A0A096N8G4_PAPAN Loading...

Ankyrin repeat domain-containing protein 13C

Acts as a molecular chaperone for G protein-coupled receptors, regulating their biogenesis and exit from the ER.

AlphaFold DB , UniProt , Accession A0A096N8G4, Species PAPAN (Papio anubis, Olive baboon), Gene ANKRD13C, Length 541 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.3	Very low	30.8	Very low	226 Å²	226	172.5 Å²	172.5	100%	1.113	85%	0.848	S	S	*	*				0	96.1	0	-77.1	156.2	64.1	0	0	106.7
2	T	29.5	Very low	30.8	Very low	144 Å²	144	169.3 Å²	169.3	88%	0.883	84%	0.838	S	S	*	*				86	106	88	49	0	0	0	0	112.1
3	G	29.1	Very low	30.7	Very low	84 Å²	84	171.2 Å²	171.2	87%	0.866	84%	0.842	S	S	*	*			trans	-174.9	63	-177.3	0	0	0	0	0	110.6
4	E	31.9	Very low	30.7	Very low	149 Å²	149	173.1 Å²	173.1	70%	0.696	84%	0.844	S	S	*	*			trans	-86.4	157.2	-175.3	-94.9	-160.3	113	0	0	114
5	K	32.8	Very low	30.9	Very low	159 Å²	159	168.5 Å²	168.5	69%	0.691	83%	0.832	S	S	*	*			trans	60.7	118.1	148.6	-69.1	157.6	179.5	143.6	0	119.3
6	I	33.9	Very low	30.8	Very low	165 Å²	165	165.1 Å²	165.1	85%	0.846	83%	0.83	S	S	*	*				-130.8	142.8	115.1	-64.9	-170.9	0	0	0	109.1
7	R	32.8	Very low	30.8	Very low	241 Å²	241	166.6 Å²	166.6	91%	0.909	83%	0.83	S	S	*	*			trans	-135.2	126	168.8	-91.6	-173.6	175.2	176.5	-1.1	109.7
8	S	30.6	Very low	30.7	Very low	102 Å²	102	168.4 Å²	168.4	71%	0.713	84%	0.835	S	S	*	*			trans	-174.7	114	156.3	50.8	0	0	0	0	108.9
9	L	29.7	Very low	30.6	Very low	168 Å²	168	169.5 Å²	169.5	88%	0.88	84%	0.838	S	S	*	*				86.4	93.8	63.6	-79	171.4	0	0	0	115
10	R	29.4	Very low	30.4	Very low	243 Å²	243	164.9 Å²	164.9	92%	0.917	84%	0.835	S	S	*	*			trans	-170.3	107.8	142.6	-100.7	158.9	-176.5	167.4	1.2	105.9
11	R	30	Very low	30.2	Very low	216 Å²	216	164.8 Å²	164.8	82%	0.815	84%	0.837	S	S	*	*				82.3	94.9	59.2	-168	-170.9	-80	179.3	-3.8	112.3
12	D	30.2	Very low	30.5	Very low	135 Å²	135	162 Å²	162	72%	0.722	83%	0.826	S	S	*	*			trans	47.6	115.2	140.9	-38.4	-29.2	0	0	0	120.1
13	H	29.4	Very low	30.3	Very low	193 Å²	193	163.2 Å²	163.2	89%	0.894	83%	0.826	S	S	*	*			trans	-145.9	137.5	131.2	-112.7	60.5	0	0	0	110.7
14	K	31.9	Very low	30.4	Very low	199 Å²	199	168.2 Å²	168.2	87%	0.865	83%	0.827	S	S	*	*			trans	-151.5	114.7	171.2	-172.8	-176.1	-174.5	179.6	0	110.9
15	P	33.6	Very low	30.3	Very low	104 Å²	104	167.3 Å²	167.3	68%	0.675	83%	0.834	S	S	*	*			trans	-122.9	171.7	132.8	28.3	-13.1	0	0	0	109.3
16	S	28.6	Very low	29.9	Very low	113 Å²	113	162.8 Å²	162.8	79%	0.79	83%	0.833	S	S	*	*			cis	-155.2	173.9	-25.6	-96.3	0	0	0	0	107
17	K	31.2	Very low	29.6	Very low	192 Å²	192	162.9 Å²	162.9	84%	0.835	84%	0.835	S	S	*	*			trans	-72.5	147.2	170.8	-73.3	-173.5	171.3	-165.2	0	111.1
18	E	28.6	Very low	29.3	Very low	198 Å²	198	161 Å²	161	93%	0.925	84%	0.837	S	S	*	*			trans	-150.4	156.2	135.3	-119.3	158.5	-144.2	0	0	108.9
19	E	29.7	Very low	29.2	Very low	190 Å²	190	164.4 Å²	164.4	89%	0.888	84%	0.841	S	S	*	*			trans	-98.1	148.2	-179.2	-71.1	164.4	123.8	0	0	109.7
20	G	26.9	Very low	29	Very low	76 Å²	76	161.1 Å²	161.1	78%	0.784	84%	0.838	S	S	*	*			trans	-162.9	135.1	179.5	0	0	0	0	0	111.5
21	D	26.4	Very low	28.7	Very low	163 Å²	163	154.7 Å²	154.7	87%	0.872	84%	0.837	S	S	*	*			trans	-68.6	162.5	-164.8	-71.9	-66.2	0	0	0	116.4	L23	D21-L23 PolarHBondContact O-N 3.46Å
22	L	33.6	Very low	28.3	Very low	169 Å²	169	149.2 Å²	149.2	89%	0.885	84%	0.838	S	S	*	*			trans	-57.3	121.8	162	-85.2	65.2	0	0	0	110.6
23	L	25.9	Very low	27.9	Very low	168 Å²	168	147.2 Å²	147.2	88%	0.88	84%	0.84	S	S	*	*			trans	-140.6	130.8	155	-73.2	178.7	0	0	0	109.5	D21	D21-L23 PolarHBondContact O-N 3.46Å
24	E	30.7	Very low	27.6	Very low	189 Å²	189	147 Å²	147	88%	0.883	85%	0.845	S	S	*	*			trans	-80.6	138.8	174.6	-62.9	-169.1	154	0	0	111.5	G26	E24-G26 PolarHBondContact O-N 2.62Å
25	P	30.4	Very low	27.2	Very low	130 Å²	130	141.2 Å²	141.2	84%	0.844	84%	0.842	S	S	*	*			trans	-84.6	105.3	162.9	32.1	-28.1	0	0	0	109.7
26	G	25.1	Very low	26.6	Very low	65 Å²	65	140 Å²	140	67%	0.67	85%	0.848	S	S	*	*			trans	-72.6	163.8	-177.5	0	0	0	0	0	115.4	E24 E28	E24-G26 PolarHBondContact O-N 2.62Å; G26-E28 PolarHBondContact O-N 3.09Å; G26-E28 VanDerWaalsContact O-N 3.17Å
27	D	27.8	Very low	26.3	Very low	167 Å²	167	141.2 Å²	141.2	89%	0.893	85%	0.851	S	S	*	*			trans	-68.7	100.9	179.2	-78.7	-41.5	0	0	0	113
28	E	25.8	Very low	26	Very low	201 Å²	201	142 Å²	142	94%	0.939	86%	0.855	S	S	*	*			trans	-98.7	91.2	158.7	-77.4	-156.8	134.7	0	0	111.5	G26	G26-E28 PolarHBondContact O-N 3.09Å; G26-E28 VanDerWaalsContact O-N 3.17Å
29	E	28.6	Very low	25.8	Very low	174 Å²	174	138.8 Å²	138.8	81%	0.813	85%	0.849	S	S	*	*			trans	-101.6	115	160.8	-165	178.7	178	0	0	109.1	A31	E29-A31 PolarHBondContact O-N 3.01Å; E29-A31 VanDerWaalsContact O-N 3.09Å
30	A	24.9	Very low	25.5	Very low	98 Å²	98	141.4 Å²	141.4	81%	0.81	85%	0.851	S	S	*	*			trans	-67.7	106.5	-159.1	0	0	0	0	0	115.1	A32	A30-A32 PolarHBondContact O-N 2.62Å
31	A	23.2	Very low	25.3	Very low	108 Å²	108	142.6 Å²	142.6	89%	0.893	85%	0.847	S	S	*	*			trans	-79.2	93.3	169.9	0	0	0	0	0	111.6	E29	E29-A31 PolarHBondContact O-N 3.01Å; E29-A31 VanDerWaalsContact O-N 3.09Å
32	A	22.9	Very low	25.4	Very low	101 Å²	101	145.3 Å²	145.3	84%	0.835	85%	0.845	S	S	*	*			trans	-112.2	94.7	179.3	0	0	0	0	0	112.6	A30	A30-A32 PolarHBondContact O-N 2.62Å
33	A	20.5	Very low	25.1	Very low	94 Å²	94	144.1 Å²	144.1	78%	0.777	84%	0.838	S	S	*	*			trans	-148.4	102.3	169.6	0	0	0	0	0	112.4
34	L	24.2	Very low	25	Very low	188 Å²	188	139.2 Å²	139.2	98%	0.984	83%	0.828	S	S	*	*			trans	-171.4	156.6	140.8	-102.6	165.6	0	0	0	109.3
35	G	21.6	Very low	24.9	Very low	78 Å²	78	140.2 Å²	140.2	80%	0.804	83%	0.829	S	S	*	*			trans	-104.6	162.4	-170	0	0	0	0	0	114.6
36	G	21.3	Very low	24.6	Very low	79 Å²	79	138 Å²	138	81%	0.814	83%	0.83	S	S	*	*			trans	-146.8	119	170.9	0	0	0	0	0	111.2
37	T	23.6	Very low	24.6	Very low	137 Å²	137	138.6 Å²	138.6	84%	0.84	84%	0.836	S	S	*	*			trans	-81	124.7	175.9	48.9	0	0	0	0	111
38	F	24.2	Very low	24.7	Very low	209 Å²	209	141.2 Å²	141.2	92%	0.917	84%	0.84	S	S	*	*			trans	-140.8	142.9	157.4	-107	-78.9	0	0	0	112.1
39	T	24.6	Very low	24.7	Very low	131 Å²	131	136 Å²	136	80%	0.804	83%	0.826	S	S	*	*			trans	-96.6	145.4	177.2	54.7	0	0	0	0	110.2
40	R	24	Very low	24.7	Very low	244 Å²	244	133.4 Å²	133.4	92%	0.921	83%	0.825	S	S	*	*				-174.8	123.4	129.8	-163	161.1	-173.3	168.5	1.5	113.9
