812	80%	0.804	S	S	*	*			trans	-151.7	121.2	160	-153.6	94.2	0	0	0	109
59	H	26	Very low	23.4	Very low	174 Å²	174	155.3 Å²	155.3	81%	0.806	81%	0.809	S	S	*	*			trans	-170.2	131	148.3	-108.7	63.9	0	0	0	104.7
60	S	24.4	Very low	23.4	Very low	110 Å²	110	154 Å²	154	77%	0.769	81%	0.806	S	S	*	*			cis	-132.8	141.4	35.2	57.7	0	0	0	0	113.5
61	Q	24.8	Very low	23.2	Very low	147 Å²	147	156.1 Å²	156.1	69%	0.687	81%	0.807	S	S	*	*			trans	-67.4	151.6	162.5	-64.4	171	-53.8	0	0	110.8
62	N	23.7	Very low	23	Very low	169 Å²	169	156.4 Å²	156.4	90%	0.904	81%	0.808	S	S	*	*				-158.4	106	124.7	-92.1	-15.4	0	0	0	107.3
63	Q	21.5	Very low	23	Very low	180 Å²	180	160.2 Å²	160.2	84%	0.841	81%	0.813	S	S	*	*			trans	-101.1	132.8	153.9	-84.9	177.5	-34.5	0	0	105.4
64	D	24.1	Very low	22.8	Very low	154 Å²	154	158.4 Å²	158.4	82%	0.824	80%	0.804	S	S	*	*			trans	-160.4	139.9	135.6	-91.3	-26.2	0	0	0	110.7
65	N	26.1	Very low	22.6	Very low	154 Å²	154	161.3 Å²	161.3	82%	0.824	81%	0.81	S	S	*	*			trans	89.3	103.3	157.5	-60.6	-23.9	0	0	0	120.9
66	I	22.1	Very low	22.4	Very low	160 Å²	160	159.3 Å²	159.3	82%	0.821	81%	0.807	S	S	*	*			trans	-73.3	130	155.5	-65.2	163.1	0	0	0	108.9
67	T	21.9	Very low	22.2	Very low	127 Å²	127	155.5 Å²	155.5	78%	0.779	80%	0.796	S	S	*	*			trans	-171.1	114.6	131.5	24.6	0	0	0	0	111.5
68	S	19.6	Very low	22.3	Very low	102 Å²	102	148.4 Å²	148.4	71%	0.713	78%	0.778	S	S	*	*			trans	21.2	115.8	146.3	59.5	0	0	0	0	120.8
69	T	22	Very low	22.2	Very low	146 Å²	146	147.3 Å²	147.3	90%	0.896	77%	0.772	S	S	*	*				-162.3	149.1	125.6	29.5	0	0	0	0	111.1
70	S	19.7	Very low	22.1	Very low	106 Å²	106	147.5 Å²	147.5	74%	0.741	77%	0.767	S	S	*	*			trans	-64.1	163.4	-173.8	-43.1	0	0	0	0	115.1
71	Q	21.4	Very low	22	Very low	185 Å²	185	145.3 Å²	145.3	86%	0.864	75%	0.752	S	S	*	*			trans	81.1	97.5	162.7	-57.9	173.6	-21.7	0	0	116.8
72	E	20.4	Very low	21.9	Very low	174 Å²	174	143.8 Å²	143.8	81%	0.813	75%	0.752	S	S	*	*				-170.2	95.3	125.2	-103.4	169.2	-171	0	0	109.4	E74	E72-E74 PolarHBondContact O-N 3.46Å; E72-E74 VanDerWaalsContact O-N 3.1Å
73	Y	20.8	Very low	21.9	Very low	238 Å²	238	139.9 Å²	139.9	93%	0.933	73%	0.729	S	S	*	*			trans	-75	83.2	158.8	-98.3	-91.6	0	0	0	107.1	M75	Y73-M75 PolarHBondContact O-N 2.81Å
74	E	21	Very low	22	Very low	147 Å²	147	135.9 Å²	135.9	69%	0.687	71%	0.713	S	S	*	*			trans	-70	98.8	165.2	-85.5	-165.4	139.1	0	0	109.2	E72 L76	E72-E74 PolarHBondContact O-N 3.46Å; E72-E74 VanDerWaalsContact O-N 3.1Å; E74-L76 VanDerWaalsContact C-N 3.26Å; E74-L76 PolarHBondContact O-N 3.38Å
75	M	20.8	Very low	22.1	Very low	148 Å²	148	137.8 Å²	137.8	73%	0.729	71%	0.71	S	S	*	*			trans	-66.4	83.8	166	-73.4	-170	65.2	0	0	110.2	Y73	Y73-M75 PolarHBondContact O-N 2.81Å
76	L	21.3	Very low	22.1	Very low	151 Å²	151	138.2 Å²	138.2	79%	0.791	71%	0.707	S	S	*	*			trans	-65.5	133.6	168.2	-69.2	172.5	0	0	0	110.9	E74	E74-L76 VanDerWaalsContact C-N 3.26Å; E74-L76 PolarHBondContact O-N 3.38Å
77	D	21.1	Very low	22.3	Very low	111 Å²	111	133.7 Å²	133.7	59%	0.594	69%	0.685	S	S	*	*			trans	-44.1	127.5	-172.9	-90.9	-40.6	0	0	0	116.7	L79	D77-L79 PolarHBondContact O-N 3.26Å; D77-L79 VanDerWaalsContact O-N 3.1Å
78	P	22.9	Very low	22.5	Very low	78 Å²	78	134.2 Å²	134.2	51%	0.506	68%	0.678	S	S	.	*	S	Bend	trans	-86.6	65.6	162.6	34.7	-29.1	0	0	0	110.2	Y361	P78-Y361 HydrophobicContact CG-CE1 4.48Å
79	L	21	Very low	22.8	Very low	133 Å²	133	137.4 Å²	137.4	70%	0.696	68%	0.675	S	S	*	*			trans	-113.1	14.7	161.5	-76.1	179.3	0	0	0	112.7	D77 S81	D77-L79 PolarHBondContact O-N 3.26Å; D77-L79 VanDerWaalsContact O-N 3.1Å; L79-S81 PolarHBondContact O-N 3.47Å
80	Y	23.2	Very low	23.1	Very low	177 Å²	177	136.1 Å²	136.1	69%	0.694	66%	0.662	S	S	*	*			trans	-78.9	120.6	168.6	-104.9	-94.2	0	0	0	111
81	S	23.2	Very low	23.5	Very low	65 Å²	65	138.4 Å²	138.4	46%	0.455	66%	0.661	S	S	.	*			trans	-47.1	147.2	171.7	44.5	0	0	0	0	111.8	L79 E83	L79-S81 PolarHBondContact O-N 3.47Å; S81-E83 PolarHBondContact O-N 3.48Å; S81-E83 PolarHBondContact OG-OE2 2.97Å
82	V	23	Very low	23.8	Very low	115 Å²	115	137.1 Å²	137.1	70%	0.697	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	61.8	171.7	-173.4	0	0	0	0	109.8
83	E	23.3	Very low	24	Very low	87 Å²	87	135.2 Å²	135.2	41%	0.407	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.4	-5.4	175.1	-72.9	-171.5	135.7	0	0	112.7	S81 R314	S81-E83 PolarHBondContact O-N 3.48Å; S81-E83 PolarHBondContact OG-OE2 2.97Å; E83-R314 IonicContact OE1-CZ 2.75Å; E83-R314 IonicContact OE1-NH1 2.89Å; E83-R314 IonicContact OE1-NH2 3.61Å; E83-R314 PolarHBondContact OE1-NH2 3.33Å
84	N	24	Very low	24.3	Very low	96 Å²	96	128.4 Å²	128.4	51%	0.513	62%	0.624	S	S	.	*			trans	-108.6	8.1	-171.6	-74.4	-1.1	0	0	0	116.6	H88	N84-H88 PolarHBondContact O-N 3.37Å
85	Y	25.5	Very low	24.5	Very low	193 Å²	193	128.9 Å²	128.9	76%	0.757	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-15.8	-179.3	-125.4	-90.9	0	0	0	114.3
86	Q	25.8	Very low	24.7	Very low	164 Å²	164	131.2 Å²	131.2	77%	0.766	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-28.9	169.9	-98.8	169	-37.7	0	0	112.6
87	D	26.7	Very low	25	Very low	65 Å²	65	130.6 Å²	130.6	35%	0.348	62%	0.62	S	S	.	*	H	α-helix	trans	-77.3	-28.1	-178.1	-68.4	-25.6	0	0	0	112.1	Y89 I90 E91	D87-Y89 VanDerWaalsContact C-N 3.33Å; D87-Y89 PolarHBondContact O-N 3.47Å; D87-I90 PolarHBondContact O-N 3.08Å; D87-E91 PolarHBondContact O-N 3.24Å
88	H	27.1	Very low	25.2	Very low	137 Å²	137	128.8 Å²	128.8	63%	0.634	62%	0.616	S	S	*	*	H	α-helix	trans	-75.1	-17.7	178.7	-150.3	42.1	0	0	0	114.5	N84 E91	N84-H88 PolarHBondContact O-N 3.37Å; H88-E91 IonicContact ND1-OE2 3.52Å
89	Y	24.6	Very low	25.2	Very low	169 Å²	169	132.4 Å²	132.4	66%	0.663	63%	0.631	S	S	*	*	H	α-helix	trans	-81.6	-21.6	171.1	-109.8	-90	0	0	0	112.5	D87 Y93	D87-Y89 VanDerWaalsContact C-N 3.33Å; D87-Y89 PolarHBondContact O-N 3.47Å; Y89-Y93 HydrophobicContact CD1-CE2 4.48Å; Y89-Y93 HydrophobicContact CE1-CE2 4.38Å
90	I	28.3	Very low	25.3	Very low	119 Å²	119	130 Å²	130	61%	0.61	62%	0.622	S	S	*	*	H	α-helix	trans	-82.3	-32.8	-179.8	-63.6	171.8	0	0	0	111	D87 K92	D87-I90 PolarHBondContact O-N 3.08Å; I90-K92 PolarHBondContact O-N 2.93Å
91	E	28.8	Very low	25.3	Very low	154 Å²	154	125.6 Å²	125.6	72%	0.72	62%	0.617	S	S	*	*	S	Bend	trans	-74.4	-20.8	177.4	-78.8	179.5	154.5	0	0	114.3	D87 H88	D87-E91 PolarHBondContact O-N 3.24Å; H88-E91 IonicContact ND1-OE2 3.52Å
92	K	27.2	Very low	25.3	Very low	159 Å²	159	127.5 Å²	127.5	69%	0.691	63%	0.626	S	S	*	*	S	Bend	trans	-93	-13.8	-176.1	-155.8	172.8	-178.2	180	0	114.3	I90	I90-K92 PolarHBondContact O-N 2.93Å
93	Y	25.2	Very low	25.5	Very low	133 Å²	133	125.6 Å²	125.6	52%	0.522	62%	0.618	S	S	.	*			trans	-137.2	76.7	-179.9	-62.4	-79.1	0	0	0	112.4	Y89 H95	Y89-Y93 HydrophobicContact CD1-CE2 4.48Å; Y89-Y93 HydrophobicContact CE1-CE2 4.38Å; Y93-H95 PolarHBondContact O-N 2.83Å; Y93-H95 VanDerWaalsContact O-N 3.14Å
94	P	26.4	Very low	25.6	Very low	95 Å²	95	127.5 Å²	127.5	62%	0.617	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-66.6	-12.3	177.5	-14.9	29	0	0	0	113.9
95	H	25.5	Very low	25.7	Very low	158 Å²	158	129.7 Å²	129.7	73%	0.731	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-92	6.1	-175.9	-65.6	-70.3	0	0	0	114.9	Y93	Y93-H95 PolarHBondContact O-N 2.83Å; Y93-H95 VanDerWaalsContact O-N 3.14Å
96	Y	24.8	Very low	25.6	Very low	196 Å²	196	128.7 Å²	128.7	77%	0.769	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-90.7	5.3	173.5	-109.5	-91.7	0	0	0	114.2
97	H	27.1	Very low	25.6	Very low	138 Å²	138	125.3 Å²	125.3	64%	0.639	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-119	14.2	175.4	-140.3	-66.7	0	0	0	114.5	T100	H97-T100 PolarHBondContact CE1-OG1 2.72Å; H97-T100 PolarHBondContact ND1-OG1 3.42Å
98	S	24.9	Very low	25.5	Very low	73 Å²	73	127.2 Å²	127.2	51%	0.51	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.8	18.6	177.6	68.9	0	0	0	0	114.8
99	L	23.2	Very low	25.4	Very low	154 Å²	154	127.9 Å²	127.9	81%	0.806	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	9.2	171.5	-79.1	171.6	0	0	0	114.1	S103	L99-S103 PolarHBondContact O-OG 3.49Å
100	T	23.5	Very low	25.4	Very low	84 Å²	84	123 Å²	123	52%	0.515	64%	0.641	S	S	.	*	S	Bend	trans	-135.8	22.1	-175.8	57.2	0	0	0	0	115.3	H97	H97-T100 PolarHBondContact CE1-OG1 2.72Å; H97-T100 PolarHBondContact ND1-OG1 3.42Å
101	S	24.3	Very low	25.3	Very low	84 Å²	84	126.1 Å²	126.1	59%	0.587	65%	0.654	S	S	*	*	S	Bend	trans	-133.8	-0.9	171.2	66.7	0	0	0	0	115.7
102	T	23.2	Very low	25.2	Very low	105 Å²	105	123.2 Å²	123.2	64%	0.644	65%	0.65	S	S	*	*	S	Bend	trans	-115.8	-11.3	173.7	32.6	0	0	0	0	113.8
103	S	25.5	Very low	25.3	Very low	75 Å²	75	120.3 Å²	120.3	52%	0.524	64%	0.641	S	S	.	*	S	Bend	trans	-92.7	-2.3	169.1	53.8	0	0	0	0	113.9	L99	L99-S103 PolarHBondContact O-OG 3.49Å
104	L	25.9	Very low	25.3	Very low	126 Å²	126	119.4 Å²	119.4	66%	0.66	65%	0.646	S	S	*	*	S	Bend	trans	-101.1	-13.3	-179.9	-151.4	74.6	0	0	0	113.4
105	Q	25.6	Very low	25.4	Very low	142 Å²	142	123.5 Å²	123.5	66%	0.664	65%	0.654	S	S	*	*	S	Bend	trans	-90.3	-20.2	177.8	-152.8	71.4	13.4	0	0	112.6
106	E	24	Very low	25.4	Very low	173 Å²	173	123.6 Å²	123.6	81%	0.808	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-86.1	-5.3	177.3	-69.5	-177	161.4	0	0	113.8	I108	E106-I108 VanDerWaalsContact C-N 3.32Å
107	S	26	Very low	25.4	Very low	92 Å²	92	122.9 Å²	122.9	64%	0.643	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-88.7	8.1	171	-73.6	0	0	0	0	114
108	I	24.6	Very low	25.6	Very low	105 Å²	105	120.3 Å²	120.3	54%	0.538	64%	0.644	S	S	.	*	G	3₁₀ helix	trans	-90.6	-6.4	-177.1	-65.5	177.2	0	0	0	112.8	E106	E106-I108 VanDerWaalsContact C-N 3.32Å
109	N	24	Very low	25.8	Very low	151 Å²	151	119.8 Å²	119.8	81%	0.807	64%	0.64	S	S	*	*	S	Bend	trans	-117.5	29.2	-170.8	-81.7	-8.8	0	0	0	117.7
110	S	26.1	Very low	26.2	Very low	66 Å²	66	119.2 Å²	119.2	46%	0.462	63%	0.632	S	S	.	*			trans	-125.5	79.3	170.1	59.6	0	0	0	0	112.6	S112	S110-S112 PolarHBondContact O-N 3.34Å
111	Q	25.8	Very low	26.6	Very low	185 Å²	185	117.9 Å²	117.9	86%	0.864	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	16.2	177.7	-79.2	-179.8	-19.6	0	0	115.5
112	S	27.5	Very low	27	Very low	93 Å²	93	118.6 Å²	118.6	65%	0.65	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-20.2	177.7	54.1	0	0	0	0	114.6	S110	S110-S112 PolarHBondContact O-N 3.34Å
113	I	27.8	Very low	27.6	Very low	98 Å²	98	120.8 Å²	120.8	50%	0.503	63%	0.627	S	S	.	*	S	Bend	trans	-89.2	-17.7	-174.8	-62.8	173.4	0	0	0	112.9
114	N	26.3	Very low	28.1	Very low	115 Å²	115	121.5 Å²	121.5	62%	0.615	63%	0.625	S	S	*	*	H	α-helix	trans	-82.9	-13	-176.4	-78	-21.6	0	0	0	114.9	V118	N114-V118 VanDerWaalsContact O-CG2 3.25Å; N114-V118 WeakPolarHBondContact O-CG2 3.47Å
115	K	27.2	Very low	28.6	Very low	181 Å²	181	122.9 Å²	122.9	79%	0.787	62%	0.622	S	S	*	*	H	α-helix	trans	-83.9	-27.8	177.9	-79	-177.3	176.2	178.4	0	113.8
116	E	25.9	Very low	29	Very low	159 Å²	159	121.5 Å²	121.5	74%	0.743	62%	0.615	S	S	*	*	H	α-helix	trans	-83.9	-33.1	176.8	-72.2	-171.8	155.8	0	0	113.2	V118 S119	E116-V118 PolarHBondContact O-N 3.22Å; E116-S119 PolarHBondContact O-N 2.87Å; E116-S119 PolarHBondContact O-OG 3.17Å
117	R	26.1	Very low	29.6	Very low	182 Å²	182	115.5 Å²	115.5	69%	0.687	59%	0.593	S	S	*	*	H	α-helix	trans	-72.7	-27.2	-179.5	-64.8	-175.8	88.6	179.7	7	113.9	A121	R117-A121 PolarHBondContact O-N 3.23Å
118	V	29.4	Very low	29.9	Very low	83 Å²	83	114.5 Å²	114.5	50%	0.503	59%	0.585	S	S	.	*	H	α-helix	trans	-70.6	-35.5	174.2	175.8	0	0	0	0	110.5	N114 E116 F120 D122	N114-V118 VanDerWaalsContact O-CG2 3.25Å; N114-V118 WeakPolarHBondContact O-CG2 3.47Å; E116-V118 PolarHBondContact O-N 3.22Å; V118-F120 VanDerWaalsContact C-N 3.32Å; V118-F120 PolarHBondContact O-N 3.16Å; V118-D122 WeakPolarHBondContact CG1-OD2 3.42Å; V118-D122 WeakPolarHBondContact O-CB 3.37Å; V118-D122 VanDerWaalsContact O-CG 3.26Å; V118-D122 PolarHBondContact O-N 2.8Å
119	S	30.9	Very low	30.4	Very low	62 Å²	62	114.9 Å²	114.9	43%	0.434	58%	0.58	S	S	.	*	H	α-helix	trans	-70.2	-21.3	179.4	85.6	0	0	0	0	115.2	E116 K123	E116-S119 PolarHBondContact O-N 2.87Å; E116-S119 PolarHBondContact O-OG 3.17Å; S119-K123 WeakPolarHBondContact O-CD 3.1Å; S119-K123 VanDerWaalsContact O-CG 3.29Å; S119-K123 WeakPolarHBondContact O-CG 3.31Å
120	F	31.5	Very low	31	Very low	142 Å²	142	112 Å²	112	62%	0.623	56%	0.564	S	S	*	*	H	α-helix	trans	-92	-35.1	-179.8	-169.6	-101.7	0	0	0	112.4	V118 L124	V118-F120 VanDerWaalsContact C-N 3.32Å; V118-F120 PolarHBondContact O-N 3.16Å; F120-L124 HydrophobicContact CD1-CD1 3.83Å; F120-L124 HydrophobicContact CE1-CD1 3.43Å; F120-L124 VanDerWaalsContact CE1-CD1 3.43Å; F120-L124 HydrophobicContact CE1-CG 4.44Å; F120-L124 HydrophobicContact CZ-CD1 4.04Å; F120-L124 PolarHBondContact O-N 3.38Å
121	A	30.7	Very low	31.4	Very low	56 Å²	56	118.2 Å²	118.2	46%	0.463	58%	0.578	S	S	.	*	H	α-helix	trans	-67.8	-38.4	173.8	0	0	0	0	0	111.7	R117 L124 Y125	R117-A121 PolarHBondContact O-N 3.23Å; A121-L124 PolarHBondContact O-N 2.89Å; A121-Y125 PolarHBondContact O-N 3.34Å
122	D	33	Very low	31.8	Very low	99 Å²	99	115.4 Å²	115.4	53%	0.529	57%	0.567	S	S	.	*	H	α-helix	trans	-68.6	-35.2	177.3	-67.9	-20.3	0	0	0	112	V118 E126	V118-D122 WeakPolarHBondContact CG1-OD2 3.42Å; V118-D122 WeakPolarHBondContact O-CB 3.37Å; V118-D122 VanDerWaalsContact O-CG 3.26Å; V118-D122 PolarHBondContact O-N 2.8Å; D122-E126 WeakPolarHBondContact O-CB 3.49Å; D122-E126 PolarHBondContact O-N 3.42Å
123	K	37	Very low	32	Very low	151 Å²	151	115.8 Å²	115.8	66%	0.657	56%	0.559	S	S	*	*	H	α-helix	trans	-70.3	-32.4	174.9	-75.6	176.8	-177.9	178	0	113.7	S119 S127	S119-K123 WeakPolarHBondContact O-CD 3.1Å; S119-K123 VanDerWaalsContact O-CG 3.29Å; S119-K123 WeakPolarHBondContact O-CG 3.31Å; K123-S127 PolarHBondContact O-N 3.27Å
124	L	34.8	Very low	32.1	Very low	91 Å²	91	116.8 Å²	116.8	48%	0.476	57%	0.565	S	S	.	*	H	α-helix	trans	-75.8	-35.6	175.6	-84.8	165	0	0	0	112.2	F120 A121 S127 C128	F120-L124 HydrophobicContact CD1-CD1 3.83Å; F120-L124 HydrophobicContact CE1-CD1 3.43Å; F120-L124 VanDerWaalsContact CE1-CD1 3.43Å; F120-L124 HydrophobicContact CE1-CG 4.44Å; F120-L124 HydrophobicContact CZ-CD1 4.04Å; F120-L124 PolarHBondContact O-N 3.38Å; A121-L124 PolarHBondContact O-N 2.89Å; L124-S127 PolarHBondContact O-OG 3.33Å; L124-C128 PolarHBondContact O-N 3.04Å
125	Y	37.5	Very low	32.3	Very low	154 Å²	154	118.1 Å²	118.1	60%	0.604	57%	0.572	S	S	*	*	H	α-helix	trans	-68.9	-44.2	175.3	-165.2	-97	0	0	0	111.8	A121 S127 C128 Y129	A121-Y125 PolarHBondContact O-N 3.34Å; Y125-S127 VanDerWaalsContact C-N 3.35Å; Y125-S127 PolarHBondContact O-N 3.19Å; Y125-C128 PolarHBondContact O-N 3.26Å; Y125-Y129 HydrophobicContact CE1-CD2 4.17Å; Y125-Y129 HydrophobicContact CE1-CG 4.44Å; Y125-Y129 WeakPolarHBondContact O-CB 3.4Å; Y125-Y129 PolarHBondContact O-N 3.41Å
126	E	33	Very low	32.3	Very low	113 Å²	113	116.1 Å²	116.1	53%	0.528	57%	0.57	S	S	.	*	H	α-helix	trans	-57.5	-42.2	173.1	-98.9	-82.3	152.7	0	0	112.5	D122 C128 L130	D122-E126 WeakPolarHBondContact O-CB 3.49Å; D122-E126 PolarHBondContact O-N 3.42Å; E126-C128 VanDerWaalsContact C-N 3.32Å; E126-C128 PolarHBondContact O-N 3.31Å; E126-L130 WeakPolarHBondContact O-CB 3.49Å; E126-L130 WeakPolarHBondContact O-CG 3.22Å; E126-L130 PolarHBondContact O-N 3.48Å; E126-L130 VanDerWaalsContact O-N 3.1Å; E126-L130 WeakPolarHBondContact OE2-CD1 3.48Å
127	S	36.9	Very low	32.3	Very low	47 Å²	47	115.2 Å²	115.2	33%	0.329	57%	0.57	S	S	.	*	H	α-helix	trans	-71	-22.8	-179	85.8	0	0	0	0	114.9	K123 L124 Y125	K123-S127 PolarHBondContact O-N 3.27Å; L124-S127 PolarHBondContact O-OG 3.33Å; Y125-S127 VanDerWaalsContact C-N 3.35Å; Y125-S127 PolarHBondContact O-N 3.19Å
128	C	32.8	Very low	32.3	Very low	71 Å²	71	113.8 Å²	113.8	48%	0.48	58%	0.576	S	S	.	*	H	α-helix	trans	-95	-33.4	177.4	-75.7	0	0	0	0	111.9	L124 Y125 E126 R131 I132	L124-C128 PolarHBondContact O-N 3.04Å; Y125-C128 PolarHBondContact O-N 3.26Å; E126-C128 VanDerWaalsContact C-N 3.32Å; E126-C128 PolarHBondContact O-N 3.31Å; C128-R131 PolarHBondContact O-N 2.95Å; C128-I132 WeakPolarHBondContact O-CG1 3.43Å; C128-I132 PolarHBondContact O-N 3.47Å
129	Y	35.5	Very low	32.2	Very low	114 Å²	114	114.9 Å²	114.9	45%	0.447	59%	0.588	S	S	.	*	H	α-helix	trans	-69.9	-42.7	177.8	-170.3	-99.7	0	0	0	111.6	Y125 R131 I132 H133	Y125-Y129 HydrophobicContact CE1-CD2 4.17Å; Y125-Y129 HydrophobicContact CE1-CG 4.44Å; Y125-Y129 WeakPolarHBondContact O-CB 3.4Å; Y125-Y129 PolarHBondContact O-N 3.41Å; Y129-R131 PolarHBondContact O-N 3.13Å; Y129-I132 PolarHBondContact O-N 3.22Å; Y129-H133 AromaticContact CE2-CD2 3.79Å; Y129-H133 AromaticContact CZ-CD2 3.97Å; Y129-H133 PolarHBondContact O-N 3.44Å; Y129-H133 VanDerWaalsContact O-N 3.14Å
130	L	35.4	Very low	32	Very low	89 Å²	89	118.8 Å²	118.8	47%	0.466	60%	0.604	S	S	.	*	H	α-helix	trans	-69.4	-12.8	175.4	-70.7	174.1	0	0	0	114.3	E126 N134	E126-L130 WeakPolarHBondContact O-CB 3.49Å; E126-L130 WeakPolarHBondContact O-CG 3.22Å; E126-L130 PolarHBondContact O-N 3.48Å; E126-L130 VanDerWaalsContact O-N 3.1Å; E126-L130 WeakPolarHBondContact OE2-CD1 3.48Å; L130-N134 PolarHBondContact O-ND2 3.01Å
131	R	34.8	Very low	31.7	Very low	197 Å²	197	119.8 Å²	119.8	74%	0.743	62%	0.615	S	S	*	*	H	α-helix	trans	-95.4	-17.7	178.1	-132.4	-177.2	-72.4	-157.8	-2.9	113.6	C128 Y129	C128-R131 PolarHBondContact O-N 2.95Å; Y129-R131 PolarHBondContact O-N 3.13Å
132	I	34.5	Very low	31.6	Very low	126 Å²	126	124.3 Å²	124.3	65%	0.646	63%	0.631	S	S	*	*	H	α-helix	trans	-101.3	-22.8	178.8	-65.3	169.8	0	0	0	111	C128 Y129	C128-I132 WeakPolarHBondContact O-CG1 3.43Å; C128-I132 PolarHBondContact O-N 3.47Å; Y129-I132 PolarHBondContact O-N 3.22Å
133	H	31.9	Very low	31.3	Very low	102 Å²	102	126.4 Å²	126.4	47%	0.472	64%	0.642	S	S	.	*	S	Bend	trans	-107.2	4.1	-176.5	-90.9	-76.4	0	0	0	116.4	Y129	Y129-H133 AromaticContact CE2-CD2 3.79Å; Y129-H133 AromaticContact CZ-CD2 3.97Å; Y129-H133 PolarHBondContact O-N 3.44Å; Y129-H133 VanDerWaalsContact O-N 3.14Å
134	N	30.3	Very low	30.9	Very low	118 Å²	118	127.1 Å²	127.1	63%	0.631	65%	0.653	S	S	*	*	S	Bend	trans	-89.8	3	170.6	-91.3	-30.1	0	0	0	114.7	L130	L130-N134 PolarHBondContact O-ND2 3.01Å
135	D	30.4	Very low	30.6	Very low	143 Å²	143	131.1 Å²	131.1	77%	0.765	67%	0.667	S	S	*	*	S	Bend	trans	-101.9	23	176	-74.4	-20.8	0	0	0	113.7
136	N	27	Very low	30.1	Very low	139 Å²	139	130.9 Å²	130.9	74%	0.743	68%	0.676	S	S	*	*	S	Bend	trans	-132	14.8	174.7	-89.4	-29.3	0	0	0	115.6
137	N	25.6	Very low	29.8	Very low	140 Å²	140	132.4 Å²	132.4	75%	0.749	69%	0.688	S	S	*	*	S	Bend	trans	-129.3	121.3	168.5	-80	-33.6	0	0	0	111
138	N	26.6	Very low	29.5	Very low	153 Å²	153	136.9 Å²	136.9	82%	0.818	71%	0.708	S	S	*	*			trans	87.2	84.6	170.3	-58.5	-18	0	0	0	117.2
139	S	27.2	Very low	29.2	Very low	106 Å²	106	142.3 Å²	142.3	74%	0.741	72%	0.72	S	S	*	*			trans	-40.1	137.9	131.7	-48.9	0	0	0	0	110.4
140	N	25.5	Very low	28.9	Very low	143 Å²	143	141.9 Å²	141.9	77%	0.765	73%	0.729	S	S	*	*			trans	103.6	77.8	171.2	-48.8	-21.9	0	0	0	115.7
141	N	25.8	Very low	28.6	Very low	163 Å²	163	148.4 Å²	148.4	87%	0.872	75%	0.748	S	S	*	*				169.4	123.7	111.4	-92.6	-30.8	0	0	0	111.1
142	L	28.7	Very low	28.3	Very low	152 Å²	152	146.1 Å²	146.1	80%	0.796	75%	0.749	S	S	*	*			trans	-66.6	161.9	163.5	-103.3	78.7	0	0	0	110.3
143	D	27.1	Very low	28.1	Very low	142 Å²	142	146.7 Å²	146.7	76%	0.759	75%	0.749	S	S	*	*	S	Bend	trans	87.5	66.5	164.9	-49.5	-28.2	0	0	0	118.1
144	N	26.9	Very low	27.9	Very low	166 Å²	166	148 Å²	148	89%	0.888	76%	0.76	S	S	*	*	S	Bend	trans	-176.6	27.5	143.7	-106.3	-30.2	0	0	0	119
145	K	28.6	Very low	27.8	Very low	176 Å²	176	150.6 Å²	150.6	77%	0.765	77%	0.768	S	S	*	*			trans	-126.3	37.8	-177.4	-78.8	-173.9	-179.8	173.1	0	116.6
146	N	27.2	Very low	27.9	Very low	149 Å²	149	154.2 Å²	154.2	80%	0.797	77%	0.773	S	S	*	*	S	Bend	trans	-93.2	2.5	173.4	-88.1	-6.4	0	0	0	116.2
147	N	28.1	Very low	27.9	Very low	145 Å²	145	153.6 Å²	153.6	78%	0.775	77%	0.774	S	S	*	*	S	Bend	trans	-115.2	5.8	-174.6	-71.3	-13.3	0	0	0	116.4
148	N	28.9	Very low	28	Very low	140 Å²	140	149.5 Å²	149.5	75%	0.749	77%	0.765	S	S	*	*	S	Bend	trans	-119.4	1.3	177	-76.3	-21.9	0	0	0	114.3
149	Y	28.2	Very low	28.2	Very low	186 Å²	186	150.4 Å²	150.4	73%	0.729	77%	0.769	S	S	*	*	S	Bend	trans	-83.5	-12.2	178.3	-93.8	-85.2	0	0	0	113.9
150	T	29	Very low	28.2	Very low	105 Å²	105	152.1 Å²	152.1	64%	0.644	77%	0.77	S	S	*	*	S	Bend	trans	-108.1	9.2	-171.5	31	0	0	0	0	115.1
151	R	28.3	Very low	28.5	Very low	226 Å²	226	148.8 Å²	148.8	85%	0.853	76%	0.762	S	S	*	*	S	Bend	trans	-120.9	3.8	-179.4	-152.9	171.7	176.2	170.2	-0.6	115.6
152	L	29.7	Very low	28.8	Very low	149 Å²	149	147.2 Å²	147.2	78%	0.78	75%	0.752	S	S	*	*	S	Bend	trans	-119.9	7.4	176.8	-74	166.9	0	0	0	113.2
153	Q	29.5	Very low	28.8	Very low	138 Å²	138	144.5 Å²	144.5	65%	0.645	74%	0.744	S	S	*	*	S	Bend	trans	-87.7	-9.3	175.4	-93.7	-178.6	-25.3	0	0	114
154	D	27	Very low	28.9	Very low	130 Å²	130	143.2 Å²	143.2	70%	0.695	74%	0.741	S	S	*	*	S	Bend	trans	-105.2	1.8	-170.4	-66.6	-27	0	0	0	115.6
155	E	29	Very low	29.1	Very low	171 Å²	171	139.5 Å²	139.5	80%	0.799	73%	0.727	S	S	*	*	S	Bend	trans	-118.9	8.1	-178.7	-73.1	-172.8	164.9	0	0	115.7
156	Y	31.6	Very low	29.2	Very low	220 Å²	220	136.3 Å²	136.3	86%	0.863	72%	0.718	S	S	*	*			trans	-127.8	31.6	174.4	-85.2	-84.9	0	0	0	113.8	G158	Y156-G158 PolarHBondContact O-N 3.21Å
157	T	27.8	Very low	29.5	Very low	125 Å²	125	138.2 Å²	138.2	77%	0.767	72%	0.719	S	S	*	*			trans	-91.9	77.2	166.1	46.3	0	0	0	0	109.7
158	G	28.3	Very low	29.7	Very low	55 Å²	55	135.3 Å²	135.3	57%	0.567	71%	0.709	S	S	*	*			trans	-163.1	120.7	178	0	0	0	0	0	112.9	Y156 N160	Y156-G158 PolarHBondContact O-N 3.21Å; G158-N160 PolarHBondContact O-N 3.46Å
159	L	29.1	Very low	29.8	Very low	171 Å²	171	132.8 Å²	132.8	90%	0.895	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.8	22	-177.6	-87.3	146.9	0	0	0	118
160	N	28.3	Very low	29.9	Very low	142 Å²	142	131.6 Å²	131.6	76%	0.759	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	11.7	-169.2	-73.3	-22.6	0	0	0	116.4	G158 P163	G158-N160 PolarHBondContact O-N 3.46Å; N160-P163 WeakPolarHBondContact O-CD 3.48Å
161	A	31.3	Very low	29.9	Very low	74 Å²	74	131.1 Å²	131.1	61%	0.612	69%	0.692	S	S	*	*	S	Bend	trans	-88.2	3.3	177.7	0	0	0	0	0	115.4
162	I	31.4	Very low	30	Very low	129 Å²	129	123 Å²	123	66%	0.662	67%	0.668	S	S	*	*	S	Bend	trans	-90.9	-21.9	-173.6	-61.7	178.6	0	0	0	115.5	T164	I162-T164 PolarHBondContact O-N 3.48Å
163	P	28.8	Very low	30.1	Very low	95 Å²	95	119.7 Å²	119.7	62%	0.617	66%	0.657	S	S	*	*	S	Bend	trans	-78.9	-13.7	-176.4	-18.2	32.7	0	0	0	117.1	N160	N160-P163 WeakPolarHBondContact O-CD 3.48Å