41	S	22.5	Very low	24.8	Very low	102 Å²	102	136.1 Å²	136.1	71%	0.713	82%	0.821	S	S	*	*			trans	-41.5	144.4	165.8	174.2	0	0	0	0	117
42	R	27.3	Very low	25	Very low	220 Å²	220	139.5 Å²	139.5	83%	0.83	82%	0.815	S	S	*	*				-169.1	136.4	111.8	-101.5	177.1	173.3	-177.6	-2.4	115.2
43	I	27.1	Very low	25.1	Very low	144 Å²	144	143 Å²	143	74%	0.738	82%	0.818	S	S	*	*			trans	34.2	129.2	136.6	-50.5	162	0	0	0	117.8
44	G	25.5	Very low	25.3	Very low	64 Å²	64	146 Å²	146	66%	0.66	81%	0.814	S	S	*	*			cis	133.9	151.2	1.4	0	0	0	0	0	113
45	K	27.2	Very low	25.4	Very low	210 Å²	210	142.8 Å²	142.8	91%	0.913	81%	0.807	S	S	*	*			trans	162.3	136.1	133.7	-92.9	-179.3	-178.3	-177.9	0	112.6
46	G	25.4	Very low	25.5	Very low	83 Å²	83	145.5 Å²	145.5	86%	0.856	80%	0.804	S	S	*	*			trans	71.4	128.9	154.4	0	0	0	0	0	117.5
47	G	24.5	Very low	25.8	Very low	78 Å²	78	150.8 Å²	150.8	80%	0.804	81%	0.807	S	S	*	*			cis	118.3	112	-7.9	0	0	0	0	0	114.2
48	K	30.8	Very low	25.9	Very low	222 Å²	222	152.2 Å²	152.2	97%	0.965	80%	0.803	S	S	*	*			trans	-156.4	143.7	156.5	-108.2	167.9	-175.6	177.7	0	108.9
49	S	25.4	Very low	26.1	Very low	93 Å²	93	151.6 Å²	151.6	65%	0.65	80%	0.803	S	S	*	*			trans	-139.4	136.4	-176	146.7	0	0	0	0	110
50	C	28.4	Very low	26.1	Very low	119 Å²	119	154.9 Å²	154.9	80%	0.804	80%	0.801	S	S	*	*			trans	-145.6	113.8	147.8	-85.6	0	0	0	0	105.6
51	H	26	Very low	26.2	Very low	155 Å²	155	151.9 Å²	151.9	72%	0.718	80%	0.802	S	S	*	*				65	97.3	86.5	-68.2	23.5	0	0	0	111.3
52	K	27.2	Very low	26.3	Very low	178 Å²	178	154.4 Å²	154.4	77%	0.774	80%	0.802	S	S	*	*				64.4	121.2	75.6	-77.6	-170.1	171.1	-177.8	0	113.7
53	I	26.2	Very low	26.3	Very low	174 Å²	174	152.2 Å²	152.2	89%	0.892	81%	0.806	S	S	*	*			trans	-148.7	151.5	135	-102.1	153.6	0	0	0	107.8
54	F	24.2	Very low	26.2	Very low	157 Å²	157	154.1 Å²	154.1	69%	0.689	81%	0.809	S	S	*	*			trans	-96.3	156.7	-178.5	-86	-109.8	0	0	0	111.4
55	S	26.8	Very low	26.3	Very low	121 Å²	121	156 Å²	156	85%	0.846	82%	0.818	S	S	*	*				-169.9	146.2	112.6	-80.5	0	0	0	0	112.9
56	N	23.8	Very low	26.2	Very low	136 Å²	136	150.2 Å²	150.2	73%	0.727	81%	0.81	S	S	*	*			trans	-84.4	164.7	168.4	-56.8	-42.5	0	0	0	109.6
57	H	26.7	Very low	26.8	Very low	189 Å²	189	152.6 Å²	152.6	88%	0.875	81%	0.81	S	S	*	*				-162	143	113	-115.4	-83.2	0	0	0	112.3
58	H	25.9	Very low	26.9	Very low	167 Å²	167	153.7 Å²	153.7	77%	0.773	81%	0.806	S	S	*	*			trans	-75.1	149.8	168.5	-70	-89.1	0	0	0	110.7
59	H	28.3	Very low	26.8	Very low	197 Å²	197	147.9 Å²	147.9	91%	0.912	79%	0.793	S	S	*	*			trans	-134.6	155.3	134	-110.7	-86.5	0	0	0	111
60	R	24.7	Very low	26.8	Very low	200 Å²	200	149.6 Å²	149.6	76%	0.755	81%	0.805	S	S	*	*			trans	-138.9	120.5	-161.8	177.5	-167.3	-169.8	-173.3	6	109.3
61	L	26.4	Very low	26.7	Very low	180 Å²	180	151.2 Å²	151.2	94%	0.942	81%	0.806	S	S	*	*			trans	-132.2	140.9	165.6	-80	173.1	0	0	0	109.7
62	Q	24.3	Very low	28.1	Very low	155 Å²	155	149 Å²	149	72%	0.724	81%	0.805	S	S	*	*			trans	-119.8	144.1	176.1	-65.1	176.9	-43	0	0	108.3
63	L	27	Very low	29	Very low	174 Å²	174	146.4 Å²	146.4	91%	0.911	81%	0.806	S	S	*	*			trans	-171.8	153.4	156	-100.1	152.7	0	0	0	108.7
64	K	25.6	Very low	29	Very low	184 Å²	184	142 Å²	142	80%	0.8	81%	0.805	S	S	*	*				-164	115.6	-70.3	172	-176	176.9	-174.4	0	109
65	A	26.5	Very low	29.2	Very low	103 Å²	103	139.3 Å²	139.3	85%	0.851	81%	0.811	S	S	*	*			trans	63.9	151.3	163.3	0	0	0	0	0	120
66	A	25.1	Very low	30	Very low	90 Å²	90	139.8 Å²	139.8	74%	0.744	81%	0.811	S	S	*	*			trans	-99.2	-176.7	163.5	0	0	0	0	0	110.2
67	P	37.9	Very low	30.1	Very low	132 Å²	132	137.9 Å²	137.9	86%	0.857	81%	0.814	S	S	*	*				-145.2	-146	89.1	40.3	-22.1	0	0	0	113.9
68	S	27.9	Very low	30.2	Very low	101 Å²	101	136.8 Å²	136.8	71%	0.706	81%	0.814	S	S	*	*			trans	-131.1	170.3	-148.8	60.5	0	0	0	0	117.3
69	S	27.4	Very low	30.7	Very low	101 Å²	101	134.5 Å²	134.5	71%	0.706	81%	0.814	S	S	*	*			trans	65.4	125.5	142.1	58.9	0	0	0	0	122.2
70	S	26.6	Very low	30.5	Very low	128 Å²	128	132.8 Å²	132.8	90%	0.895	81%	0.81	S	S	*	*				175.6	169.3	122	44.1	0	0	0	0	113
71	N	26.3	Very low	30.7	Very low	153 Å²	153	132.4 Å²	132.4	82%	0.818	82%	0.817	S	S	*	*			trans	-162.3	170.3	-171.7	-144.8	12.7	0	0	0	108.9
72	P	54.9	Low	30.8	Very low	109 Å²	109	130.1 Å²	130.1	71%	0.708	81%	0.806	S	S	*	*			cis	-103.2	-94	-30.2	29.8	-9.2	0	0	0	109.3
73	P	46.5	Very low	30.9	Very low	123 Å²	123	127.9 Å²	127.9	80%	0.799	81%	0.807	S	S	*	*			cis	-122.7	176.6	-26.5	41.8	-27.3	0	0	0	115.1
74	G	26.8	Very low	30.8	Very low	83 Å²	83	123.9 Å²	123.9	86%	0.856	79%	0.794	S	S	*	*			trans	141.5	132.1	154.6	0	0	0	0	0	118.3
75	A	28.4	Very low	31	Very low	99 Å²	99	121.7 Å²	121.7	82%	0.818	80%	0.796	S	S	*	*			trans	-150.9	152.1	172	0	0	0	0	0	111.2
76	P	42.3	Very low	31.1	Very low	132 Å²	132	122.6 Å²	122.6	86%	0.857	79%	0.791	S	S	*	*				-149	174.1	125.5	37.5	-21.4	0	0	0	112
77	A	26.8	Very low	31.2	Very low	96 Å²	96	122.4 Å²	122.4	79%	0.793	79%	0.789	S	S	*	*			cis	-177.1	-176.8	-15.7	0	0	0	0	0	106.8
78	L	28.8	Very low	30.7	Very low	166 Å²	166	121.9 Å²	121.9	87%	0.869	78%	0.783	S	S	*	*			trans	-95.1	173.3	-173	-61	160.8	0	0	0	113.9
79	P	35.9	Very low	30.6	Very low	118 Å²	118	121.4 Å²	121.4	77%	0.766	78%	0.78	S	S	*	*				-151.6	142.1	91	38.4	-19.6	0	0	0	119.1
80	L	25.1	Very low	30.7	Very low	161 Å²	161	125.5 Å²	125.5	84%	0.843	79%	0.788	S	S	*	*			trans	40.3	124.4	132.9	-56.9	169.6	0	0	0	123.2
81	H	28.5	Very low	30.9	Very low	192 Å²	192	124.4 Å²	124.4	89%	0.889	78%	0.781	S	S	*	*				-152.1	174.6	110.3	-147.5	-97.2	0	0	0	112.7
82	N	27.2	Very low	31.5	Very low	132 Å²	132	123.4 Å²	123.4	71%	0.706	78%	0.782	S	S	*	*			trans	-122.2	155.2	-158.4	-165.9	14	0	0	0	114.5
83	S	26.6	Very low	30.2	Very low	109 Å²	109	123.1 Å²	123.1	76%	0.762	79%	0.789	S	S	*	*			trans	147.4	136.4	159.1	-82.1	0	0	0	0	111.3
84	S	26.5	Very low	29.3	Very low	89 Å²	89	125.4 Å²	125.4	62%	0.622	79%	0.794	S	S	*	*			cis	164.5	112.6	-31.7	48.8	0	0	0	0	107.9
85	V	29.3	Very low	29.3	Very low	139 Å²	139	130 Å²	130	84%	0.842	80%	0.798	S	S	*	*			trans	56.1	149.6	165.6	-72.6	0	0	0	0	119.7
86	T	28.9	Very low	29.2	Very low	122 Å²	122	130 Å²	130	75%	0.748	80%	0.798	S	S	*	*			cis	-148.6	150.4	8.4	-12.3	0	0	0	0	112.3
87	A	26.8	Very low	28.5	Very low	85 Å²	85	127.2 Å²	127.2	70%	0.702	79%	0.793	S	S	*	*			trans	29	138	136.9	0	0	0	0	0	121.1