164	T	30	Very low	30.2	Very low	115 Å²	115	119.2 Å²	119.2	71%	0.706	66%	0.658	S	S	*	*	S	Bend	trans	-92.9	-17	-172.6	-17	0	0	0	0	113.9	I162	I162-T164 PolarHBondContact O-N 3.48Å
165	C	30.4	Very low	30.3	Very low	88 Å²	88	122.1 Å²	122.1	60%	0.595	66%	0.661	S	S	*	*	S	Bend	trans	-83.8	-19.7	-179.3	-74.5	0	0	0	0	114.3
166	L	31.9	Very low	30.3	Very low	109 Å²	109	118.4 Å²	118.4	57%	0.571	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-23.9	-177	-92.3	144.4	0	0	0	114	Y169	L166-Y169 WeakPolarHBondContact O-CB 3.39Å
167	K	34	Very low	30.2	Very low	189 Å²	189	110 Å²	110	82%	0.822	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-19.8	179.2	-81.1	-179.1	176.4	177.5	0	114
168	C	32.2	Very low	30.5	Very low	84 Å²	84	110.6 Å²	110.6	57%	0.568	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-8.4	174.4	-65.3	0	0	0	0	113.6	H170 S171	C168-H170 VanDerWaalsContact C-N 3.25Å; C168-H170 PolarHBondContact O-N 3.16Å; C168-S171 PolarHBondContact O-N 3.17Å; C168-S171 PolarHBondContact O-OG 3.07Å
169	Y	31.1	Very low	30.7	Very low	88 Å²	88	111 Å²	111	35%	0.345	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.4	-27	-179	-173	-99.6	0	0	0	113.5	L166 Q177	L166-Y169 WeakPolarHBondContact O-CB 3.39Å; Y169-Q177 HydrophobicContact CE2-CG 4.43Å; Y169-Q177 PolarHBondContact O-NE2 3.39Å
170	H	30.2	Very low	30.9	Very low	160 Å²	160	106.4 Å²	106.4	74%	0.741	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	2	-175.2	-70.9	-69.1	0	0	0	114.8	C168	C168-H170 VanDerWaalsContact C-N 3.25Å; C168-H170 PolarHBondContact O-N 3.16Å
171	S	29.1	Very low	31.3	Very low	95 Å²	95	105 Å²	105	66%	0.664	56%	0.564	S	S	*	*	S	Bend	trans	-124.1	8.8	-173.3	49.4	0	0	0	0	115.7	C168	C168-S171 PolarHBondContact O-N 3.17Å; C168-S171 PolarHBondContact O-OG 3.07Å
172	T	28.4	Very low	31.6	Very low	57 Å²	57	107.4 Å²	107.4	35%	0.35	56%	0.56	S	S	.	*	S	Bend	trans	-118.8	150	-178.3	52.3	0	0	0	0	113.2
173	S	32.1	Very low	31.9	Very low	79 Å²	79	108.4 Å²	108.4	55%	0.552	56%	0.557	S	S	*	*			trans	-66.9	150.3	-176.8	66.8	0	0	0	0	112.2	Y175 Q176	S173-Y175 PolarHBondContact O-N 2.98Å; S173-Q176 PolarHBondContact O-N 3.45Å
174	N	31.5	Very low	32.3	Very low	127 Å²	127	108.4 Å²	108.4	68%	0.679	55%	0.551	S	S	*	*	H	α-helix	trans	-48.3	-25.5	-172.3	-77.6	-13.8	0	0	0	115.6
175	Y	29.8	Very low	32.7	Very low	191 Å²	191	108.8 Å²	108.8	75%	0.749	54%	0.543	S	S	*	.	H	α-helix	trans	-73.5	-35.8	179.5	-169.5	-97.7	0	0	0	113	S173	S173-Y175 PolarHBondContact O-N 2.98Å
176	Q	29.3	Very low	33	Very low	94 Å²	94	108.7 Å²	108.7	44%	0.439	54%	0.537	S	S	.	.	H	α-helix	trans	-79.3	-22.1	-179.3	-67.6	-170.6	-26.7	0	0	113	S173 Y178 S179 V180	S173-Q176 PolarHBondContact O-N 3.45Å; Q176-Y178 VanDerWaalsContact C-N 3.34Å; Q176-S179 PolarHBondContact O-OG 2.82Å; Q176-V180 WeakPolarHBondContact O-CG2 3.4Å; Q176-V180 PolarHBondContact O-N 3.02Å
177	Q	30.3	Very low	33.2	Very low	43 Å²	43	107.5 Å²	107.5	20%	0.201	53%	0.528	C	S	.	.	H	α-helix	trans	-69.3	-31.5	173.7	-68.9	179	-19.6	0	0	112.4	Y169 Q181	Y169-Q177 HydrophobicContact CE2-CG 4.43Å; Y169-Q177 PolarHBondContact O-NE2 3.39Å; Q177-Q181 WeakPolarHBondContact O-CB 3.46Å; Q177-Q181 PolarHBondContact O-N 2.79Å; Q177-Q181 VanDerWaalsContact O-N 3.08Å
178	Y	32.9	Very low	33	Very low	137 Å²	137	102.3 Å²	102.3	54%	0.537	51%	0.513	S	S	.	.	H	α-helix	trans	-70.9	-39.9	-179.5	-174.1	-97.2	0	0	0	112.9	Q176 K182	Q176-Y178 VanDerWaalsContact C-N 3.34Å; Y178-K182 WeakPolarHBondContact O-CB 3.49Å; Y178-K182 PolarHBondContact O-N 3.26Å
179	S	31.8	Very low	33.1	Very low	65 Å²	65	100.9 Å²	100.9	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-69.6	-37.7	178.7	29.8	0	0	0	0	112.4	Q176 K182 Y183	Q176-S179 PolarHBondContact O-OG 2.82Å; S179-K182 PolarHBondContact O-N 3.47Å; S179-Y183 PolarHBondContact O-N 3.11Å
180	V	34.8	Very low	33.3	Very low	74 Å²	74	100.3 Å²	100.3	45%	0.448	51%	0.509	S	S	.	.	H	α-helix	trans	-70.4	-39.3	175.4	177.7	0	0	0	0	111.5	Q176 K182 Y183 L184	Q176-V180 WeakPolarHBondContact O-CG2 3.4Å; Q176-V180 PolarHBondContact O-N 3.02Å; V180-K182 VanDerWaalsContact C-N 3.33Å; V180-K182 PolarHBondContact O-N 2.97Å; V180-Y183 PolarHBondContact O-N 3.17Å; V180-L184 HydrophobicContact CG1-CD1 3.97Å; V180-L184 HydrophobicContact CG1-CG 4.47Å; V180-L184 WeakPolarHBondContact O-CG 3.41Å; V180-L184 PolarHBondContact O-N 3.23Å
181	Q	35.6	Very low	33.2	Very low	112 Å²	112	96.8 Å²	96.8	52%	0.523	50%	0.496	S	S	.	.	H	α-helix	trans	-61.9	-39.6	172.9	-99.3	-177.5	-17	0	0	112.7	Q177 F185	Q177-Q181 WeakPolarHBondContact O-CB 3.46Å; Q177-Q181 PolarHBondContact O-N 2.79Å; Q177-Q181 VanDerWaalsContact O-N 3.08Å; Q181-F185 WeakPolarHBondContact O-CB 3Å; Q181-F185 PolarHBondContact O-N 3.15Å; Q181-F185 VanDerWaalsContact O-N 3.11Å
182	K	37.7	Very low	33.3	Very low	125 Å²	125	98.8 Å²	98.8	54%	0.543	50%	0.496	S	S	.	.	H	α-helix	trans	-65.5	-45	176.9	-169.8	175.4	177.6	-176.2	0	111.5	Y178 S179 V180 L184 F185 D186	Y178-K182 WeakPolarHBondContact O-CB 3.49Å; Y178-K182 PolarHBondContact O-N 3.26Å; S179-K182 PolarHBondContact O-N 3.47Å; V180-K182 VanDerWaalsContact C-N 3.33Å; V180-K182 PolarHBondContact O-N 2.97Å; K182-L184 PolarHBondContact O-N 3.37Å; K182-F185 WeakPolarHBondContact O-CB 3.3Å; K182-F185 PolarHBondContact O-N 2.86Å; K182-D186 PolarHBondContact O-N 3.35Å
183	Y	38	Very low	33.5	Very low	149 Å²	149	102.7 Å²	102.7	58%	0.584	52%	0.515	S	S	*	.	H	α-helix	trans	-61.5	-41.4	177.3	-178.2	-99.7	0	0	0	113.2	S179 V180 F185 D186 Q187	S179-Y183 PolarHBondContact O-N 3.11Å; V180-Y183 PolarHBondContact O-N 3.17Å; Y183-F185 VanDerWaalsContact C-N 3.33Å; Y183-F185 PolarHBondContact O-N 3.13Å; Y183-D186 PolarHBondContact O-N 3.22Å; Y183-Q187 HydrophobicContact CD1-CG 4.47Å; Y183-Q187 HydrophobicContact CE1-CG 4.16Å; Y183-Q187 WeakPolarHBondContact O-CG 3.43Å; Y183-Q187 PolarHBondContact O-N 2.89Å; Y183-Q187 VanDerWaalsContact O-N 3.16Å
184	L	37.1	Very low	33.5	Very low	95 Å²	95	106.5 Å²	106.5	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-69.1	-30.6	176.8	-69.5	168.7	0	0	0	112.9	V180 K182 T188	V180-L184 HydrophobicContact CG1-CD1 3.97Å; V180-L184 HydrophobicContact CG1-CG 4.47Å; V180-L184 WeakPolarHBondContact O-CG 3.41Å; V180-L184 PolarHBondContact O-N 3.23Å; K182-L184 PolarHBondContact O-N 3.37Å; L184-T188 WeakPolarHBondContact O-CG2 3.42Å; L184-T188 PolarHBondContact O-N 3.26Å; L184-T188 VanDerWaalsContact O-N 3.16Å; L184-T188 PolarHBondContact O-OG1 2.88Å
185	F	38.6	Very low	33.4	Very low	123 Å²	123	108.5 Å²	108.5	54%	0.539	53%	0.527	S	S	.	.	H	α-helix	trans	-71.1	-37.5	175.4	-174.5	-94.5	0	0	0	112.2	Q181 K182 Y183 T188 S189	Q181-F185 WeakPolarHBondContact O-CB 3Å; Q181-F185 PolarHBondContact O-N 3.15Å; Q181-F185 VanDerWaalsContact O-N 3.11Å; K182-F185 WeakPolarHBondContact O-CB 3.3Å; K182-F185 PolarHBondContact O-N 2.86Å; Y183-F185 VanDerWaalsContact C-N 3.33Å; Y183-F185 PolarHBondContact O-N 3.13Å; F185-T188 PolarHBondContact O-OG1 3.05Å; F185-T188 VanDerWaalsContact O-OG1 3.13Å; F185-S189 WeakPolarHBondContact O-CB 3.43Å; F185-S189 PolarHBondContact O-N 2.62Å; F185-S189 VanDerWaalsContact O-N 3.17Å; F185-S189 PolarHBondContact O-OG 3.15Å
186	D	37.4	Very low	33.4	Very low	86 Å²	86	105.8 Å²	105.8	46%	0.46	52%	0.519	S	S	.	.	H	α-helix	trans	-71.5	-35.2	178.2	-65.6	-22.8	0	0	0	111.7	K182 Y183 T190	K182-D186 PolarHBondContact O-N 3.35Å; Y183-D186 PolarHBondContact O-N 3.22Å; D186-T190 PolarHBondContact O-N 3.42Å; D186-T190 PolarHBondContact O-OG1 3.22Å
187	Q	34.7	Very low	33.3	Very low	84 Å²	84	110.9 Å²	110.9	39%	0.393	54%	0.542	S	S	.	.	H	α-helix	trans	-68	-44.6	174.7	-73.2	-86.7	-32.7	0	0	112.8	Y183 S189 T190 D191	Y183-Q187 HydrophobicContact CD1-CG 4.47Å; Y183-Q187 HydrophobicContact CE1-CG 4.16Å; Y183-Q187 WeakPolarHBondContact O-CG 3.43Å; Y183-Q187 PolarHBondContact O-N 2.89Å; Y183-Q187 VanDerWaalsContact O-N 3.16Å; Q187-S189 VanDerWaalsContact C-N 3.3Å; Q187-S189 PolarHBondContact O-N 3.37Å; Q187-T190 WeakPolarHBondContact CA-OG1 3.13Å; Q187-T190 PolarHBondContact O-N 2.92Å; Q187-T190 PolarHBondContact O-OG1 3.42Å; Q187-D191 PolarHBondContact O-N 3.47Å
188	T	31.3	Very low	33.1	Very low	81 Å²	81	113.4 Å²	113.4	50%	0.497	56%	0.556	S	S	.	*	H	α-helix	trans	-68.4	-29.7	178.1	46.3	0	0	0	0	112.8	L184 F185 M192	L184-T188 WeakPolarHBondContact O-CG2 3.42Å; L184-T188 PolarHBondContact O-N 3.26Å; L184-T188 VanDerWaalsContact O-N 3.16Å; L184-T188 PolarHBondContact O-OG1 2.88Å; F185-T188 PolarHBondContact O-OG1 3.05Å; F185-T188 VanDerWaalsContact O-OG1 3.13Å; T188-M192 WeakPolarHBondContact O-CG 3.39Å; T188-M192 PolarHBondContact O-N 3.31Å
189	S	34.1	Very low	32.8	Very low	53 Å²	53	112 Å²	112	37%	0.371	56%	0.564	S	S	.	*	H	α-helix	trans	-71	-28.6	173	-64.6	0	0	0	0	113.1	F185 Q187 N193	F185-S189 WeakPolarHBondContact O-CB 3.43Å; F185-S189 PolarHBondContact O-N 2.62Å; F185-S189 VanDerWaalsContact O-N 3.17Å; F185-S189 PolarHBondContact O-OG 3.15Å; Q187-S189 VanDerWaalsContact C-N 3.3Å; Q187-S189 PolarHBondContact O-N 3.37Å; S189-N193 PolarHBondContact O-ND2 2.81Å; S189-N193 VanDerWaalsContact O-ND2 3.11Å
190	T	34.1	Very low	32.6	Very low	76 Å²	76	115.6 Å²	115.6	47%	0.466	58%	0.578	S	S	.	*	H	α-helix	trans	-82.5	-34.9	177.6	26	0	0	0	0	112.6	D186 Q187 N193	D186-T190 PolarHBondContact O-N 3.42Å; D186-T190 PolarHBondContact O-OG1 3.22Å; Q187-T190 WeakPolarHBondContact CA-OG1 3.13Å; Q187-T190 PolarHBondContact O-N 2.92Å; Q187-T190 PolarHBondContact O-OG1 3.42Å; T190-N193 PolarHBondContact O-N 3.13Å
191	D	29.7	Very low	32.3	Very low	87 Å²	87	119.8 Å²	119.8	47%	0.465	59%	0.592	S	S	.	*	H	α-helix	trans	-72.2	-33.7	176.7	-78.9	-18.8	0	0	0	113.5	Q187 N193 K194	Q187-D191 PolarHBondContact O-N 3.47Å; D191-N193 PolarHBondContact O-N 2.88Å; D191-K194 PolarHBondContact O-N 3.35Å; D191-K194 VanDerWaalsContact O-N 3.16Å
192	M	29.7	Very low	31.8	Very low	137 Å²	137	121.5 Å²	121.5	68%	0.675	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-22.2	174.6	-74.7	-76.6	-84.4	0	0	113.3	T188	T188-M192 WeakPolarHBondContact O-CG 3.39Å; T188-M192 PolarHBondContact O-N 3.31Å
193	N	32.9	Very low	31.4	Very low	139 Å²	139	119.2 Å²	119.2	74%	0.743	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-15.2	177.3	-74.7	-34.1	0	0	0	113.5	S189 T190 D191	S189-N193 PolarHBondContact O-ND2 2.81Å; S189-N193 VanDerWaalsContact O-ND2 3.11Å; T190-N193 PolarHBondContact O-N 3.13Å; D191-N193 PolarHBondContact O-N 2.88Å
194	K	32.7	Very low	31.1	Very low	158 Å²	158	116.4 Å²	116.4	69%	0.687	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-20.9	-180	-75.1	-179.2	178	176	0	114.3	D191	D191-K194 PolarHBondContact O-N 3.35Å; D191-K194 VanDerWaalsContact O-N 3.16Å
195	H	28.6	Very low	30.7	Very low	170 Å²	170	116.1 Å²	116.1	79%	0.787	59%	0.593	S	S	*	*			trans	-100.6	34.7	-172.9	-80.7	-58.7	0	0	0	116.2
196	K	30.8	Very low	30.4	Very low	134 Å²	134	115.2 Å²	115.2	58%	0.583	59%	0.588	S	S	*	*			trans	-119.2	84	170.2	-76.2	-174.1	179.2	176.2	0	112.9	I198	K196-I198 HydrophobicContact CB-CG1 4.46Å; K196-I198 HydrophobicContact CD-CD1 4.2Å; K196-I198 HydrophobicContact CG-CD1 4.08Å; K196-I198 HydrophobicContact CG-CG1 4.41Å; K196-I198 PolarHBondContact O-N 3.36Å
197	Q	26.9	Very low	30	Very low	200 Å²	200	119.1 Å²	119.1	94%	0.935	60%	0.597	S	S	*	*			trans	-78.2	92.2	142	-70.1	-176.4	22.1	0	0	107.2
198	I	26	Very low	29.8	Very low	96 Å²	96	120.4 Å²	120.4	49%	0.492	61%	0.606	S	S	.	*			trans	-133.6	133	168.1	-59.5	179.7	0	0	0	106.7	K196	K196-I198 HydrophobicContact CB-CG1 4.46Å; K196-I198 HydrophobicContact CD-CD1 4.2Å; K196-I198 HydrophobicContact CG-CD1 4.08Å; K196-I198 HydrophobicContact CG-CG1 4.41Å; K196-I198 PolarHBondContact O-N 3.36Å
199	P	25.8	Very low	29.8	Very low	107 Å²	107	120.7 Å²	120.7	70%	0.695	61%	0.605	S	S	*	*			trans	-58.3	149.9	-165.1	-24.6	33.8	0	0	0	115.6	H201 F202	P199-H201 PolarHBondContact O-N 3.32Å; P199-F202 PolarHBondContact O-N 2.95Å
200	D	28.2	Very low	30	Very low	142 Å²	142	122.4 Å²	122.4	76%	0.759	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-55.5	-5.3	-166.4	-76.2	-44.2	0	0	0	117.8	F202	D200-F202 PolarHBondContact O-N 3.35Å
201	H	28.5	Very low	30	Very low	161 Å²	161	125.9 Å²	125.9	75%	0.745	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-78	-17.3	-179.6	-150.5	-7.7	0	0	0	114.2	P199	P199-H201 PolarHBondContact O-N 3.32Å
202	F	25.8	Very low	30.2	Very low	149 Å²	149	126.3 Å²	126.3	65%	0.654	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-94.3	-2.3	-177.5	-87.9	-82.9	0	0	0	115.4	P199 D200	P199-F202 PolarHBondContact O-N 2.95Å; D200-F202 PolarHBondContact O-N 3.35Å
203	N	29	Very low	30.6	Very low	77 Å²	77	124 Å²	124	41%	0.412	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.5	-9	-175.4	-83.1	-28.8	0	0	0	114.9	R207	N203-R207 PolarHBondContact O-NH1 3.4Å; N203-R207 VanDerWaalsContact O-NH1 3.08Å
204	T	31.3	Very low	30.7	Very low	89 Å²	89	123.9 Å²	123.9	55%	0.546	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.9	-45.3	174.6	46.2	0	0	0	0	111.4	K206	T204-K206 VanDerWaalsContact C-N 3.28Å; T204-K206 PolarHBondContact O-N 3.31Å
205	V	28.8	Very low	30.9	Very low	90 Å²	90	121.1 Å²	121.1	55%	0.545	60%	0.598	S	S	.	*	H	α-helix	trans	-70.3	-19.8	-178.1	-176.5	0	0	0	0	113.6	N209	V205-N209 PolarHBondContact O-ND2 3.2Å
206	K	32.4	Very low	31.1	Very low	103 Å²	103	116.3 Å²	116.3	45%	0.448	58%	0.581	S	S	.	*	H	α-helix	trans	-83.9	-26.3	-179.1	-97.4	-178	180	172.6	0	115.1	T204 I210	T204-K206 VanDerWaalsContact C-N 3.28Å; T204-K206 PolarHBondContact O-N 3.31Å; K206-I210 WeakPolarHBondContact O-CB 3.46Å; K206-I210 VanDerWaalsContact O-CD1 3.3Å; K206-I210 WeakPolarHBondContact O-CD1 3.47Å; K206-I210 WeakPolarHBondContact O-CG1 3.42Å; K206-I210 PolarHBondContact O-N 2.77Å; K206-I210 VanDerWaalsContact O-N 3.13Å
207	R	29.6	Very low	31.3	Very low	169 Å²	169	112.9 Å²	112.9	64%	0.638	57%	0.574	S	S	*	*	H	α-helix	trans	-73	-43.3	-179.4	-74.3	-172.6	-179.3	97.1	-7.1	110.6	N203 N209 I210 E211	N203-R207 PolarHBondContact O-NH1 3.4Å; N203-R207 VanDerWaalsContact O-NH1 3.08Å; R207-N209 PolarHBondContact O-N 3Å; R207-I210 PolarHBondContact O-N 2.75Å; R207-E211 PolarHBondContact O-N 2.56Å
208	D	30.4	Very low	31.6	Very low	111 Å²	111	109 Å²	109	59%	0.594	56%	0.557	S	S	*	*	H	α-helix	trans	-65	-40.4	179	-53.9	-17.3	0	0	0	111	I210 D212	D208-I210 PolarHBondContact O-N 3.36Å; D208-D212 WeakPolarHBondContact O-CB 3.42Å; D208-D212 PolarHBondContact O-N 3.21Å
209	N	31.6	Very low	31.7	Very low	87 Å²	87	108.3 Å²	108.3	47%	0.465	55%	0.551	S	S	.	*	H	α-helix	trans	-72.9	-24.7	176.5	-77.9	-55.1	0	0	0	114.7	V205 R207 V213	V205-N209 PolarHBondContact O-ND2 3.2Å; R207-N209 PolarHBondContact O-N 3Å; N209-V213 VanDerWaalsContact O-CB 3.23Å; N209-V213 WeakPolarHBondContact O-CB 3.43Å; N209-V213 WeakPolarHBondContact O-CG2 3.4Å; N209-V213 PolarHBondContact O-N 3.33Å
210	I	36.3	Very low	32	Very low	89 Å²	89	108.6 Å²	108.6	46%	0.456	55%	0.547	S	S	.	.	H	α-helix	trans	-79.2	-35.4	178.4	-72.5	166.4	0	0	0	110.7	K206 R207 D208 K214	K206-I210 WeakPolarHBondContact O-CB 3.46Å; K206-I210 VanDerWaalsContact O-CD1 3.3Å; K206-I210 WeakPolarHBondContact O-CD1 3.47Å; K206-I210 WeakPolarHBondContact O-CG1 3.42Å; K206-I210 PolarHBondContact O-N 2.77Å; K206-I210 VanDerWaalsContact O-N 3.13Å; R207-I210 PolarHBondContact O-N 2.75Å; D208-I210 PolarHBondContact O-N 3.36Å; I210-K214 HydrophobicContact CG2-CD 4.28Å; I210-K214 WeakPolarHBondContact O-CB 3.26Å; I210-K214 VanDerWaalsContact O-CG 3.23Å; I210-K214 WeakPolarHBondContact O-CG 3.45Å; I210-K214 PolarHBondContact O-N 2.94Å
211	E	35	Very low	32.1	Very low	148 Å²	148	106.9 Å²	106.9	69%	0.692	54%	0.537	S	S	*	.	H	α-helix	trans	-69.7	-43.1	170	-71.3	-157.3	161.5	0	0	111.1	R207 V213 K214 Q215	R207-E211 PolarHBondContact O-N 2.56Å; E211-V213 VanDerWaalsContact C-N 3.34Å; E211-V213 PolarHBondContact O-N 2.61Å; E211-K214 PolarHBondContact O-N 3.28Å; E211-Q215 WeakPolarHBondContact O-CB 3.39Å; E211-Q215 PolarHBondContact O-N 2.76Å
212	D	33.7	Very low	32.2	Very low	96 Å²	96	105 Å²	105	51%	0.513	53%	0.529	S	S	.	.	H	α-helix	trans	-63.4	-36.1	175.4	-77	-19	0	0	0	112.9	D208 T216	D208-D212 WeakPolarHBondContact O-CB 3.42Å; D208-D212 PolarHBondContact O-N 3.21Å; D212-T216 WeakPolarHBondContact O-CB 3.5Å; D212-T216 PolarHBondContact O-N 3.28Å; D212-T216 PolarHBondContact O-OG1 3.31Å
213	V	38	Very low	32.3	Very low	90 Å²	90	104.3 Å²	104.3	55%	0.545	53%	0.528	S	S	.	.	H	α-helix	trans	-74	-33.9	175.1	169.8	0	0	0	0	111.9	N209 E211 S217	N209-V213 VanDerWaalsContact O-CB 3.23Å; N209-V213 WeakPolarHBondContact O-CB 3.43Å; N209-V213 WeakPolarHBondContact O-CG2 3.4Å; N209-V213 PolarHBondContact O-N 3.33Å; E211-V213 VanDerWaalsContact C-N 3.34Å; E211-V213 PolarHBondContact O-N 2.61Å; V213-S217 WeakPolarHBondContact O-CB 3.37Å; V213-S217 PolarHBondContact O-N 2.96Å
214	K	36.4	Very low	32.4	Very low	136 Å²	136	110.1 Å²	110.1	59%	0.591	54%	0.544	S	S	*	.	H	α-helix	trans	-68.6	-42.5	172.4	-78.5	175.5	-179.9	-179.6	0	111.1	I210 E211 S217 M218	I210-K214 HydrophobicContact CG2-CD 4.28Å; I210-K214 WeakPolarHBondContact O-CB 3.26Å; I210-K214 VanDerWaalsContact O-CG 3.23Å; I210-K214 WeakPolarHBondContact O-CG 3.45Å; I210-K214 PolarHBondContact O-N 2.94Å; E211-K214 PolarHBondContact O-N 3.28Å; K214-S217 PolarHBondContact O-N 3.03Å; K214-M218 WeakPolarHBondContact O-CB 3.28Å; K214-M218 WeakPolarHBondContact O-CG 3.43Å; K214-M218 PolarHBondContact O-N 3.3Å
215	Q	36.6	Very low	32.3	Very low	100 Å²	100	112.7 Å²	112.7	47%	0.467	55%	0.554	S	S	.	*	H	α-helix	trans	-63.7	-47.5	175.5	-168.4	68.6	20.7	0	0	110.2	E211 S217 M218 E219	E211-Q215 WeakPolarHBondContact O-CB 3.39Å; E211-Q215 PolarHBondContact O-N 2.76Å; Q215-S217 VanDerWaalsContact C-N 3.34Å; Q215-S217 PolarHBondContact O-N 3.41Å; Q215-M218 CarbonylContact O-C 3.6Å; Q215-M218 PolarHBondContact O-N 3.28Å; Q215-M218 VanDerWaalsContact O-N 3.17Å; Q215-E219 WeakPolarHBondContact CG-OE1 3.5Å; Q215-E219 PolarHBondContact NE2-OE1 3.16Å; Q215-E219 VanDerWaalsContact NE2-OE1 3.14Å; Q215-E219 VanDerWaalsContact O-CB 3.31Å; Q215-E219 WeakPolarHBondContact O-CB 3.39Å; Q215-E219 VanDerWaalsContact O-CG 3.27Å; Q215-E219 WeakPolarHBondContact O-CG 3.27Å; Q215-E219 PolarHBondContact O-N 3.44Å
216	T	33.1	Very low	32.2	Very low	68 Å²	68	112.5 Å²	112.5	42%	0.417	56%	0.556	S	S	.	*	H	α-helix	trans	-67.8	-31.2	175.9	-50.2	0	0	0	0	112.1	D212 L220	D212-T216 WeakPolarHBondContact O-CB 3.5Å; D212-T216 PolarHBondContact O-N 3.28Å; D212-T216 PolarHBondContact O-OG1 3.31Å; T216-L220 HydrophobicContact CG2-CD1 4.06Å; T216-L220 HydrophobicContact CG2-CG 4.33Å; T216-L220 VanDerWaalsContact O-CB 3.23Å; T216-L220 WeakPolarHBondContact O-CB 3.43Å; T216-L220 WeakPolarHBondContact O-CG 3.49Å; T216-L220 PolarHBondContact O-N 3.45Å
217	S	34	Very low	31.9	Very low	62 Å²	62	112.9 Å²	112.9	43%	0.434	57%	0.567	S	S	.	*	H	α-helix	trans	-76.2	-26.3	173.7	-174.4	0	0	0	0	112.8	V213 K214 Q215 N221	V213-S217 WeakPolarHBondContact O-CB 3.37Å; V213-S217 PolarHBondContact O-N 2.96Å; K214-S217 PolarHBondContact O-N 3.03Å; Q215-S217 VanDerWaalsContact C-N 3.34Å; Q215-S217 PolarHBondContact O-N 3.41Å; S217-N221 PolarHBondContact O-N 3.49Å; S217-N221 PolarHBondContact O-ND2 3.46Å
218	M	32.9	Very low	31.9	Very low	118 Å²	118	111.4 Å²	111.4	58%	0.581	58%	0.576	S	S	*	*	H	α-helix	trans	-76.3	-45	169	-79.6	175.6	136	0	0	110	K214 Q215 L220 N221 E222	K214-M218 WeakPolarHBondContact O-CB 3.28Å; K214-M218 WeakPolarHBondContact O-CG 3.43Å; K214-M218 PolarHBondContact O-N 3.3Å; Q215-M218 CarbonylContact O-C 3.6Å; Q215-M218 PolarHBondContact O-N 3.28Å; Q215-M218 VanDerWaalsContact O-N 3.17Å; M218-L220 PolarHBondContact O-N 3.11Å; M218-N221 CarbonylContact O-C 3.47Å; M218-N221 WeakPolarHBondContact O-CA 3.48Å; M218-N221 WeakPolarHBondContact O-CB 3.25Å; M218-N221 PolarHBondContact O-N 3.21Å; M218-E222 WeakPolarHBondContact O-CB 3.45Å; M218-E222 WeakPolarHBondContact O-CG 3.23Å; M218-E222 PolarHBondContact O-N 2.89Å
219	E	27.9	Very low	32	Very low	82 Å²	82	109.1 Å²	109.1	38%	0.383	58%	0.579	S	S	.	*	H	α-helix	trans	-66	-33.6	176.8	-72.7	173.5	-172.6	0	0	112.8	Q215 N221 E222 E223	Q215-E219 WeakPolarHBondContact CG-OE1 3.5Å; Q215-E219 PolarHBondContact NE2-OE1 3.16Å; Q215-E219 VanDerWaalsContact NE2-OE1 3.14Å; Q215-E219 VanDerWaalsContact O-CB 3.31Å; Q215-E219 WeakPolarHBondContact O-CB 3.39Å; Q215-E219 VanDerWaalsContact O-CG 3.27Å; Q215-E219 WeakPolarHBondContact O-CG 3.27Å; Q215-E219 PolarHBondContact O-N 3.44Å; E219-N221 VanDerWaalsContact C-N 3.29Å; E219-N221 PolarHBondContact O-N 3.47Å; E219-E222 PolarHBondContact O-N 2.92Å; E219-E223 VanDerWaalsContact O-CB 3.24Å; E219-E223 WeakPolarHBondContact O-CB 3.23Å; E219-E223 WeakPolarHBondContact O-CG 3.17Å; E219-E223 PolarHBondContact O-N 3.17Å
220	L	33.3	Very low	32.7	Very low	113 Å²	113	109 Å²	109	59%	0.592	59%	0.59	S	S	*	*	H	α-helix	trans	-74.2	-19.5	171.3	-75	169.8	0	0	0	113.2	T216 M218	T216-L220 HydrophobicContact CG2-CD1 4.06Å; T216-L220 HydrophobicContact CG2-CG 4.33Å; T216-L220 VanDerWaalsContact O-CB 3.23Å; T216-L220 WeakPolarHBondContact O-CB 3.43Å; T216-L220 WeakPolarHBondContact O-CG 3.49Å; T216-L220 PolarHBondContact O-N 3.45Å; M218-L220 PolarHBondContact O-N 3.11Å
221	N	29.6	Very low	33.9	Very low	106 Å²	106	112.5 Å²	112.5	57%	0.567	60%	0.602	S	S	*	*	H	α-helix	trans	-86.5	-32.6	168.9	-78.4	-33.6	0	0	0	111.4	S217 M218 E219 L225	S217-N221 PolarHBondContact O-N 3.49Å; S217-N221 PolarHBondContact O-ND2 3.46Å; M218-N221 CarbonylContact O-C 3.47Å; M218-N221 WeakPolarHBondContact O-CA 3.48Å; M218-N221 WeakPolarHBondContact O-CB 3.25Å; M218-N221 PolarHBondContact O-N 3.21Å; E219-N221 VanDerWaalsContact C-N 3.29Å; E219-N221 PolarHBondContact O-N 3.47Å; N221-L225 WeakPolarHBondContact O-CD1 3.35Å
222	E	29.7	Very low	36.3	Very low	123 Å²	123	109.2 Å²	109.2	58%	0.575	59%	0.592	S	S	*	*	H	α-helix	trans	-85	-33.8	-178.5	-75.2	-172.1	169.6	0	0	114.1	M218 E219 R224 L225 S226	M218-E222 WeakPolarHBondContact O-CB 3.45Å; M218-E222 WeakPolarHBondContact O-CG 3.23Å; M218-E222 PolarHBondContact O-N 2.89Å; E219-E222 PolarHBondContact O-N 2.92Å; E222-R224 PolarHBondContact O-N 3.5Å; E222-R224 VanDerWaalsContact O-N 3.11Å; E222-L225 CarbonylContact O-C 3.21Å; E222-L225 WeakPolarHBondContact O-CA 3.09Å; E222-L225 PolarHBondContact O-N 3.23Å; E222-S226 PolarHBondContact O-N 3.31Å; E222-S226 VanDerWaalsContact O-N 3.14Å
223	E	27.9	Very low	38.9	Very low	134 Å²	134	107.3 Å²	107.3	63%	0.626	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-5.5	168.9	-76.2	-167.1	150.3	0	0	111.9	E219	E219-E223 VanDerWaalsContact O-CB 3.24Å; E219-E223 WeakPolarHBondContact O-CB 3.23Å; E219-E223 WeakPolarHBondContact O-CG 3.17Å; E219-E223 PolarHBondContact O-N 3.17Å
224	R	31.9	Very low	41.5	Very low	198 Å²	198	105.7 Å²	105.7	75%	0.747	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-1.4	164.2	-103.9	-177	157	174.1	-4	114.5	E222 K231	E222-R224 PolarHBondContact O-N 3.5Å; E222-R224 VanDerWaalsContact O-N 3.11Å; R224-K231 PolarHBondContact O-NZ 3.07Å
225	L	29.4	Very low	44.3	Very low	143 Å²	143	99.2 Å²	99.2	75%	0.749	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.9	10.7	-168.4	-96	162.1	0	0	0	115.1	N221 E222	N221-L225 WeakPolarHBondContact O-CD1 3.35Å; E222-L225 CarbonylContact O-C 3.21Å; E222-L225 WeakPolarHBondContact O-CA 3.09Å; E222-L225 PolarHBondContact O-N 3.23Å
226	S	25.9	Very low	47	Very low	86 Å²	86	99 Å²	99	60%	0.601	54%	0.543	S	S	*	.	S	Bend	trans	-104.1	121.5	164.6	69.2	0	0	0	0	111.1	E222	E222-S226 PolarHBondContact O-N 3.31Å; E222-S226 VanDerWaalsContact O-N 3.14Å
227	V	26.7	Very low	49.9	Very low	112 Å²	112	96.6 Å²	96.6	68%	0.679	53%	0.526	S	S	*	.	S	Bend	trans	97.5	99	177	-166.2	0	0	0	0	114.6
228	V	29	Very low	52.5	Low	137 Å²	137	98.6 Å²	98.6	83%	0.83	53%	0.527	S	S	*	.	S	Bend	trans	83.5	104.2	154.9	-176.2	0	0	0	0	118.2
229	G	32.5	Very low	55.1	Low	63 Å²	63	99.1 Å²	99.1	65%	0.649	54%	0.542	S	S	*	.			trans	75.5	123.8	157.3	0	0	0	0	0	115.8	K231	G229-K231 PolarHBondContact O-N 2.81Å
230	A	47.4	Very low	58.1	Low	84 Å²	84	96.6 Å²	96.6	69%	0.694	53%	0.534	S	S	*	.			trans	-49.7	115.5	166.3	0	0	0	0	0	108.7	T232	A230-T232 VanDerWaalsContact C-N 3.31Å; A230-T232 PolarHBondContact O-N 3.41Å
231	K	61.9	Low	60.8	Low	163 Å²	163	98.7 Å²	98.7	71%	0.709	53%	0.534	S	S	*	.			trans	-64.4	93.7	-179	-79.9	174.2	-179.9	154.9	0	108.5	R224 G229	R224-K231 PolarHBondContact O-NZ 3.07Å; G229-K231 PolarHBondContact O-N 2.81Å
232	T	84.3	Confident	63.9	Low	79 Å²	79	98 Å²	98	49%	0.485	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-76.3	138.2	175.9	48.1	0	0	0	0	109.6	A230 F244	A230-T232 VanDerWaalsContact C-N 3.31Å; A230-T232 PolarHBondContact O-N 3.41Å; T232-F244 CarbonylContact C-O 3.44Å; T232-F244 WeakPolarHBondContact CA-O 3.48Å
233	L	89.5	Confident	66.9	Low	56 Å²	56	96.4 Å²	96.4	29%	0.293	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	118.3	175	-64.6	168.4	0	0	0	108.1	T243 F244 H247 F250	L233-T243 CarbonylContact O-C 3.52Å; L233-T243 WeakPolarHBondContact O-CA 3.18Å; L233-F244 HydrophobicContact CB-CB 4.44Å; L233-F244 PolarHBondContact N-O 3.2Å; L233-F244 PolarHBondContact O-N 3.18Å; L233-H247 HydrophobicContact CD1-CB 3.87Å; L233-F250 HydrophobicContact CB-CB 4.31Å; L233-F250 HydrophobicContact CB-CD1 4.08Å; L233-F250 HydrophobicContact CB-CD2 4.26Å; L233-F250 HydrophobicContact CB-CE1 4.3Å; L233-F250 HydrophobicContact CB-CG 3.99Å; L233-F250 HydrophobicContact CB-CZ 4.47Å; L233-F250 HydrophobicContact CD1-CB 4.11Å; L233-F250 HydrophobicContact CD1-CD1 3.94Å; L233-F250 HydrophobicContact CD1-CG 4.25Å; L233-F250 HydrophobicContact CG-CD1 4.49Å
234	T	92.6	Very high	69.9	Low	57 Å²	57	91.8 Å²	91.8	35%	0.35	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.5	-179.1	-50.6	0	0	0	0	110.7	Q236 L242 T243	T234-Q236 PolarHBondContact O-N 3.12Å; T234-L242 CarbonylContact C-O 3.6Å; T234-L242 WeakPolarHBondContact CA-O 3.32Å; T234-T243 HydrophobicContact CG2-CG2 4.01Å
235	C	94.5	Very high	72.7	Confident	0 Å²	0	88 Å²	88	0%	0	51%	0.505	C	S	.	.			trans	-70.6	113.2	171.7	-173.1	0	0	0	0	110.6	W237 C240 R241 L242 F244 F250 H253 H258	C235-W237 VanDerWaalsContact C-N 3.27Å; C235-W237 WeakPolarHBondContact SG-CB 3.32Å; C235-C240 HydrophobicContact CB-CB 4.28Å; C235-R241 VanDerWaalsContact O-CA 3.23Å; C235-R241 WeakPolarHBondContact O-CA 3.43Å; C235-R241 PolarHBondContact O-N 2.73Å; C235-R241 VanDerWaalsContact O-N 3.15Å; C235-L242 PolarHBondContact N-O 3.43Å; C235-F244 HydrophobicContact CB-CE2 4.49Å; C235-F250 HydrophobicContact CB-CE2 4.14Å; C235-H253 PolarHBondContact SG-NE2 3.01Å; C235-H253 VanDerWaalsContact SG-NE2 3.44Å; C235-H258 PolarHBondContact SG-NE2 3.15Å
236	Q	93.6	Very high	75.5	Confident	95 Å²	95	84.1 Å²	84.1	44%	0.444	49%	0.485	S	S	.	.			trans	-94.9	21.5	176.4	-52.3	175	-30.5	0	0	111.8	T234 W272 E273	T234-Q236 PolarHBondContact O-N 3.12Å; Q236-W272 HydrophobicContact CB-CD2 4.26Å; Q236-W272 HydrophobicContact CB-CZ2 3.77Å; Q236-W272 HydrophobicContact CG-CZ2 4.03Å; Q236-E273 HydrophobicContact CB-CB 4.37Å; Q236-E273 WeakPolarHBondContact O-CG 3.44Å; Q236-E273 PolarHBondContact O-N 2.97Å
237	W	93.1	Very high	78.5	Confident	17 Å²	17	83.6 Å²	83.6	6%	0.064	47%	0.473	C	S	.	.	B	Isolated β-bridge	trans	-64.4	135.6	166.6	-161.7	-84.1	0	0	0	108.9	C235 S239 C240 H258 Y271 W272 L292	C235-W237 VanDerWaalsContact C-N 3.27Å; C235-W237 WeakPolarHBondContact SG-CB 3.32Å; W237-S239 PolarHBondContact O-N 2.93Å; W237-S239 VanDerWaalsContact O-N 3.09Å; W237-C240 HydrophobicContact CB-CB 4.01Å; W237-C240 PolarHBondContact O-N 3.41Å; W237-H258 WeakPolarHBondContact CB-NE2 3.45Å; W237-H258 AromaticContact CD1-CE1 3.76Å; W237-H258 AromaticContact CD1-CG 3.89Å; W237-H258 AromaticContact CD1-ND1 3.56Å; W237-H258 HydrophobicContact CD2-CB 3.6Å; W237-H258 AromaticContact CD2-CD2 3.63Å; W237-H258 AromaticContact CD2-CG 3.42Å; W237-H258 VanDerWaalsContact CD2-CG 3.42Å; W237-H258 AromaticContact CD2-ND1 3.92Å; W237-H258 AromaticContact CE2-CG 3.71Å; W237-H258 HydrophobicContact CE3-CB 3.64Å; W237-H258 AromaticContact CE3-CD2 3.75Å; W237-H258 AromaticContact CE3-CG 3.76Å; W237-H258 HydrophobicContact CG-CB 4.28Å; W237-H258 AromaticContact CG-CD2 3.58Å; W237-H258 AromaticContact CG-CE1 3.72Å; W237-H258 AromaticContact CG-CG 3.59Å; W237-H258 AromaticContact CG-ND1 3.67Å; W237-H258 AromaticContact CG-NE2 3.67Å; W237-H258 HydrophobicContact CH2-CB 3.7Å; W237-H258 HydrophobicContact CZ2-CB 3.63Å; W237-H258 HydrophobicContact CZ3-CB 3.68Å; W237-H258 AromaticContact NE1-CG 3.96Å; W237-H258 AromaticContact NE1-ND1 3.76Å; W237-Y271 AromaticContact CE2-CD2 3.99Å; W237-Y271 HydrophobicContact CH2-CD2 4.39Å; W237-Y271 AromaticContact CZ2-CD2 3.53Å; W237-Y271 HydrophobicContact CZ2-CD2 3.53Å; W237-Y271 HydrophobicContact CZ2-CE2 4.48Å; W237-Y271 HydrophobicContact CZ2-CG 4.25Å; W237-W272 HydrophobicContact CE3-CE3 4.41Å; W237-L292 HydrophobicContact CE3-CD2 4.45Å; W237-L292 HydrophobicContact CH2-CD1 4.45Å; W237-L292 HydrophobicContact CZ3-CD1 3.88Å; W237-L292 HydrophobicContact CZ3-CD2 3.64Å; W237-L292 HydrophobicContact CZ3-CG 4.43Å
238	K	89	Confident	81.6	Confident	104 Å²	104	83.7 Å²	83.7	45%	0.452	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.6	122.1	176.8	-77.3	177.8	-176.4	-174.6	0	109.5	Y271 E273	K238-Y271 HydrophobicContact CD-CD1 4.33Å; K238-Y271 WeakPolarHBondContact CG-O 3.23Å; K238-Y271 PolarHBondContact N-O 2.82Å; K238-E273 HydrophobicContact CG-CG 4.4Å
239	S	87	Confident	84.7	Confident	129 Å²	129	79.6 Å²	79.6	90%	0.902	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	10.1	179.6	-43.4	0	0	0	0	118	W237	W237-S239 PolarHBondContact O-N 2.93Å; W237-S239 VanDerWaalsContact O-N 3.09Å
240	C	90.4	Very high	87.6	Confident	29 Å²	29	76.9 Å²	76.9	20%	0.196	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-63.8	178.5	-171.4	0	0	0	0	114	C235 W237 L242 H253	C235-C240 HydrophobicContact CB-CB 4.28Å; W237-C240 HydrophobicContact CB-CB 4.01Å; W237-C240 PolarHBondContact O-N 3.41Å; C240-L242 PolarHBondContact O-N 2.94Å; C240-H253 PolarHBondContact SG-CE1 2.93Å; C240-H253 PolarHBondContact SG-NE2 3.29Å
241	R	91	Very high	89.8	Confident	157 Å²	157	73.6 Å²	73.6	59%	0.592	38%	0.383	S	S	*	.			trans	50.2	14.4	-179.2	-59.3	-158.3	-178.8	-102.9	-12.4	117	C235 E273	C235-R241 VanDerWaalsContact O-CA 3.23Å; C235-R241 WeakPolarHBondContact O-CA 3.43Å; C235-R241 PolarHBondContact O-N 2.73Å; C235-R241 VanDerWaalsContact O-N 3.15Å; R241-E273 IonicContact CZ-OE1 3.74Å; R241-E273 IonicContact CZ-OE2 3.8Å; R241-E273 IonicContact NH2-OE1 2.77Å; R241-E273 PolarHBondContact NH2-OE1 2.96Å; R241-E273 IonicContact NH2-OE2 2.94Å; R241-E273 PolarHBondContact NH2-OE2 3.34Å
242	L	93.9	Very high	91.3	Very high	93 Å²	93	69.9 Å²	69.9	49%	0.487	37%	0.371	S	S	.	.			trans	-62.8	142.2	172.7	-70.1	177.8	0	0	0	111.3	T234 C235 C240 F244	T234-L242 CarbonylContact C-O 3.6Å; T234-L242 WeakPolarHBondContact CA-O 3.32Å; C235-L242 PolarHBondContact N-O 3.43Å; C240-L242 PolarHBondContact O-N 2.94Å; L242-F244 HydrophobicContact CB-CE2 3.73Å; L242-F244 HydrophobicContact CB-CZ 3.94Å; L242-F244 HydrophobicContact CD1-CZ 4.44Å
243	T	92.8	Very high	91.8	Very high	89 Å²	89	66.8 Å²	66.8	55%	0.546	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	144.8	179.8	56.6	0	0	0	0	110.9	L233 T234	L233-T243 CarbonylContact O-C 3.52Å; L233-T243 WeakPolarHBondContact O-CA 3.18Å; T234-T243 HydrophobicContact CG2-CG2 4.01Å
244	F	92.3	Very high	91.9	Very high	36 Å²	36	64.3 Å²	64.3	16%	0.158	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	141.8	-176.4	-60.8	-91.9	0	0	0	109.7	T232 L233 C235 L242 F250 H253	T232-F244 CarbonylContact C-O 3.44Å; T232-F244 WeakPolarHBondContact CA-O 3.48Å; L233-F244 HydrophobicContact CB-CB 4.44Å; L233-F244 PolarHBondContact N-O 3.2Å; L233-F244 PolarHBondContact O-N 3.18Å; C235-F244 HydrophobicContact CB-CE2 4.49Å; L242-F244 HydrophobicContact CB-CE2 3.73Å; L242-F244 HydrophobicContact CB-CZ 3.94Å; L242-F244 HydrophobicContact CD1-CZ 4.44Å; F244-F250 HydrophobicContact CB-CB 3.88Å; F244-F250 HydrophobicContact CD2-CB 4.04Å; F244-F250 AromaticContact CD2-CD2 3.59Å; F244-F250 HydrophobicContact CD2-CD2 3.59Å; F244-F250 HydrophobicContact CD2-CG 4.28Å; F244-F250 HydrophobicContact CE2-CD2 4.04Å; F244-F250 HydrophobicContact CG-CB 3.88Å; F244-F250 HydrophobicContact CG-CD2 4.3Å; F244-H253 HydrophobicContact CE1-CB 3.7Å; F244-H253 HydrophobicContact CE2-CB 4.1Å; F244-H253 AromaticContact CE2-CD2 3.45Å; F244-H253 VanDerWaalsContact CE2-CD2 3.45Å; F244-H253 WeakPolarHBondContact CE2-CD2 3.27Å; F244-H253 AromaticContact CE2-CG 3.79Å; F244-H253 HydrophobicContact CZ-CB 3.34Å; F244-H253 AromaticContact CZ-CD2 3.41Å; F244-H253 VanDerWaalsContact CZ-CD2 3.41Å; F244-H253 WeakPolarHBondContact CZ-CD2 3.36Å; F244-H253 AromaticContact CZ-CG 3.23Å; F244-H253 AromaticContact CZ-ND1 3.92Å
245	T	89.2	Confident	91.8	Very high	118 Å²	118	64.2 Å²	64.2	72%	0.724	33%	0.334	S	S	*	.	S	Bend	trans	-88.4	-21.3	174.6	50.7	0	0	0	0	112.1
246	D	89.1	Confident	91.7	Very high	63 Å²	63	67.7 Å²	67.7	34%	0.337	36%	0.358	S	S	.	.	S	Bend	trans	-123.8	145.2	179.3	81.5	95.2	0	0	0	112.6	K248 S249 F250	D246-K248 VanDerWaalsContact C-N 3.34Å; D246-K248 PolarHBondContact O-N 2.81Å; D246-K248 WeakPolarHBondContact OD1-CB 3.42Å; D246-K248 PolarHBondContact OD1-N 3.39Å; D246-K248 VanDerWaalsContact OD1-N 3.15Å; D246-S249 WeakPolarHBondContact OD1-CB 3.32Å; D246-S249 PolarHBondContact OD1-N 2.74Å; D246-S249 PolarHBondContact OD1-OG 2.59Å; D246-S249 WeakPolarHBondContact OD2-CB 3.48Å; D246-S249 PolarHBondContact OD2-OG 3.17Å; D246-F250 PolarHBondContact O-N 2.84Å
247	H	89.5	Confident	91.6	Very high	74 Å²	74	65.9 Å²	65.9	34%	0.343	36%	0.356	S	S	.	.	H	α-helix	trans	-68.8	-31.6	-176.4	-175.3	-94.4	0	0	0	113.1	L233 F250 V251 S296 D298	L233-H247 HydrophobicContact CD1-CB 3.87Å; H247-F250 WeakPolarHBondContact O-CB 3.47Å; H247-F250 PolarHBondContact O-N 3.08Å; H247-V251 VanDerWaalsContact CE1-CG2 3.42Å; H247-V251 WeakPolarHBondContact CE1-CG2 3.5Å; H247-V251 WeakPolarHBondContact O-CG2 3.37Å; H247-V251 PolarHBondContact O-N 3.33Å; H247-S296 PolarHBondContact NE2-O 2.83Å; H247-D298 IonicContact CE1-OD1 3.86Å
248	K	91.1	Very high	91.5	Very high	115 Å²	115	65.9 Å²	65.9	50%	0.5	36%	0.357	S	S	.	.	H	α-helix	trans	-68.5	-46.5	-177.7	-174.1	177.7	-179.5	179	0	111	D246 F250 V251 N252	D246-K248 VanDerWaalsContact C-N 3.34Å; D246-K248 PolarHBondContact O-N 2.81Å; D246-K248 WeakPolarHBondContact OD1-CB 3.42Å; D246-K248 PolarHBondContact OD1-N 3.39Å; D246-K248 VanDerWaalsContact OD1-N 3.15Å; K248-F250 VanDerWaalsContact C-N 3.31Å; K248-F250 PolarHBondContact O-N 3.4Å; K248-V251 PolarHBondContact O-N 2.73Å; K248-N252 WeakPolarHBondContact O-CB 3.31Å; K248-N252 PolarHBondContact O-N 2.75Å; K248-N252 PolarHBondContact O-ND2 3.19Å
249	S	93.8	Very high	91.4	Very high	50 Å²	50	61 Å²	61	35%	0.35	34%	0.335	S	S	.	.	H	α-helix	trans	-63.4	-38.8	175.6	-59.2	0	0	0	0	111.5	D246 N252 H253	D246-S249 WeakPolarHBondContact OD1-CB 3.32Å; D246-S249 PolarHBondContact OD1-N 2.74Å; D246-S249 PolarHBondContact OD1-OG 2.59Å; D246-S249 WeakPolarHBondContact OD2-CB 3.48Å; D246-S249 PolarHBondContact OD2-OG 3.17Å; S249-N252 PolarHBondContact O-N 2.89Å; S249-H253 VanDerWaalsContact O-CB 3.28Å; S249-H253 WeakPolarHBondContact O-CB 3.22Å; S249-H253 PolarHBondContact O-N 3.33Å
250	F	94.6	Very high	91.2	Very high	7 Å²	7	56.7 Å²	56.7	3%	0.031	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-48.7	175	174	-126	0	0	0	112.8	L233 C235 F244 D246 H247 K248 H253 I254 W272	L233-F250 HydrophobicContact CB-CB 4.31Å; L233-F250 HydrophobicContact CB-CD1 4.08Å; L233-F250 HydrophobicContact CB-CD2 4.26Å; L233-F250 HydrophobicContact CB-CE1 4.3Å; L233-F250 HydrophobicContact CB-CG 3.99Å; L233-F250 HydrophobicContact CB-CZ 4.47Å; L233-F250 HydrophobicContact CD1-CB 4.11Å; L233-F250 HydrophobicContact CD1-CD1 3.94Å; L233-F250 HydrophobicContact CD1-CG 4.25Å; L233-F250 HydrophobicContact CG-CD1 4.49Å; C235-F250 HydrophobicContact CB-CE2 4.14Å; F244-F250 HydrophobicContact CB-CB 3.88Å; F244-F250 HydrophobicContact CD2-CB 4.04Å; F244-F250 AromaticContact CD2-CD2 3.59Å; F244-F250 HydrophobicContact CD2-CD2 3.59Å; F244-F250 HydrophobicContact CD2-CG 4.28Å; F244-F250 HydrophobicContact CE2-CD2 4.04Å; F244-F250 HydrophobicContact CG-CB 3.88Å; F244-F250 HydrophobicContact CG-CD2 4.3Å; D246-F250 PolarHBondContact O-N 2.84Å; H247-F250 WeakPolarHBondContact O-CB 3.47Å; H247-F250 PolarHBondContact O-N 3.08Å; K248-F250 VanDerWaalsContact C-N 3.31Å; K248-F250 PolarHBondContact O-N 3.4Å; F250-H253 PolarHBondContact O-N 3.26Å; F250-I254 HydrophobicContact CD1-CD1 4.29Å; F250-I254 HydrophobicContact CD2-CD1 4.14Å; F250-I254 HydrophobicContact CE1-CD1 4.01Å; F250-I254 HydrophobicContact CE2-CD1 3.82Å; F250-I254 HydrophobicContact CE2-CG1 4.39Å; F250-I254 HydrophobicContact CG-CD1 4.4Å; F250-I254 HydrophobicContact CZ-CD1 3.8Å; F250-I254 WeakPolarHBondContact O-CG1 3.36Å; F250-I254 PolarHBondContact O-N 3.33Å; F250-I254 VanDerWaalsContact O-N 3.1Å; F250-W272 HydrophobicContact CE2-CH2 4.27Å; F250-W272 AromaticContact CZ-CH2 3.74Å; F250-W272 HydrophobicContact CZ-CH2 3.74Å
251	V	92.5	Very high	90.8	Very high	15 Å²	15	58.8 Å²	58.8	9%	0.091	32%	0.321	C	S	.	.	H	α-helix	trans	-64.2	-45	177.3	174.1	0	0	0	0	110.9	H247 K248 H253 I254 E255 D298	H247-V251 VanDerWaalsContact CE1-CG2 3.42Å; H247-V251 WeakPolarHBondContact CE1-CG2 3.5Å; H247-V251 WeakPolarHBondContact O-CG2 3.37Å; H247-V251 PolarHBondContact O-N 3.33Å; K248-V251 PolarHBondContact O-N 2.73Å; V251-H253 VanDerWaalsContact C-N 3.31Å; V251-H253 PolarHBondContact O-N 3.17Å; V251-I254 PolarHBondContact O-N 2.83Å; V251-E255 PolarHBondContact O-N 2.82Å; V251-D298 HydrophobicContact CG1-CB 4.5Å; V251-D298 HydrophobicContact CG2-CB 3.83Å
252	N	93.3	Very high	90.1	Very high	85 Å²	85	52 Å²	52	46%	0.455	30%	0.296	S	S	.	.	H	α-helix	trans	-57.9	-44.8	177	-75.5	-16.2	0	0	0	111.4	K248 S249 I254 E255 S256	K248-N252 WeakPolarHBondContact O-CB 3.31Å; K248-N252 PolarHBondContact O-N 2.75Å; K248-N252 PolarHBondContact O-ND2 3.19Å; S249-N252 PolarHBondContact O-N 2.89Å; N252-I254 PolarHBondContact O-N 3.14Å; N252-E255 PolarHBondContact O-N 2.79Å; N252-S256 VanDerWaalsContact O-CB 3.3Å; N252-S256 WeakPolarHBondContact O-CB 3.05Å; N252-S256 PolarHBondContact O-N 2.95Å; N252-S256 PolarHBondContact O-OG 3.01Å
253	H	94.1	Very high	88.9	Confident	14 Å²	14	53.6 Å²	53.6	7%	0.065	30%	0.303	C	S	.	.	H	α-helix	trans	-57.9	-46.4	175.8	160.2	65.5	0	0	0	112.1	C235 C240 F244 S249 F250 V251 E255 S256 S257 H258	C235-H253 PolarHBondContact SG-NE2 3.01Å; C235-H253 VanDerWaalsContact SG-NE2 3.44Å; C240-H253 PolarHBondContact SG-CE1 2.93Å; C240-H253 PolarHBondContact SG-NE2 3.29Å; F244-H253 HydrophobicContact CE1-CB 3.7Å; F244-H253 HydrophobicContact CE2-CB 4.1Å; F244-H253 AromaticContact CE2-CD2 3.45Å; F244-H253 VanDerWaalsContact CE2-CD2 3.45Å; F244-H253 WeakPolarHBondContact CE2-CD2 3.27Å; F244-H253 AromaticContact CE2-CG 3.79Å; F244-H253 HydrophobicContact CZ-CB 3.34Å; F244-H253 AromaticContact CZ-CD2 3.41Å; F244-H253 VanDerWaalsContact CZ-CD2 3.41Å; F244-H253 WeakPolarHBondContact CZ-CD2 3.36Å; F244-H253 AromaticContact CZ-CG 3.23Å; F244-H253 AromaticContact CZ-ND1 3.92Å; S249-H253 VanDerWaalsContact O-CB 3.28Å; S249-H253 WeakPolarHBondContact O-CB 3.22Å; S249-H253 PolarHBondContact O-N 3.33Å; F250-H253 PolarHBondContact O-N 3.26Å; V251-H253 VanDerWaalsContact C-N 3.31Å; V251-H253 PolarHBondContact O-N 3.17Å; H253-E255 VanDerWaalsContact C-N 3.33Å; H253-E255 PolarHBondContact O-N 2.97Å; H253-S256 PolarHBondContact O-N 3.06Å; H253-S256 PolarHBondContact O-OG 3.35Å; H253-S257 PolarHBondContact ND1-OG 2.89Å; H253-S257 WeakPolarHBondContact O-CB 3.36Å; H253-S257 PolarHBondContact O-N 3.17Å; H253-S257 PolarHBondContact O-OG 3.07Å; H253-H258 AromaticContact CE1-CE1 3.97Å; H253-H258 AromaticContact CE1-NE2 3.54Å; H253-H258 AromaticContact NE2-CD2 3.94Å; H253-H258 AromaticContact NE2-NE2 3.18Å; H253-H258 PolarHBondContact NE2-NE2 2.8Å; H253-H258 VanDerWaalsContact NE2-NE2 3.18Å
254	I	92.5	Very high	87.5	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.021	31%	0.31	C	S	.	.	I	π-helix	trans	-59	-46.9	178.5	-67.4	165.1	0	0	0	110.4	F250 V251 N252 H258 V259 W272 L292	F250-I254 HydrophobicContact CD1-CD1 4.29Å; F250-I254 HydrophobicContact CD2-CD1 4.14Å; F250-I254 HydrophobicContact CE1-CD1 4.01Å; F250-I254 HydrophobicContact CE2-CD1 3.82Å; F250-I254 HydrophobicContact CE2-CG1 4.39Å; F250-I254 HydrophobicContact CG-CD1 4.4Å; F250-I254 HydrophobicContact CZ-CD1 3.8Å; F250-I254 WeakPolarHBondContact O-CG1 3.36Å; F250-I254 PolarHBondContact O-N 3.33Å; F250-I254 VanDerWaalsContact O-N 3.1Å; V251-I254 PolarHBondContact O-N 2.83Å; N252-I254 PolarHBondContact O-N 3.14Å; I254-H258 VanDerWaalsContact O-CB 3.3Å; I254-H258 WeakPolarHBondContact O-CB 3.31Å; I254-H258 PolarHBondContact O-N 2.98Å; I254-H258 VanDerWaalsContact O-N 3.1Å; I254-V259 PolarHBondContact O-N 3.06Å; I254-V259 VanDerWaalsContact O-N 3.16Å; I254-W272 HydrophobicContact CD1-CH2 4.15Å; I254-W272 HydrophobicContact CD1-CZ3 3.81Å; I254-W272 HydrophobicContact CG1-CZ3 4.31Å; I254-L292 HydrophobicContact CG2-CB 4.25Å; I254-L292 HydrophobicContact CG2-CD1 3.65Å; I254-L292 HydrophobicContact CG2-CG 4.4Å
255	E	91.5	Very high	86.4	Confident	54 Å²	54	57.9 Å²	57.9	25%	0.252	33%	0.332	S	S	.	.	I	π-helix	trans	-69	-44.9	-179.9	-67.5	-168.6	-172.8	0	0	112.7	V251 N252 H253 V259 S260 I289	V251-E255 PolarHBondContact O-N 2.82Å; N252-E255 PolarHBondContact O-N 2.79Å; H253-E255 VanDerWaalsContact C-N 3.33Å; H253-E255 PolarHBondContact O-N 2.97Å; E255-V259 WeakPolarHBondContact O-CB 3.1Å; E255-V259 PolarHBondContact O-N 3.39Å; E255-S260 PolarHBondContact O-N 3.46Å; E255-S260 PolarHBondContact O-OG 3.08Å; E255-S260 VanDerWaalsContact O-OG 3.06Å; E255-I289 WeakPolarHBondContact OE1-CG2 3.38Å
256	S	91.5	Very high	85.4	Confident	73 Å²	73	60.1 Å²	60.1	51%	0.51	33%	0.332	S	S	.	.	I	π-helix	trans	-73.7	-40.8	-175.8	66.5	0	0	0	0	112.6	N252 H253 S260	N252-S256 VanDerWaalsContact O-CB 3.3Å; N252-S256 WeakPolarHBondContact O-CB 3.05Å; N252-S256 PolarHBondContact O-N 2.95Å; N252-S256 PolarHBondContact O-OG 3.01Å; H253-S256 PolarHBondContact O-N 3.06Å; H253-S256 PolarHBondContact O-OG 3.35Å; S256-S260 WeakPolarHBondContact O-CB 3.23Å; S256-S260 PolarHBondContact O-OG 3.46Å
257	S	91.2	Very high	85.1	Confident	58 Å²	58	62.6 Å²	62.6	41%	0.406	34%	0.342	S	S	.	.	I	π-helix	trans	-92.8	-36.7	-172.4	-57.7	0	0	0	0	112.7	H253	H253-S257 PolarHBondContact ND1-OG 2.89Å; H253-S257 WeakPolarHBondContact O-CB 3.36Å; H253-S257 PolarHBondContact O-N 3.17Å; H253-S257 PolarHBondContact O-OG 3.07Å
258	H	91.1	Very high	85.1	Confident	17 Å²	17	60.9 Å²	60.9	8%	0.079	33%	0.332	C	S	.	.	I	π-helix	trans	-105.6	-40.4	-171.7	-57.8	-40.5	0	0	0	113.3	C235 W237 H253 I254 S261 H262	C235-H258 PolarHBondContact SG-NE2 3.15Å; W237-H258 WeakPolarHBondContact CB-NE2 3.45Å; W237-H258 AromaticContact CD1-CE1 3.76Å; W237-H258 AromaticContact CD1-CG 3.89Å; W237-H258 AromaticContact CD1-ND1 3.56Å; W237-H258 HydrophobicContact CD2-CB 3.6Å; W237-H258 AromaticContact CD2-CD2 3.63Å; W237-H258 AromaticContact CD2-CG 3.42Å; W237-H258 VanDerWaalsContact CD2-CG 3.42Å; W237-H258 AromaticContact CD2-ND1 3.92Å; W237-H258 AromaticContact CE2-CG 3.71Å; W237-H258 HydrophobicContact CE3-CB 3.64Å; W237-H258 AromaticContact CE3-CD2 3.75Å; W237-H258 AromaticContact CE3-CG 3.76Å; W237-H258 HydrophobicContact CG-CB 4.28Å; W237-H258 AromaticContact CG-CD2 3.58Å; W237-H258 AromaticContact CG-CE1 3.72Å; W237-H258 AromaticContact CG-CG 3.59Å; W237-H258 AromaticContact CG-ND1 3.67Å; W237-H258 AromaticContact CG-NE2 3.67Å; W237-H258 HydrophobicContact CH2-CB 3.7Å; W237-H258 HydrophobicContact CZ2-CB 3.63Å; W237-H258 HydrophobicContact CZ3-CB 3.68Å; W237-H258 AromaticContact NE1-CG 3.96Å; W237-H258 AromaticContact NE1-ND1 3.76Å; H253-H258 AromaticContact CE1-CE1 3.97Å; H253-H258 AromaticContact CE1-NE2 3.54Å; H253-H258 AromaticContact NE2-CD2 3.94Å; H253-H258 AromaticContact NE2-NE2 3.18Å; H253-H258 PolarHBondContact NE2-NE2 2.8Å; H253-H258 VanDerWaalsContact NE2-NE2 3.18Å; I254-H258 VanDerWaalsContact O-CB 3.3Å; I254-H258 WeakPolarHBondContact O-CB 3.31Å; I254-H258 PolarHBondContact O-N 2.98Å; I254-H258 VanDerWaalsContact O-N 3.1Å; H258-S261 PolarHBondContact O-OG 3.04Å; H258-H262 PolarHBondContact O-CD2 2.98Å
259	V	87.5	Confident	85.1	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.311	C	S	.	.	I	π-helix	trans	-75.1	-35.6	177.3	-172.7	0	0	0	0	110.6	I254 E255 S261 H262 R285 L288 I289 L292	I254-V259 PolarHBondContact O-N 3.06Å; I254-V259 VanDerWaalsContact O-N 3.16Å; E255-V259 WeakPolarHBondContact O-CB 3.1Å; E255-V259 PolarHBondContact O-N 3.39Å; V259-S261 VanDerWaalsContact C-N 3.31Å; V259-S261 PolarHBondContact O-N 3.43Å; V259-H262 PolarHBondContact O-N 2.93Å; V259-R285 HydrophobicContact CG1-CG 3.75Å; V259-R285 PolarHBondContact O-NH1 2.92Å; V259-L288 HydrophobicContact CG1-CD2 4.35Å; V259-L288 HydrophobicContact CG2-CD2 4.44Å; V259-I289 HydrophobicContact CB-CG1 4.5Å; V259-I289 HydrophobicContact CG1-CD1 4.17Å; V259-I289 HydrophobicContact CG1-CG1 3.77Å; V259-I289 HydrophobicContact CG2-CG1 4.2Å; V259-L292 HydrophobicContact CG2-CD1 3.39Å