88	T	26.2	Very low	28.5	Very low	121 Å²	121	129.7 Å²	129.7	74%	0.742	80%	0.798	S	S	*	*			cis	-144.1	169.3	5.2	54.2	0	0	0	0	109.8
89	S	26.6	Very low	28.6	Very low	92 Å²	92	129.2 Å²	129.2	64%	0.643	80%	0.797	S	S	*	*			cis	85.2	131.7	11.7	81.9	0	0	0	0	117.9
90	Q	28.8	Very low	29.2	Very low	186 Å²	186	129 Å²	129	87%	0.869	80%	0.795	S	S	*	*			cis	-163.5	156.9	-6.7	-127.5	168.4	8.7	0	0	111.5
91	S	31.7	Very low	29.5	Very low	106 Å²	106	127.2 Å²	127.2	74%	0.741	79%	0.791	S	S	*	*			trans	-106.8	158.6	151.9	54.3	0	0	0	0	109.6
92	P	39.6	Very low	29.9	Very low	131 Å²	131	122.7 Å²	122.7	85%	0.851	79%	0.787	S	S	*	*			trans	-128	164.9	161.5	36.8	-24.4	0	0	0	113.5
93	A	27.9	Very low	30.2	Very low	103 Å²	103	122.8 Å²	122.8	85%	0.851	79%	0.792	S	S	*	*			trans	-116.4	-176.5	-176.5	0	0	0	0	0	112.9
94	L	26.9	Very low	30.6	Very low	172 Å²	172	124 Å²	124	90%	0.901	80%	0.795	S	S	*	*			trans	-57	148.7	-179.2	-68.8	148.7	0	0	0	114.7
95	L	26.1	Very low	31	Very low	180 Å²	180	124.4 Å²	124.4	94%	0.942	80%	0.803	S	S	*	*			trans	-147.8	162.6	140.7	-108.7	173.3	0	0	0	109.4
96	A	27.7	Very low	31.1	Very low	99 Å²	99	125.2 Å²	125.2	82%	0.818	80%	0.803	S	S	*	*			trans	-121	146.7	-158	0	0	0	0	0	115.6
97	G	26.6	Very low	31.7	Very low	73 Å²	73	124.3 Å²	124.3	75%	0.753	81%	0.808	S	S	*	*			trans	94.5	90.7	133.2	0	0	0	0	0	119.3
98	T	26.5	Very low	32.4	Very low	147 Å²	147	123.3 Å²	123.3	90%	0.902	81%	0.806	S	S	*	*			trans	-143.2	153	143	45.4	0	0	0	0	111.6
99	N	31.3	Very low	33.1	Very low	156 Å²	156	123.2 Å²	123.2	83%	0.834	81%	0.81	S	S	*	*			trans	-151.5	158	165.7	-124.5	-13.5	0	0	0	104.8
100	P	48.7	Very low	33.8	Very low	114 Å²	114	123.8 Å²	123.8	74%	0.74	81%	0.813	S	S	*	*			cis	-127.9	175.3	10.6	42.7	-28.9	0	0	0	114.6
101	V	30.2	Very low	34.9	Very low	123 Å²	123	120 Å²	120	75%	0.745	81%	0.805	S	S	*	*				-156.5	141.1	127.7	146.2	0	0	0	0	107	V103	V101-V103 PolarHBondContact O-N 2.82Å
102	A	38.4	Very low	36.4	Very low	98 Å²	98	117.7 Å²	117.7	81%	0.81	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-79.2	116.1	172.5	0	0	0	0	0	110.2
103	V	33.8	Very low	38.5	Very low	133 Å²	133	118.3 Å²	118.3	81%	0.806	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-89.8	130.2	164.8	-179.6	0	0	0	0	107.8	V101 A105	V101-V103 PolarHBondContact O-N 2.82Å; V103-A105 PolarHBondContact O-N 2.74Å
104	V	33.7	Very low	41.6	Very low	136 Å²	136	115 Å²	115	82%	0.824	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-65.4	121.9	176.7	-177.3	0	0	0	0	108.5	D106	V104-D106 PolarHBondContact O-N 3.46Å
105	A	35.3	Very low	44.8	Very low	97 Å²	97	107.4 Å²	107.4	80%	0.802	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-72.7	119.5	177.3	0	0	0	0	0	110	V103	V103-A105 PolarHBondContact O-N 2.74Å
106	D	31	Very low	48.2	Very low	155 Å²	155	98.9 Å²	98.9	83%	0.829	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-70.3	151	176.2	-168.1	16.2	0	0	0	111.5	V104 G108	V104-D106 PolarHBondContact O-N 3.46Å; D106-G108 PolarHBondContact O-N 3.04Å
107	A	42.1	Very low	51.5	Low	104 Å²	104	94.2 Å²	94.2	86%	0.86	63%	0.626	S	S	*	*	S	Bend	trans	-83.5	72.6	-169.1	0	0	0	0	0	112.1
108	G	41.7	Very low	54.8	Low	64 Å²	64	92.1 Å²	92.1	66%	0.66	60%	0.597	S	S	*	*			trans	-163.4	31.9	-173.3	0	0	0	0	0	117.2	D106 C110	D106-G108 PolarHBondContact O-N 3.04Å; G108-C110 PolarHBondContact O-N 3.18Å
109	S	40.8	Very low	58.1	Low	118 Å²	118	85.1 Å²	85.1	83%	0.825	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-66.6	119.1	176.4	-168.7	0	0	0	0	111.3
110	C	41.2	Very low	61.2	Low	105 Å²	105	77.7 Å²	77.7	71%	0.709	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-56.4	143.2	157.2	-57.7	0	0	0	0	109.1	G108 A112	G108-C110 PolarHBondContact O-N 3.18Å; C110-A112 PolarHBondContact O-N 3.1Å
111	P	51.7	Low	63.4	Low	107 Å²	107	73.1 Å²	73.1	70%	0.695	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-57.2	136.1	170.4	-23.8	34.1	0	0	0	110.3	H113	P111-H113 PolarHBondContact O-N 3.2Å; P111-H113 VanDerWaalsContact O-N 3.16Å
112	A	62.7	Low	66.5	Low	57 Å²	57	72 Å²	72	47%	0.471	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-60.6	121.2	173	0	0	0	0	0	108.7	C110 Y114	C110-A112 PolarHBondContact O-N 3.1Å; A112-Y114 HydrophobicContact CB-CD2 4.41Å; A112-Y114 HydrophobicContact CB-CE2 3.58Å; A112-Y114 WeakPolarHBondContact O-CD2 3.39Å; A112-Y114 WeakPolarHBondContact O-CE2 3.44Å; A112-Y114 PolarHBondContact O-N 3.15Å
113	H	84.5	Confident	69.2	Low	143 Å²	143	69 Å²	69	66%	0.662	45%	0.446	S	S	*	.			trans	-84	113.5	-172.2	-174.5	-107.9	0	0	0	110.3	P111 P115	P111-H113 PolarHBondContact O-N 3.2Å; P111-H113 VanDerWaalsContact O-N 3.16Å; H113-P115 VanDerWaalsContact C-CD 3.48Å; H113-P115 WeakPolarHBondContact O-CD 3.43Å
114	Y	93.6	Very high	72.2	Confident	33 Å²	33	65.4 Å²	65.4	13%	0.129	42%	0.422	C	S	.	.			trans	-109.8	75.6	-177.7	-60.1	-78.8	0	0	0	111.2	A112 V116 H117 E118 Q139 K140 D141 I426	A112-Y114 HydrophobicContact CB-CD2 4.41Å; A112-Y114 HydrophobicContact CB-CE2 3.58Å; A112-Y114 WeakPolarHBondContact O-CD2 3.39Å; A112-Y114 WeakPolarHBondContact O-CE2 3.44Å; A112-Y114 PolarHBondContact O-N 3.15Å; Y114-V116 VanDerWaalsContact C-N 3.32Å; Y114-V116 PolarHBondContact O-N 3.46Å; Y114-H117 PolarHBondContact O-N 2.83Å; Y114-E118 PolarHBondContact O-N 3.25Å; Y114-Q139 HydrophobicContact CD1-CG 4.34Å; Y114-Q139 HydrophobicContact CE1-CG 4.33Å; Y114-K140 WeakPolarHBondContact CE1-O 3.49Å; Y114-D141 HydrophobicContact CD1-CB 4.42Å; Y114-D141 HydrophobicContact CD2-CB 4.27Å; Y114-D141 HydrophobicContact CE1-CB 4.38Å; Y114-D141 HydrophobicContact CE2-CB 4.22Å; Y114-D141 HydrophobicContact CG-CB 4.37Å; Y114-I426 HydrophobicContact CD2-CD1 3.56Å; Y114-I426 HydrophobicContact CD2-CG1 4.23Å; Y114-I426 HydrophobicContact CE2-CD1 3.9Å
115	P	94.4	Very high	75.2	Confident	13 Å²	13	61.5 Å²	61.5	8%	0.084	40%	0.399	C	S	.	.	H	α-helix	trans	-67.3	-30.3	-169.9	27.7	-36.1	0	0	0	113.2	H113 C119 L131	H113-P115 VanDerWaalsContact C-CD 3.48Å; H113-P115 WeakPolarHBondContact O-CD 3.43Å; P115-C119 PolarHBondContact O-N 3.07Å; P115-C119 VanDerWaalsContact O-N 3.13Å; P115-C119 PolarHBondContact O-SG 2.96Å; P115-L131 HydrophobicContact CB-CD1 4Å