260	S	83.2	Confident	85.1	Confident	39 Å²	39	53.5 Å²	53.5	27%	0.273	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-73.3	-16.6	179.2	-50.2	0	0	0	0	114.6	E255 S256 H262 I263 R285	E255-S260 PolarHBondContact O-N 3.46Å; E255-S260 PolarHBondContact O-OG 3.08Å; E255-S260 VanDerWaalsContact O-OG 3.06Å; S256-S260 WeakPolarHBondContact O-CB 3.23Å; S256-S260 PolarHBondContact O-OG 3.46Å; S260-H262 PolarHBondContact O-N 3.05Å; S260-I263 WeakPolarHBondContact O-CD1 3.31Å; S260-I263 WeakPolarHBondContact O-CG1 3.27Å; S260-R285 PolarHBondContact OG-NH2 3.37Å; S260-R285 VanDerWaalsContact OG-NH2 3.09Å
261	S	81.4	Confident	84.9	Confident	74 Å²	74	56.9 Å²	56.9	52%	0.517	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-68.7	-16.1	172.8	65.5	0	0	0	0	113.1	H258 V259 I263	H258-S261 PolarHBondContact O-OG 3.04Å; V259-S261 VanDerWaalsContact C-N 3.31Å; V259-S261 PolarHBondContact O-N 3.43Å; S261-I263 VanDerWaalsContact C-N 3.27Å; S261-I263 PolarHBondContact O-N 2.81Å
262	H	76.2	Confident	85	Confident	14 Å²	14	56.9 Å²	56.9	7%	0.065	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-81.6	9.5	179.9	-70.1	-74.3	0	0	0	115.4	H258 V259 S260 S264 K266 E267 Y268 C269 Y271	H258-H262 PolarHBondContact O-CD2 2.98Å; V259-H262 PolarHBondContact O-N 2.93Å; S260-H262 PolarHBondContact O-N 3.05Å; H262-S264 VanDerWaalsContact C-N 3.29Å; H262-S264 PolarHBondContact O-N 3.33Å; H262-K266 PolarHBondContact O-N 3.3Å; H262-E267 PolarHBondContact CE1-O 3.24Å; H262-E267 VanDerWaalsContact CE1-O 3.27Å; H262-E267 PolarHBondContact ND1-O 3.11Å; H262-Y268 HydrophobicContact CB-CD1 3.67Å; H262-Y268 HydrophobicContact CB-CE1 3.84Å; H262-C269 PolarHBondContact CE1-N 3.31Å; H262-C269 PolarHBondContact NE2-O 3.25Å; H262-Y271 AromaticContact CE1-CE2 3.76Å
263	I	68.6	Low	84.9	Confident	126 Å²	126	56.5 Å²	56.5	65%	0.646	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-64.7	-33.5	-177.2	-68.2	164.5	0	0	0	111.8	S260 S261	S260-I263 WeakPolarHBondContact O-CD1 3.31Å; S260-I263 WeakPolarHBondContact O-CG1 3.27Å; S261-I263 VanDerWaalsContact C-N 3.27Å; S261-I263 PolarHBondContact O-N 2.81Å
264	S	63.1	Low	84.7	Confident	100 Å²	100	59.5 Å²	59.5	70%	0.699	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-43.7	-174.7	51.8	0	0	0	0	114	H262	H262-S264 VanDerWaalsContact C-N 3.29Å; H262-S264 PolarHBondContact O-N 3.33Å
265	N	69	Low	84.7	Confident	116 Å²	116	59.7 Å²	59.7	62%	0.62	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-9.7	-170.7	-75.8	3.3	0	0	0	114.6	E267	N265-E267 PolarHBondContact O-N 3.27Å
266	K	69.4	Low	84.8	Confident	164 Å²	164	68.6 Å²	68.6	71%	0.713	37%	0.37	S	S	*	.			trans	52.4	4.8	-172.1	-67.7	-178.8	179.9	174.7	0	115.5	H262 Y268	H262-K266 PolarHBondContact O-N 3.3Å; K266-Y268 WeakPolarHBondContact O-CD2 3.41Å; K266-Y268 VanDerWaalsContact O-CE2 3.22Å; K266-Y268 WeakPolarHBondContact O-CE2 3.41Å
267	E	81.8	Confident	84.7	Confident	116 Å²	116	68.7 Å²	68.7	54%	0.542	36%	0.359	S	S	.	.			trans	-88.7	106	172.3	-68.1	-174.2	156.3	0	0	108.8	H262 N265 C269	H262-E267 PolarHBondContact CE1-O 3.24Å; H262-E267 VanDerWaalsContact CE1-O 3.27Å; H262-E267 PolarHBondContact ND1-O 3.11Å; N265-E267 PolarHBondContact O-N 3.27Å; E267-C269 PolarHBondContact O-N 3.26Å
268	Y	89.7	Confident	84.4	Confident	37 Å²	37	73.3 Å²	73.3	15%	0.145	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-92.9	94	-176.6	-61.2	-78.6	0	0	0	110	H262 K266 F282 A284 R285 L288	H262-Y268 HydrophobicContact CB-CD1 3.67Å; H262-Y268 HydrophobicContact CB-CE1 3.84Å; K266-Y268 WeakPolarHBondContact O-CD2 3.41Å; K266-Y268 VanDerWaalsContact O-CE2 3.22Å; K266-Y268 WeakPolarHBondContact O-CE2 3.41Å; Y268-F282 VanDerWaalsContact O-CD2 3.28Å; Y268-F282 WeakPolarHBondContact O-CD2 3.38Å; Y268-F282 PolarHBondContact O-N 3.27Å; Y268-A284 VanDerWaalsContact CD2-C 3.44Å; Y268-R285 HydrophobicContact CD1-CB 3.95Å; Y268-R285 HydrophobicContact CD1-CG 4.17Å; Y268-R285 HydrophobicContact CE1-CB 3.39Å; Y268-R285 HydrophobicContact CE1-CG 3.68Å; Y268-R285 HydrophobicContact CE2-CB 4.19Å; Y268-R285 VanDerWaalsContact CE2-N 3.3Å; Y268-L288 HydrophobicContact CD1-CD2 4.38Å
269	C	91.4	Very high	84.1	Confident	7 Å²	7	75.8 Å²	75.8	5%	0.047	39%	0.388	C	S	.	.			trans	-105.6	143	-176.8	-66	0	0	0	0	111.4	H262 E267 Y271 L279	H262-C269 PolarHBondContact CE1-N 3.31Å; H262-C269 PolarHBondContact NE2-O 3.25Å; E267-C269 PolarHBondContact O-N 3.26Å; C269-Y271 HydrophobicContact CB-CD2 4.17Å; C269-Y271 HydrophobicContact CB-CE2 3.46Å; C269-Y271 VanDerWaalsContact CB-CE2 3.46Å; C269-Y271 WeakPolarHBondContact O-CD2 3.36Å; C269-L279 PolarHBondContact SG-O 3.37Å
270	C	92.5	Very high	84.2	Confident	3 Å²	3	81.2 Å²	81.2	2%	0.02	41%	0.411	C	S	.	.			trans	-91	116.1	171.7	179.7	0	0	0	0	109.4	W272 L279 F282 L288 H291 L292	C270-W272 VanDerWaalsContact SG-CB 3.56Å; C270-L279 WeakPolarHBondContact O-CD2 3.19Å; C270-F282 HydrophobicContact CB-CE2 4.48Å; C270-L288 HydrophobicContact CB-CD1 3.88Å; C270-H291 PolarHBondContact SG-NE2 2.73Å; C270-L292 HydrophobicContact CB-CD2 4.44Å
271	Y	91.8	Very high	84.5	Confident	78 Å²	78	82.5 Å²	82.5	31%	0.306	42%	0.419	S	S	.	.			trans	-102.5	28	176.6	-60.1	-100.6	0	0	0	112.4	W237 K238 H262 C269 L279	W237-Y271 AromaticContact CE2-CD2 3.99Å; W237-Y271 HydrophobicContact CH2-CD2 4.39Å; W237-Y271 AromaticContact CZ2-CD2 3.53Å; W237-Y271 HydrophobicContact CZ2-CD2 3.53Å; W237-Y271 HydrophobicContact CZ2-CE2 4.48Å; W237-Y271 HydrophobicContact CZ2-CG 4.25Å; K238-Y271 HydrophobicContact CD-CD1 4.33Å; K238-Y271 WeakPolarHBondContact CG-O 3.23Å; K238-Y271 PolarHBondContact N-O 2.82Å; H262-Y271 AromaticContact CE1-CE2 3.76Å; C269-Y271 HydrophobicContact CB-CD2 4.17Å; C269-Y271 HydrophobicContact CB-CE2 3.46Å; C269-Y271 VanDerWaalsContact CB-CE2 3.46Å; C269-Y271 WeakPolarHBondContact O-CD2 3.36Å; Y271-L279 HydrophobicContact CD1-CD1 4.45Å; Y271-L279 HydrophobicContact CD1-CD2 3.3Å; Y271-L279 HydrophobicContact CD2-CD2 4.48Å; Y271-L279 HydrophobicContact CE1-CD1 4.22Å; Y271-L279 HydrophobicContact CE1-CD2 3.62Å; Y271-L279 HydrophobicContact CG-CD2 3.78Å
272	W	93.3	Very high	85	Confident	16 Å²	16	80.1 Å²	80.1	6%	0.061	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-69	133.5	174.5	-160.9	-80.4	0	0	0	111	Q236 W237 F250 I254 C270 G274 C275 H295	Q236-W272 HydrophobicContact CB-CD2 4.26Å; Q236-W272 HydrophobicContact CB-CZ2 3.77Å; Q236-W272 HydrophobicContact CG-CZ2 4.03Å; W237-W272 HydrophobicContact CE3-CE3 4.41Å; F250-W272 HydrophobicContact CE2-CH2 4.27Å; F250-W272 AromaticContact CZ-CH2 3.74Å; F250-W272 HydrophobicContact CZ-CH2 3.74Å; I254-W272 HydrophobicContact CD1-CH2 4.15Å; I254-W272 HydrophobicContact CD1-CZ3 3.81Å; I254-W272 HydrophobicContact CG1-CZ3 4.31Å; C270-W272 VanDerWaalsContact SG-CB 3.56Å; W272-G274 PolarHBondContact O-N 2.88Å; W272-C275 HydrophobicContact CB-CB 4.17Å; W272-C275 WeakPolarHBondContact O-CB 3.41Å; W272-C275 PolarHBondContact O-N 2.82Å; W272-C275 VanDerWaalsContact O-N 3.1Å; W272-H295 AromaticContact CD1-CE1 3.53Å; W272-H295 AromaticContact CD1-CG 3.79Å; W272-H295 AromaticContact CD1-ND1 3.21Å; W272-H295 HydrophobicContact CD2-CB 3.47Å; W272-H295 VanDerWaalsContact CD2-CB 3.47Å; W272-H295 AromaticContact CD2-CD2 3.98Å; W272-H295 AromaticContact CD2-CG 3.45Å; W272-H295 VanDerWaalsContact CD2-CG 3.45Å; W272-H295 AromaticContact CD2-ND1 3.73Å; W272-H295 AromaticContact CE2-CG 3.78Å; W272-H295 AromaticContact CE2-ND1 3.81Å; W272-H295 HydrophobicContact CE3-CB 3.63Å; W272-H295 AromaticContact CE3-CG 3.93Å; W272-H295 HydrophobicContact CG-CB 4.08Å; W272-H295 AromaticContact CG-CD2 3.77Å; W272-H295 AromaticContact CG-CE1 3.59Å; W272-H295 AromaticContact CG-CG 3.48Å; W272-H295 VanDerWaalsContact CG-CG 3.48Å; W272-H295 AromaticContact CG-ND1 3.37Å; W272-H295 AromaticContact CG-NE2 3.85Å; W272-H295 HydrophobicContact CH2-CB 3.93Å; W272-H295 HydrophobicContact CZ2-CB 3.79Å; W272-H295 HydrophobicContact CZ3-CB 3.86Å; W272-H295 AromaticContact NE1-CG 3.94Å; W272-H295 AromaticContact NE1-ND1 3.48Å; W272-H295 PolarHBondContact NE1-ND1 2.89Å
273	E	91.7	Very high	85.6	Confident	76 Å²	76	85.7 Å²	85.7	36%	0.355	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	122.4	177.2	-72.1	-177.8	177.8	0	0	110.5	Q236 K238 R241	Q236-E273 HydrophobicContact CB-CB 4.37Å; Q236-E273 WeakPolarHBondContact O-CG 3.44Å; Q236-E273 PolarHBondContact O-N 2.97Å; K238-E273 HydrophobicContact CG-CG 4.4Å; R241-E273 IonicContact CZ-OE1 3.74Å; R241-E273 IonicContact CZ-OE2 3.8Å; R241-E273 IonicContact NH2-OE1 2.77Å; R241-E273 PolarHBondContact NH2-OE1 2.96Å; R241-E273 IonicContact NH2-OE2 2.94Å; R241-E273 PolarHBondContact NH2-OE2 3.34Å
274	G	90.4	Very high	86.6	Confident	78 Å²	78	80.7 Å²	80.7	80%	0.804	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	12	-178.3	0	0	0	0	0	115.5	W272 R276	W272-G274 PolarHBondContact O-N 2.88Å; G274-R276 PolarHBondContact O-N 3.35Å
275	C	93.1	Very high	87.9	Confident	7 Å²	7	79.7 Å²	79.7	5%	0.047	39%	0.388	C	S	.	.			trans	-63.7	124.1	173.9	-173.5	0	0	0	0	111.6	W272 R277 Q278 H291	W272-C275 HydrophobicContact CB-CB 4.17Å; W272-C275 WeakPolarHBondContact O-CB 3.41Å; W272-C275 PolarHBondContact O-N 2.82Å; W272-C275 VanDerWaalsContact O-N 3.1Å; C275-R277 PolarHBondContact O-N 3.37Å; C275-Q278 PolarHBondContact O-N 3.04Å; C275-Q278 VanDerWaalsContact O-N 3.08Å; C275-H291 PolarHBondContact SG-NE2 2.87Å; C275-H291 VanDerWaalsContact SG-NE2 3.37Å
276	R	92	Very high	88.9	Confident	241 Å²	241	81.1 Å²	81.1	91%	0.909	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.5	177.8	-65.9	-171.6	-174	-140.2	0.5	114.2	G274 Q278	G274-R276 PolarHBondContact O-N 3.35Å; R276-Q278 VanDerWaalsContact C-N 3.28Å; R276-Q278 PolarHBondContact O-N 3.49Å
277	R	90.4	Very high	90	Very high	75 Å²	75	75.7 Å²	75.7	28%	0.283	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-11.5	178.2	-70.1	-168.4	64.9	90.1	-1.5	113.8	C275 L279 K280	C275-R277 PolarHBondContact O-N 3.37Å; R277-L279 VanDerWaalsContact C-N 3.33Å; R277-L279 PolarHBondContact O-N 2.78Å; R277-K280 VanDerWaalsContact O-CB 3.23Å; R277-K280 WeakPolarHBondContact O-CB 2.88Å; R277-K280 PolarHBondContact O-N 3.42Å
278	Q	84.8	Confident	90.6	Very high	155 Å²	155	70.1 Å²	70.1	72%	0.724	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	52.5	173.2	-58.3	-68	5.8	0	0	113.3	C275 R276 K280	C275-Q278 PolarHBondContact O-N 3.04Å; C275-Q278 VanDerWaalsContact O-N 3.08Å; R276-Q278 VanDerWaalsContact C-N 3.28Å; R276-Q278 PolarHBondContact O-N 3.49Å; Q278-K280 PolarHBondContact O-N 3.39Å; Q278-K280 VanDerWaalsContact O-N 3.17Å
279	L	85.4	Confident	90.7	Very high	69 Å²	69	69.8 Å²	69.8	36%	0.361	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	8.8	-179.6	-48.8	179.2	0	0	0	116.3	C269 C270 Y271 R277 P281	C269-L279 PolarHBondContact SG-O 3.37Å; C270-L279 WeakPolarHBondContact O-CD2 3.19Å; Y271-L279 HydrophobicContact CD1-CD1 4.45Å; Y271-L279 HydrophobicContact CD1-CD2 3.3Å; Y271-L279 HydrophobicContact CD2-CD2 4.48Å; Y271-L279 HydrophobicContact CE1-CD1 4.22Å; Y271-L279 HydrophobicContact CE1-CD2 3.62Å; Y271-L279 HydrophobicContact CG-CD2 3.78Å; R277-L279 VanDerWaalsContact C-N 3.33Å; R277-L279 PolarHBondContact O-N 2.78Å; L279-P281 WeakPolarHBondContact O-CD 3.43Å; L279-P281 VanDerWaalsContact O-N 3.14Å
280	K	88.9	Confident	90.8	Very high	114 Å²	114	71.2 Å²	71.2	50%	0.496	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-60.3	118	175.6	-173.6	172.8	-177.7	172.2	0	110.6	R277 Q278	R277-K280 VanDerWaalsContact O-CB 3.23Å; R277-K280 WeakPolarHBondContact O-CB 2.88Å; R277-K280 PolarHBondContact O-N 3.42Å; Q278-K280 PolarHBondContact O-N 3.39Å; Q278-K280 VanDerWaalsContact O-N 3.17Å
281	P	90.2	Very high	90.8	Very high	67 Å²	67	72 Å²	72	44%	0.435	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-64.5	149.1	-172.5	23.7	-32.7	0	0	0	111.8	L279	L279-P281 WeakPolarHBondContact O-CD 3.43Å; L279-P281 VanDerWaalsContact O-N 3.14Å
282	F	90.4	Very high	90.9	Very high	23 Å²	23	68.5 Å²	68.5	10%	0.101	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-89.6	140.9	163.1	-65.2	-84.5	0	0	0	109.1	Y268 C270 A284 K287 L288 H291	Y268-F282 VanDerWaalsContact O-CD2 3.28Å; Y268-F282 WeakPolarHBondContact O-CD2 3.38Å; Y268-F282 PolarHBondContact O-N 3.27Å; C270-F282 HydrophobicContact CB-CE2 4.48Å; F282-A284 PolarHBondContact O-N 3.34Å; F282-K287 HydrophobicContact CB-CB 4.08Å; F282-K287 HydrophobicContact CD1-CB 3.68Å; F282-K287 HydrophobicContact CE1-CB 4.48Å; F282-K287 HydrophobicContact CG-CB 4.15Å; F282-L288 HydrophobicContact CB-CB 4.41Å; F282-L288 HydrophobicContact CD2-CB 3.79Å; F282-L288 HydrophobicContact CD2-CD1 3.78Å; F282-L288 HydrophobicContact CD2-CG 4.37Å; F282-L288 HydrophobicContact CE2-CB 4.4Å; F282-L288 HydrophobicContact CE2-CD1 3.76Å; F282-L288 HydrophobicContact CG-CB 4.26Å; F282-H291 HydrophobicContact CE1-CB 3.99Å; F282-H291 HydrophobicContact CE2-CB 3.92Å; F282-H291 AromaticContact CE2-CD2 3.68Å; F282-H291 AromaticContact CE2-CG 3.8Å; F282-H291 HydrophobicContact CZ-CB 3.35Å; F282-H291 AromaticContact CZ-CD2 3.68Å; F282-H291 AromaticContact CZ-CG 3.32Å; F282-H291 AromaticContact CZ-ND1 3.82Å
283	N	89.1	Confident	91	Very high	132 Å²	132	70.1 Å²	70.1	71%	0.706	34%	0.341	S	S	*	.	S	Bend	trans	-76.5	-0.2	177.2	66.5	-9.6	0	0	0	113.8	K287	N283-K287 VanDerWaalsContact OD1-CD 3.29Å; N283-K287 WeakPolarHBondContact OD1-CD 3.5Å; N283-K287 WeakPolarHBondContact OD1-CE 3.44Å; N283-K287 PolarHBondContact OD1-NZ 3.02Å
284	A	89.6	Confident	91	Very high	21 Å²	21	72 Å²	72	17%	0.174	35%	0.352	C	S	.	.	S	Bend	trans	-154.8	145.8	177.9	0	0	0	0	0	112.5	Y268 F282 Y286 K287 L288	Y268-A284 VanDerWaalsContact CD2-C 3.44Å; F282-A284 PolarHBondContact O-N 3.34Å; A284-Y286 VanDerWaalsContact C-N 3.32Å; A284-Y286 HydrophobicContact CB-CD1 3.52Å; A284-Y286 HydrophobicContact CB-CE1 3.34Å; A284-Y286 PolarHBondContact O-N 3.03Å; A284-K287 HydrophobicContact CB-CG 4.35Å; A284-K287 PolarHBondContact O-N 3.01Å; A284-K287 VanDerWaalsContact O-N 3.13Å; A284-L288 PolarHBondContact O-N 3.15Å
285	R	91.4	Very high	91.1	Very high	78 Å²	78	70.4 Å²	70.4	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-51.9	-48.3	178.5	-172.1	-177.6	170.8	90.7	0.8	112.5	V259 S260 Y268 K287 L288 I289	V259-R285 HydrophobicContact CG1-CG 3.75Å; V259-R285 PolarHBondContact O-NH1 2.92Å; S260-R285 PolarHBondContact OG-NH2 3.37Å; S260-R285 VanDerWaalsContact OG-NH2 3.09Å; Y268-R285 HydrophobicContact CD1-CB 3.95Å; Y268-R285 HydrophobicContact CD1-CG 4.17Å; Y268-R285 HydrophobicContact CE1-CB 3.39Å; Y268-R285 HydrophobicContact CE1-CG 3.68Å; Y268-R285 HydrophobicContact CE2-CB 4.19Å; Y268-R285 VanDerWaalsContact CE2-N 3.3Å; R285-K287 VanDerWaalsContact C-N 3.26Å; R285-K287 PolarHBondContact O-N 3.11Å; R285-L288 WeakPolarHBondContact O-CB 3.29Å; R285-L288 PolarHBondContact O-N 3.45Å; R285-L288 VanDerWaalsContact O-N 3.15Å; R285-I289 HydrophobicContact CG-CD1 4.14Å; R285-I289 PolarHBondContact O-N 3.46Å
286	Y	89.9	Confident	91	Very high	146 Å²	146	70.6 Å²	70.6	57%	0.573	33%	0.325	S	S	*	.	H	α-helix	trans	-64.3	-31.3	-175.7	79.4	-88.4	0	0	0	112.3	A284 I289 V290	A284-Y286 VanDerWaalsContact C-N 3.32Å; A284-Y286 HydrophobicContact CB-CD1 3.52Å; A284-Y286 HydrophobicContact CB-CE1 3.34Å; A284-Y286 PolarHBondContact O-N 3.03Å; Y286-I289 PolarHBondContact O-N 3.33Å; Y286-V290 WeakPolarHBondContact O-CG2 3.47Å; Y286-V290 PolarHBondContact O-N 2.73Å
287	K	92.4	Very high	90.9	Very high	50 Å²	50	60.8 Å²	60.8	22%	0.217	30%	0.299	C	S	.	.	H	α-helix	trans	-68.1	-38.5	176.6	-67.6	-169.5	-176.9	179.2	0	111.2	F282 N283 A284 R285 H291	F282-K287 HydrophobicContact CB-CB 4.08Å; F282-K287 HydrophobicContact CD1-CB 3.68Å; F282-K287 HydrophobicContact CE1-CB 4.48Å; F282-K287 HydrophobicContact CG-CB 4.15Å; N283-K287 VanDerWaalsContact OD1-CD 3.29Å; N283-K287 WeakPolarHBondContact OD1-CD 3.5Å; N283-K287 WeakPolarHBondContact OD1-CE 3.44Å; N283-K287 PolarHBondContact OD1-NZ 3.02Å; A284-K287 HydrophobicContact CB-CG 4.35Å; A284-K287 PolarHBondContact O-N 3.01Å; A284-K287 VanDerWaalsContact O-N 3.13Å; R285-K287 VanDerWaalsContact C-N 3.26Å; R285-K287 PolarHBondContact O-N 3.11Å; K287-H291 WeakPolarHBondContact O-CB 3.27Å; K287-H291 PolarHBondContact O-N 2.72Å
288	L	93.4	Very high	91	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.9	-48.4	171.4	176	61.6	0	0	0	110.7	V259 Y268 C270 F282 A284 R285 V290 H291 L292	V259-L288 HydrophobicContact CG1-CD2 4.35Å; V259-L288 HydrophobicContact CG2-CD2 4.44Å; Y268-L288 HydrophobicContact CD1-CD2 4.38Å; C270-L288 HydrophobicContact CB-CD1 3.88Å; F282-L288 HydrophobicContact CB-CB 4.41Å; F282-L288 HydrophobicContact CD2-CB 3.79Å; F282-L288 HydrophobicContact CD2-CD1 3.78Å; F282-L288 HydrophobicContact CD2-CG 4.37Å; F282-L288 HydrophobicContact CE2-CB 4.4Å; F282-L288 HydrophobicContact CE2-CD1 3.76Å; F282-L288 HydrophobicContact CG-CB 4.26Å; A284-L288 PolarHBondContact O-N 3.15Å; R285-L288 WeakPolarHBondContact O-CB 3.29Å; R285-L288 PolarHBondContact O-N 3.45Å; R285-L288 VanDerWaalsContact O-N 3.15Å; L288-V290 PolarHBondContact O-N 3.1Å; L288-H291 WeakPolarHBondContact O-CA 3.39Å; L288-H291 WeakPolarHBondContact O-CB 3.46Å; L288-H291 PolarHBondContact O-N 3.45Å; L288-L292 HydrophobicContact CD1-CD1 4.08Å; L288-L292 HydrophobicContact CD1-CD2 4.11Å; L288-L292 HydrophobicContact CD1-CG 3.93Å; L288-L292 HydrophobicContact CG-CD1 3.96Å; L288-L292 HydrophobicContact CG-CG 4.25Å; L288-L292 VanDerWaalsContact O-CG 3.3Å; L288-L292 WeakPolarHBondContact O-CG 3.36Å; L288-L292 PolarHBondContact O-N 3.26Å
289	I	92.7	Very high	91.3	Very high	30 Å²	30	58.2 Å²	58.2	15%	0.154	28%	0.284	C	S	.	.	H	α-helix	trans	-55.5	-49.7	177.8	-66.7	171.8	0	0	0	111.2	E255 V259 R285 Y286 H291 L292 R293	E255-I289 WeakPolarHBondContact OE1-CG2 3.38Å; V259-I289 HydrophobicContact CB-CG1 4.5Å; V259-I289 HydrophobicContact CG1-CD1 4.17Å; V259-I289 HydrophobicContact CG1-CG1 3.77Å; V259-I289 HydrophobicContact CG2-CG1 4.2Å; R285-I289 HydrophobicContact CG-CD1 4.14Å; R285-I289 PolarHBondContact O-N 3.46Å; Y286-I289 PolarHBondContact O-N 3.33Å; I289-H291 VanDerWaalsContact C-N 3.27Å; I289-H291 PolarHBondContact O-N 2.81Å; I289-L292 PolarHBondContact O-N 3.22Å; I289-L292 VanDerWaalsContact O-N 3.17Å; I289-R293 PolarHBondContact O-N 2.87Å
290	V	92.6	Very high	91.4	Very high	36 Å²	36	57.8 Å²	57.8	22%	0.218	29%	0.286	C	S	.	.	H	α-helix	trans	-62.2	-35.8	178.2	171.1	0	0	0	0	111.7	Y286 L288 R293 R314	Y286-V290 WeakPolarHBondContact O-CG2 3.47Å; Y286-V290 PolarHBondContact O-N 2.73Å; L288-V290 PolarHBondContact O-N 3.1Å; V290-R293 WeakPolarHBondContact O-CB 3.48Å; V290-R314 HydrophobicContact CG1-CG 3.93Å
291	H	94	Very high	91.5	Very high	20 Å²	20	54 Å²	54	9%	0.093	27%	0.271	C	S	.	.	H	α-helix	trans	-66.4	-41.9	174.5	167.8	74.2	0	0	0	112.4	C270 C275 F282 K287 L288 I289 R293 I294 H295	C270-H291 PolarHBondContact SG-NE2 2.73Å; C275-H291 PolarHBondContact SG-NE2 2.87Å; C275-H291 VanDerWaalsContact SG-NE2 3.37Å; F282-H291 HydrophobicContact CE1-CB 3.99Å; F282-H291 HydrophobicContact CE2-CB 3.92Å; F282-H291 AromaticContact CE2-CD2 3.68Å; F282-H291 AromaticContact CE2-CG 3.8Å; F282-H291 HydrophobicContact CZ-CB 3.35Å; F282-H291 AromaticContact CZ-CD2 3.68Å; F282-H291 AromaticContact CZ-CG 3.32Å; F282-H291 AromaticContact CZ-ND1 3.82Å; K287-H291 WeakPolarHBondContact O-CB 3.27Å; K287-H291 PolarHBondContact O-N 2.72Å; L288-H291 WeakPolarHBondContact O-CA 3.39Å; L288-H291 WeakPolarHBondContact O-CB 3.46Å; L288-H291 PolarHBondContact O-N 3.45Å; I289-H291 VanDerWaalsContact C-N 3.27Å; I289-H291 PolarHBondContact O-N 2.81Å; H291-R293 PolarHBondContact O-N 3.4Å; H291-R293 VanDerWaalsContact O-N 3.14Å; H291-I294 VanDerWaalsContact O-CB 3.27Å; H291-I294 WeakPolarHBondContact O-CB 3.26Å; H291-I294 WeakPolarHBondContact O-CG1 3.44Å; H291-I294 PolarHBondContact O-N 3.17Å; H291-H295 AromaticContact CE1-NE2 3.9Å; H291-H295 AromaticContact NE2-CD2 3.96Å; H291-H295 AromaticContact NE2-NE2 3.47Å; H291-H295 PolarHBondContact NE2-NE2 2.97Å
292	L	94	Very high	91.6	Very high	5 Å²	5	58.1 Å²	58.1	3%	0.026	28%	0.282	C	S	.	.	H	α-helix	trans	-63.6	-20.3	-178.8	-66.4	174.9	0	0	0	113.1	W237 I254 V259 C270 L288 I289 I294 H295 S296	W237-L292 HydrophobicContact CE3-CD2 4.45Å; W237-L292 HydrophobicContact CH2-CD1 4.45Å; W237-L292 HydrophobicContact CZ3-CD1 3.88Å; W237-L292 HydrophobicContact CZ3-CD2 3.64Å; W237-L292 HydrophobicContact CZ3-CG 4.43Å; I254-L292 HydrophobicContact CG2-CB 4.25Å; I254-L292 HydrophobicContact CG2-CD1 3.65Å; I254-L292 HydrophobicContact CG2-CG 4.4Å; V259-L292 HydrophobicContact CG2-CD1 3.39Å; C270-L292 HydrophobicContact CB-CD2 4.44Å; L288-L292 HydrophobicContact CD1-CD1 4.08Å; L288-L292 HydrophobicContact CD1-CD2 4.11Å; L288-L292 HydrophobicContact CD1-CG 3.93Å; L288-L292 HydrophobicContact CG-CD1 3.96Å; L288-L292 HydrophobicContact CG-CG 4.25Å; L288-L292 VanDerWaalsContact O-CG 3.3Å; L288-L292 WeakPolarHBondContact O-CG 3.36Å; L288-L292 PolarHBondContact O-N 3.26Å; I289-L292 PolarHBondContact O-N 3.22Å; I289-L292 VanDerWaalsContact O-N 3.17Å; L292-I294 PolarHBondContact O-N 2.99Å; L292-H295 WeakPolarHBondContact O-CB 3.39Å; L292-H295 PolarHBondContact O-N 3.34Å; L292-S296 PolarHBondContact O-N 3.41Å; L292-S296 PolarHBondContact O-OG 2.99Å
293	R	94	Very high	91.7	Very high	49 Å²	49	57.6 Å²	57.6	19%	0.185	28%	0.281	C	S	.	.	H	α-helix	trans	-58.5	-24	169.1	-62	-173.7	175.8	149.1	7.6	113.9	I289 V290 H291 H295 S296 G297 D298 S313	I289-R293 PolarHBondContact O-N 2.87Å; V290-R293 WeakPolarHBondContact O-CB 3.48Å; H291-R293 PolarHBondContact O-N 3.4Å; H291-R293 VanDerWaalsContact O-N 3.14Å; R293-H295 VanDerWaalsContact C-N 3.29Å; R293-S296 WeakPolarHBondContact CA-OG 3.34Å; R293-G297 WeakPolarHBondContact O-CA 3.47Å; R293-G297 PolarHBondContact O-N 2.98Å; R293-D298 HydrophobicContact CB-CB 4.42Å; R293-D298 WeakPolarHBondContact CB-O 3.39Å; R293-D298 HydrophobicContact CG-CB 4.14Å; R293-D298 IonicContact NE-OD2 2.89Å; R293-D298 PolarHBondContact O-N 3.5Å; R293-S313 VanDerWaalsContact CD-O 3.31Å; R293-S313 WeakPolarHBondContact CD-O 3.35Å; R293-S313 PolarHBondContact NH1-O 2.84Å
294	I	92.4	Very high	91.8	Very high	115 Å²	115	56.8 Å²	56.8	59%	0.59	28%	0.281	S	S	*	.	H	α-helix	trans	-68.1	-34.6	173.9	-61.1	170.8	0	0	0	110.6	H291 L292	H291-I294 VanDerWaalsContact O-CB 3.27Å; H291-I294 WeakPolarHBondContact O-CB 3.26Å; H291-I294 WeakPolarHBondContact O-CG1 3.44Å; H291-I294 PolarHBondContact O-N 3.17Å; L292-I294 PolarHBondContact O-N 2.99Å
295	H	92.9	Very high	92	Very high	45 Å²	45	61.4 Å²	61.4	21%	0.208	30%	0.295	C	S	.	.	H	α-helix	trans	-85.5	-44.9	-178.9	-66.2	-58.3	0	0	0	112.1	W272 H291 L292 R293 G297	W272-H295 AromaticContact CD1-CE1 3.53Å; W272-H295 AromaticContact CD1-CG 3.79Å; W272-H295 AromaticContact CD1-ND1 3.21Å; W272-H295 HydrophobicContact CD2-CB 3.47Å; W272-H295 VanDerWaalsContact CD2-CB 3.47Å; W272-H295 AromaticContact CD2-CD2 3.98Å; W272-H295 AromaticContact CD2-CG 3.45Å; W272-H295 VanDerWaalsContact CD2-CG 3.45Å; W272-H295 AromaticContact CD2-ND1 3.73Å; W272-H295 AromaticContact CE2-CG 3.78Å; W272-H295 AromaticContact CE2-ND1 3.81Å; W272-H295 HydrophobicContact CE3-CB 3.63Å; W272-H295 AromaticContact CE3-CG 3.93Å; W272-H295 HydrophobicContact CG-CB 4.08Å; W272-H295 AromaticContact CG-CD2 3.77Å; W272-H295 AromaticContact CG-CE1 3.59Å; W272-H295 AromaticContact CG-CG 3.48Å; W272-H295 VanDerWaalsContact CG-CG 3.48Å; W272-H295 AromaticContact CG-ND1 3.37Å; W272-H295 AromaticContact CG-NE2 3.85Å; W272-H295 HydrophobicContact CH2-CB 3.93Å; W272-H295 HydrophobicContact CZ2-CB 3.79Å; W272-H295 HydrophobicContact CZ3-CB 3.86Å; W272-H295 AromaticContact NE1-CG 3.94Å; W272-H295 AromaticContact NE1-ND1 3.48Å; W272-H295 PolarHBondContact NE1-ND1 2.89Å; H291-H295 AromaticContact CE1-NE2 3.9Å; H291-H295 AromaticContact NE2-CD2 3.96Å; H291-H295 AromaticContact NE2-NE2 3.47Å; H291-H295 PolarHBondContact NE2-NE2 2.97Å; L292-H295 WeakPolarHBondContact O-CB 3.39Å; L292-H295 PolarHBondContact O-N 3.34Å; R293-H295 VanDerWaalsContact C-N 3.29Å; H295-G297 VanDerWaalsContact C-N 3.28Å; H295-G297 PolarHBondContact O-N 3.33Å
296	S	91.1	Very high	92	Very high	12 Å²	12	62.4 Å²	62.4	8%	0.084	31%	0.311	C	S	.	.	H	α-helix	trans	-76.3	-17	179.5	64.8	0	0	0	0	113.4	H247 L292 R293 D298	H247-S296 PolarHBondContact NE2-O 2.83Å; L292-S296 PolarHBondContact O-N 3.41Å; L292-S296 PolarHBondContact O-OG 2.99Å; R293-S296 WeakPolarHBondContact CA-OG 3.34Å; S296-D298 PolarHBondContact O-N 3.45Å; S296-D298 VanDerWaalsContact OG-CB 3.26Å; S296-D298 WeakPolarHBondContact OG-CB 3.19Å; S296-D298 PolarHBondContact OG-N 3.4Å
297	G	90	Very high	92.1	Very high	34 Å²	34	58.7 Å²	58.7	35%	0.351	32%	0.318	S	S	.	.			trans	71.6	11.4	-171.3	0	0	0	0	0	113.6	R293 H295	R293-G297 WeakPolarHBondContact O-CA 3.47Å; R293-G297 PolarHBondContact O-N 2.98Å; H295-G297 VanDerWaalsContact C-N 3.28Å; H295-G297 PolarHBondContact O-N 3.33Å
298	D	91.8	Very high	92.1	Very high	26 Å²	26	57.2 Å²	57.2	14%	0.139	31%	0.313	C	S	.	.			trans	-66.5	133.5	-176.7	-178.4	41.2	0	0	0	113	H247 V251 R293 S296 P300	H247-D298 IonicContact CE1-OD1 3.86Å; V251-D298 HydrophobicContact CG1-CB 4.5Å; V251-D298 HydrophobicContact CG2-CB 3.83Å; R293-D298 HydrophobicContact CB-CB 4.42Å; R293-D298 WeakPolarHBondContact CB-O 3.39Å; R293-D298 HydrophobicContact CG-CB 4.14Å; R293-D298 IonicContact NE-OD2 2.89Å; R293-D298 PolarHBondContact O-N 3.5Å; S296-D298 PolarHBondContact O-N 3.45Å; S296-D298 VanDerWaalsContact OG-CB 3.26Å; S296-D298 WeakPolarHBondContact OG-CB 3.19Å; S296-D298 PolarHBondContact OG-N 3.4Å; D298-P300 WeakPolarHBondContact OD2-CD 3.31Å
299	R	91	Very high	92	Very high	151 Å²	151	66.2 Å²	66.2	57%	0.57	35%	0.353	S	S	*	.			trans	-139.2	75.1	-175.5	-68.1	178.7	177.3	113.2	-3.8	108.9	N301 A311 F312	R299-N301 VanDerWaalsContact C-N 3.28Å; R299-N301 PolarHBondContact O-N 3.19Å; R299-A311 HydrophobicContact CB-CB 3.75Å; R299-A311 WeakPolarHBondContact CD-O 3.45Å; R299-A311 WeakPolarHBondContact O-CB 3.4Å; R299-F312 CarbonylContact C-O 3.54Å
300	P	88.3	Confident	91.9	Very high	60 Å²	60	68.7 Å²	68.7	39%	0.39	36%	0.362	S	S	.	.			trans	-73.6	-21	-171	26.7	-31.9	0	0	0	113	D298 K302	D298-P300 WeakPolarHBondContact OD2-CD 3.31Å; P300-K302 PolarHBondContact O-N 3.14Å
301	N	89.8	Confident	91.8	Very high	34 Å²	34	68.5 Å²	68.5	18%	0.182	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	90.3	-175.1	-49.2	-82.6	0	0	0	109.9	R299 A311 F312 L318	R299-N301 VanDerWaalsContact C-N 3.28Å; R299-N301 PolarHBondContact O-N 3.19Å; N301-A311 CarbonylContact O-C 3.55Å; N301-A311 WeakPolarHBondContact O-CA 3.42Å; N301-F312 HydrophobicContact CB-CB 4.46Å; N301-F312 WeakPolarHBondContact CB-O 3.29Å; N301-F312 PolarHBondContact N-O 3.29Å; N301-F312 VanDerWaalsContact N-O 3.13Å; N301-F312 PolarHBondContact ND2-O 3.12Å; N301-F312 PolarHBondContact O-N 3.17Å; N301-L318 HydrophobicContact CB-CB 4Å; N301-L318 HydrophobicContact CB-CD2 3.73Å; N301-L318 HydrophobicContact CB-CG 4.46Å
302	K	92.6	Very high	91.7	Very high	153 Å²	153	69.5 Å²	69.5	67%	0.665	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	143.5	179	-60.1	-177.7	-178.2	-178	0	111.3	P300 A311 L318	P300-K302 PolarHBondContact O-N 3.14Å; K302-A311 HydrophobicContact CG-CB 4.07Å; K302-L318 WeakPolarHBondContact O-CD2 3.21Å
303	C	91.9	Very high	91.5	Very high	12 Å²	12	70.9 Å²	70.9	8%	0.081	38%	0.379	C	S	.	.			trans	-69.1	137.3	167.6	-166.7	0	0	0	0	109.8	C308 K310 L318 H321	C303-C308 HydrophobicContact CB-CB 4.26Å; C303-K310 WeakPolarHBondContact CB-O 3.13Å; C303-K310 PolarHBondContact N-O 3.03Å; C303-L318 HydrophobicContact CB-CD1 4.08Å; C303-H321 PolarHBondContact SG-NE2 3.26Å; C303-H321 VanDerWaalsContact SG-NE2 3.39Å
304	T	92.8	Very high	91.3	Very high	115 Å²	115	73.3 Å²	73.3	71%	0.706	39%	0.388	S	S	*	.			trans	-101.8	0.5	178.2	54.1	0	0	0	0	112.5
305	Y	92.3	Very high	91.2	Very high	119 Å²	119	71.9 Å²	71.9	47%	0.467	38%	0.381	S	S	.	.	S	Bend	trans	-68.7	132.7	179	-161.2	-92.2	0	0	0	110.3	G307 C308 H325	Y305-G307 PolarHBondContact O-N 3.05Å; Y305-C308 WeakPolarHBondContact O-CB 3.49Å; Y305-C308 PolarHBondContact O-N 3.39Å; Y305-H325 HydrophobicContact CD1-CB 4.19Å; Y305-H325 AromaticContact CD1-CE1 3.86Å; Y305-H325 AromaticContact CD1-CG 3.76Å; Y305-H325 AromaticContact CD1-ND1 3.48Å; Y305-H325 WeakPolarHBondContact CD1-ND1 3.39Å; Y305-H325 HydrophobicContact CD2-CB 3.54Å; Y305-H325 AromaticContact CD2-CG 3.81Å; Y305-H325 HydrophobicContact CE1-CB 4.31Å; Y305-H325 AromaticContact CE1-ND1 3.9Å; Y305-H325 HydrophobicContact CE2-CB 3.69Å; Y305-H325 HydrophobicContact CG-CB 3.8Å; Y305-H325 AromaticContact CG-CD2 3.76Å; Y305-H325 AromaticContact CG-CG 3.5Å; Y305-H325 AromaticContact CG-ND1 3.74Å
306	P	91.8	Very high	91	Very high	99 Å²	99	74.5 Å²	74.5	64%	0.643	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	130.1	-178.2	-26.8	34.7	0	0	0	112.5	C308	P306-C308 PolarHBondContact O-N 3.18Å
307	G	92.7	Very high	91	Very high	68 Å²	68	77.2 Å²	77.2	70%	0.701	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	-2.7	-177.5	0	0	0	0	0	115.2	Y305	Y305-G307 PolarHBondContact O-N 3.05Å
308	C	91.2	Very high	91.1	Very high	18 Å²	18	76.4 Å²	76.4	12%	0.122	39%	0.394	C	S	.	.			trans	-100.1	117.7	175.3	-170.3	0	0	0	0	111.6	C303 Y305 P306 H321 H325	C303-C308 HydrophobicContact CB-CB 4.26Å; Y305-C308 WeakPolarHBondContact O-CB 3.49Å; Y305-C308 PolarHBondContact O-N 3.39Å; P306-C308 PolarHBondContact O-N 3.18Å; C308-H321 PolarHBondContact SG-NE2 3.5Å; C308-H325 PolarHBondContact SG-NE2 2.87Å; C308-H325 VanDerWaalsContact SG-NE2 3.35Å
309	F	92.2	Very high	91.1	Very high	190 Å²	190	79.4 Å²	79.4	83%	0.833	41%	0.406	S	S	*	.			trans	-104.3	13.5	178.9	-56.3	-74.3	0	0	0	113.4
310	K	90.5	Very high	91.1	Very high	82 Å²	82	74.5 Å²	74.5	36%	0.357	39%	0.391	S	S	.	.			trans	-70.9	139.3	-178.3	-66.9	-169.3	178.1	-166.6	0	111	C303 F312 Y450	C303-K310 WeakPolarHBondContact CB-O 3.13Å; C303-K310 PolarHBondContact N-O 3.03Å; K310-F312 HydrophobicContact CB-CE2 3.88Å; K310-F312 HydrophobicContact CB-CZ 4.05Å; K310-Y450 PolarHBondContact NZ-O 3.1Å
311	A	90	Very high	91.4	Very high	31 Å²	31	72.7 Å²	72.7	26%	0.256	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	150.8	176.6	0	0	0	0	0	111.1	R299 N301 K302	R299-A311 HydrophobicContact CB-CB 3.75Å; R299-A311 WeakPolarHBondContact CD-O 3.45Å; R299-A311 WeakPolarHBondContact O-CB 3.4Å; N301-A311 CarbonylContact O-C 3.55Å; N301-A311 WeakPolarHBondContact O-CA 3.42Å; K302-A311 HydrophobicContact CG-CB 4.07Å
312	F	92.2	Very high	91.4	Very high	41 Å²	41	74 Å²	74	18%	0.18	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142.1	-172.4	-58.8	-91.8	0	0	0	111.5	R299 N301 K310 R314 N317 L318 H321	R299-F312 CarbonylContact C-O 3.54Å; N301-F312 HydrophobicContact CB-CB 4.46Å; N301-F312 WeakPolarHBondContact CB-O 3.29Å; N301-F312 PolarHBondContact N-O 3.29Å; N301-F312 VanDerWaalsContact N-O 3.13Å; N301-F312 PolarHBondContact ND2-O 3.12Å; N301-F312 PolarHBondContact O-N 3.17Å; K310-F312 HydrophobicContact CB-CE2 3.88Å; K310-F312 HydrophobicContact CB-CZ 4.05Å; F312-R314 VanDerWaalsContact C-N 3.28Å; F312-R314 PolarHBondContact O-N 3.35Å; F312-N317 HydrophobicContact CB-CB 4.12Å; F312-N317 HydrophobicContact CD1-CB 3.77Å; F312-N317 HydrophobicContact CG-CB 4.19Å; F312-L318 HydrophobicContact CB-CB 4.25Å; F312-L318 HydrophobicContact CD2-CB 3.91Å; F312-L318 HydrophobicContact CD2-CD1 3.85Å; F312-L318 HydrophobicContact CE2-CD1 4.12Å; F312-L318 HydrophobicContact CG-CB 4.28Å; F312-H321 HydrophobicContact CE1-CB 3.99Å; F312-H321 HydrophobicContact CE2-CB 3.64Å; F312-H321 AromaticContact CE2-CD2 3.27Å; F312-H321 WeakPolarHBondContact CE2-CD2 3.42Å; F312-H321 AromaticContact CE2-CG 3.47Å; F312-H321 VanDerWaalsContact CE2-CG 3.47Å; F312-H321 HydrophobicContact CZ-CB 3.32Å; F312-H321 AromaticContact CZ-CD2 3.57Å; F312-H321 AromaticContact CZ-CG 3.25Å; F312-H321 AromaticContact CZ-ND1 3.87Å
313	S	89.8	Confident	91.5	Very high	35 Å²	35	69.1 Å²	69.1	25%	0.245	36%	0.361	C	S	.	.	S	Bend	trans	-74	-18.5	176.3	57	0	0	0	0	113.2	R293	R293-S313 VanDerWaalsContact CD-O 3.31Å; R293-S313 WeakPolarHBondContact CD-O 3.35Å; R293-S313 PolarHBondContact NH1-O 2.84Å
314	R	89.6	Confident	91.5	Very high	99 Å²	99	70.7 Å²	70.7	37%	0.374	37%	0.372	S	S	.	.	S	Bend	trans	-128.2	140.5	178.4	-62.6	-175	-178.8	173.2	2.4	110.4	E83 V290 F312 E316 N317 L318	E83-R314 IonicContact OE1-CZ 2.75Å; E83-R314 IonicContact OE1-NH1 2.89Å; E83-R314 IonicContact OE1-NH2 3.61Å; E83-R314 PolarHBondContact OE1-NH2 3.33Å; V290-R314 HydrophobicContact CG1-CG 3.93Å; F312-R314 VanDerWaalsContact C-N 3.28Å; F312-R314 PolarHBondContact O-N 3.35Å; R314-E316 PolarHBondContact O-N 2.98Å; R314-N317 PolarHBondContact O-N 3.28Å; R314-L318 PolarHBondContact O-N 3.14Å
315	L	90.8	Very high	91.4	Very high	85 Å²	85	67.8 Å²	67.8	45%	0.445	35%	0.35	S	S	.	.	H	α-helix	trans	-62.7	-40.3	-179.3	-179.1	62.6	0	0	0	112.5	N317 L318 K319	L315-N317 PolarHBondContact O-N 3.41Å; L315-L318 HydrophobicContact CD1-CD2 4.36Å; L315-L318 WeakPolarHBondContact O-CA 3.42Å; L315-L318 WeakPolarHBondContact O-CB 3.22Å; L315-L318 PolarHBondContact O-N 3.45Å; L315-K319 PolarHBondContact O-N 3.32Å
316	E	88.9	Confident	91.3	Very high	100 Å²	100	66.3 Å²	66.3	47%	0.467	35%	0.353	S	S	.	.	H	α-helix	trans	-62.1	-34.2	179	-62.7	-50.5	135.4	0	0	112.4	R314 L318 K319 I320	R314-E316 PolarHBondContact O-N 2.98Å; E316-L318 VanDerWaalsContact C-N 3.34Å; E316-K319 PolarHBondContact O-N 3.21Å; E316-K319 IonicContact OE1-NZ 2.81Å; E316-K319 PolarHBondContact OE1-NZ 3.35Å; E316-K319 WeakPolarHBondContact OE2-CD 3.45Å; E316-K319 IonicContact OE2-NZ 3.55Å; E316-I320 VanDerWaalsContact O-CG1 3.26Å; E316-I320 WeakPolarHBondContact O-CG1 3.47Å; E316-I320 PolarHBondContact O-N 3.4Å
317	N	91.4	Very high	91.1	Very high	70 Å²	70	63.1 Å²	63.1	37%	0.374	34%	0.339	S	S	.	.	H	α-helix	trans	-68.2	-37.1	174.8	-64.9	-5.9	0	0	0	111.3	F312 R314 L315 H321	F312-N317 HydrophobicContact CB-CB 4.12Å; F312-N317 HydrophobicContact CD1-CB 3.77Å; F312-N317 HydrophobicContact CG-CB 4.19Å; R314-N317 PolarHBondContact O-N 3.28Å; L315-N317 PolarHBondContact O-N 3.41Å; N317-H321 VanDerWaalsContact O-CB 3.32Å; N317-H321 WeakPolarHBondContact O-CB 3.24Å; N317-H321 PolarHBondContact O-N 3.18Å
318	L	92	Very high	91	Very high	17 Å²	17	64.4 Å²	64.4	9%	0.089	33%	0.326	C	S	.	.	H	α-helix	trans	-63.1	-46.1	172.2	172.1	62.5	0	0	0	110.9	N301 K302 C303 F312 R314 L315 E316 I320 H321 I322	N301-L318 HydrophobicContact CB-CB 4Å; N301-L318 HydrophobicContact CB-CD2 3.73Å; N301-L318 HydrophobicContact CB-CG 4.46Å; K302-L318 WeakPolarHBondContact O-CD2 3.21Å; C303-L318 HydrophobicContact CB-CD1 4.08Å; F312-L318 HydrophobicContact CB-CB 4.25Å; F312-L318 HydrophobicContact CD2-CB 3.91Å; F312-L318 HydrophobicContact CD2-CD1 3.85Å; F312-L318 HydrophobicContact CE2-CD1 4.12Å; F312-L318 HydrophobicContact CG-CB 4.28Å; R314-L318 PolarHBondContact O-N 3.14Å; L315-L318 HydrophobicContact CD1-CD2 4.36Å; L315-L318 WeakPolarHBondContact O-CA 3.42Å; L315-L318 WeakPolarHBondContact O-CB 3.22Å; L315-L318 PolarHBondContact O-N 3.45Å; E316-L318 VanDerWaalsContact C-N 3.34Å; L318-I320 PolarHBondContact O-N 3.22Å; L318-H321 CarbonylContact O-C 3.59Å; L318-H321 WeakPolarHBondContact O-CA 3.31Å; L318-H321 WeakPolarHBondContact O-CB 3.34Å; L318-H321 PolarHBondContact O-N 3.4Å; L318-H321 VanDerWaalsContact O-N 3.12Å; L318-I322 HydrophobicContact CD1-CD1 3.98Å; L318-I322 HydrophobicContact CD1-CG1 4Å; L318-I322 HydrophobicContact CD2-CD1 4.46Å; L318-I322 HydrophobicContact CG-CD1 3.89Å; L318-I322 HydrophobicContact CG-CG1 4.36Å; L318-I322 WeakPolarHBondContact O-CG1 3.25Å; L318-I322 PolarHBondContact O-N 3.5Å
319	K	92	Very high	91.1	Very high	89 Å²	89	70 Å²	70	39%	0.387	35%	0.345	S	S	.	.	H	α-helix	trans	-58.6	-46.7	177.8	-70.2	177.7	-175.7	163.9	0	111.9	L315 E316 H321 I322 R323	L315-K319 PolarHBondContact O-N 3.32Å; E316-K319 PolarHBondContact O-N 3.21Å; E316-K319 IonicContact OE1-NZ 2.81Å; E316-K319 PolarHBondContact OE1-NZ 3.35Å; E316-K319 WeakPolarHBondContact OE2-CD 3.45Å; E316-K319 IonicContact OE2-NZ 3.55Å; K319-H321 VanDerWaalsContact C-N 3.28Å; K319-H321 PolarHBondContact O-N 3.31Å; K319-I322 PolarHBondContact O-N 3.17Å; K319-R323 PolarHBondContact O-N 3.34Å
320	I	91.4	Very high	91	Very high	48 Å²	48	63.7 Å²	63.7	25%	0.246	32%	0.323	C	S	.	.	H	α-helix	trans	-61.6	-39.8	176.3	-65.3	165.5	0	0	0	110.7	E316 L318 R323 N344	E316-I320 VanDerWaalsContact O-CG1 3.26Å; E316-I320 WeakPolarHBondContact O-CG1 3.47Å; E316-I320 PolarHBondContact O-N 3.4Å; L318-I320 PolarHBondContact O-N 3.22Å; I320-R323 WeakPolarHBondContact O-CB 3.36Å; I320-R323 PolarHBondContact O-N 3.13Å; I320-N344 HydrophobicContact CD1-CB 3.67Å; I320-N344 HydrophobicContact CG1-CB 3.83Å; I320-N344 HydrophobicContact CG2-CB 3.94Å
321	H	92.8	Very high	91.1	Very high	22 Å²	22	62.3 Å²	62.3	10%	0.102	32%	0.317	C	S	.	.	H	α-helix	trans	-65.4	-41.7	175.3	168.7	60.8	0	0	0	112.4	C303 C308 F312 N317 L318 K319 R323 S324 H325	C303-H321 PolarHBondContact SG-NE2 3.26Å; C303-H321 VanDerWaalsContact SG-NE2 3.39Å; C308-H321 PolarHBondContact SG-NE2 3.5Å; F312-H321 HydrophobicContact CE1-CB 3.99Å; F312-H321 HydrophobicContact CE2-CB 3.64Å; F312-H321 AromaticContact CE2-CD2 3.27Å; F312-H321 WeakPolarHBondContact CE2-CD2 3.42Å; F312-H321 AromaticContact CE2-CG 3.47Å; F312-H321 VanDerWaalsContact CE2-CG 3.47Å; F312-H321 HydrophobicContact CZ-CB 3.32Å; F312-H321 AromaticContact CZ-CD2 3.57Å; F312-H321 AromaticContact CZ-CG 3.25Å; F312-H321 AromaticContact CZ-ND1 3.87Å; N317-H321 VanDerWaalsContact O-CB 3.32Å; N317-H321 WeakPolarHBondContact O-CB 3.24Å; N317-H321 PolarHBondContact O-N 3.18Å; L318-H321 CarbonylContact O-C 3.59Å; L318-H321 WeakPolarHBondContact O-CA 3.31Å; L318-H321 WeakPolarHBondContact O-CB 3.34Å; L318-H321 PolarHBondContact O-N 3.4Å; L318-H321 VanDerWaalsContact O-N 3.12Å; K319-H321 VanDerWaalsContact C-N 3.28Å; K319-H321 PolarHBondContact O-N 3.31Å; H321-R323 PolarHBondContact O-N 3.47Å; H321-S324 PolarHBondContact ND1-OG 3.46Å; H321-S324 WeakPolarHBondContact O-CA 3.43Å; H321-S324 VanDerWaalsContact O-CB 3.25Å; H321-S324 WeakPolarHBondContact O-CB 3.47Å; H321-S324 PolarHBondContact O-N 2.73Å; H321-S324 PolarHBondContact O-OG 2.92Å; H321-H325 AromaticContact CE1-NE2 3.31Å; H321-H325 PolarHBondContact CE1-NE2 3.05Å; H321-H325 VanDerWaalsContact CE1-NE2 3.31Å; H321-H325 AromaticContact NE2-CD2 3.87Å; H321-H325 AromaticContact NE2-NE2 3.2Å; H321-H325 PolarHBondContact NE2-NE2 3.38Å
322	I	91.4	Very high	91.2	Very high	60 Å²	60	65.3 Å²	65.3	31%	0.308	33%	0.328	S	S	.	.	H	α-helix	trans	-57.6	-36.3	176.9	-71.1	167.2	0	0	0	111.1	L318 K319 S324 H325 T326	L318-I322 HydrophobicContact CD1-CD1 3.98Å; L318-I322 HydrophobicContact CD1-CG1 4Å; L318-I322 HydrophobicContact CD2-CD1 4.46Å; L318-I322 HydrophobicContact CG-CD1 3.89Å; L318-I322 HydrophobicContact CG-CG1 4.36Å; L318-I322 WeakPolarHBondContact O-CG1 3.25Å; L318-I322 PolarHBondContact O-N 3.5Å; K319-I322 PolarHBondContact O-N 3.17Å; I322-S324 PolarHBondContact O-N 3.38Å; I322-S324 VanDerWaalsContact O-N 3.15Å; I322-H325 WeakPolarHBondContact O-CA 3.38Å; I322-H325 WeakPolarHBondContact O-CB 3.49Å; I322-H325 PolarHBondContact O-N 2.94Å; I322-T326 HydrophobicContact CG2-CG2 4.41Å; I322-T326 PolarHBondContact O-N 3.28Å
323	R	93.4	Very high	91.3	Very high	52 Å²	52	63.6 Å²	63.6	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-61	-22.5	173.8	-64.8	-174	-179.9	129.7	4.5	114.2	K319 I320 H321 H325 T326 G327 E328 S343	K319-R323 PolarHBondContact O-N 3.34Å; I320-R323 WeakPolarHBondContact O-CB 3.36Å; I320-R323 PolarHBondContact O-N 3.13Å; H321-R323 PolarHBondContact O-N 3.47Å; R323-H325 VanDerWaalsContact C-N 3.27Å; R323-T326 WeakPolarHBondContact CA-OG1 3.45Å; R323-G327 WeakPolarHBondContact O-CA 3.44Å; R323-G327 PolarHBondContact O-N 2.92Å; R323-E328 HydrophobicContact CB-CB 4.26Å; R323-E328 WeakPolarHBondContact CB-O 3.42Å; R323-E328 HydrophobicContact CG-CB 4.06Å; R323-E328 IonicContact NE-OE1 3.83Å; R323-E328 IonicContact NE-OE2 2.8Å; R323-E328 PolarHBondContact NE-OE2 3.35Å; R323-E328 PolarHBondContact O-N 3.29Å; R323-S343 VanDerWaalsContact CD-O 3.26Å; R323-S343 WeakPolarHBondContact CD-O 3.44Å; R323-S343 PolarHBondContact NH1-O 2.75Å
324	S	91.5	Very high	91.4	Very high	44 Å²	44	69.2 Å²	69.2	31%	0.308	34%	0.344	S	S	.	.	H	α-helix	trans	-71.8	-22.3	172.1	74.6	0	0	0	0	113	H321 I322 Y447	H321-S324 PolarHBondContact ND1-OG 3.46Å; H321-S324 WeakPolarHBondContact O-CA 3.43Å; H321-S324 VanDerWaalsContact O-CB 3.25Å; H321-S324 WeakPolarHBondContact O-CB 3.47Å; H321-S324 PolarHBondContact O-N 2.73Å; H321-S324 PolarHBondContact O-OG 2.92Å; I322-S324 PolarHBondContact O-N 3.38Å; I322-S324 VanDerWaalsContact O-N 3.15Å; S324-Y447 WeakPolarHBondContact O-CD1 3.29Å; S324-Y447 WeakPolarHBondContact O-CE1 3.41Å
325	H	91.4	Very high	91.4	Very high	55 Å²	55	69.4 Å²	69.4	26%	0.255	35%	0.349	S	S	.	.	H	α-helix	trans	-85.1	-38.6	172.7	-66.1	-61.2	0	0	0	112.1	Y305 C308 H321 I322 R323	Y305-H325 HydrophobicContact CD1-CB 4.19Å; Y305-H325 AromaticContact CD1-CE1 3.86Å; Y305-H325 AromaticContact CD1-CG 3.76Å; Y305-H325 AromaticContact CD1-ND1 3.48Å; Y305-H325 WeakPolarHBondContact CD1-ND1 3.39Å; Y305-H325 HydrophobicContact CD2-CB 3.54Å; Y305-H325 AromaticContact CD2-CG 3.81Å; Y305-H325 HydrophobicContact CE1-CB 4.31Å; Y305-H325 AromaticContact CE1-ND1 3.9Å; Y305-H325 HydrophobicContact CE2-CB 3.69Å; Y305-H325 HydrophobicContact CG-CB 3.8Å; Y305-H325 AromaticContact CG-CD2 3.76Å; Y305-H325 AromaticContact CG-CG 3.5Å; Y305-H325 AromaticContact CG-ND1 3.74Å; C308-H325 PolarHBondContact SG-NE2 2.87Å; C308-H325 VanDerWaalsContact SG-NE2 3.35Å; H321-H325 AromaticContact CE1-NE2 3.31Å; H321-H325 PolarHBondContact CE1-NE2 3.05Å; H321-H325 VanDerWaalsContact CE1-NE2 3.31Å; H321-H325 AromaticContact NE2-CD2 3.87Å; H321-H325 AromaticContact NE2-NE2 3.2Å; H321-H325 PolarHBondContact NE2-NE2 3.38Å; I322-H325 WeakPolarHBondContact O-CA 3.38Å; I322-H325 WeakPolarHBondContact O-CB 3.49Å; I322-H325 PolarHBondContact O-N 2.94Å; R323-H325 VanDerWaalsContact C-N 3.27Å
326	T	89.7	Confident	91.3	Very high	87 Å²	87	73.7 Å²	73.7	53%	0.534	37%	0.366	S	S	.	.	H	α-helix	trans	-84.2	-17.1	-178.3	63.9	0	0	0	0	113.7	I322 R323 E328	I322-T326 HydrophobicContact CG2-CG2 4.41Å; I322-T326 PolarHBondContact O-N 3.28Å; R323-T326 WeakPolarHBondContact CA-OG1 3.45Å; T326-E328 PolarHBondContact O-N 3.13Å; T326-E328 WeakPolarHBondContact OG1-CB 3.18Å; T326-E328 PolarHBondContact OG1-N 2.79Å
327	G	89.3	Confident	91.3	Very high	33 Å²	33	72.9 Å²	72.9	34%	0.34	39%	0.385	S	S	.	.			trans	76.7	4.6	-172.6	0	0	0	0	0	114.4	R323 R329	R323-G327 WeakPolarHBondContact O-CA 3.44Å; R323-G327 PolarHBondContact O-N 2.92Å; G327-R329 PolarHBondContact O-N 2.68Å
328	E	90.4	Very high	91.3	Very high	94 Å²	94	70.3 Å²	70.3	44%	0.439	37%	0.372	S	S	.	.			trans	-64.4	125	-176.8	-165	-153.5	148.1	0	0	111.8	R323 T326 P330	R323-E328 HydrophobicContact CB-CB 4.26Å; R323-E328 WeakPolarHBondContact CB-O 3.42Å; R323-E328 HydrophobicContact CG-CB 4.06Å; R323-E328 IonicContact NE-OE1 3.83Å; R323-E328 IonicContact NE-OE2 2.8Å; R323-E328 PolarHBondContact NE-OE2 3.35Å; R323-E328 PolarHBondContact O-N 3.29Å; T326-E328 PolarHBondContact O-N 3.13Å; T326-E328 WeakPolarHBondContact OG1-CB 3.18Å; T326-E328 PolarHBondContact OG1-N 2.79Å; E328-P330 WeakPolarHBondContact OE1-CG 3.48Å
329	R	91.7	Very high	91.3	Very high	137 Å²	137	76.6 Å²	76.6	52%	0.517	41%	0.406	S	S	.	.			trans	-128.3	70.9	179.8	-67.3	171.2	114.2	124.7	3.2	111	G327 F331 T341 F342	G327-R329 PolarHBondContact O-N 2.68Å; R329-F331 PolarHBondContact O-N 3.23Å; R329-T341 WeakPolarHBondContact CB-OG1 3.47Å; R329-T341 WeakPolarHBondContact CD-OG1 3.49Å; R329-T341 PolarHBondContact NE-O 3.08Å; R329-F342 CarbonylContact C-O 3.54Å; R329-F342 VanDerWaalsContact CA-O 3.31Å; R329-F342 WeakPolarHBondContact CA-O 3.49Å
330	P	90	Very high	91.3	Very high	57 Å²	57	78.1 Å²	78.1	37%	0.37	41%	0.409	S	S	.	.			trans	-74.1	-12.3	-168.9	29.2	-33.4	0	0	0	113.6	E328 I332	E328-P330 WeakPolarHBondContact OE1-CG 3.48Å; P330-I332 PolarHBondContact O-N 3.47Å
331	F	92.5	Very high	91.4	Very high	53 Å²	53	78.2 Å²	78.2	23%	0.232	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	96.6	-176.4	-59.3	-83	0	0	0	110.7	R329 T341 F342 N344 R348	R329-F331 PolarHBondContact O-N 3.23Å; F331-T341 CarbonylContact O-C 3.19Å; F331-T341 WeakPolarHBondContact O-CA 3.31Å; F331-F342 HydrophobicContact CB-CB 4.23Å; F331-F342 WeakPolarHBondContact CB-O 3.32Å; F331-F342 PolarHBondContact N-O 3.16Å; F331-F342 WeakPolarHBondContact O-CD2 3.38Å; F331-F342 PolarHBondContact O-N 3.23Å; F331-N344 VanDerWaalsContact CE2-CA 3.44Å; F331-R348 HydrophobicContact CB-CB 4.1Å