116	V	96.4	Very high	78.1	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.012	40%	0.4	C	S	.	.	H	α-helix	trans	-69.5	-46	177.3	-171	0	0	0	0	110.4	Y114 C119 V120 L128 L131 H135 P147	Y114-V116 VanDerWaalsContact C-N 3.32Å; Y114-V116 PolarHBondContact O-N 3.46Å; V116-C119 PolarHBondContact O-N 2.97Å; V116-V120 WeakPolarHBondContact O-CG2 3.12Å; V116-V120 PolarHBondContact O-N 2.91Å; V116-L128 HydrophobicContact CG1-CD1 3.65Å; V116-L131 HydrophobicContact CG2-CB 4.33Å; V116-H135 HydrophobicContact CG2-CB 3.41Å; V116-H135 VanDerWaalsContact CG2-CB 3.41Å; V116-P147 HydrophobicContact CB-CG 4.06Å; V116-P147 HydrophobicContact CG1-CB 3.9Å; V116-P147 HydrophobicContact CG1-CG 3.63Å
117	H	96.5	Very high	81.2	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-59.5	-46.2	174.8	-63.3	68.5	0	0	0	111.7	Y114 C119 V120 F121 Q139 D141 N145 L150 W422	Y114-H117 PolarHBondContact O-N 2.83Å; H117-C119 VanDerWaalsContact C-N 3.34Å; H117-C119 PolarHBondContact O-N 3.29Å; H117-V120 PolarHBondContact O-N 2.85Å; H117-F121 WeakPolarHBondContact O-CB 3.37Å; H117-F121 PolarHBondContact O-N 3.05Å; H117-Q139 PolarHBondContact CE1-O 2.97Å; H117-Q139 PolarHBondContact NE2-O 3.1Å; H117-D141 IonicContact CD2-OD2 2.79Å; H117-D141 PolarHBondContact NE2-N 3.43Å; H117-N145 PolarHBondContact NE2-O 3.01Å; H117-L150 HydrophobicContact CB-CD1 3.68Å; H117-W422 HydrophobicContact CB-CH2 3.46Å; H117-W422 VanDerWaalsContact CB-CH2 3.46Å; H117-W422 HydrophobicContact CB-CZ2 4.45Å; H117-W422 HydrophobicContact CB-CZ3 3.79Å
118	E	95.7	Very high	83.8	Confident	29 Å²	29	59.2 Å²	59.2	14%	0.136	34%	0.335	C	S	.	.	H	α-helix	trans	-56.7	-46.6	176	-174.4	-161.8	-172.6	0	0	111.7	Y114 V120 F121 K122 R127 W422	Y114-E118 PolarHBondContact O-N 3.25Å; E118-V120 PolarHBondContact O-N 2.86Å; E118-F121 PolarHBondContact O-N 2.93Å; E118-K122 HydrophobicContact CG-CD 3.88Å; E118-K122 HydrophobicContact CG-CG 4.46Å; E118-K122 WeakPolarHBondContact O-CB 3.49Å; E118-K122 WeakPolarHBondContact O-CG 3.29Å; E118-K122 PolarHBondContact O-N 3Å; E118-K122 WeakPolarHBondContact OE1-CE 3.41Å; E118-K122 IonicContact OE1-NZ 2.72Å; E118-K122 PolarHBondContact OE1-NZ 3.26Å; E118-R127 VanDerWaalsContact CD-NH1 3.33Å; E118-R127 IonicContact OE1-NH1 3.2Å; E118-R127 IonicContact OE2-CZ 3.07Å; E118-R127 IonicContact OE2-NH1 3.96Å; E118-R127 PolarHBondContact OE2-NH1 2.87Å; E118-R127 IonicContact OE2-NH2 2.77Å; E118-R127 PolarHBondContact OE2-NH2 2.85Å; E118-W422 HydrophobicContact CB-CD2 4.02Å; E118-W422 HydrophobicContact CB-CG 4.36Å; E118-W422 HydrophobicContact CB-CZ2 4.03Å; E118-W422 HydrophobicContact CG-CD2 4.09Å; E118-W422 HydrophobicContact CG-CG 3.89Å
119	C	95.6	Very high	86.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.4	-43.8	179.6	-65	0	0	0	0	111.8	P115 V116 H117 F121 K122 G123 D124 R127 L128 L131	P115-C119 PolarHBondContact O-N 3.07Å; P115-C119 VanDerWaalsContact O-N 3.13Å; P115-C119 PolarHBondContact O-SG 2.96Å; V116-C119 PolarHBondContact O-N 2.97Å; H117-C119 VanDerWaalsContact C-N 3.34Å; H117-C119 PolarHBondContact O-N 3.29Å; C119-F121 VanDerWaalsContact C-N 3.34Å; C119-K122 PolarHBondContact O-N 2.84Å; C119-G123 CarbonylContact O-C 3.51Å; C119-G123 PolarHBondContact O-N 2.69Å; C119-D124 HydrophobicContact CB-CB 4.47Å; C119-D124 PolarHBondContact O-N 3.06Å; C119-R127 WeakPolarHBondContact SG-CD 3.43Å; C119-R127 WeakPolarHBondContact SG-CG 3.19Å; C119-R127 PolarHBondContact SG-NE 2.78Å; C119-R127 VanDerWaalsContact SG-NE 3.38Å; C119-L128 HydrophobicContact CB-CB 4.19Å; C119-L131 WeakPolarHBondContact SG-CD1 3.45Å
120	V	97.1	Very high	89	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-62.6	-43.3	175.6	172.1	0	0	0	0	111.1	V116 H117 E118 G123 L128 P147 L150 A151 N156 C159 L163	V116-V120 WeakPolarHBondContact O-CG2 3.12Å; V116-V120 PolarHBondContact O-N 2.91Å; H117-V120 PolarHBondContact O-N 2.85Å; E118-V120 PolarHBondContact O-N 2.86Å; V120-G123 PolarHBondContact O-N 3.12Å; V120-L128 HydrophobicContact CG2-CD1 4.07Å; V120-L128 HydrophobicContact CG2-CD2 3.91Å; V120-P147 WeakPolarHBondContact CG1-O 3.33Å; V120-P147 HydrophobicContact CG2-CB 3.93Å; V120-L150 HydrophobicContact CG1-CB 3.91Å; V120-A151 VanDerWaalsContact CG1-CA 3.49Å; V120-A151 HydrophobicContact CG1-CB 3.58Å; V120-A151 VanDerWaalsContact CG1-N 3.34Å; V120-N156 PolarHBondContact O-ND2 3Å; V120-C159 HydrophobicContact CG1-CB 4.21Å; V120-C159 HydrophobicContact CG2-CB 4.25Å; V120-L163 HydrophobicContact CG2-CD1 3.97Å
121	F	95.5	Very high	91.6	Very high	19 Å²	19	52.8 Å²	52.8	8%	0.083	28%	0.279	C	S	.	.	H	α-helix	trans	-62.4	-44.8	-179.7	-164.9	-74.2	0	0	0	111.3	H117 E118 C119 G123 L154 I420 W422 Y425 L436	H117-F121 WeakPolarHBondContact O-CB 3.37Å; H117-F121 PolarHBondContact O-N 3.05Å; E118-F121 PolarHBondContact O-N 2.93Å; C119-F121 VanDerWaalsContact C-N 3.34Å; F121-G123 VanDerWaalsContact C-N 3.28Å; F121-G123 PolarHBondContact O-N 3.29Å; F121-L154 HydrophobicContact CB-CD1 4.25Å; F121-L154 HydrophobicContact CD2-CD1 3.89Å; F121-L154 HydrophobicContact CE2-CD1 4.39Å; F121-L154 HydrophobicContact CG-CD1 3.97Å; F121-I420 VanDerWaalsContact CE1-O 3.23Å; F121-I420 WeakPolarHBondContact CE1-O 3.43Å; F121-I420 HydrophobicContact CZ-CG2 4.47Å; F121-I420 VanDerWaalsContact CZ-O 3.29Å; F121-I420 WeakPolarHBondContact CZ-O 3.46Å; F121-W422 HydrophobicContact CB-CE3 3.74Å; F121-W422 HydrophobicContact CB-CZ3 4.33Å; F121-W422 HydrophobicContact CD1-CB 3.9Å; F121-W422 HydrophobicContact CD1-CE3 4.47Å; F121-W422 AromaticContact CD2-CE3 3.76Å; F121-W422 HydrophobicContact CD2-CE3 3.76Å; F121-W422 HydrophobicContact CD2-CZ3 4.29Å; F121-W422 HydrophobicContact CE1-CB 4.22Å; F121-W422 HydrophobicContact CE2-CE3 4.48Å; F121-W422 HydrophobicContact CG-CB 4.32Å; F121-W422 AromaticContact CG-CE3 3.75Å; F121-W422 HydrophobicContact CG-CE3 3.75Å; F121-Y425 HydrophobicContact CD2-CD1 4.36Å; F121-Y425 HydrophobicContact CD2-CG 4.29Å; F121-Y425 HydrophobicContact CE2-CD1 4.15Å; F121-Y425 AromaticContact CE2-CD2 3.97Å; F121-Y425 HydrophobicContact CE2-CD2 3.97Å; F121-Y425 AromaticContact CE2-CG 3.64Å; F121-Y425 HydrophobicContact CE2-CG 3.64Å; F121-Y425 HydrophobicContact CZ-CG 4.41Å; F121-L436 HydrophobicContact CD2-CD1 4.45Å; F121-L436 HydrophobicContact CE2-CD1 3.91Å; F121-L436 HydrophobicContact CE2-CD2 3.78Å; F121-L436 HydrophobicContact CZ-CD2 3.98Å