332	I	93	Very high	91.5	Very high	93 Å²	93	78.8 Å²	78.8	48%	0.477	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	140	179.6	-46.9	179.6	0	0	0	109.8	P330 T341 R348	P330-I332 PolarHBondContact O-N 3.47Å; I332-T341 HydrophobicContact CB-CG2 4.3Å; I332-T341 HydrophobicContact CG1-CG2 3.89Å; I332-T341 HydrophobicContact CG2-CG2 4.11Å; I332-R348 WeakPolarHBondContact O-CD 3.45Å
333	C	94.5	Very high	91.5	Very high	6 Å²	6	77.6 Å²	77.6	4%	0.041	41%	0.411	C	S	.	.			trans	-65.2	132.3	166.7	-164.3	0	0	0	0	109.9	C338 R340 H355	C333-C338 HydrophobicContact CB-CB 4.36Å; C333-R340 WeakPolarHBondContact CB-O 3.35Å; C333-R340 PolarHBondContact N-O 3.38Å; C333-H355 PolarHBondContact SG-NE2 2.93Å
334	Q	91	Very high	91.4	Very high	153 Å²	153	75.8 Å²	75.8	72%	0.715	41%	0.405	S	S	*	.			trans	-99.3	11.7	-179.2	-66.5	-180	-17.8	0	0	112.4
335	Q	89.6	Confident	91.5	Very high	102 Å²	102	76.3 Å²	76.3	48%	0.477	41%	0.409	S	S	.	.	S	Bend	trans	-80.4	132	177.2	-172.4	68.6	34.4	0	0	109.1	G337 C338 H355	Q335-G337 PolarHBondContact O-N 3.25Å; Q335-C338 HydrophobicContact CB-CB 4.24Å; Q335-C338 WeakPolarHBondContact O-CB 3.48Å; Q335-C338 PolarHBondContact O-N 2.77Å; Q335-H355 HydrophobicContact CG-CB 4.21Å
336	E	90.2	Very high	91.4	Very high	176 Å²	176	76.2 Å²	76.2	82%	0.822	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	130.7	175.7	-61.4	-58	130.9	0	0	111.3	C338	E336-C338 VanDerWaalsContact C-N 3.33Å
337	G	88.7	Confident	91.5	Very high	83 Å²	83	74.9 Å²	74.9	86%	0.856	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	9.9	-175.4	0	0	0	0	0	115.1	Q335	Q335-G337 PolarHBondContact O-N 3.25Å
338	C	91.9	Very high	91.7	Very high	15 Å²	15	76.4 Å²	76.4	10%	0.101	40%	0.4	C	S	.	.			trans	-125.9	105.6	174.9	-171	0	0	0	0	113	C333 Q335 E336 R340 H351 H355	C333-C338 HydrophobicContact CB-CB 4.36Å; Q335-C338 HydrophobicContact CB-CB 4.24Å; Q335-C338 WeakPolarHBondContact O-CB 3.48Å; Q335-C338 PolarHBondContact O-N 2.77Å; E336-C338 VanDerWaalsContact C-N 3.33Å; C338-R340 VanDerWaalsContact C-N 3.35Å; C338-R340 PolarHBondContact O-N 3.11Å; C338-H351 PolarHBondContact SG-NE2 2.89Å; C338-H355 PolarHBondContact SG-CE1 3.14Å
339	D	90	Very high	91.6	Very high	149 Å²	149	73.7 Å²	73.7	80%	0.797	39%	0.394	S	S	*	.			trans	-95.2	18.1	179.4	-58.2	-48.1	0	0	0	113.6	T341	D339-T341 PolarHBondContact O-N 2.88Å
340	R	92.6	Very high	91.4	Very high	121 Å²	121	71.9 Å²	71.9	46%	0.457	39%	0.389	S	S	.	.			trans	-69.9	133.8	-177.1	-74.1	-168.1	174.7	-167.5	0.8	111.8	C333 C338 F342 Y439	C333-R340 WeakPolarHBondContact CB-O 3.35Å; C333-R340 PolarHBondContact N-O 3.38Å; C338-R340 VanDerWaalsContact C-N 3.35Å; C338-R340 PolarHBondContact O-N 3.11Å; R340-F342 HydrophobicContact CB-CE2 3.87Å; R340-F342 HydrophobicContact CB-CZ 3.89Å; R340-F342 WeakPolarHBondContact O-CE2 3.32Å; R340-Y439 VanDerWaalsContact NH2-CE1 3.25Å
341	T	94.3	Very high	91.4	Very high	50 Å²	50	70.1 Å²	70.1	31%	0.307	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	145.3	-179.5	65.8	0	0	0	0	112.8	R329 F331 I332 D339	R329-T341 WeakPolarHBondContact CB-OG1 3.47Å; R329-T341 WeakPolarHBondContact CD-OG1 3.49Å; R329-T341 PolarHBondContact NE-O 3.08Å; F331-T341 CarbonylContact O-C 3.19Å; F331-T341 WeakPolarHBondContact O-CA 3.31Å; I332-T341 HydrophobicContact CB-CG2 4.3Å; I332-T341 HydrophobicContact CG1-CG2 3.89Å; I332-T341 HydrophobicContact CG2-CG2 4.11Å; D339-T341 PolarHBondContact O-N 2.88Å
342	F	93.9	Very high	91.1	Very high	34 Å²	34	70.8 Å²	70.8	15%	0.149	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	147.8	-171.9	-56.8	-89.2	0	0	0	111.3	R329 F331 R340 N344 D347 R348 H351	R329-F342 CarbonylContact C-O 3.54Å; R329-F342 VanDerWaalsContact CA-O 3.31Å; R329-F342 WeakPolarHBondContact CA-O 3.49Å; F331-F342 HydrophobicContact CB-CB 4.23Å; F331-F342 WeakPolarHBondContact CB-O 3.32Å; F331-F342 PolarHBondContact N-O 3.16Å; F331-F342 WeakPolarHBondContact O-CD2 3.38Å; F331-F342 PolarHBondContact O-N 3.23Å; R340-F342 HydrophobicContact CB-CE2 3.87Å; R340-F342 HydrophobicContact CB-CZ 3.89Å; R340-F342 WeakPolarHBondContact O-CE2 3.32Å; F342-N344 VanDerWaalsContact C-N 3.28Å; F342-N344 PolarHBondContact O-N 3.12Å; F342-D347 HydrophobicContact CD1-CB 4.16Å; F342-R348 HydrophobicContact CB-CB 4.11Å; F342-R348 HydrophobicContact CD2-CB 3.62Å; F342-R348 HydrophobicContact CD2-CG 3.84Å; F342-R348 HydrophobicContact CE2-CB 4.37Å; F342-R348 HydrophobicContact CE2-CG 4.3Å; F342-R348 HydrophobicContact CG-CB 3.97Å; F342-H351 HydrophobicContact CE1-CB 3.75Å; F342-H351 HydrophobicContact CE2-CB 3.95Å; F342-H351 AromaticContact CE2-CD2 3.43Å; F342-H351 VanDerWaalsContact CE2-CD2 3.43Å; F342-H351 WeakPolarHBondContact CE2-CD2 2.95Å; F342-H351 AromaticContact CE2-CG 3.82Å; F342-H351 HydrophobicContact CZ-CB 3.32Å; F342-H351 AromaticContact CZ-CD2 3.28Å; F342-H351 WeakPolarHBondContact CZ-CD2 3.32Å; F342-H351 AromaticContact CZ-CG 3.22Å; F342-H351 AromaticContact CZ-ND1 3.99Å
343	S	91.1	Very high	90.7	Very high	35 Å²	35	70.8 Å²	70.8	25%	0.245	37%	0.374	C	S	.	.	S	Bend	trans	-75.9	-15	177.2	58.9	0	0	0	0	113.3	R323	R323-S343 VanDerWaalsContact CD-O 3.26Å; R323-S343 WeakPolarHBondContact CD-O 3.44Å; R323-S343 PolarHBondContact NH1-O 2.75Å
344	N	93	Very high	90.2	Very high	14 Å²	14	74 Å²	74	8%	0.075	39%	0.394	C	S	.	.	S	Bend	trans	-145.5	157	176	69.7	75.3	0	0	0	112.5	I320 F331 F342 S346 D347 R348	I320-N344 HydrophobicContact CD1-CB 3.67Å; I320-N344 HydrophobicContact CG1-CB 3.83Å; I320-N344 HydrophobicContact CG2-CB 3.94Å; F331-N344 VanDerWaalsContact CE2-CA 3.44Å; F342-N344 VanDerWaalsContact C-N 3.28Å; F342-N344 PolarHBondContact O-N 3.12Å; N344-S346 VanDerWaalsContact C-N 3.35Å; N344-S346 PolarHBondContact O-N 3.31Å; N344-S346 WeakPolarHBondContact OD1-CB 3.35Å; N344-S346 PolarHBondContact OD1-N 3.02Å; N344-D347 PolarHBondContact ND2-OD2 2.88Å; N344-D347 WeakPolarHBondContact OD1-CB 3.43Å; N344-D347 PolarHBondContact OD1-N 2.99Å; N344-D347 PolarHBondContact OD1-OD2 2.95Å; N344-R348 PolarHBondContact O-N 2.69Å
345	S	93.3	Very high	89.9	Confident	55 Å²	55	69.2 Å²	69.2	39%	0.385	37%	0.371	S	S	.	.	H	α-helix	trans	-67.7	-32.3	-177.4	56.6	0	0	0	0	113.5	R348 A349	S345-R348 PolarHBondContact O-N 3.44Å; S345-A349 WeakPolarHBondContact O-CB 3.25Å; S345-A349 PolarHBondContact O-N 3.1Å
346	S	89.9	Confident	89.2	Confident	54 Å²	54	68.8 Å²	68.8	38%	0.378	37%	0.371	S	S	.	.	H	α-helix	trans	-67.1	-41.3	-178.3	-69.7	0	0	0	0	111.5	N344 A349 K350	N344-S346 VanDerWaalsContact C-N 3.35Å; N344-S346 PolarHBondContact O-N 3.31Å; N344-S346 WeakPolarHBondContact OD1-CB 3.35Å; N344-S346 PolarHBondContact OD1-N 3.02Å; S346-A349 PolarHBondContact O-N 3.19Å; S346-K350 WeakPolarHBondContact O-CG 3.5Å; S346-K350 PolarHBondContact O-N 3.47Å
347	D	90.1	Very high	88.3	Confident	59 Å²	59	69.3 Å²	69.3	32%	0.316	37%	0.373	S	S	.	.	H	α-helix	trans	-72.9	-35.4	178.6	-68	-23	0	0	0	111.6	F342 N344 A349 K350 H351	F342-D347 HydrophobicContact CD1-CB 4.16Å; N344-D347 PolarHBondContact ND2-OD2 2.88Å; N344-D347 WeakPolarHBondContact OD1-CB 3.43Å; N344-D347 PolarHBondContact OD1-N 2.99Å; N344-D347 PolarHBondContact OD1-OD2 2.95Å; D347-A349 PolarHBondContact O-N 3.36Å; D347-K350 PolarHBondContact O-N 2.98Å; D347-K350 IonicContact OD1-NZ 3.82Å; D347-K350 PolarHBondContact OD1-NZ 3.34Å; D347-H351 WeakPolarHBondContact O-CB 3.5Å; D347-H351 PolarHBondContact O-N 3.03Å
348	R	93.7	Very high	87.6	Confident	64 Å²	64	69.5 Å²	69.5	24%	0.242	36%	0.358	C	S	.	.	H	α-helix	trans	-57.3	-48.7	166.7	-174.9	-161.2	63.7	-171.1	3	111.2	F331 I332 F342 N344 S345 K350 H351 Q352	F331-R348 HydrophobicContact CB-CB 4.1Å; I332-R348 WeakPolarHBondContact O-CD 3.45Å; F342-R348 HydrophobicContact CB-CB 4.11Å; F342-R348 HydrophobicContact CD2-CB 3.62Å; F342-R348 HydrophobicContact CD2-CG 3.84Å; F342-R348 HydrophobicContact CE2-CB 4.37Å; F342-R348 HydrophobicContact CE2-CG 4.3Å; F342-R348 HydrophobicContact CG-CB 3.97Å; N344-R348 PolarHBondContact O-N 2.69Å; S345-R348 PolarHBondContact O-N 3.44Å; R348-K350 VanDerWaalsContact C-N 3.34Å; R348-K350 PolarHBondContact O-N 3.48Å; R348-H351 WeakPolarHBondContact O-CB 3.32Å; R348-H351 PolarHBondContact O-N 2.98Å; R348-H351 VanDerWaalsContact O-N 3.15Å; R348-Q352 WeakPolarHBondContact O-CG 3.45Å; R348-Q352 PolarHBondContact O-N 3.47Å
349	A	89.5	Confident	87.1	Confident	38 Å²	38	74.6 Å²	74.6	31%	0.314	38%	0.378	S	S	.	.	H	α-helix	trans	-63.6	-37.2	-179.4	0	0	0	0	0	112.7	S345 S346 D347 Q352	S345-A349 WeakPolarHBondContact O-CB 3.25Å; S345-A349 PolarHBondContact O-N 3.1Å; S346-A349 PolarHBondContact O-N 3.19Å; D347-A349 PolarHBondContact O-N 3.36Å; A349-Q352 PolarHBondContact O-N 3.1Å
350	K	86.3	Confident	86.7	Confident	98 Å²	98	70.5 Å²	70.5	43%	0.426	36%	0.36	S	S	.	.	H	α-helix	trans	-64.6	-44.1	171.8	-70.3	172.1	-161.2	155.6	0	111.2	S346 D347 R348 Q352 R353	S346-K350 WeakPolarHBondContact O-CG 3.5Å; S346-K350 PolarHBondContact O-N 3.47Å; D347-K350 PolarHBondContact O-N 2.98Å; D347-K350 IonicContact OD1-NZ 3.82Å; D347-K350 PolarHBondContact OD1-NZ 3.34Å; R348-K350 VanDerWaalsContact C-N 3.34Å; R348-K350 PolarHBondContact O-N 3.48Å; K350-Q352 VanDerWaalsContact C-N 3.29Å; K350-Q352 PolarHBondContact O-N 2.92Å; K350-R353 VanDerWaalsContact O-CB 3.31Å; K350-R353 WeakPolarHBondContact O-CB 3.19Å; K350-R353 PolarHBondContact O-N 2.95Å
351	H	89.8	Confident	86.4	Confident	21 Å²	21	67.3 Å²	67.3	10%	0.097	35%	0.348	C	S	.	.	H	α-helix	trans	-61	-38.5	177.5	169	61.5	0	0	0	112.1	C338 F342 D347 R348 R353 T354 H355	C338-H351 PolarHBondContact SG-NE2 2.89Å; F342-H351 HydrophobicContact CE1-CB 3.75Å; F342-H351 HydrophobicContact CE2-CB 3.95Å; F342-H351 AromaticContact CE2-CD2 3.43Å; F342-H351 VanDerWaalsContact CE2-CD2 3.43Å; F342-H351 WeakPolarHBondContact CE2-CD2 2.95Å; F342-H351 AromaticContact CE2-CG 3.82Å; F342-H351 HydrophobicContact CZ-CB 3.32Å; F342-H351 AromaticContact CZ-CD2 3.28Å; F342-H351 WeakPolarHBondContact CZ-CD2 3.32Å; F342-H351 AromaticContact CZ-CG 3.22Å; F342-H351 AromaticContact CZ-ND1 3.99Å; D347-H351 WeakPolarHBondContact O-CB 3.5Å; D347-H351 PolarHBondContact O-N 3.03Å; R348-H351 WeakPolarHBondContact O-CB 3.32Å; R348-H351 PolarHBondContact O-N 2.98Å; R348-H351 VanDerWaalsContact O-N 3.15Å; H351-R353 PolarHBondContact O-N 2.86Å; H351-T354 PolarHBondContact CE1-OG1 3.36Å; H351-T354 PolarHBondContact ND1-OG1 3.37Å; H351-T354 WeakPolarHBondContact O-CA 3.33Å; H351-T354 VanDerWaalsContact O-CB 3.27Å; H351-T354 WeakPolarHBondContact O-CB 3.42Å; H351-T354 WeakPolarHBondContact O-CG2 3.49Å; H351-T354 PolarHBondContact O-N 2.98Å; H351-T354 PolarHBondContact O-OG1 2.93Å; H351-H355 AromaticContact CD2-NE2 3.83Å; H351-H355 AromaticContact CE1-CE1 3.89Å; H351-H355 AromaticContact CE1-NE2 3.9Å; H351-H355 AromaticContact NE2-CE1 3.62Å; H351-H355 AromaticContact NE2-NE2 3.31Å; H351-H355 PolarHBondContact NE2-NE2 3.45Å
352	Q	87.1	Confident	86.2	Confident	66 Å²	66	66.8 Å²	66.8	31%	0.308	35%	0.349	S	S	.	.	H	α-helix	trans	-57.6	-25.9	178.1	-74.7	176.1	-54.3	0	0	113.3	R348 A349 K350 T354 H355	R348-Q352 WeakPolarHBondContact O-CG 3.45Å; R348-Q352 PolarHBondContact O-N 3.47Å; A349-Q352 PolarHBondContact O-N 3.1Å; K350-Q352 VanDerWaalsContact C-N 3.29Å; K350-Q352 PolarHBondContact O-N 2.92Å; Q352-T354 PolarHBondContact O-N 3.04Å; Q352-H355 WeakPolarHBondContact O-CB 3.26Å; Q352-H355 PolarHBondContact O-N 3.28Å; Q352-H355 VanDerWaalsContact O-N 3.13Å
353	R	84.5	Confident	86.1	Confident	94 Å²	94	65.7 Å²	65.7	36%	0.355	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-19	173.2	-58.1	178.4	180	157.3	-1.2	113.4	K350 H351 H355 I356	K350-R353 VanDerWaalsContact O-CB 3.31Å; K350-R353 WeakPolarHBondContact O-CB 3.19Å; K350-R353 PolarHBondContact O-N 2.95Å; H351-R353 PolarHBondContact O-N 2.86Å; R353-H355 VanDerWaalsContact C-N 3.31Å; R353-I356 PolarHBondContact O-N 3.36Å
354	T	83.3	Confident	86	Confident	74 Å²	74	71.4 Å²	71.4	45%	0.454	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-21.2	175.9	68.9	0	0	0	0	112.8	H351 Q352 I356	H351-T354 PolarHBondContact CE1-OG1 3.36Å; H351-T354 PolarHBondContact ND1-OG1 3.37Å; H351-T354 WeakPolarHBondContact O-CA 3.33Å; H351-T354 VanDerWaalsContact O-CB 3.27Å; H351-T354 WeakPolarHBondContact O-CB 3.42Å; H351-T354 WeakPolarHBondContact O-CG2 3.49Å; H351-T354 PolarHBondContact O-N 2.98Å; H351-T354 PolarHBondContact O-OG1 2.93Å; Q352-T354 PolarHBondContact O-N 3.04Å; T354-I356 VanDerWaalsContact C-N 3.27Å
355	H	85.2	Confident	85.7	Confident	51 Å²	51	72.8 Å²	72.8	24%	0.236	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-20	171.6	-56.3	-50.5	0	0	0	112.2	C333 Q335 C338 H351 Q352 R353 H357	C333-H355 PolarHBondContact SG-NE2 2.93Å; Q335-H355 HydrophobicContact CG-CB 4.21Å; C338-H355 PolarHBondContact SG-CE1 3.14Å; H351-H355 AromaticContact CD2-NE2 3.83Å; H351-H355 AromaticContact CE1-CE1 3.89Å; H351-H355 AromaticContact CE1-NE2 3.9Å; H351-H355 AromaticContact NE2-CE1 3.62Å; H351-H355 AromaticContact NE2-NE2 3.31Å; H351-H355 PolarHBondContact NE2-NE2 3.45Å; Q352-H355 WeakPolarHBondContact O-CB 3.26Å; Q352-H355 PolarHBondContact O-N 3.28Å; Q352-H355 VanDerWaalsContact O-N 3.13Å; R353-H355 VanDerWaalsContact C-N 3.31Å; H355-H357 PolarHBondContact O-N 2.8Å
356	I	75.6	Confident	85.3	Confident	93 Å²	93	77.2 Å²	77.2	48%	0.477	40%	0.397	S	S	.	.	S	Bend	trans	-82	109.2	174.1	-51	175.5	0	0	0	106.4	R353 T354 T358	R353-I356 PolarHBondContact O-N 3.36Å; T354-I356 VanDerWaalsContact C-N 3.27Å; I356-T358 HydrophobicContact CG2-CG2 4.21Å; I356-T358 WeakPolarHBondContact CG2-OG1 3.34Å; I356-T358 PolarHBondContact O-N 3.37Å
357	H	70.7	Confident	85	Confident	188 Å²	188	78.5 Å²	78.5	87%	0.87	42%	0.42	S	S	*	.			trans	-65.8	7.2	178.4	-60.1	-61.9	0	0	0	114	H355	H355-H357 PolarHBondContact O-N 2.8Å
358	T	73.6	Confident	84.8	Confident	86 Å²	86	76.8 Å²	76.8	53%	0.528	41%	0.412	S	S	.	.			trans	-96.5	138.2	175.5	73.2	0	0	0	0	110	I356 P360	I356-T358 HydrophobicContact CG2-CG2 4.21Å; I356-T358 WeakPolarHBondContact CG2-OG1 3.34Å; I356-T358 PolarHBondContact O-N 3.37Å; T358-P360 VanDerWaalsContact C-CD 3.42Å; T358-P360 WeakPolarHBondContact O-CD 3.42Å
359	K	81.3	Confident	84.6	Confident	122 Å²	122	79.8 Å²	79.8	53%	0.53	44%	0.437	S	S	.	.			trans	-102.8	80.1	172.1	-75	173.2	172.2	-172.9	0	108.1	Y361 R371 Y372 T373	K359-Y361 PolarHBondContact O-N 3.45Å; K359-R371 HydrophobicContact CB-CB 3.63Å; K359-R371 WeakPolarHBondContact CD-O 3.41Å; K359-R371 PolarHBondContact O-NE 3Å; K359-Y372 CarbonylContact C-O 3.55Å; K359-Y372 VanDerWaalsContact CA-O 3.31Å; K359-Y372 WeakPolarHBondContact CA-O 3.49Å; K359-T373 HydrophobicContact CG-CG2 3.78Å
360	P	82.6	Confident	84.4	Confident	63 Å²	63	81 Å²	81	41%	0.409	44%	0.436	S	S	.	.			trans	-64.9	-29	-169.1	24.5	-34	0	0	0	112.3	T358 A362 R371	T358-P360 VanDerWaalsContact C-CD 3.42Å; T358-P360 WeakPolarHBondContact O-CD 3.42Å; P360-A362 PolarHBondContact O-N 3.45Å; P360-R371 PolarHBondContact O-NH2 3.18Å
361	Y	86.6	Confident	84.6	Confident	55 Å²	55	82.8 Å²	82.8	22%	0.216	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	95.7	-173.3	-55.2	-73.8	0	0	0	111.6	P78 K359 R371 Y372 T373 P375	P78-Y361 HydrophobicContact CG-CE1 4.48Å; K359-Y361 PolarHBondContact O-N 3.45Å; Y361-R371 CarbonylContact O-C 3.57Å; Y361-R371 VanDerWaalsContact O-CA 3.29Å; Y361-R371 WeakPolarHBondContact O-CA 3.09Å; Y361-Y372 WeakPolarHBondContact CD2-O 3.33Å; Y361-Y372 PolarHBondContact N-O 3.38Å; Y361-Y372 VanDerWaalsContact N-O 3.11Å; Y361-Y372 PolarHBondContact O-N 3.46Å; Y361-T373 WeakPolarHBondContact CE2-O 3.29Å; Y361-P375 HydrophobicContact CD1-CG 4.18Å; Y361-P375 HydrophobicContact CD2-CG 4.43Å; Y361-P375 HydrophobicContact CE1-CG 3.72Å; Y361-P375 HydrophobicContact CE2-CG 4Å
362	A	90.2	Very high	84.4	Confident	38 Å²	38	83.9 Å²	83.9	31%	0.314	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	145.1	176	0	0	0	0	0	112.3	P360 R371	P360-A362 PolarHBondContact O-N 3.45Å; A362-R371 HydrophobicContact CB-CG 3.95Å
363	C	91.7	Very high	84.3	Confident	11 Å²	11	82.6 Å²	82.6	7%	0.074	44%	0.44	C	S	.	.			trans	-66	130.6	165.3	-167.4	0	0	0	0	109.8	C368 K370 L378 H381	C363-C368 HydrophobicContact CB-CB 4.2Å; C363-K370 WeakPolarHBondContact CB-O 3.4Å; C363-K370 PolarHBondContact N-O 3.4Å; C363-L378 HydrophobicContact CB-CD1 4.06Å; C363-H381 PolarHBondContact SG-NE2 3.15Å
364	K	89.2	Confident	84.2	Confident	156 Å²	156	80 Å²	80	68%	0.678	43%	0.433	S	S	*	.			trans	-90.2	0.5	179.9	-65.1	-174.3	177.5	-178.8	0	113.3
365	I	86.1	Confident	84.4	Confident	43 Å²	43	78.3 Å²	78.3	22%	0.221	42%	0.424	C	S	.	.	S	Bend	trans	-80.4	129.6	-176.9	-67.1	177.6	0	0	0	109.6	G367 C368 H385	I365-G367 PolarHBondContact O-N 3.49Å; I365-C368 HydrophobicContact CB-CB 4.42Å; I365-C368 WeakPolarHBondContact O-CB 3.26Å; I365-C368 PolarHBondContact O-N 2.76Å; I365-H385 HydrophobicContact CD1-CB 3.18Å; I365-H385 VanDerWaalsContact CD1-CG 3.46Å; I365-H385 HydrophobicContact CG1-CB 4.49Å; I365-H385 HydrophobicContact CG2-CB 4.44Å
366	T	84.7	Confident	84.5	Confident	147 Å²	147	78.5 Å²	78.5	90%	0.902	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	123.9	-173.1	-24.6	0	0	0	0	110.8
367	G	82.5	Confident	85.1	Confident	82 Å²	82	76.3 Å²	76.3	85%	0.845	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	-3.1	-176.1	0	0	0	0	0	115	I365	I365-G367 PolarHBondContact O-N 3.49Å
368	C	87.4	Confident	86	Confident	22 Å²	22	68.8 Å²	68.8	15%	0.149	39%	0.39	C	S	.	.			trans	-99.6	117.4	170.6	-169.4	0	0	0	0	111.4	C363 I365 H381 H385	C363-C368 HydrophobicContact CB-CB 4.2Å; I365-C368 HydrophobicContact CB-CB 4.42Å; I365-C368 WeakPolarHBondContact O-CB 3.26Å; I365-C368 PolarHBondContact O-N 2.76Å; C368-H381 VanDerWaalsContact SG-CE1 3.57Å; C368-H381 PolarHBondContact SG-NE2 3.3Å; C368-H385 PolarHBondContact SG-NE2 3.45Å
369	T	87.8	Confident	86.8	Confident	127 Å²	127	71.3 Å²	71.3	78%	0.779	39%	0.389	S	S	*	.			trans	-97.3	4.7	179.3	56.6	0	0	0	0	113.4
370	K	86.1	Confident	87.1	Confident	64 Å²	64	72.9 Å²	72.9	28%	0.278	40%	0.396	S	S	.	.			trans	-68.1	134.6	-175	-62.8	-157.9	177.9	-160.1	0	111.2	C363 Y372 D431	C363-K370 WeakPolarHBondContact CB-O 3.4Å; C363-K370 PolarHBondContact N-O 3.4Å; K370-Y372 HydrophobicContact CB-CE2 4.02Å; K370-Y372 WeakPolarHBondContact CB-OH 3.36Å; K370-D431 WeakPolarHBondContact CE-OD2 3.32Å; K370-D431 VanDerWaalsContact NZ-CG 3.26Å; K370-D431 IonicContact NZ-OD1 3.85Å; K370-D431 PolarHBondContact NZ-OD1 3.3Å; K370-D431 IonicContact NZ-OD2 3.45Å; K370-D431 PolarHBondContact NZ-OD2 3.29Å
371	R	89.9	Confident	87.5	Confident	135 Å²	135	70.8 Å²	70.8	51%	0.509	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	154.7	177	-52.5	-175	70.2	131.5	4.5	110.9	K359 P360 Y361 A362	K359-R371 HydrophobicContact CB-CB 3.63Å; K359-R371 WeakPolarHBondContact CD-O 3.41Å; K359-R371 PolarHBondContact O-NE 3Å; P360-R371 PolarHBondContact O-NH2 3.18Å; Y361-R371 CarbonylContact O-C 3.57Å; Y361-R371 VanDerWaalsContact O-CA 3.29Å; Y361-R371 WeakPolarHBondContact O-CA 3.09Å; A362-R371 HydrophobicContact CB-CG 3.95Å
372	Y	86.6	Confident	87.5	Confident	44 Å²	44	70 Å²	70	17%	0.173	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	153.6	-174	-57.7	-86.4	0	0	0	112.2	K359 Y361 K370 L378 H381	K359-Y372 CarbonylContact C-O 3.55Å; K359-Y372 VanDerWaalsContact CA-O 3.31Å; K359-Y372 WeakPolarHBondContact CA-O 3.49Å; Y361-Y372 WeakPolarHBondContact CD2-O 3.33Å; Y361-Y372 PolarHBondContact N-O 3.38Å; Y361-Y372 VanDerWaalsContact N-O 3.11Å; Y361-Y372 PolarHBondContact O-N 3.46Å; K370-Y372 HydrophobicContact CB-CE2 4.02Å; K370-Y372 WeakPolarHBondContact CB-OH 3.36Å; Y372-L378 HydrophobicContact CD2-CB 3.67Å; Y372-L378 HydrophobicContact CD2-CD1 3.74Å; Y372-L378 HydrophobicContact CD2-CG 4.3Å; Y372-L378 HydrophobicContact CE2-CB 4.43Å; Y372-L378 HydrophobicContact CE2-CD1 3.91Å; Y372-L378 HydrophobicContact CG-CB 4.1Å; Y372-H381 HydrophobicContact CE1-CB 4.23Å; Y372-H381 HydrophobicContact CE2-CB 3.85Å; Y372-H381 AromaticContact CE2-CD2 3.68Å; Y372-H381 AromaticContact CE2-CG 3.82Å; Y372-H381 VanDerWaalsContact CZ-CB 3.47Å; Y372-H381 AromaticContact CZ-CD2 3.89Å; Y372-H381 AromaticContact CZ-CG 3.57Å; Y372-H381 WeakPolarHBondContact OH-CB 3.37Å; Y372-H381 PolarHBondContact OH-CD2 3.25Å; Y372-H381 PolarHBondContact OH-ND1 3.08Å
373	T	84	Confident	87.3	Confident	40 Å²	40	73.9 Å²	73.9	25%	0.245	39%	0.393	C	S	.	.	S	Bend	trans	-82.1	-18.5	175	49.9	0	0	0	0	112.6	K359 Y361	K359-T373 HydrophobicContact CG-CG2 3.78Å; Y361-T373 WeakPolarHBondContact CE2-O 3.29Å
374	D	83.9	Confident	86.9	Confident	38 Å²	38	77.4 Å²	77.4	20%	0.203	41%	0.411	C	S	.	.	S	Bend	trans	-137.7	152.8	177.7	81.4	92.7	0	0	0	113.5	S376 S377 L378	D374-S376 VanDerWaalsContact C-N 3.31Å; D374-S376 PolarHBondContact O-N 3.42Å; D374-S376 VanDerWaalsContact OD1-CA 3.31Å; D374-S376 WeakPolarHBondContact OD1-CA 3.49Å; D374-S376 WeakPolarHBondContact OD1-CB 3.33Å; D374-S376 PolarHBondContact OD1-N 2.91Å; D374-S377 PolarHBondContact OD1-N 3.32Å; D374-S377 VanDerWaalsContact OD2-CB 3.23Å; D374-S377 WeakPolarHBondContact OD2-CB 3.45Å; D374-S377 PolarHBondContact OD2-OG 2.94Å; D374-L378 PolarHBondContact O-N 3.33Å
375	P	87.2	Confident	86.5	Confident	40 Å²	40	71.8 Å²	71.8	26%	0.26	39%	0.387	S	S	.	.	H	α-helix	trans	-66.7	-25.7	-178.9	-21.1	32.1	0	0	0	114.8	Y361 R379	Y361-P375 HydrophobicContact CD1-CG 4.18Å; Y361-P375 HydrophobicContact CD2-CG 4.43Å; Y361-P375 HydrophobicContact CE1-CG 3.72Å; Y361-P375 HydrophobicContact CE2-CG 4Å; P375-R379 WeakPolarHBondContact O-CB 3.3Å; P375-R379 PolarHBondContact O-N 3.37Å
376	S	86.6	Confident	86	Confident	55 Å²	55	72.5 Å²	72.5	39%	0.385	40%	0.396	S	S	.	.	H	α-helix	trans	-72.9	-40.7	-176.9	-56	0	0	0	0	110.6	D374 R379 K380	D374-S376 VanDerWaalsContact C-N 3.31Å; D374-S376 PolarHBondContact O-N 3.42Å; D374-S376 VanDerWaalsContact OD1-CA 3.31Å; D374-S376 WeakPolarHBondContact OD1-CA 3.49Å; D374-S376 WeakPolarHBondContact OD1-CB 3.33Å; D374-S376 PolarHBondContact OD1-N 2.91Å; S376-R379 PolarHBondContact O-N 3.44Å; S376-K380 WeakPolarHBondContact O-CG 3.36Å; S376-K380 PolarHBondContact O-N 3.06Å
377	S	87.5	Confident	85.3	Confident	46 Å²	46	69.8 Å²	69.8	32%	0.322	38%	0.375	S	S	.	.	H	α-helix	trans	-62.8	-44.2	173.1	-61.2	0	0	0	0	111.7	D374 R379 K380 H381	D374-S377 PolarHBondContact OD1-N 3.32Å; D374-S377 VanDerWaalsContact OD2-CB 3.23Å; D374-S377 WeakPolarHBondContact OD2-CB 3.45Å; D374-S377 PolarHBondContact OD2-OG 2.94Å; S377-R379 PolarHBondContact O-N 3.48Å; S377-K380 PolarHBondContact O-N 3.02Å; S377-H381 PolarHBondContact O-N 3.42Å
378	L	91	Very high	84.5	Confident	31 Å²	31	71.5 Å²	71.5	16%	0.162	36%	0.359	C	S	.	.	H	α-helix	trans	-57.8	-48.8	172.6	172.3	59.7	0	0	0	111.3	C363 Y372 D374 K380 H381 S382	C363-L378 HydrophobicContact CB-CD1 4.06Å; Y372-L378 HydrophobicContact CD2-CB 3.67Å; Y372-L378 HydrophobicContact CD2-CD1 3.74Å; Y372-L378 HydrophobicContact CD2-CG 4.3Å; Y372-L378 HydrophobicContact CE2-CB 4.43Å; Y372-L378 HydrophobicContact CE2-CD1 3.91Å; Y372-L378 HydrophobicContact CG-CB 4.1Å; D374-L378 PolarHBondContact O-N 3.33Å; L378-K380 VanDerWaalsContact C-N 3.34Å; L378-K380 PolarHBondContact O-N 3.34Å; L378-H381 CarbonylContact O-C 3.58Å; L378-H381 WeakPolarHBondContact O-CB 3.48Å; L378-H381 PolarHBondContact O-N 3.13Å; L378-H381 VanDerWaalsContact O-N 3.15Å; L378-S382 PolarHBondContact O-N 3.1Å; L378-S382 PolarHBondContact O-OG 3.42Å; L378-S382 VanDerWaalsContact O-OG 3.13Å
379	R	90.8	Very high	82.8	Confident	139 Å²	139	76.2 Å²	76.2	53%	0.525	38%	0.379	S	S	.	.	H	α-helix	trans	-60.9	-41.5	-179.8	-175.7	176.8	64.2	-149	-1.6	112.6	P375 S376 S377 H381 S382 K383	P375-R379 WeakPolarHBondContact O-CB 3.3Å; P375-R379 PolarHBondContact O-N 3.37Å; S376-R379 PolarHBondContact O-N 3.44Å; S377-R379 PolarHBondContact O-N 3.48Å; R379-H381 VanDerWaalsContact C-N 3.32Å; R379-S382 PolarHBondContact O-N 3.44Å; R379-K383 WeakPolarHBondContact O-CG 3.44Å; R379-K383 PolarHBondContact O-N 3.43Å
380	K	87.8	Confident	80.8	Confident	154 Å²	154	77.7 Å²	77.7	67%	0.67	38%	0.381	S	S	*	.	H	α-helix	trans	-59.8	-45	175	-75.5	178.9	179.3	-174.7	0	110.8	S376 S377 L378 K383	S376-K380 WeakPolarHBondContact O-CG 3.36Å; S376-K380 PolarHBondContact O-N 3.06Å; S377-K380 PolarHBondContact O-N 3.02Å; L378-K380 VanDerWaalsContact C-N 3.34Å; L378-K380 PolarHBondContact O-N 3.34Å; K380-K383 PolarHBondContact O-N 3.32Å
381	H	89	Confident	78.8	Confident	20 Å²	20	78.1 Å²	78.1	9%	0.093	39%	0.392	C	S	.	.	H	α-helix	trans	-64.2	-45.5	175.5	167.8	75.2	0	0	0	113	C363 C368 Y372 S377 L378 R379 K383 L384 H385	C363-H381 PolarHBondContact SG-NE2 3.15Å; C368-H381 VanDerWaalsContact SG-CE1 3.57Å; C368-H381 PolarHBondContact SG-NE2 3.3Å; Y372-H381 HydrophobicContact CE1-CB 4.23Å; Y372-H381 HydrophobicContact CE2-CB 3.85Å; Y372-H381 AromaticContact CE2-CD2 3.68Å; Y372-H381 AromaticContact CE2-CG 3.82Å; Y372-H381 VanDerWaalsContact CZ-CB 3.47Å; Y372-H381 AromaticContact CZ-CD2 3.89Å; Y372-H381 AromaticContact CZ-CG 3.57Å; Y372-H381 WeakPolarHBondContact OH-CB 3.37Å; Y372-H381 PolarHBondContact OH-CD2 3.25Å; Y372-H381 PolarHBondContact OH-ND1 3.08Å; S377-H381 PolarHBondContact O-N 3.42Å; L378-H381 CarbonylContact O-C 3.58Å; L378-H381 WeakPolarHBondContact O-CB 3.48Å; L378-H381 PolarHBondContact O-N 3.13Å; L378-H381 VanDerWaalsContact O-N 3.15Å; R379-H381 VanDerWaalsContact C-N 3.32Å; H381-K383 PolarHBondContact O-N 2.93Å; H381-L384 WeakPolarHBondContact O-CA 3.05Å; H381-L384 VanDerWaalsContact O-CB 3.22Å; H381-L384 WeakPolarHBondContact O-CB 3.46Å; H381-L384 PolarHBondContact O-N 3.14Å; H381-H385 AromaticContact CD2-CD2 4Å; H381-H385 AromaticContact CD2-NE2 3.83Å; H381-H385 AromaticContact CE1-CD2 3.87Å; H381-H385 AromaticContact CE1-NE2 3.17Å; H381-H385 PolarHBondContact CE1-NE2 3.04Å; H381-H385 AromaticContact NE2-CD2 3.53Å; H381-H385 AromaticContact NE2-NE2 2.92Å; H381-H385 PolarHBondContact NE2-NE2 2.96Å
382	S	87.3	Confident	76.5	Confident	39 Å²	39	77.2 Å²	77.2	27%	0.273	39%	0.394	S	S	.	.	H	α-helix	trans	-60.8	-33.1	178.6	-62.3	0	0	0	0	112.5	L378 R379 L384 H385 S386	L378-S382 PolarHBondContact O-N 3.1Å; L378-S382 PolarHBondContact O-OG 3.42Å; L378-S382 VanDerWaalsContact O-OG 3.13Å; R379-S382 PolarHBondContact O-N 3.44Å; S382-L384 VanDerWaalsContact C-N 3.25Å; S382-L384 PolarHBondContact O-N 3.17Å; S382-H385 PolarHBondContact O-N 3.34Å; S382-S386 PolarHBondContact O-N 3.41Å
383	K	86.4	Confident	74.3	Confident	118 Å²	118	78.8 Å²	78.8	51%	0.513	41%	0.41	S	S	.	.	H	α-helix	trans	-60.8	-34.2	171.6	-75.2	-177.2	176	-167.8	0	112.5	R379 K380 H381 H385 S386 I387	R379-K383 WeakPolarHBondContact O-CG 3.44Å; R379-K383 PolarHBondContact O-N 3.43Å; K380-K383 PolarHBondContact O-N 3.32Å; H381-K383 PolarHBondContact O-N 2.93Å; K383-H385 VanDerWaalsContact C-N 3.32Å; K383-H385 PolarHBondContact O-N 3.07Å; K383-S386 WeakPolarHBondContact CA-OG 3.36Å; K383-S386 PolarHBondContact O-N 3.17Å; K383-S386 PolarHBondContact O-OG 3.39Å; K383-I387 WeakPolarHBondContact O-CG1 3.27Å; K383-I387 PolarHBondContact O-N 3.4Å; K383-I387 VanDerWaalsContact O-N 3.08Å
384	L	84.1	Confident	72.4	Confident	85 Å²	85	79.2 Å²	79.2	45%	0.445	41%	0.414	S	S	.	.	H	α-helix	trans	-61.8	-43.5	176.6	-59.8	175.7	0	0	0	110.7	H381 S382 S386 I387 F388	H381-L384 WeakPolarHBondContact O-CA 3.05Å; H381-L384 VanDerWaalsContact O-CB 3.22Å; H381-L384 WeakPolarHBondContact O-CB 3.46Å; H381-L384 PolarHBondContact O-N 3.14Å; S382-L384 VanDerWaalsContact C-N 3.25Å; S382-L384 PolarHBondContact O-N 3.17Å; L384-S386 VanDerWaalsContact C-N 3.34Å; L384-S386 PolarHBondContact O-N 3.06Å; L384-I387 PolarHBondContact O-N 2.87Å; L384-I387 VanDerWaalsContact O-N 3.12Å; L384-F388 HydrophobicContact CB-CD2 4.1Å; L384-F388 HydrophobicContact CB-CE2 4Å; L384-F388 HydrophobicContact CD2-CE2 4.48Å; L384-F388 WeakPolarHBondContact O-CD2 3.5Å; L384-F388 PolarHBondContact O-N 3.37Å
385	H	79.8	Confident	70.5	Confident	39 Å²	39	84.4 Å²	84.4	18%	0.181	44%	0.435	C	S	.	.	H	α-helix	trans	-60.8	-41.8	175.3	-68	-68	0	0	0	112.5	I365 C368 H381 S382 K383 I387 F388 E389	I365-H385 HydrophobicContact CD1-CB 3.18Å; I365-H385 VanDerWaalsContact CD1-CG 3.46Å; I365-H385 HydrophobicContact CG1-CB 4.49Å; I365-H385 HydrophobicContact CG2-CB 4.44Å; C368-H385 PolarHBondContact SG-NE2 3.45Å; H381-H385 AromaticContact CD2-CD2 4Å; H381-H385 AromaticContact CD2-NE2 3.83Å; H381-H385 AromaticContact CE1-CD2 3.87Å; H381-H385 AromaticContact CE1-NE2 3.17Å; H381-H385 PolarHBondContact CE1-NE2 3.04Å; H381-H385 AromaticContact NE2-CD2 3.53Å; H381-H385 AromaticContact NE2-NE2 2.92Å; H381-H385 PolarHBondContact NE2-NE2 2.96Å; S382-H385 PolarHBondContact O-N 3.34Å; K383-H385 VanDerWaalsContact C-N 3.32Å; K383-H385 PolarHBondContact O-N 3.07Å; H385-I387 PolarHBondContact O-N 3.35Å; H385-F388 PolarHBondContact O-N 2.94Å; H385-F388 VanDerWaalsContact O-N 3.16Å; H385-E389 WeakPolarHBondContact O-CB 3.35Å; H385-E389 WeakPolarHBondContact O-CG 3.45Å; H385-E389 PolarHBondContact O-N 2.62Å
386	S	75.4	Confident	68.6	Low	58 Å²	58	85.3 Å²	85.3	41%	0.406	44%	0.442	S	S	.	.	H	α-helix	trans	-62.2	-32.9	176.3	65.3	0	0	0	0	113.1	S382 K383 L384 L390	S382-S386 PolarHBondContact O-N 3.41Å; K383-S386 WeakPolarHBondContact CA-OG 3.36Å; K383-S386 PolarHBondContact O-N 3.17Å; K383-S386 PolarHBondContact O-OG 3.39Å; L384-S386 VanDerWaalsContact C-N 3.34Å; L384-S386 PolarHBondContact O-N 3.06Å; S386-L390 WeakPolarHBondContact O-CD1 3.22Å; S386-L390 VanDerWaalsContact O-CG 3.26Å; S386-L390 WeakPolarHBondContact O-CG 3.25Å
387	I	71.1	Confident	66.8	Low	89 Å²	89	86.6 Å²	86.6	46%	0.456	45%	0.445	S	S	.	.	H	α-helix	trans	-72.7	-42.6	175.8	-64.8	163	0	0	0	110	K383 L384 H385 S391	K383-I387 WeakPolarHBondContact O-CG1 3.27Å; K383-I387 PolarHBondContact O-N 3.4Å; K383-I387 VanDerWaalsContact O-N 3.08Å; L384-I387 PolarHBondContact O-N 2.87Å; L384-I387 VanDerWaalsContact O-N 3.12Å; H385-I387 PolarHBondContact O-N 3.35Å; I387-S391 PolarHBondContact O-N 3.47Å
388	F	63.9	Low	65.1	Low	118 Å²	118	87 Å²	87	52%	0.518	45%	0.445	S	S	.	.	H	α-helix	trans	-78.4	-34.3	-176	-69.5	-62.1	0	0	0	113.8	L384 H385 L390 S391 Q392	L384-F388 HydrophobicContact CB-CD2 4.1Å; L384-F388 HydrophobicContact CB-CE2 4Å; L384-F388 HydrophobicContact CD2-CE2 4.48Å; L384-F388 WeakPolarHBondContact O-CD2 3.5Å; L384-F388 PolarHBondContact O-N 3.37Å; H385-F388 PolarHBondContact O-N 2.94Å; H385-F388 VanDerWaalsContact O-N 3.16Å; F388-L390 VanDerWaalsContact C-N 3.33Å; F388-L390 PolarHBondContact O-N 3.38Å; F388-S391 VanDerWaalsContact CA-OG 3.32Å; F388-S391 WeakPolarHBondContact CA-OG 3.18Å; F388-S391 PolarHBondContact O-N 3Å; F388-S391 VanDerWaalsContact O-N 3.08Å; F388-S391 PolarHBondContact O-OG 3.48Å; F388-Q392 PolarHBondContact O-N 3.02Å
389	E	52	Low	63.2	Low	121 Å²	121	89 Å²	89	57%	0.565	46%	0.456	S	S	*	.	H	α-helix	trans	-65.5	-35.2	174.5	-76.4	178.5	165.8	0	0	111.8	H385 S391 Q392	H385-E389 WeakPolarHBondContact O-CB 3.35Å; H385-E389 WeakPolarHBondContact O-CG 3.45Å; H385-E389 PolarHBondContact O-N 2.62Å; E389-S391 PolarHBondContact O-N 2.75Å; E389-Q392 PolarHBondContact O-N 3.15Å
390	L	47.3	Very low	61.4	Low	158 Å²	158	90.7 Å²	90.7	83%	0.827	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-16.7	172.3	-68.9	172.2	0	0	0	113.4	S386 F388	S386-L390 WeakPolarHBondContact O-CD1 3.22Å; S386-L390 VanDerWaalsContact O-CG 3.26Å; S386-L390 WeakPolarHBondContact O-CG 3.25Å; F388-L390 VanDerWaalsContact C-N 3.33Å; F388-L390 PolarHBondContact O-N 3.38Å
391	S	42.7	Very low	59.6	Low	73 Å²	73	92.2 Å²	92.2	51%	0.51	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-1	179.1	71.5	0	0	0	0	114.3	I387 F388 E389 P393	I387-S391 PolarHBondContact O-N 3.47Å; F388-S391 VanDerWaalsContact CA-OG 3.32Å; F388-S391 WeakPolarHBondContact CA-OG 3.18Å; F388-S391 PolarHBondContact O-N 3Å; F388-S391 VanDerWaalsContact O-N 3.08Å; F388-S391 PolarHBondContact O-OG 3.48Å; E389-S391 PolarHBondContact O-N 2.75Å; S391-P393 WeakPolarHBondContact O-CD 3.19Å
392	Q	41.6	Very low	57.3	Low	116 Å²	116	93 Å²	93	54%	0.542	48%	0.48	S	S	.	.	S	Bend	trans	-92.4	98.5	166.2	-60.6	-142.7	8.3	0	0	108.4	F388 E389 S394	F388-Q392 PolarHBondContact O-N 3.02Å; E389-Q392 PolarHBondContact O-N 3.15Å; Q392-S394 PolarHBondContact O-N 3.4Å
393	P	40	Very low	55.5	Low	77 Å²	77	101.1 Å²	101.1	50%	0.5	51%	0.511	S	S	.	.			trans	-56.5	130.2	166.7	26.5	-34	0	0	0	106.8	S391 K395 D397 V398	S391-P393 WeakPolarHBondContact O-CD 3.19Å; P393-K395 PolarHBondContact O-N 3.29Å; P393-D397 HydrophobicContact CB-CB 4.44Å; P393-V398 HydrophobicContact CB-CG2 3.46Å; P393-V398 VanDerWaalsContact CB-CG2 3.46Å; P393-V398 HydrophobicContact CG-CG2 3.22Å
394	S	44.6	Very low	53.7	Low	49 Å²	49	100.2 Å²	100.2	34%	0.343	51%	0.511	S	S	.	.			trans	-49.7	143	177.2	73.5	0	0	0	0	108.1	Q392 S396 D397 V398	Q392-S394 PolarHBondContact O-N 3.4Å; S394-S396 CarbonylContact O-C 3.47Å; S394-S396 PolarHBondContact O-N 3.46Å; S394-S396 PolarHBondContact OG-OG 2.95Å; S394-D397 PolarHBondContact O-N 3.29Å; S394-D397 PolarHBondContact OG-N 3.48Å; S394-D397 PolarHBondContact OG-OD2 2.96Å; S394-V398 PolarHBondContact O-N 2.92Å
395	K	44.7	Very low	52.2	Low	147 Å²	147	99.5 Å²	99.5	64%	0.639	51%	0.513	S	S	*	.	H	α-helix	trans	-49	-28.4	177.8	-168.2	176.2	179.7	-179.1	0	111.3	P393 I399	P393-K395 PolarHBondContact O-N 3.29Å; K395-I399 HydrophobicContact CG-CD1 4Å; K395-I399 WeakPolarHBondContact O-CB 3.3Å; K395-I399 VanDerWaalsContact O-CD1 3.25Å; K395-I399 WeakPolarHBondContact O-CD1 3.28Å; K395-I399 WeakPolarHBondContact O-CG1 3.4Å
396	S	47.3	Very low	51	Low	59 Å²	59	105.7 Å²	105.7	41%	0.413	54%	0.54	S	S	.	.	H	α-helix	trans	-71.3	-34.2	172.8	46.4	0	0	0	0	115.7	S394 K400	S394-S396 CarbonylContact O-C 3.47Å; S394-S396 PolarHBondContact O-N 3.46Å; S394-S396 PolarHBondContact OG-OG 2.95Å; S396-K400 VanDerWaalsContact O-CB 3.3Å; S396-K400 WeakPolarHBondContact O-CB 3.23Å; S396-K400 WeakPolarHBondContact O-CG 3.18Å; S396-K400 PolarHBondContact O-N 3.18Å; S396-K400 VanDerWaalsContact O-N 3.07Å
397	D	49.4	Very low	49.9	Very low	83 Å²	83	108.5 Å²	108.5	44%	0.444	55%	0.55	S	S	.	*	H	α-helix	trans	-77.4	-33.8	-175.3	-65.8	-36.1	0	0	0	112.8	P393 S394 K401	P393-D397 HydrophobicContact CB-CB 4.44Å; S394-D397 PolarHBondContact O-N 3.29Å; S394-D397 PolarHBondContact OG-N 3.48Å; S394-D397 PolarHBondContact OG-OD2 2.96Å; D397-K401 PolarHBondContact O-N 2.79Å
398	V	50.7	Low	49.1	Very low	54 Å²	54	106.9 Å²	106.9	33%	0.327	54%	0.544	S	S	.	.	H	α-helix	trans	-73.3	-38	175	-171.9	0	0	0	0	111.5	P393 S394 L416	P393-V398 HydrophobicContact CB-CG2 3.46Å; P393-V398 VanDerWaalsContact CB-CG2 3.46Å; P393-V398 HydrophobicContact CG-CG2 3.22Å; S394-V398 PolarHBondContact O-N 2.92Å; V398-L416 HydrophobicContact CG1-CD1 3.79Å
399	I	51.4	Low	48.4	Very low	74 Å²	74	106.3 Å²	106.3	38%	0.379	54%	0.539	S	S	.	.	H	α-helix	trans	-73.4	-35.2	-179	-65.9	173.8	0	0	0	111.2	K395	K395-I399 HydrophobicContact CG-CD1 4Å; K395-I399 WeakPolarHBondContact O-CB 3.3Å; K395-I399 VanDerWaalsContact O-CD1 3.25Å; K395-I399 WeakPolarHBondContact O-CD1 3.28Å; K395-I399 WeakPolarHBondContact O-CG1 3.4Å
400	K	52.1	Low	48.6	Very low	173 Å²	173	105.7 Å²	105.7	75%	0.752	54%	0.539	S	S	*	.	H	α-helix	trans	-71.3	-27.5	179	-78	176.2	-180	179.5	0	114	S396	S396-K400 VanDerWaalsContact O-CB 3.3Å; S396-K400 WeakPolarHBondContact O-CB 3.23Å; S396-K400 WeakPolarHBondContact O-CG 3.18Å; S396-K400 PolarHBondContact O-N 3.18Å; S396-K400 VanDerWaalsContact O-N 3.07Å
401	K	49.9	Very low	49	Very low	187 Å²	187	105.5 Å²	105.5	81%	0.813	53%	0.531	S	S	*	.	H	α-helix	trans	-91.1	-6.4	179.5	-71.3	-177	178.2	179.1	0	114.4	D397 K403	D397-K401 PolarHBondContact O-N 2.79Å; K401-K403 PolarHBondContact O-N 2.77Å
402	C	40.7	Very low	49.1	Very low	35 Å²	35	104.2 Å²	104.2	24%	0.236	52%	0.521	C	S	.	.			trans	-85.9	107.4	-177.3	-170.3	0	0	0	0	111.8	L404	C402-L404 PolarHBondContact O-N 3.46Å
403	K	50.5	Low	49.5	Very low	211 Å²	211	99.8 Å²	99.8	92%	0.917	50%	0.503	S	S	*	.			trans	-77.3	6.2	178.3	-71.1	-173.1	177.3	-178.3	0	114.8	K401	K401-K403 PolarHBondContact O-N 2.77Å
404	L	47.5	Very low	50.2	Low	98 Å²	98	100.6 Å²	100.6	51%	0.513	50%	0.503	S	S	.	.	S	Bend	trans	-86.9	158.5	-175.7	-64.8	160.7	0	0	0	112	C402 V408 R409	C402-L404 PolarHBondContact O-N 3.46Å; L404-V408 HydrophobicContact CB-CB 3.97Å; L404-V408 HydrophobicContact CB-CG1 3.86Å; L404-V408 HydrophobicContact CD1-CG1 3.87Å; L404-V408 HydrophobicContact CG-CG1 4.37Å; L404-R409 PolarHBondContact O-NE 3.12Å; L404-R409 PolarHBondContact O-NH2 2.88Å
405	S	53.8	Low	50.7	Low	71 Å²	71	104.1 Å²	104.1	50%	0.497	52%	0.515	S	S	.	.			trans	-58.4	158.6	-177.1	72.7	0	0	0	0	112.4	D407 V408 R409	S405-D407 PolarHBondContact O-N 3.38Å; S405-D407 VanDerWaalsContact O-N 3.12Å; S405-V408 PolarHBondContact O-N 3.48Å; S405-R409 PolarHBondContact O-N 3.19Å
406	K	55.1	Low	51.2	Low	169 Å²	169	100.5 Å²	100.5	74%	0.735	50%	0.502	S	S	*	.	H	α-helix	trans	-54.4	-35.4	-171.7	-143.4	176.3	-177.2	-178	0	112.8	R409 L410	K406-R409 PolarHBondContact O-N 3.39Å; K406-L410 PolarHBondContact O-N 3.42Å
407	D	51.7	Low	51.2	Low	117 Å²	117	101.2 Å²	101.2	63%	0.626	50%	0.501	S	S	*	.	H	α-helix	trans	-74.8	-30.1	-179.7	-56.8	-41.9	0	0	0	113.5	S405 K411	S405-D407 PolarHBondContact O-N 3.38Å; S405-D407 VanDerWaalsContact O-N 3.12Å; D407-K411 PolarHBondContact O-N 3.09Å
408	V	54.3	Low	51.5	Low	55 Å²	55	101.6 Å²	101.6	33%	0.333	50%	0.502	S	S	.	.	H	α-helix	trans	-74.1	-31.8	174.3	-178	0	0	0	0	110.7	L404 S405 L410 K411 C412	L404-V408 HydrophobicContact CB-CB 3.97Å; L404-V408 HydrophobicContact CB-CG1 3.86Å; L404-V408 HydrophobicContact CD1-CG1 3.87Å; L404-V408 HydrophobicContact CG-CG1 4.37Å; S405-V408 PolarHBondContact O-N 3.48Å; V408-L410 PolarHBondContact O-N 3.29Å; V408-K411 PolarHBondContact O-N 3.42Å; V408-C412 PolarHBondContact O-N 2.99Å
409	R	49.8	Very low	51.2	Low	106 Å²	106	107.4 Å²	107.4	40%	0.4	52%	0.518	S	S	.	.	H	α-helix	trans	-63.8	-39.2	174.9	-64.9	-176.3	-145	174.4	5.2	112.9	L404 S405 K406 S413	L404-R409 PolarHBondContact O-NE 3.12Å; L404-R409 PolarHBondContact O-NH2 2.88Å; S405-R409 PolarHBondContact O-N 3.19Å; K406-R409 PolarHBondContact O-N 3.39Å; R409-S413 WeakPolarHBondContact O-CB 3.3Å; R409-S413 PolarHBondContact O-N 2.8Å
410	L	54.7	Low	51.1	Low	108 Å²	108	105.8 Å²	105.8	57%	0.565	51%	0.512	S	S	*	.	H	α-helix	trans	-64.9	-42.1	176.2	-81.2	158.1	0	0	0	111.5	K406 V408 S413 N414	K406-L410 PolarHBondContact O-N 3.42Å; V408-L410 PolarHBondContact O-N 3.29Å; L410-S413 PolarHBondContact O-N 3.06Å; L410-N414 PolarHBondContact O-N 3.27Å; L410-N414 PolarHBondContact O-ND2 3.48Å
411	K	56	Low	50.8	Low	153 Å²	153	103.6 Å²	103.6	67%	0.665	50%	0.504	S	S	*	.	H	α-helix	trans	-66.2	-42.6	175.9	-72.2	-178.2	178.8	178.6	0	112.8	D407 V408 N414 Q415	D407-K411 PolarHBondContact O-N 3.09Å; V408-K411 PolarHBondContact O-N 3.42Å; K411-N414 PolarHBondContact O-N 3.24Å; K411-Q415 PolarHBondContact O-N 3.16Å
412	C	44.2	Very low	50.3	Low	46 Å²	46	98.7 Å²	98.7	31%	0.311	49%	0.487	S	S	.	.	H	α-helix	trans	-65.3	-39	174.7	-76.3	0	0	0	0	112.6	V408 N414 Q415 L416	V408-C412 PolarHBondContact O-N 2.99Å; C412-N414 VanDerWaalsContact C-N 3.3Å; C412-N414 PolarHBondContact O-N 3.45Å; C412-Q415 PolarHBondContact O-N 3.44Å; C412-L416 WeakPolarHBondContact O-CG 3.41Å; C412-L416 PolarHBondContact O-N 2.79Å
413	S	51.8	Low	50.4	Low	23 Å²	23	102.5 Å²	102.5	16%	0.161	50%	0.501	C	S	.	.	H	α-helix	trans	-63.2	-37.4	175.5	-170.5	0	0	0	0	111.8	R409 L410 N417	R409-S413 WeakPolarHBondContact O-CB 3.3Å; R409-S413 PolarHBondContact O-N 2.8Å; L410-S413 PolarHBondContact O-N 3.06Å; S413-N417 PolarHBondContact O-N 3.44Å; S413-N417 VanDerWaalsContact O-N 3.1Å
414	N	54.5	Low	49.8	Very low	94 Å²	94	98.7 Å²	98.7	50%	0.503	49%	0.485	S	S	.	.	H	α-helix	trans	-70.8	-38.2	176.8	-72	-15	0	0	0	112.1	L410 K411 C412 N417 I418	L410-N414 PolarHBondContact O-N 3.27Å; L410-N414 PolarHBondContact O-ND2 3.48Å; K411-N414 PolarHBondContact O-N 3.24Å; C412-N414 VanDerWaalsContact C-N 3.3Å; C412-N414 PolarHBondContact O-N 3.45Å; N414-N417 PolarHBondContact O-N 2.96Å; N414-I418 WeakPolarHBondContact O-CG1 3.45Å; N414-I418 PolarHBondContact O-N 3.32Å
415	Q	55.2	Low	49.1	Very low	124 Å²	124	97 Å²	97	58%	0.579	48%	0.479	S	S	*	.	H	α-helix	trans	-67.7	-33.7	174.4	-78.6	175.2	-13.5	0	0	113.2	K411 C412 I418 R419	K411-Q415 PolarHBondContact O-N 3.16Å; C412-Q415 PolarHBondContact O-N 3.44Å; Q415-I418 PolarHBondContact O-N 2.84Å; Q415-R419 PolarHBondContact O-N 3.41Å
416	L	53.8	Low	48.2	Very low	70 Å²	70	98 Å²	98	37%	0.366	48%	0.477	S	S	.	.	H	α-helix	trans	-68.7	-36.5	172.4	-75.6	162.2	0	0	0	112.2	V398 C412 R419 T420	V398-L416 HydrophobicContact CG1-CD1 3.79Å; C412-L416 WeakPolarHBondContact O-CG 3.41Å; C412-L416 PolarHBondContact O-N 2.79Å; L416-R419 PolarHBondContact O-N 3.39Å; L416-T420 WeakPolarHBondContact O-CG2 3.28Å; L416-T420 PolarHBondContact O-N 2.85Å; L416-T420 PolarHBondContact O-OG1 3.47Å
417	N	49	Very low	47.3	Very low	75 Å²	75	94.7 Å²	94.7	40%	0.401	47%	0.467	S	S	.	.	H	α-helix	trans	-65	-40.6	172.4	-83.2	-17.8	0	0	0	112.4	S413 N414 T420 Q421	S413-N417 PolarHBondContact O-N 3.44Å; S413-N417 VanDerWaalsContact O-N 3.1Å; N414-N417 PolarHBondContact O-N 2.96Å; N417-T420 WeakPolarHBondContact CA-OG1 3.38Å; N417-T420 PolarHBondContact O-N 3.28Å; N417-T420 PolarHBondContact O-OG1 3.1Å; N417-Q421 WeakPolarHBondContact O-CB 3.38Å; N417-Q421 PolarHBondContact O-N 3.1Å
418	I	55.2	Low	46.2	Very low	91 Å²	91	96.1 Å²	96.1	47%	0.467	47%	0.468	S	S	.	.	H	α-helix	trans	-66.2	-40.8	175.5	-65.5	164.7	0	0	0	110.6	N414 Q415 Q421 N422	N414-I418 WeakPolarHBondContact O-CG1 3.45Å; N414-I418 PolarHBondContact O-N 3.32Å; Q415-I418 PolarHBondContact O-N 2.84Å; I418-Q421 PolarHBondContact O-N 2.92Å; I418-N422 WeakPolarHBondContact O-CB 3.38Å; I418-N422 VanDerWaalsContact O-CG 3.25Å; I418-N422 PolarHBondContact O-N 3.17Å
419	R	44.3	Very low	44.9	Very low	176 Å²	176	101.1 Å²	101.1	66%	0.664	49%	0.487	S	S	*	.	H	α-helix	trans	-64.3	-40.5	175.4	-83.4	-176.7	175.6	158.1	-0.6	113.2	Q415 L416 N422 Q423	Q415-R419 PolarHBondContact O-N 3.41Å; L416-R419 PolarHBondContact O-N 3.39Å; R419-N422 PolarHBondContact O-N 3.21Å; R419-Q423 WeakPolarHBondContact O-CB 3.37Å; R419-Q423 WeakPolarHBondContact O-CG 3.46Å; R419-Q423 PolarHBondContact O-N 3.49Å
420	T	48	Very low	43.9	Very low	40 Å²	40	102 Å²	102	25%	0.245	50%	0.496	C	S	.	.	H	α-helix	trans	-72	-30.4	177.8	46.8	0	0	0	0	112.5	L416 N417 K424	L416-T420 WeakPolarHBondContact O-CG2 3.28Å; L416-T420 PolarHBondContact O-N 2.85Å; L416-T420 PolarHBondContact O-OG1 3.47Å; N417-T420 WeakPolarHBondContact CA-OG1 3.38Å; N417-T420 PolarHBondContact O-N 3.28Å; N417-T420 PolarHBondContact O-OG1 3.1Å; T420-K424 VanDerWaalsContact O-CG 3.31Å; T420-K424 WeakPolarHBondContact O-CG 3.3Å; T420-K424 PolarHBondContact O-N 3.04Å
421	Q	46.2	Very low	42.8	Very low	126 Å²	126	100.4 Å²	100.4	59%	0.589	49%	0.488	S	S	*	.	H	α-helix	trans	-69.6	-40.7	168.3	-79.2	178.9	-33.5	0	0	112.2	N417 I418 K424 T425	N417-Q421 WeakPolarHBondContact O-CB 3.38Å; N417-Q421 PolarHBondContact O-N 3.1Å; I418-Q421 PolarHBondContact O-N 2.92Å; Q421-K424 WeakPolarHBondContact O-CB 3.21Å; Q421-K424 PolarHBondContact O-N 3.27Å; Q421-T425 PolarHBondContact O-N 3.1Å; Q421-T425 PolarHBondContact O-OG1 2.82Å
422	N	39.7	Very low	41.5	Very low	85 Å²	85	100.2 Å²	100.2	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-71.1	-33.6	178.5	-71.7	-11.1	0	0	0	113.3	I418 R419 K424 T425 I426	I418-N422 WeakPolarHBondContact O-CB 3.38Å; I418-N422 VanDerWaalsContact O-CG 3.25Å; I418-N422 PolarHBondContact O-N 3.17Å; R419-N422 PolarHBondContact O-N 3.21Å; N422-K424 VanDerWaalsContact C-N 3.34Å; N422-T425 VanDerWaalsContact CA-OG1 3.27Å; N422-T425 WeakPolarHBondContact CA-OG1 3.14Å; N422-T425 PolarHBondContact O-N 3.08Å; N422-T425 PolarHBondContact O-OG1 2.81Å; N422-I426 VanDerWaalsContact O-CG1 3.29Å; N422-I426 WeakPolarHBondContact O-CG1 3.16Å; N422-I426 PolarHBondContact O-N 2.81Å
423	Q	43.1	Very low	40.7	Very low	114 Å²	114	104.3 Å²	104.3	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-67.1	-36.3	170.5	-78.8	177.8	-18.2	0	0	111.7	R419 I427	R419-Q423 WeakPolarHBondContact O-CB 3.37Å; R419-Q423 WeakPolarHBondContact O-CG 3.46Å; R419-Q423 PolarHBondContact O-N 3.49Å; Q423-I427 WeakPolarHBondContact O-CD1 3.44Å; Q423-I427 WeakPolarHBondContact O-CG1 3.38Å; Q423-I427 PolarHBondContact O-N 2.61Å
424	K	38.6	Very low	39.7	Very low	131 Å²	131	113.8 Å²	113.8	57%	0.57	54%	0.544	S	S	*	.	H	α-helix	trans	-62.4	-45.2	170.8	-75.5	174.7	-179.8	-176.4	0	110.8	T420 Q421 N422 I427 F428	T420-K424 VanDerWaalsContact O-CG 3.31Å; T420-K424 WeakPolarHBondContact O-CG 3.3Å; T420-K424 PolarHBondContact O-N 3.04Å; Q421-K424 WeakPolarHBondContact O-CB 3.21Å; Q421-K424 PolarHBondContact O-N 3.27Å; N422-K424 VanDerWaalsContact C-N 3.34Å; K424-I427 WeakPolarHBondContact O-CB 3.18Å; K424-I427 PolarHBondContact O-N 3.2Å; K424-F428 HydrophobicContact CB-CE2 4.41Å; K424-F428 WeakPolarHBondContact O-CD2 3.49Å; K424-F428 PolarHBondContact O-N 2.77Å