122	K	94.4	Very high	93.6	Very high	100 Å²	100	48.3 Å²	48.3	44%	0.435	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	5.9	179.3	-61.1	-179.2	-176.4	176.8	0	113.7	E118 C119 D124 W422 E423	E118-K122 HydrophobicContact CG-CD 3.88Å; E118-K122 HydrophobicContact CG-CG 4.46Å; E118-K122 WeakPolarHBondContact O-CB 3.49Å; E118-K122 WeakPolarHBondContact O-CG 3.29Å; E118-K122 PolarHBondContact O-N 3Å; E118-K122 WeakPolarHBondContact OE1-CE 3.41Å; E118-K122 IonicContact OE1-NZ 2.72Å; E118-K122 PolarHBondContact OE1-NZ 3.26Å; C119-K122 PolarHBondContact O-N 2.84Å; K122-D124 VanDerWaalsContact C-N 3.26Å; K122-D124 PolarHBondContact O-N 2.74Å; K122-W422 VanDerWaalsContact CE-CB 3.41Å; K122-E423 IonicContact NZ-OE1 2.68Å; K122-E423 PolarHBondContact NZ-OE1 3.19Å; K122-E423 IonicContact NZ-OE2 3.63Å
123	G	95.1	Very high	95	Very high	33 Å²	33	55 Å²	55	34%	0.34	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	14.6	178.6	0	0	0	0	0	115.5	C119 V120 F121 V125	C119-G123 CarbonylContact O-C 3.51Å; C119-G123 PolarHBondContact O-N 2.69Å; V120-G123 PolarHBondContact O-N 3.12Å; F121-G123 VanDerWaalsContact C-N 3.28Å; F121-G123 PolarHBondContact O-N 3.29Å; G123-V125 PolarHBondContact O-N 2.76Å
124	D	96.6	Very high	95.3	Very high	59 Å²	59	53.5 Å²	53.5	32%	0.316	26%	0.263	S	S	.	.			trans	-81.7	79.2	-176	-170.1	-10.4	0	0	0	111.9	C119 K122 R126 R127 L128	C119-D124 HydrophobicContact CB-CB 4.47Å; C119-D124 PolarHBondContact O-N 3.06Å; K122-D124 VanDerWaalsContact C-N 3.26Å; K122-D124 PolarHBondContact O-N 2.74Å; D124-R126 PolarHBondContact O-N 2.78Å; D124-R126 WeakPolarHBondContact OD1-CB 3.36Å; D124-R126 PolarHBondContact OD1-N 3.1Å; D124-R126 VanDerWaalsContact OD1-N 3.08Å; D124-R127 HydrophobicContact CB-CB 4.23Å; D124-R127 PolarHBondContact O-N 3.21Å; D124-R127 PolarHBondContact OD1-N 2.97Å; D124-R127 WeakPolarHBondContact OD2-CB 3.42Å; D124-L128 VanDerWaalsContact O-CB 3.24Å; D124-L128 WeakPolarHBondContact O-CB 3.36Å; D124-L128 PolarHBondContact O-N 2.85Å
125	V	97.1	Very high	95.3	Very high	53 Å²	53	55.2 Å²	55.2	32%	0.321	27%	0.273	S	S	.	.	H	α-helix	trans	-55.8	-30	174.6	-172.7	0	0	0	0	112	G123 S129 E158 L162	G123-V125 PolarHBondContact O-N 2.76Å; V125-S129 WeakPolarHBondContact O-CB 3.36Å; V125-S129 PolarHBondContact O-N 2.81Å; V125-E158 HydrophobicContact CG1-CB 4.39Å; V125-E158 HydrophobicContact CG2-CB 3.65Å; V125-L162 HydrophobicContact CG1-CD2 4.08Å
126	R	96.5	Very high	95.2	Very high	222 Å²	222	59.6 Å²	59.6	84%	0.838	30%	0.296	S	S	*	.	H	α-helix	trans	-74.9	-50.3	-176.4	-53.7	-174.2	-164.6	-176.2	6.8	110.9	D124 L128 S129 S130	D124-R126 PolarHBondContact O-N 2.78Å; D124-R126 WeakPolarHBondContact OD1-CB 3.36Å; D124-R126 PolarHBondContact OD1-N 3.1Å; D124-R126 VanDerWaalsContact OD1-N 3.08Å; R126-L128 VanDerWaalsContact C-N 3.32Å; R126-S129 PolarHBondContact O-N 2.92Å; R126-S130 PolarHBondContact O-N 3.4Å
127	R	96.1	Very high	95.1	Very high	86 Å²	86	60.7 Å²	60.7	33%	0.325	30%	0.301	S	S	.	.	H	α-helix	trans	-66.2	-37.2	175.9	-170.4	-179.8	159.4	-144	-8	110.6	E118 C119 D124 S130 L131	E118-R127 VanDerWaalsContact CD-NH1 3.33Å; E118-R127 IonicContact OE1-NH1 3.2Å; E118-R127 IonicContact OE2-CZ 3.07Å; E118-R127 IonicContact OE2-NH1 3.96Å; E118-R127 PolarHBondContact OE2-NH1 2.87Å; E118-R127 IonicContact OE2-NH2 2.77Å; E118-R127 PolarHBondContact OE2-NH2 2.85Å; C119-R127 WeakPolarHBondContact SG-CD 3.43Å; C119-R127 WeakPolarHBondContact SG-CG 3.19Å; C119-R127 PolarHBondContact SG-NE 2.78Å; C119-R127 VanDerWaalsContact SG-NE 3.38Å; D124-R127 HydrophobicContact CB-CB 4.23Å; D124-R127 PolarHBondContact O-N 3.21Å; D124-R127 PolarHBondContact OD1-N 2.97Å; D124-R127 WeakPolarHBondContact OD2-CB 3.42Å; R127-S130 WeakPolarHBondContact O-CB 3.5Å; R127-S130 PolarHBondContact O-N 2.61Å; R127-L131 HydrophobicContact CG-CD1 4.08Å; R127-L131 HydrophobicContact CG-CG 4.47Å; R127-L131 VanDerWaalsContact O-CG 3.32Å; R127-L131 WeakPolarHBondContact O-CG 3.38Å; R127-L131 PolarHBondContact O-N 3.15Å
128	L	97.2	Very high	95	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-55.6	-51.6	169.1	177.8	59.9	0	0	0	111.8	V116 C119 V120 D124 R126 S130 L131 I132 C159 L162 L163	V116-L128 HydrophobicContact CG1-CD1 3.65Å; C119-L128 HydrophobicContact CB-CB 4.19Å; V120-L128 HydrophobicContact CG2-CD1 4.07Å; V120-L128 HydrophobicContact CG2-CD2 3.91Å; D124-L128 VanDerWaalsContact O-CB 3.24Å; D124-L128 WeakPolarHBondContact O-CB 3.36Å; D124-L128 PolarHBondContact O-N 2.85Å; R126-L128 VanDerWaalsContact C-N 3.32Å; L128-S130 PolarHBondContact O-N 2.88Å; L128-S130 VanDerWaalsContact O-N 3.16Å; L128-L131 PolarHBondContact O-N 2.92Å; L128-L131 VanDerWaalsContact O-N 3.11Å; L128-I132 VanDerWaalsContact O-CB 3.28Å; L128-I132 WeakPolarHBondContact O-CB 3.35Å; L128-I132 PolarHBondContact O-N 2.91Å; L128-C159 HydrophobicContact CD2-CB 3.74Å; L128-L162 HydrophobicContact CB-CD2 4.48Å; L128-L162 HydrophobicContact CD2-CD2 4.01Å; L128-L162 HydrophobicContact CG-CD2 3.93Å; L128-L163 HydrophobicContact CD1-CD2 4.35Å
129	S	96.4	Very high	95	Very high	43 Å²	43	63.8 Å²	63.8	30%	0.301	32%	0.322	S	S	.	.	H	α-helix	trans	-60.7	-24.5	179.5	-167	0	0	0	0	114.3	V125 R126 R133	V125-S129 WeakPolarHBondContact O-CB 3.36Å; V125-S129 PolarHBondContact O-N 2.81Å; R126-S129 PolarHBondContact O-N 2.92Å; S129-R133 PolarHBondContact O-NE 3.06Å
130	S	95.3	Very high	95	Very high	83 Å²	83	68.2 Å²	68.2	58%	0.58	34%	0.341	S	S	*	.	H	α-helix	trans	-78.8	-48.7	171.2	-169.6	0	0	0	0	112.2	R126 R127 L128	R126-S130 PolarHBondContact O-N 3.4Å; R127-S130 WeakPolarHBondContact O-CB 3.5Å; R127-S130 PolarHBondContact O-N 2.61Å; L128-S130 PolarHBondContact O-N 2.88Å; L128-S130 VanDerWaalsContact O-N 3.16Å
131	L	94.4	Very high	94.9	Very high	27 Å²	27	68.6 Å²	68.6	14%	0.141	34%	0.343	C	S	.	.	H	α-helix	trans	-70.3	-32.1	-176.6	-65.8	171.6	0	0	0	113.4	P115 V116 C119 R127 L128 R133 T134 H135	P115-L131 HydrophobicContact CB-CD1 4Å; V116-L131 HydrophobicContact CG2-CB 4.33Å; C119-L131 WeakPolarHBondContact SG-CD1 3.45Å; R127-L131 HydrophobicContact CG-CD1 4.08Å; R127-L131 HydrophobicContact CG-CG 4.47Å; R127-L131 VanDerWaalsContact O-CG 3.32Å; R127-L131 WeakPolarHBondContact O-CG 3.38Å; R127-L131 PolarHBondContact O-N 3.15Å; L128-L131 PolarHBondContact O-N 2.92Å; L128-L131 VanDerWaalsContact O-N 3.11Å; L131-R133 PolarHBondContact O-N 2.83Å; L131-T134 PolarHBondContact O-N 3.49Å; L131-T134 PolarHBondContact O-OG1 2.94Å; L131-H135 VanDerWaalsContact CD2-CE1 3.44Å; L131-H135 WeakPolarHBondContact CD2-CE1 3.31Å; L131-H135 WeakPolarHBondContact O-CB 3.2Å; L131-H135 PolarHBondContact O-N 3.28Å; L131-H135 PolarHBondContact O-ND1 3.49Å