425	T	32.2	Very low	38.4	Very low	64 Å²	64	113.9 Å²	113.9	39%	0.393	55%	0.552	S	S	.	*	H	α-helix	trans	-71.4	-32	-179.5	49.2	0	0	0	0	114.7	Q421 N422 I427 F428 Q429	Q421-T425 PolarHBondContact O-N 3.1Å; Q421-T425 PolarHBondContact O-OG1 2.82Å; N422-T425 VanDerWaalsContact CA-OG1 3.27Å; N422-T425 WeakPolarHBondContact CA-OG1 3.14Å; N422-T425 PolarHBondContact O-N 3.08Å; N422-T425 PolarHBondContact O-OG1 2.81Å; T425-I427 VanDerWaalsContact C-N 3.32Å; T425-F428 CarbonylContact O-C 3.37Å; T425-F428 WeakPolarHBondContact O-CA 3.34Å; T425-F428 WeakPolarHBondContact O-CB 3.41Å; T425-F428 PolarHBondContact O-N 3.07Å; T425-Q429 PolarHBondContact O-N 3Å
426	I	34.5	Very low	37	Very low	91 Å²	91	114.9 Å²	114.9	47%	0.467	56%	0.557	S	S	.	*	H	α-helix	trans	-66.5	-37.1	172.2	-67.7	165.7	0	0	0	110.5	N422 F428 Q429 E430	N422-I426 VanDerWaalsContact O-CG1 3.29Å; N422-I426 WeakPolarHBondContact O-CG1 3.16Å; N422-I426 PolarHBondContact O-N 2.81Å; I426-F428 PolarHBondContact O-N 3.26Å; I426-Q429 PolarHBondContact O-N 2.81Å; I426-E430 PolarHBondContact O-N 3.25Å
427	I	35.6	Very low	35.6	Very low	100 Å²	100	118.9 Å²	118.9	51%	0.513	58%	0.578	S	S	.	*	H	α-helix	trans	-63.4	-23.6	169.4	-65.3	165.4	0	0	0	111.8	Q423 K424 T425	Q423-I427 WeakPolarHBondContact O-CD1 3.44Å; Q423-I427 WeakPolarHBondContact O-CG1 3.38Å; Q423-I427 PolarHBondContact O-N 2.61Å; K424-I427 WeakPolarHBondContact O-CB 3.18Å; K424-I427 PolarHBondContact O-N 3.2Å; T425-I427 VanDerWaalsContact C-N 3.32Å
428	F	29.9	Very low	34.4	Very low	147 Å²	147	125 Å²	125	65%	0.645	60%	0.597	S	S	*	*	H	α-helix	trans	-90.2	-18.8	176.5	-75.2	-68.9	0	0	0	114.7	K424 T425 I426	K424-F428 HydrophobicContact CB-CE2 4.41Å; K424-F428 WeakPolarHBondContact O-CD2 3.49Å; K424-F428 PolarHBondContact O-N 2.77Å; T425-F428 CarbonylContact O-C 3.37Å; T425-F428 WeakPolarHBondContact O-CA 3.34Å; T425-F428 WeakPolarHBondContact O-CB 3.41Å; T425-F428 PolarHBondContact O-N 3.07Å; I426-F428 PolarHBondContact O-N 3.26Å
429	Q	27.7	Very low	33	Very low	159 Å²	159	129 Å²	129	74%	0.743	61%	0.608	S	S	*	*	H	α-helix	trans	-103.3	-19.3	-174.4	-77.1	-174.1	-28.8	0	0	114.9	T425 I426 D431	T425-Q429 PolarHBondContact O-N 3Å; I426-Q429 PolarHBondContact O-N 2.81Å; Q429-D431 PolarHBondContact O-N 3.38Å
430	E	28.3	Very low	32.1	Very low	124 Å²	124	126.2 Å²	126.2	58%	0.579	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-73.8	-8.3	171.6	-68.1	-177.9	165.2	0	0	113	I426 M432 N433	I426-E430 PolarHBondContact O-N 3.25Å; E430-M432 VanDerWaalsContact C-N 3.32Å; E430-M432 PolarHBondContact O-N 3.38Å; E430-N433 PolarHBondContact O-N 3.35Å
431	D	30.9	Very low	30.8	Very low	75 Å²	75	132.5 Å²	132.5	40%	0.401	64%	0.639	S	S	.	*	G	3₁₀ helix	trans	-83.9	9.8	-171.2	-81.2	-22.4	0	0	0	115.1	K370 Q429	K370-D431 WeakPolarHBondContact CE-OD2 3.32Å; K370-D431 VanDerWaalsContact NZ-CG 3.26Å; K370-D431 IonicContact NZ-OD1 3.85Å; K370-D431 PolarHBondContact NZ-OD1 3.3Å; K370-D431 IonicContact NZ-OD2 3.45Å; K370-D431 PolarHBondContact NZ-OD2 3.29Å; Q429-D431 PolarHBondContact O-N 3.38Å
432	M	28.9	Very low	29.7	Very low	150 Å²	150	133.9 Å²	133.9	74%	0.739	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-101.5	-15	168.9	-69.7	-70.8	-82.5	0	0	114	E430	E430-M432 VanDerWaalsContact C-N 3.32Å; E430-M432 PolarHBondContact O-N 3.38Å
433	N	27.6	Very low	28.9	Very low	132 Å²	132	137.3 Å²	137.3	71%	0.706	67%	0.669	S	S	*	*	S	Bend	trans	-107.4	1.5	-174.2	-78.1	-17.1	0	0	0	114.8	E430	E430-N433 PolarHBondContact O-N 3.35Å
434	Y	30.6	Very low	27.9	Very low	222 Å²	222	137.6 Å²	137.6	87%	0.871	68%	0.678	S	S	*	*	S	Bend	trans	-109	7.3	176.3	-130.3	-92.5	0	0	0	114.3
435	S	27.3	Very low	27.1	Very low	96 Å²	96	138.4 Å²	138.4	67%	0.671	69%	0.689	S	S	*	*	S	Bend	trans	-115.5	5.3	176.8	56.2	0	0	0	0	113.9
436	Q	25.2	Very low	26.7	Very low	145 Å²	145	141 Å²	141	68%	0.678	71%	0.71	S	S	*	*			trans	-134.4	15.7	-176.6	-83	-158.5	-15.5	0	0	116.8	Y438	Q436-Y438 WeakPolarHBondContact O-CD2 3.33Å; Q436-Y438 PolarHBondContact O-N 3.39Å
437	N	24.4	Very low	26.2	Very low	153 Å²	153	144.3 Å²	144.3	82%	0.818	72%	0.718	S	S	*	*			trans	-82.2	81.6	166.3	-77.7	-19.5	0	0	0	110.8
438	Y	24.4	Very low	25.6	Very low	203 Å²	203	142.3 Å²	142.3	80%	0.796	72%	0.721	S	S	*	*			trans	11.3	124.1	135.8	-91.3	-96.1	0	0	0	116.5	Q436 P440	Q436-Y438 WeakPolarHBondContact O-CD2 3.33Å; Q436-Y438 PolarHBondContact O-N 3.39Å; Y438-P440 WeakPolarHBondContact O-CD 3.23Å
439	Y	25.6	Very low	25.2	Very low	176 Å²	176	143.1 Å²	143.1	69%	0.69	73%	0.731	S	S	*	*			trans	-38.7	135.9	143	-69.3	-103.6	0	0	0	110.7	R340	R340-Y439 VanDerWaalsContact NH2-CE1 3.25Å
440	P	24.4	Very low	25	Very low	118 Å²	118	144 Å²	144	77%	0.766	73%	0.729	S	S	*	*			trans	-105.8	113.3	138.4	20.7	-4.4	0	0	0	107.1	Y438 N442	Y438-P440 WeakPolarHBondContact O-CD 3.23Å; P440-N442 PolarHBondContact O-N 3.27Å
441	E	22.2	Very low	24.6	Very low	172 Å²	172	140.3 Å²	140.3	80%	0.804	72%	0.724	S	S	*	*			trans	-48.4	119.3	144.6	-67	174.3	159.9	0	0	107.3
442	N	22.6	Very low	24.2	Very low	154 Å²	154	141.6 Å²	141.6	82%	0.824	74%	0.738	S	S	*	*			trans	179	126.4	130	-84.7	-24.7	0	0	0	110.4	P440 T444	P440-N442 PolarHBondContact O-N 3.27Å; N442-T444 PolarHBondContact O-N 2.65Å
443	N	23.4	Very low	23.9	Very low	158 Å²	158	143 Å²	143	85%	0.845	74%	0.74	S	S	*	*			trans	-52.2	123	157.4	-73.2	-40.3	0	0	0	109.1
444	T	20.9	Very low	23.7	Very low	119 Å²	119	142.6 Å²	142.6	73%	0.73	74%	0.738	S	S	*	*			trans	162.9	126.8	130.1	42.9	0	0	0	0	110	N442	N442-T444 PolarHBondContact O-N 2.65Å
445	D	22.3	Very low	23.3	Very low	149 Å²	149	139.4 Å²	139.4	80%	0.797	74%	0.737	S	S	*	*			trans	63.1	95	141.4	-49.6	-22.6	0	0	0	120.5
446	S	24.1	Very low	23	Very low	117 Å²	117	140.4 Å²	140.4	82%	0.818	74%	0.739	S	S	*	*				-176.9	114.4	111	59.6	0	0	0	0	110.4	G448	S446-G448 PolarHBondContact O-N 3.26Å
447	Y	24.2	Very low	23	Very low	162 Å²	162	139.4 Å²	139.4	64%	0.635	74%	0.737	S	S	*	*			trans	-75	81.8	165.7	-89.3	-90.2	0	0	0	108.7	S324	S324-Y447 WeakPolarHBondContact O-CD1 3.29Å; S324-Y447 WeakPolarHBondContact O-CE1 3.41Å
448	G	22.1	Very low	23.1	Very low	57 Å²	57	136.7 Å²	136.7	59%	0.588	73%	0.728	S	S	*	*			trans	-71.1	122.6	166.4	0	0	0	0	0	110.7	S446 Y450	S446-G448 PolarHBondContact O-N 3.26Å; G448-Y450 PolarHBondContact O-N 3.2Å
449	I	22.6	Very low	23	Very low	165 Å²	165	132.3 Å²	132.3	85%	0.846	73%	0.726	S	S	*	*			trans	-33.5	114.8	170.7	-61.5	168.4	0	0	0	111.3	G451	I449-G451 PolarHBondContact O-N 3.4Å
450	Y	23.2	Very low	23	Very low	178 Å²	178	133.2 Å²	133.2	70%	0.698	73%	0.73	S	S	*	*			trans	-66.5	82.2	162.3	-95	-86.6	0	0	0	108.6	K310 G448 F453	K310-Y450 PolarHBondContact NZ-O 3.1Å; G448-Y450 PolarHBondContact O-N 3.2Å; Y450-F453 HydrophobicContact CD1-CE2 4.41Å; Y450-F453 HydrophobicContact CE1-CE2 4.23Å
451	G	20.4	Very low	22.9	Very low	46 Å²	46	132.9 Å²	132.9	47%	0.474	73%	0.729	S	S	.	*			trans	-64.2	146.8	157.8	0	0	0	0	0	109.2	I449 F453	I449-G451 PolarHBondContact O-N 3.4Å; G451-F453 PolarHBondContact O-N 2.88Å; G451-F453 VanDerWaalsContact O-N 3.08Å
452	S	22.7	Very low	23.1	Very low	102 Å²	102	131.6 Å²	131.6	71%	0.713	73%	0.726	S	S	*	*			trans	-40.3	114.8	167.9	179.4	0	0	0	0	110.6	N454	S452-N454 PolarHBondContact O-N 3.19Å
453	F	22.4	Very low	23.2	Very low	178 Å²	178	131.8 Å²	131.8	78%	0.781	72%	0.722	S	S	*	*			trans	-65.7	86.2	158.7	-84.7	-88.2	0	0	0	106.5	Y450 G451 D455	Y450-F453 HydrophobicContact CD1-CE2 4.41Å; Y450-F453 HydrophobicContact CE1-CE2 4.23Å; G451-F453 PolarHBondContact O-N 2.88Å; G451-F453 VanDerWaalsContact O-N 3.08Å; F453-D455 PolarHBondContact O-N 3.3Å
454	N	21.7	Very low	23.2	Very low	124 Å²	124	130.9 Å²	130.9	66%	0.663	72%	0.717	S	S	*	*			trans	-58.2	123.8	147.4	-83	-9.6	0	0	0	105.7	S452 T456	S452-N454 PolarHBondContact O-N 3.19Å; N454-T456 PolarHBondContact O-N 3.18Å; N454-T456 PolarHBondContact O-OG1 3.26Å; N454-T456 VanDerWaalsContact O-OG1 3.1Å
455	D	23.1	Very low	23.4	Very low	156 Å²	156	131.2 Å²	131.2	83%	0.834	72%	0.715	S	S	*	*			trans	-53.1	89.3	170.9	-75.6	-48.9	0	0	0	109	F453	F453-D455 PolarHBondContact O-N 3.3Å
456	T	21.9	Very low	23.6	Very low	116 Å²	116	131.4 Å²	131.4	71%	0.712	72%	0.715	S	S	*	*			trans	-99.7	94.2	168.1	-32	0	0	0	0	104.5	N454	N454-T456 PolarHBondContact O-N 3.18Å; N454-T456 PolarHBondContact O-OG1 3.26Å; N454-T456 VanDerWaalsContact O-OG1 3.1Å
457	I	25.3	Very low	23.7	Very low	124 Å²	124	134.8 Å²	134.8	64%	0.636	72%	0.715	S	S	*	*			trans	-48.5	133.1	160.4	-62.6	170.4	0	0	0	106.1	S459	I457-S459 PolarHBondContact O-N 3.23Å
458	P	24.8	Very low	23.7	Very low	97 Å²	97	134.7 Å²	134.7	63%	0.63	73%	0.725	S	S	*	*			trans	-54.3	111.6	172.4	-22.2	31.9	0	0	0	108.4	Y460	P458-Y460 HydrophobicContact CB-CD2 4.24Å; P458-Y460 HydrophobicContact CB-CE2 4.23Å; P458-Y460 PolarHBondContact O-N 3.09Å
459	S	23.3	Very low	23.9	Very low	110 Å²	110	137 Å²	137	77%	0.769	73%	0.731	S	S	*	*			trans	-62.4	84.7	165.9	-61.5	0	0	0	0	106.9	I457 C461	I457-S459 PolarHBondContact O-N 3.23Å; S459-C461 PolarHBondContact O-N 3.44Å
460	Y	25.8	Very low	24	Very low	196 Å²	196	136.4 Å²	136.4	77%	0.769	73%	0.73	S	S	*	*			trans	-61.2	112.5	162.2	-87.7	-86.5	0	0	0	106.4	P458 I462	P458-Y460 HydrophobicContact CB-CD2 4.24Å; P458-Y460 HydrophobicContact CB-CE2 4.23Å; P458-Y460 PolarHBondContact O-N 3.09Å; Y460-I462 PolarHBondContact O-N 3.09Å
461	C	22.5	Very low	24.1	Very low	111 Å²	111	138.6 Å²	138.6	75%	0.75	74%	0.737	S	S	*	*			trans	-48.7	109.9	172.1	-68.3	0	0	0	0	109.6	S459 Q463	S459-C461 PolarHBondContact O-N 3.44Å; C461-Q463 HydrophobicContact CB-CG 4.46Å; C461-Q463 PolarHBondContact O-N 2.93Å
462	I	25	Very low	24.2	Very low	145 Å²	145	143.3 Å²	143.3	74%	0.744	75%	0.751	S	S	*	*			trans	-72.3	76.8	150.8	-58.9	176.7	0	0	0	105.6	Y460 N464	Y460-I462 PolarHBondContact O-N 3.09Å; I462-N464 HydrophobicContact CG2-CB 3.86Å; I462-N464 VanDerWaalsContact CG2-ND2 3.25Å; I462-N464 WeakPolarHBondContact CG2-ND2 3.46Å; I462-N464 PolarHBondContact O-N 2.98Å
463	Q	25	Very low	24.4	Very low	157 Å²	157	145 Å²	145	73%	0.734	76%	0.762	S	S	*	*			trans	-77.1	71	154.2	-87.4	-173.7	-13.4	0	0	107.4	C461 N465	C461-Q463 HydrophobicContact CB-CG 4.46Å; C461-Q463 PolarHBondContact O-N 2.93Å; Q463-N465 PolarHBondContact O-N 2.89Å
464	N	24.8	Very low	24.5	Very low	139 Å²	139	142.4 Å²	142.4	74%	0.743	76%	0.761	S	S	*	*			trans	-75.5	70.8	154.9	-84.8	-29.6	0	0	0	107.4	I462 L466	I462-N464 HydrophobicContact CG2-CB 3.86Å; I462-N464 VanDerWaalsContact CG2-ND2 3.25Å; I462-N464 WeakPolarHBondContact CG2-ND2 3.46Å; I462-N464 PolarHBondContact O-N 2.98Å; N464-L466 PolarHBondContact O-N 2.89Å
465	N	24.6	Very low	24.7	Very low	126 Å²	126	143.2 Å²	143.2	67%	0.674	77%	0.765	S	S	*	*			trans	-85	97.4	160.8	-90.9	-36.5	0	0	0	107.7	Q463 K467	Q463-N465 PolarHBondContact O-N 2.89Å; N465-K467 VanDerWaalsContact C-N 3.25Å; N465-K467 PolarHBondContact O-N 3.26Å
466	L	25.3	Very low	24.7	Very low	153 Å²	153	141.6 Å²	141.6	80%	0.801	76%	0.755	S	S	*	*			trans	-49	93	150.6	-79.8	149.5	0	0	0	108.8	N464 L468	N464-L466 PolarHBondContact O-N 2.89Å; L466-L468 HydrophobicContact CD2-CD1 4.32Å
467	K	26.1	Very low	24.8	Very low	189 Å²	189	144.1 Å²	144.1	82%	0.822	76%	0.759	S	S	*	*			trans	-101	82.7	153.7	-84.1	-169.3	176.3	-177.4	0	108.3	N465 S469	N465-K467 VanDerWaalsContact C-N 3.25Å; N465-K467 PolarHBondContact O-N 3.26Å; K467-S469 PolarHBondContact O-N 3.15Å
468	L	24.2	Very low	24.7	Very low	160 Å²	160	143.1 Å²	143.1	84%	0.838	76%	0.763	S	S	*	*			trans	-67.2	100.8	151.1	-83.5	153	0	0	0	107.4	L466	L466-L468 HydrophobicContact CD2-CD1 4.32Å
469	S	27.2	Very low	24.7	Very low	104 Å²	104	143.8 Å²	143.8	73%	0.727	77%	0.77	S	S	*	*			trans	-155.1	111.1	152.5	62.7	0	0	0	0	110.5	K467	K467-S469 PolarHBondContact O-N 3.15Å
470	N	23.7	Very low	24.7	Very low	154 Å²	154	145.7 Å²	145.7	82%	0.824	77%	0.771	S	S	*	*			trans	-32.7	137.7	172.9	-65.5	-39.3	0	0	0	115.9
471	R	25.7	Very low	24.6	Very low	223 Å²	223	144.7 Å²	144.7	84%	0.842	78%	0.776	S	S	*	*				-179.2	132.6	100.3	-93.8	175.5	-173.1	-167.9	2.4	112.4
472	N	23.7	Very low	24.6	Very low	145 Å²	145	145.1 Å²	145.1	78%	0.775	78%	0.775	S	S	*	*			trans	67.2	99.8	149.4	-57.3	-8.1	0	0	0	119.4
473	C	25.9	Very low	24.7	Very low	139 Å²	139	147.6 Å²	147.6	94%	0.939	78%	0.781	S	S	*	*				-156.2	107.9	121.7	-100.4	0	0	0	0	109.5
474	T	24	Very low	24.8	Very low	122 Å²	122	148.3 Å²	148.3	75%	0.748	79%	0.788	S	S	*	*			trans	-70.5	154.9	165.5	40.1	0	0	0	0	111.4
475	N	26.1	Very low	24.7	Very low	141 Å²	141	147 Å²	147	75%	0.754	79%	0.785	S	S	*	*			trans	83.4	136.1	165.1	-60	-13.4	0	0	0	117.4
476	I	22.9	Very low	24.6	Very low	123 Å²	123	147.5 Å²	147.5	63%	0.631	79%	0.787	S	S	*	*			cis	176.1	147.1	-22	-109.3	167	0	0	0	104.2
477	Q	25.9	Very low	24.7	Very low	168 Å²	168	147.7 Å²	147.7	79%	0.785	79%	0.789	S	S	*	*			trans	71.3	112.5	158.2	-79	158.1	3.5	0	0	119.6
478	S	22.9	Very low	24.5	Very low	103 Å²	103	147.6 Å²	147.6	72%	0.72	79%	0.789	S	S	*	*				57.2	133	95.1	69.3	0	0	0	0	113.5
479	S	25.1	Very low	24.7	Very low	112 Å²	112	145.6 Å²	145.6	78%	0.783	79%	0.786	S	S	*	*			cis	-176.5	163.6	16.7	28.8	0	0	0	0	107.7
480	N	22.6	Very low	24.4	Very low	149 Å²	149	146.1 Å²	146.1	80%	0.797	79%	0.789	S	S	*	*			trans	-42.8	139.1	171.4	-65.6	-34.1	0	0	0	114.9
481	M	23.1	Very low	24.5	Very low	175 Å²	175	143.9 Å²	143.9	86%	0.862	79%	0.785	S	S	*	*				171.3	158.6	118.3	-92	-66.4	169.3	0	0	113.1
482	T	23.6	Very low	24.5	Very low	120 Å²	120	143.7 Å²	143.7	74%	0.736	79%	0.786	S	S	*	*			trans	-61.4	144.7	-170.7	34.5	0	0	0	0	118.5
483	K	26.7	Very low	24.5	Very low	198 Å²	198	144.3 Å²	144.3	86%	0.861	79%	0.787	S	S	*	*			trans	18.5	130.7	148.3	-72.4	-179.7	175.4	180	0	119.7
484	I	25.9	Very low	24.5	Very low	171 Å²	171	142.7 Å²	142.7	88%	0.877	78%	0.778	S	S	*	*				-162	152.7	124.1	-87.8	144.1	0	0	0	108.4
485	T	22.9	Very low	24.6	Very low	113 Å²	113	141.5 Å²	141.5	69%	0.693	77%	0.774	S	S	*	*			trans	-87.8	154.5	-160.1	44.3	0	0	0	0	117
486	N	23.4	Very low	24.4	Very low	135 Å²	135	145.8 Å²	145.8	72%	0.722	78%	0.781	S	S	*	*			trans	70.9	114.9	147.5	-61.2	-8.1	0	0	0	121.2
487	D	26.8	Very low	24.6	Very low	157 Å²	157	149.1 Å²	149.1	84%	0.84	79%	0.794	S	S	*	*				-164.6	148.3	107.7	-90.6	-29.1	0	0	0	112.4
488	F	22.5	Very low	24.4	Very low	187 Å²	187	145.7 Å²	145.7	82%	0.82	79%	0.789	S	S	*	*			trans	-59.6	-174.3	-165	-83.3	-95.4	0	0	0	119.8
489	P	28	Very low	24.4	Very low	119 Å²	119	146.9 Å²	146.9	77%	0.773	79%	0.792	S	S	*	*			cis	-135.6	-179.8	-8.1	21.9	4.6	0	0	0	116.6
490	C	21.8	Very low	24.4	Very low	115 Å²	115	147 Å²	147	78%	0.777	79%	0.788	S	S	*	*			trans	-65.3	137.7	-179.6	-149.2	0	0	0	0	116.6
491	S	25.2	Very low	24.5	Very low	106 Å²	106	147.5 Å²	147.5	74%	0.741	79%	0.79	S	S	*	*			trans	-154.4	107.2	142.5	47.5	0	0	0	0	105.9
492	Y	25.5	Very low	24.5	Very low	220 Å²	220	142.1 Å²	142.1	86%	0.863	78%	0.78	S	S	*	*				-153.2	115.4	83.9	-103.2	-102.4	0	0	0	109.9
493	I	23.5	Very low	24.6	Very low	157 Å²	157	144.3 Å²	144.3	81%	0.805	79%	0.787	S	S	*	*			trans	-120.9	126.6	148.8	-68.8	176.8	0	0	0	106
494	S	26.9	Very low	24.5	Very low	106 Å²	106	140.1 Å²	140.1	74%	0.741	78%	0.783	S	S	*	*			trans	-161.4	124.3	151.5	170	0	0	0	0	105.6
495	S	25.9	Very low	24.6	Very low	96 Å²	96	137.8 Å²	137.8	67%	0.671	78%	0.779	S	S	*	*			cis	-170.8	142.8	-15.5	39.9	0	0	0	0	104.4
496	Y	20.9	Very low	24.9	Very low	231 Å²	231	137.8 Å²	137.8	91%	0.906	78%	0.783	S	S	*	*			trans	-74.1	130.5	163.3	-100.5	-99.1	0	0	0	108.3
497	Q	27.3	Very low	25.1	Very low	194 Å²	194	139.1 Å²	139.1	91%	0.907	79%	0.785	S	S	*	*			trans	-161.4	132.5	140	-109.4	171	3.5	0	0	111.9
498	S	21.5	Very low	24.8	Very low	96 Å²	96	141.8 Å²	141.8	67%	0.671	78%	0.784	S	S	*	*			trans	-73.2	151	-175.8	43.2	0	0	0	0	114.9
499	T	23.4	Very low	24.8	Very low	127 Å²	127	140.1 Å²	140.1	78%	0.779	78%	0.783	S	S	*	*				146.5	130.8	121.5	49.2	0	0	0	0	114.8
500	V	25.6	Very low	25	Very low	116 Å²	116	139.2 Å²	139.2	70%	0.703	78%	0.777	S	S	*	*			trans	82.7	114.6	134.1	175.7	0	0	0	0	120.2
501	N	23.8	Very low	25	Very low	159 Å²	159	138.5 Å²	138.5	85%	0.85	77%	0.774	S	S	*	*			trans	66.6	130.6	143.5	-65.5	-9.1	0	0	0	122
502	G	23	Very low	25.1	Very low	62 Å²	62	140.8 Å²	140.8	64%	0.639	78%	0.776	S	S	*	*			trans	134.8	110.2	131.3	0	0	0	0	0	115.4
503	N	27.1	Very low	25	Very low	165 Å²	165	136.4 Å²	136.4	88%	0.882	77%	0.768	S	S	*	*			trans	93	97.9	148.8	-51.5	-19.4	0	0	0	118.5
504	S	22.8	Very low	25.1	Very low	111 Å²	111	136.5 Å²	136.5	78%	0.776	77%	0.765	S	S	*	*				-68.7	177.3	127.9	-34.9	0	0	0	0	109
505	P	30	Very low	25	Very low	122 Å²	122	140 Å²	140	79%	0.792	77%	0.767	S	S	*	*			cis	-136.4	164.3	-9	38.9	-21	0	0	0	114.3
506	S	28.5	Very low	25.1	Very low	112 Å²	112	141.8 Å²	141.8	78%	0.783	77%	0.769	S	S	*	*			trans	-159.1	103.6	149.9	59.8	0	0	0	0	108.4
507	Q	26.6	Very low	25.1	Very low	164 Å²	164	135 Å²	135	77%	0.766	76%	0.756	S	S	*	*				78.7	111.8	80.7	-83.3	-156.9	-29.4	0	0	114.8
508	W	22.2	Very low	25.1	Very low	213 Å²	213	136.7 Å²	136.7	81%	0.807	76%	0.756	S	S	*	*			trans	87	101	140.1	-68.9	53	0	0	0	121
509	N	22.7	Very low	25	Very low	152 Å²	152	141 Å²	141	81%	0.813	77%	0.765	S	S	*	*				58	164	104.6	-101.4	6	0	0	0	121.6
510	P	31.6	Very low	25.3	Very low	100 Å²	100	141.6 Å²	141.6	65%	0.649	76%	0.762	S	S	*	*				-112.6	177.4	-123.9	42.3	-32.5	0	0	0	116.1
511	S	21.9	Very low	25.3	Very low	100 Å²	100	142.2 Å²	142.2	70%	0.699	76%	0.762	S	S	*	*			trans	80.7	111.3	157.4	-29.2	0	0	0	0	118
512	L	26.8	Very low	25.4	Very low	153 Å²	153	143.2 Å²	143.2	80%	0.801	76%	0.76	S	S	*	*				172.8	120.8	108.4	-112.2	101.9	0	0	0	111.4
513	D	23.5	Very low	25.3	Very low	129 Å²	129	145.3 Å²	145.3	69%	0.69	76%	0.761	S	S	*	*			trans	58.9	132	130	-72.5	-21.9	0	0	0	125.1
514	Q	25.6	Very low	25.4	Very low	158 Å²	158	143.1 Å²	143.1	74%	0.738	76%	0.759	S	S	*	*			trans	79.5	102.9	148.3	-70.3	171.2	6.9	0	0	118.5
515	F	25	Very low	25.5	Very low	180 Å²	180	148.9 Å²	148.9	79%	0.789	76%	0.764	S	S	*	*				178.9	142.8	97.9	-104	-84.5	0	0	0	112.1
516	N	26.7	Very low	25.3	Very low	133 Å²	133	149.7 Å²	149.7	71%	0.711	76%	0.761	S	S	*	*			trans	86.6	87.3	159	-60.7	-22	0	0	0	120.6
517	S	21.9	Very low	25.1	Very low	90 Å²	90	151 Å²	151	63%	0.629	75%	0.752	S	S	*	*				34.9	115.1	118.3	62.5	0	0	0	0	118.9
518	Y	26.3	Very low	25	Very low	229 Å²	229	151.9 Å²	151.9	90%	0.898	75%	0.75	S	S	*	*				-165.9	104.6	126.4	-93.1	-69.2	0	0	0	108.9
519	E	21.2	Very low	25.1	Very low	187 Å²	187	149.6 Å²	149.6	87%	0.874	75%	0.748	S	S	*	*			trans	-68.3	138.4	159.2	-76.4	172.8	141	0	0	109.3
520	I	28.8	Very low	25.1	Very low	139 Å²	139	153 Å²	153	71%	0.713	75%	0.749	S	S	*	*			trans	-127.7	95.1	153.9	-61.1	-179.5	0	0	0	106.9
521	D	25.6	Very low	24.5	Very low	129 Å²	129	154.7 Å²	154.7	69%	0.69	75%	0.753	S	S	*	*			trans	-79.2	123.4	163	-167.6	8	0	0	0	108.5	T523	D521-T523 PolarHBondContact O-N 2.94Å
522	H	25.5	Very low	24.7	Very low	179 Å²	179	158.7 Å²	158.7	83%	0.829	76%	0.76	S	S	*	*			trans	-100.1	68.7	178.1	-95.9	-56.2	0	0	0	110.2
523	T	21.7	Very low	24.5	Very low	107 Å²	107	158.8 Å²	158.8	66%	0.656	76%	0.762	S	S	*	*			trans	-118	102	157.9	54.6	0	0	0	0	110.1	D521	D521-T523 PolarHBondContact O-N 2.94Å
524	S	27.8	Very low	24.7	Very low	119 Å²	119	158.2 Å²	158.2	83%	0.832	77%	0.768	S	S	*	*			trans	-145.1	90.2	161.9	-74.5	0	0	0	0	109	L526	S524-L526 PolarHBondContact O-N 2.77Å
525	R	24.9	Very low	24.7	Very low	232 Å²	232	155.8 Å²	155.8	88%	0.875	77%	0.768	S	S	*	*			trans	-63.8	107.8	159	-83.7	175.3	164.8	-179	-6.2	107.9
526	L	26.5	Very low	24.7	Very low	139 Å²	139	158.1 Å²	158.1	73%	0.728	77%	0.774	S	S	*	*			trans	-93.7	96.4	157.6	-88.4	164.7	0	0	0	108.4	S524 Y528	S524-L526 PolarHBondContact O-N 2.77Å; L526-Y528 HydrophobicContact CB-CE2 4.48Å; L526-Y528 HydrophobicContact CD2-CE2 4.04Å
527	K	23.5	Very low	24.7	Very low	140 Å²	140	157.1 Å²	157.1	61%	0.609	77%	0.772	S	S	*	*			trans	-69.6	116.3	157.6	-82.1	-176.6	172.1	-172.9	0	107.5
528	Y	26.2	Very low	24.9	Very low	182 Å²	182	160.2 Å²	160.2	71%	0.714	78%	0.776	S	S	*	*			trans	-107.8	97.9	157.2	-85.7	-78.2	0	0	0	108	L526	L526-Y528 HydrophobicContact CB-CE2 4.48Å; L526-Y528 HydrophobicContact CD2-CE2 4.04Å
529	H	24.2	Very low	25.1	Very low	164 Å²	164	155.8 Å²	155.8	76%	0.759	76%	0.764	S	S	*	*			trans	-75.5	129.6	156	-86	-83.7	0	0	0	107.7
530	W	21.4	Very low	25.3	Very low	225 Å²	225	152.7 Å²	152.7	85%	0.852	75%	0.753	S	S	*	*			trans	-117.5	114.1	162.7	-88.9	68.4	0	0	0	107.1
531	N	20.5	Very low	25.4	Very low	134 Å²	134	154.2 Å²	154.2	72%	0.717	76%	0.757	S	S	*	*			trans	-168.6	113.2	156.6	-99.1	-2	0	0	0	106.2
532	E	25	Very low	25.8	Very low	184 Å²	184	156.1 Å²	156.1	86%	0.86	76%	0.762	S	S	*	*				165.4	145.8	113.5	-87.4	-175.9	-176.8	0	0	111.8
533	D	22.3	Very low	26	Very low	155 Å²	155	156.3 Å²	156.3	83%	0.829	76%	0.762	S	S	*	*			trans	-61.9	147.3	-179.7	-57.3	-65.6	0	0	0	113.2
534	S	28.6	Very low	26.8	Very low	118 Å²	118	158.8 Å²	158.8	83%	0.825	77%	0.77	S	S	*	*				-175.1	123.9	129.9	36	0	0	0	0	112.1
535	S	24	Very low	26.9	Very low	107 Å²	107	165.8 Å²	165.8	75%	0.748	79%	0.785	S	S	*	*			trans	-52.8	137.7	160	48.1	0	0	0	0	113
536	Y	27	Very low	27	Very low	229 Å²	229	162.5 Å²	162.5	90%	0.898	78%	0.781	S	S	*	*			trans	-160.9	138.2	130	-121.8	-87.9	0	0	0	111.8
537	T	26.1	Very low	27	Very low	111 Å²	111	163.7 Å²	163.7	68%	0.681	78%	0.784	S	S	*	*			trans	-86.4	160.5	-174.9	39.9	0	0	0	0	113.8
538	H	26.3	Very low	27.2	Very low	155 Å²	155	165 Å²	165	72%	0.718	79%	0.794	S	S	*	*			trans	100.1	115.7	140.9	-94.8	36.6	0	0	0	120.8
539	H	28.9	Very low	27.3	Very low	137 Å²	137	164 Å²	164	63%	0.634	80%	0.798	S	S	*	*				118.1	113.5	122.3	-91.7	24.5	0	0	0	119.6
540	N	26.2	Very low	27.5	Very low	122 Å²	122	164 Å²	164	65%	0.652	80%	0.801	S	S	*	*			trans	50.9	119.1	131	-66.9	-15.9	0	0	0	120.4
541	H	31.4	Very low	27.9	Very low	170 Å²	170	159.9 Å²	159.9	79%	0.787	80%	0.797	S	S	*	*				178.6	111.1	106.2	-105.4	-89.6	0	0	0	107.9
542	Q	34	Very low	28.4	Very low	169 Å²	169	161.8 Å²	161.8	79%	0.79	80%	0.803	S	S	*	*				42.3	110.5	93.1	-81.9	-164.6	-13	0	0	116.4
543	H	28.9	Very low	28.7	Very low	183 Å²	183	160.1 Å²	160.1	85%	0.847	80%	0.799	S	S	*	*			trans	32.3	119.2	138.9	-92.9	-77.3	0	0	0	120.8
544	I	38.2	Very low	29.2	Very low	159 Å²	159	160.5 Å²	160.5	82%	0.815	80%	0.796	S	S	*	*			trans	-150.5	123.6	151	-68.1	-171.1	0	0	0	102.2
545	K	31	Very low	29.3	Very low	266 Å²	266	164.4 Å²	164.4	100%	1.157	79%	0.793	S	S	*	*			cis	35.1	0	37.4	-127.8	-161.8	-169.4	-168.7	0	115.4

Retrieved 545 of 545 residues in 141.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).