132	I	94.6	Very high	94.7	Very high	12 Å²	12	69.2 Å²	69.2	6%	0.062	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-17	-175	-152.3	166.5	0	0	0	113.7	L128 I137 L162 L163 H166	L128-I132 VanDerWaalsContact O-CB 3.28Å; L128-I132 WeakPolarHBondContact O-CB 3.35Å; L128-I132 PolarHBondContact O-N 2.91Å; I132-I137 HydrophobicContact CD1-CG2 4.19Å; I132-I137 HydrophobicContact CG1-CG2 3.5Å; I132-I137 VanDerWaalsContact CG1-CG2 3.5Å; I132-L162 HydrophobicContact CD1-CG 4.07Å; I132-L163 HydrophobicContact CD1-CD2 3.98Å; I132-L163 HydrophobicContact CD1-CG 4.49Å; I132-H166 HydrophobicContact CD1-CB 3.69Å; I132-H166 HydrophobicContact CG1-CB 4.03Å
133	R	91.4	Very high	94.6	Very high	197 Å²	197	64.5 Å²	64.5	74%	0.743	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-14.4	178.3	-56.1	-180	-174.1	-156.6	-3.4	113.7	S129 L131	S129-R133 PolarHBondContact O-NE 3.06Å; L131-R133 PolarHBondContact O-N 2.83Å
134	T	91.8	Very high	94.5	Very high	112 Å²	112	63.5 Å²	63.5	69%	0.687	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.1	-13.2	-171.1	53.8	0	0	0	0	113.9	L131	L131-T134 PolarHBondContact O-N 3.49Å; L131-T134 PolarHBondContact O-OG1 2.94Å
135	H	92.8	Very high	94.5	Very high	69 Å²	69	60.7 Å²	60.7	32%	0.319	30%	0.302	S	S	.	.	S	Bend	trans	-114.4	150.5	-176.8	-66.9	65.1	0	0	0	112	V116 L131 I137	V116-H135 HydrophobicContact CG2-CB 3.41Å; V116-H135 VanDerWaalsContact CG2-CB 3.41Å; L131-H135 VanDerWaalsContact CD2-CE1 3.44Å; L131-H135 WeakPolarHBondContact CD2-CE1 3.31Å; L131-H135 WeakPolarHBondContact O-CB 3.2Å; L131-H135 PolarHBondContact O-N 3.28Å; L131-H135 PolarHBondContact O-ND1 3.49Å; H135-I137 PolarHBondContact O-N 3.2Å
136	N	92.9	Very high	94.5	Very high	106 Å²	106	58.2 Å²	58.2	57%	0.567	29%	0.286	S	S	*	.			trans	-76.8	103.4	-179	-177.6	-2.7	0	0	0	111.8	G138 Q139	N136-G138 PolarHBondContact O-N 3.14Å; N136-G138 WeakPolarHBondContact OD1-CA 3.48Å; N136-G138 PolarHBondContact OD1-N 3.46Å; N136-Q139 HydrophobicContact CB-CB 4.33Å; N136-Q139 WeakPolarHBondContact O-CB 3.4Å; N136-Q139 PolarHBondContact O-N 3.36Å; N136-Q139 PolarHBondContact OD1-N 3.03Å
137	I	94.6	Very high	94.6	Very high	25 Å²	25	47.6 Å²	47.6	13%	0.128	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-13.9	175.3	62.8	-174.6	0	0	0	114.8	I132 H135 P147 L163 H166 A168	I132-I137 HydrophobicContact CD1-CG2 4.19Å; I132-I137 HydrophobicContact CG1-CG2 3.5Å; I132-I137 VanDerWaalsContact CG1-CG2 3.5Å; H135-I137 PolarHBondContact O-N 3.2Å; I137-P147 WeakPolarHBondContact O-CD 3.24Å; I137-L163 HydrophobicContact CB-CD2 4.14Å; I137-L163 HydrophobicContact CG2-CD2 3.92Å; I137-H166 HydrophobicContact CD1-CB 4.18Å; I137-H166 WeakPolarHBondContact CD1-O 3.45Å; I137-A168 HydrophobicContact CB-CB 4.43Å; I137-A168 HydrophobicContact CD1-CB 3.94Å; I137-A168 HydrophobicContact CG1-CB 4.25Å
138	G	94.6	Very high	94.7	Very high	24 Å²	24	43.5 Å²	43.5	25%	0.247	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-2.1	171	0	0	0	0	0	114.2	N136	N136-G138 PolarHBondContact O-N 3.14Å; N136-G138 WeakPolarHBondContact OD1-CA 3.48Å; N136-G138 PolarHBondContact OD1-N 3.46Å
139	Q	95.4	Very high	94.7	Very high	69 Å²	69	43.5 Å²	43.5	32%	0.322	23%	0.231	S	C	.	.			trans	-60.7	139.1	176.8	-177.2	174.5	0.2	0	0	110.7	Y114 H117 N136 T146 P147	Y114-Q139 HydrophobicContact CD1-CG 4.34Å; Y114-Q139 HydrophobicContact CE1-CG 4.33Å; H117-Q139 PolarHBondContact CE1-O 2.97Å; H117-Q139 PolarHBondContact NE2-O 3.1Å; N136-Q139 HydrophobicContact CB-CB 4.33Å; N136-Q139 WeakPolarHBondContact O-CB 3.4Å; N136-Q139 PolarHBondContact O-N 3.36Å; N136-Q139 PolarHBondContact OD1-N 3.03Å; Q139-T146 WeakPolarHBondContact O-CA 3.09Å; Q139-P147 WeakPolarHBondContact O-CD 3.43Å
140	K	95.4	Very high	94.7	Very high	93 Å²	93	41.5 Å²	41.5	40%	0.404	22%	0.217	S	C	.	.			trans	-99.5	145.5	173.7	-66.4	-175.9	177.2	-167.8	0	111.2	Y114 G144 N145 T146 K173	Y114-K140 WeakPolarHBondContact CE1-O 3.49Å; K140-G144 VanDerWaalsContact CD-O 3.27Å; K140-G144 WeakPolarHBondContact CD-O 3.45Å; K140-G144 WeakPolarHBondContact CG-O 3.37Å; K140-N145 CarbonylContact C-O 3.57Å; K140-N145 VanDerWaalsContact CA-O 3.3Å; K140-N145 WeakPolarHBondContact CA-O 3.42Å; K140-T146 HydrophobicContact CG-CG2 3.98Å; K140-K173 PolarHBondContact NZ-O 2.79Å
141	D	94.3	Very high	94.8	Very high	9 Å²	9	37.5 Å²	37.5	5%	0.048	19%	0.189	C	C	.	.			trans	-79.8	-176.9	168.5	65.2	18.5	0	0	0	112.5	Y114 H117 H143 G144 N145 Y425 I426	Y114-D141 HydrophobicContact CD1-CB 4.42Å; Y114-D141 HydrophobicContact CD2-CB 4.27Å; Y114-D141 HydrophobicContact CE1-CB 4.38Å; Y114-D141 HydrophobicContact CE2-CB 4.22Å; Y114-D141 HydrophobicContact CG-CB 4.37Å; H117-D141 IonicContact CD2-OD2 2.79Å; H117-D141 PolarHBondContact NE2-N 3.43Å; D141-H143 PolarHBondContact O-N 3.18Å; D141-H143 VanDerWaalsContact OD1-C 3.27Å; D141-H143 WeakPolarHBondContact OD1-CA 3.36Å; D141-H143 PolarHBondContact OD1-N 2.89Å; D141-G144 PolarHBondContact O-N 3.44Å; D141-G144 PolarHBondContact OD1-N 2.89Å; D141-N145 PolarHBondContact N-O 3.22Å; D141-N145 PolarHBondContact OD1-N 2.78Å; D141-N145 WeakPolarHBondContact OD2-CB 3.36Å; D141-Y425 WeakPolarHBondContact OD2-CE1 3.13Å; D141-Y425 PolarHBondContact OD2-OH 3.26Å; D141-I426 HydrophobicContact CB-CD1 4.37Å
142	N	92.1	Very high	94.9	Very high	32 Å²	32	36.4 Å²	36.4	17%	0.171	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-16	174	65.2	-36.6	0	0	0	114.4	I426 G431	N142-I426 PolarHBondContact ND2-O 2.76Å; N142-I426 WeakPolarHBondContact OD1-CD1 3.5Å; N142-G431 PolarHBondContact O-N 3.34Å
143	H	92.3	Very high	94.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	4.8	173.5	-52.4	-69.1	0	0	0	112.6	D141 N145 A175 Y425 E429 G431 A433	D141-H143 PolarHBondContact O-N 3.18Å; D141-H143 VanDerWaalsContact OD1-C 3.27Å; D141-H143 WeakPolarHBondContact OD1-CA 3.36Å; D141-H143 PolarHBondContact OD1-N 2.89Å; H143-N145 VanDerWaalsContact C-N 3.28Å; H143-N145 PolarHBondContact O-N 2.87Å; H143-A175 WeakPolarHBondContact O-CB 3.28Å; H143-A175 PolarHBondContact O-N 3.37Å; H143-Y425 AromaticContact CD2-CE1 3.8Å; H143-Y425 AromaticContact CD2-CE2 3.96Å; H143-Y425 AromaticContact CD2-CZ 3.51Å; H143-Y425 PolarHBondContact NE2-O 3.16Å; H143-Y425 VanDerWaalsContact NE2-O 3.07Å; H143-E429 PolarHBondContact CE1-O 2.92Å; H143-E429 PolarHBondContact ND1-O 2.92Å; H143-G431 PolarHBondContact ND1-N 3.12Å; H143-A433 HydrophobicContact CB-CB 3.93Å; H143-A433 PolarHBondContact ND1-N 3.33Å
144	G	93.8	Very high	95	Very high	12 Å²	12	29.1 Å²	29.1	12%	0.124	16%	0.158	C	C	.	.	S	Bend	trans	80.7	0.8	179.2	0	0	0	0	0	114.6	K140 D141 N174	K140-G144 VanDerWaalsContact CD-O 3.27Å; K140-G144 WeakPolarHBondContact CD-O 3.45Å; K140-G144 WeakPolarHBondContact CG-O 3.37Å; D141-G144 PolarHBondContact O-N 3.44Å; D141-G144 PolarHBondContact OD1-N 2.89Å; G144-N174 WeakPolarHBondContact O-CA 3.44Å
145	N	95.6	Very high	95.1	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	14%	0.135	C	C	.	.			trans	-77	137.9	-179.6	-72.9	-44.5	0	0	0	110.4	H117 K140 D141 H143 H149 N174 Y425	H117-N145 PolarHBondContact NE2-O 3.01Å; K140-N145 CarbonylContact C-O 3.57Å; K140-N145 VanDerWaalsContact CA-O 3.3Å; K140-N145 WeakPolarHBondContact CA-O 3.42Å; D141-N145 PolarHBondContact N-O 3.22Å; D141-N145 PolarHBondContact OD1-N 2.78Å; D141-N145 WeakPolarHBondContact OD2-CB 3.36Å; H143-N145 VanDerWaalsContact C-N 3.28Å; H143-N145 PolarHBondContact O-N 2.87Å; N145-H149 HydrophobicContact CB-CB 3.9Å; N145-N174 WeakPolarHBondContact OD1-CB 2.75Å; N145-N174 PolarHBondContact OD1-ND2 2.86Å; N145-N174 VanDerWaalsContact OD1-ND2 3.1Å; N145-Y425 PolarHBondContact ND2-OH 3.37Å
146	T	97.3	Very high	95.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.13	C	C	.	.			trans	-85.6	164.5	164.6	65.6	0	0	0	0	109.8	Q139 K140 L148 H149 L150 V172	Q139-T146 WeakPolarHBondContact O-CA 3.09Å; K140-T146 HydrophobicContact CG-CG2 3.98Å; T146-L148 PolarHBondContact O-N 2.83Å; T146-H149 PolarHBondContact N-ND1 3.06Å; T146-H149 VanDerWaalsContact N-ND1 3.17Å; T146-H149 WeakPolarHBondContact O-CB 3.35Å; T146-H149 PolarHBondContact O-N 3.02Å; T146-H149 PolarHBondContact OG1-ND1 3Å; T146-L150 PolarHBondContact O-N 2.85Å; T146-V172 HydrophobicContact CG2-CG2 4.03Å
147	P	97.6	Very high	95.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-53.2	-32.6	175.7	-24.6	33.7	0	0	0	112.6	V116 V120 I137 Q139 H149 L150 A151 L163	V116-P147 HydrophobicContact CB-CG 4.06Å; V116-P147 HydrophobicContact CG1-CB 3.9Å; V116-P147 HydrophobicContact CG1-CG 3.63Å; V120-P147 WeakPolarHBondContact CG1-O 3.33Å; V120-P147 HydrophobicContact CG2-CB 3.93Å; I137-P147 WeakPolarHBondContact O-CD 3.24Å; Q139-P147 WeakPolarHBondContact O-CD 3.43Å; P147-H149 PolarHBondContact O-N 3.06Å; P147-L150 PolarHBondContact O-N 3.08Å; P147-A151 PolarHBondContact O-N 2.81Å; P147-L163 HydrophobicContact CB-CD1 3.92Å; P147-L163 HydrophobicContact CB-CD2 4.13Å
148	L	98.3	Very high	95.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-68	-31.8	177.3	-174.6	63	0	0	0	113.3	T146 A151 V152 A160 L163 L164 A168 V170 P180 L196	T146-L148 PolarHBondContact O-N 2.83Å; L148-A151 PolarHBondContact O-N 2.79Å; L148-V152 WeakPolarHBondContact O-CG1 3.37Å; L148-V152 PolarHBondContact O-N 2.9Å; L148-A160 HydrophobicContact CD1-CB 4.13Å; L148-L163 HydrophobicContact CB-CD1 4.26Å; L148-L163 HydrophobicContact CD1-CB 4.12Å; L148-L163 HydrophobicContact CD1-CD1 4.4Å; L148-L164 HydrophobicContact CD1-CD2 4.21Å; L148-L164 HydrophobicContact CD1-CG 4.08Å; L148-L164 HydrophobicContact CD2-CD2 3.82Å; L148-A168 HydrophobicContact CB-CB 4.46Å; L148-A168 HydrophobicContact CD2-CB 4.21Å; L148-V170 HydrophobicContact CD2-CB 4.48Å; L148-V170 HydrophobicContact CD2-CG1 3.75Å; L148-P180 HydrophobicContact CB-CG 4.43Å; L148-P180 HydrophobicContact CD2-CB 3.98Å; L148-P180 HydrophobicContact CD2-CG 4.04Å; L148-P180 HydrophobicContact CG-CB 3.92Å; L148-P180 HydrophobicContact CG-CG 4.14Å; L148-L196 HydrophobicContact CD2-CD2 4Å; L148-L196 HydrophobicContact CG-CD2 4.45Å
149	H	97.4	Very high	95.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.2	-47.4	172.1	-67.2	77.4	0	0	0	110.3	N145 T146 P147 A151 V152 M153 N174 W178	N145-H149 HydrophobicContact CB-CB 3.9Å; T146-H149 PolarHBondContact N-ND1 3.06Å; T146-H149 VanDerWaalsContact N-ND1 3.17Å; T146-H149 WeakPolarHBondContact O-CB 3.35Å; T146-H149 PolarHBondContact O-N 3.02Å; T146-H149 PolarHBondContact OG1-ND1 3Å; P147-H149 PolarHBondContact O-N 3.06Å; H149-A151 VanDerWaalsContact C-N 3.31Å; H149-A151 PolarHBondContact O-N 2.71Å; H149-V152 WeakPolarHBondContact O-CG2 3.43Å; H149-V152 PolarHBondContact O-N 2.84Å; H149-M153 HydrophobicContact CB-SD 4.33Å; H149-M153 WeakPolarHBondContact O-CB 3.48Å; H149-M153 WeakPolarHBondContact O-CG 3.2Å; H149-M153 PolarHBondContact O-N 2.85Å; H149-N174 PolarHBondContact NE2-N 2.88Å; H149-W178 PolarHBondContact NE2-O 2.87Å
150	L	96.4	Very high	95.8	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.8	-41	178	-64.7	-179.7	0	0	0	112	H117 V120 T146 P147 V152 M153 L154 W422 Y425 L436	H117-L150 HydrophobicContact CB-CD1 3.68Å; V120-L150 HydrophobicContact CG1-CB 3.91Å; T146-L150 PolarHBondContact O-N 2.85Å; P147-L150 PolarHBondContact O-N 3.08Å; L150-V152 VanDerWaalsContact C-N 3.33Å; L150-V152 PolarHBondContact O-N 2.89Å; L150-M153 PolarHBondContact O-N 2.82Å; L150-L154 WeakPolarHBondContact O-CB 3.33Å; L150-L154 WeakPolarHBondContact O-CG 3.06Å; L150-L154 PolarHBondContact O-N 2.58Å; L150-W422 HydrophobicContact CD1-CZ3 4.18Å; L150-Y425 HydrophobicContact CD1-CE1 4.5Å; L150-Y425 HydrophobicContact CD2-CE1 4.18Å; L150-Y425 HydrophobicContact CD2-CE2 4.15Å; L150-L436 HydrophobicContact CD2-CD1 3.73Å
151	A	97.1	Very high	96	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.4	-41.5	179.9	0	0	0	0	0	112.2	V120 P147 L148 H149 G155 N156 C159 A160 L163	V120-A151 VanDerWaalsContact CG1-CA 3.49Å; V120-A151 HydrophobicContact CG1-CB 3.58Å; V120-A151 VanDerWaalsContact CG1-N 3.34Å; P147-A151 PolarHBondContact O-N 2.81Å; L148-A151 PolarHBondContact O-N 2.79Å; H149-A151 VanDerWaalsContact C-N 3.31Å; H149-A151 PolarHBondContact O-N 2.71Å; A151-G155 CarbonylContact O-C 3.59Å; A151-G155 PolarHBondContact O-N 3.01Å; A151-N156 PolarHBondContact O-N 2.65Å; A151-C159 HydrophobicContact CB-CB 4.18Å; A151-A160 HydrophobicContact CB-CB 3.72Å; A151-L163 HydrophobicContact CB-CD1 4.21Å
152	V	96.7	Very high	96.1	Very high	4 Å²	4	22.1 Å²	22.1	2%	0.024	12%	0.115	C	C	.	.	H	α-helix	trans	-79.9	-37.3	179.8	-56.3	0	0	0	0	112.6	L148 H149 L150 L154 G155 A160 E183 A184 Y187 M192 L196	L148-V152 WeakPolarHBondContact O-CG1 3.37Å; L148-V152 PolarHBondContact O-N 2.9Å; H149-V152 WeakPolarHBondContact O-CG2 3.43Å; H149-V152 PolarHBondContact O-N 2.84Å; L150-V152 VanDerWaalsContact C-N 3.33Å; L150-V152 PolarHBondContact O-N 2.89Å; V152-L154 VanDerWaalsContact C-N 3.31Å; V152-L154 PolarHBondContact O-N 2.85Å; V152-G155 PolarHBondContact O-N 2.82Å; V152-A160 HydrophobicContact CG1-CB 4.38Å; V152-E183 HydrophobicContact CG2-CB 3.68Å; V152-A184 HydrophobicContact CB-CB 4.16Å; V152-A184 HydrophobicContact CG1-CB 4.31Å; V152-Y187 WeakPolarHBondContact O-CD2 3.46Å; V152-M192 HydrophobicContact CG1-CG 3.89Å; V152-M192 HydrophobicContact CG1-SD 4.18Å; V152-L196 HydrophobicContact CG1-CD1 3.85Å
153	M	94.8	Very high	96.4	Very high	26 Å²	26	20.6 Å²	20.6	13%	0.128	11%	0.107	C	C	.	.	H	α-helix	trans	-64	-36.6	178.8	-70.5	168.6	74.2	0	0	112	H149 L150 E183 L436	H149-M153 HydrophobicContact CB-SD 4.33Å; H149-M153 WeakPolarHBondContact O-CB 3.48Å; H149-M153 WeakPolarHBondContact O-CG 3.2Å; H149-M153 PolarHBondContact O-N 2.85Å; L150-M153 PolarHBondContact O-N 2.82Å; M153-E183 HydrophobicContact CG-CB 3.9Å; M153-E183 HydrophobicContact CG-CG 4.03Å; M153-E183 HydrophobicContact SD-CG 4.29Å; M153-L436 HydrophobicContact CB-CB 4.4Å; M153-L436 HydrophobicContact CE-CB 4.38Å; M153-L436 HydrophobicContact CE-CD1 4.31Å; M153-L436 HydrophobicContact CE-CG 4.48Å
154	L	94.3	Very high	96.7	Very high	29 Å²	29	21.1 Å²	21.1	15%	0.152	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-11.5	177.9	-65.6	166.6	0	0	0	113.5	F121 L150 V152 N156 N418 L436	F121-L154 HydrophobicContact CB-CD1 4.25Å; F121-L154 HydrophobicContact CD2-CD1 3.89Å; F121-L154 HydrophobicContact CE2-CD1 4.39Å; F121-L154 HydrophobicContact CG-CD1 3.97Å; L150-L154 WeakPolarHBondContact O-CB 3.33Å; L150-L154 WeakPolarHBondContact O-CG 3.06Å; L150-L154 PolarHBondContact O-N 2.58Å; V152-L154 VanDerWaalsContact C-N 3.31Å; V152-L154 PolarHBondContact O-N 2.85Å; L154-N156 VanDerWaalsContact C-N 3.35Å; L154-N418 HydrophobicContact CD2-CB 3.93Å; L154-L436 HydrophobicContact CD2-CB 3.95Å; L154-L436 HydrophobicContact CD2-CD1 4.26Å; L154-L436 HydrophobicContact CD2-CD2 4.43Å; L154-L436 HydrophobicContact CD2-CG 4.44Å; L154-L436 HydrophobicContact CG-CD1 4.32Å
155	G	94	Very high	96.8	Very high	19 Å²	19	24.5 Å²	24.5	20%	0.196	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	16.5	-175.5	0	0	0	0	0	115.3	A151 V152 K157	A151-G155 CarbonylContact O-C 3.59Å; A151-G155 PolarHBondContact O-N 3.01Å; V152-G155 PolarHBondContact O-N 2.82Å; G155-K157 VanDerWaalsContact C-N 3.26Å; G155-K157 WeakPolarHBondContact O-CG 3.12Å; G155-K157 PolarHBondContact O-N 3.29Å
156	N	95.4	Very high	96.9	Very high	41 Å²	41	28.5 Å²	28.5	22%	0.219	16%	0.155	C	C	.	.			trans	-75.8	74.7	-179.8	-70.9	-18.2	0	0	0	110.6	V120 A151 L154 E158 C159 A160	V120-N156 PolarHBondContact O-ND2 3Å; A151-N156 PolarHBondContact O-N 2.65Å; L154-N156 VanDerWaalsContact C-N 3.35Å; N156-E158 VanDerWaalsContact C-N 3.34Å; N156-E158 PolarHBondContact O-N 3.18Å; N156-C159 HydrophobicContact CB-CB 4.17Å; N156-C159 WeakPolarHBondContact O-CB 3.46Å; N156-C159 PolarHBondContact O-N 2.71Å; N156-C159 VanDerWaalsContact O-N 3.15Å; N156-A160 PolarHBondContact O-N 3.47Å
157	K	96.1	Very high	96.8	Very high	61 Å²	61	31.8 Å²	31.8	27%	0.265	17%	0.173	S	C	.	.	H	α-helix	trans	-56.2	-42.5	-169.5	-55.4	-160.9	-173.7	-154.9	0	113.3	G155 C159 A160 H161 D189 M192	G155-K157 VanDerWaalsContact C-N 3.26Å; G155-K157 WeakPolarHBondContact O-CG 3.12Å; G155-K157 PolarHBondContact O-N 3.29Å; K157-C159 VanDerWaalsContact C-N 3.34Å; K157-C159 PolarHBondContact O-N 2.78Å; K157-A160 PolarHBondContact O-N 3.04Å; K157-A160 VanDerWaalsContact O-N 3.17Å; K157-H161 PolarHBondContact O-CD2 3.14Å; K157-H161 PolarHBondContact O-N 2.77Å; K157-D189 WeakPolarHBondContact CE-OD2 3.38Å; K157-D189 IonicContact NZ-OD1 3.31Å; K157-D189 PolarHBondContact NZ-OD1 3.09Å; K157-D189 IonicContact NZ-OD2 2.99Å; K157-D189 PolarHBondContact NZ-OD2 2.96Å; K157-M192 HydrophobicContact CB-CE 4.14Å; K157-M192 HydrophobicContact CG-CE 4.46Å
158	E	97.5	Very high	96.7	Very high	123 Å²	123	31.8 Å²	31.8	58%	0.575	17%	0.173	S	C	*	.	H	α-helix	trans	-63.9	-40.9	-178.8	-63.7	69.2	-153.8	0	0	111.1	V125 N156 L162	V125-E158 HydrophobicContact CG1-CB 4.39Å; V125-E158 HydrophobicContact CG2-CB 3.65Å; N156-E158 VanDerWaalsContact C-N 3.34Å; N156-E158 PolarHBondContact O-N 3.18Å; E158-L162 VanDerWaalsContact O-CB 3.26Å; E158-L162 WeakPolarHBondContact O-CB 3.46Å; E158-L162 PolarHBondContact O-N 3.42Å
159	C	97.9	Very high	96.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.8	-43.9	172.8	-70.2	0	0	0	0	111.2	V120 L128 A151 N156 K157 L162 L163	V120-C159 HydrophobicContact CG1-CB 4.21Å; V120-C159 HydrophobicContact CG2-CB 4.25Å; L128-C159 HydrophobicContact CD2-CB 3.74Å; A151-C159 HydrophobicContact CB-CB 4.18Å; N156-C159 HydrophobicContact CB-CB 4.17Å; N156-C159 WeakPolarHBondContact O-CB 3.46Å; N156-C159 PolarHBondContact O-N 2.71Å; N156-C159 VanDerWaalsContact O-N 3.15Å; K157-C159 VanDerWaalsContact C-N 3.34Å; K157-C159 PolarHBondContact O-N 2.78Å; C159-L162 PolarHBondContact O-N 3.03Å; C159-L163 WeakPolarHBondContact O-CB 3.46Å; C159-L163 WeakPolarHBondContact O-CD1 3.4Å; C159-L163 VanDerWaalsContact O-CG 3.24Å; C159-L163 WeakPolarHBondContact O-CG 3.25Å; C159-L163 PolarHBondContact O-N 2.92Å
160	A	98.1	Very high	96.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.1	-48.8	178.8	0	0	0	0	0	111.9	L148 A151 V152 N156 K157 L162 L163 L164 M192	L148-A160 HydrophobicContact CD1-CB 4.13Å; A151-A160 HydrophobicContact CB-CB 3.72Å; V152-A160 HydrophobicContact CG1-CB 4.38Å; N156-A160 PolarHBondContact O-N 3.47Å; K157-A160 PolarHBondContact O-N 3.04Å; K157-A160 VanDerWaalsContact O-N 3.17Å; A160-L162 VanDerWaalsContact C-N 3.35Å; A160-L162 PolarHBondContact O-N 3.34Å; A160-L163 PolarHBondContact O-N 2.92Å; A160-L164 VanDerWaalsContact O-CG 3.25Å; A160-L164 WeakPolarHBondContact O-CG 3.15Å; A160-L164 PolarHBondContact O-N 3.22Å; A160-M192 HydrophobicContact CB-CE 3.6Å; A160-M192 HydrophobicContact CB-SD 3.6Å; A160-M192 VanDerWaalsContact CB-SD 3.6Å
161	H	98.1	Very high	96.3	Very high	82 Å²	82	41 Å²	41	38%	0.38	22%	0.217	S	C	.	.	H	α-helix	trans	-62.3	-39.4	177.3	-70.5	-57.5	0	0	0	112.4	K157 L164 A165 M192	K157-H161 PolarHBondContact O-CD2 3.14Å; K157-H161 PolarHBondContact O-N 2.77Å; H161-L164 PolarHBondContact O-N 2.96Å; H161-A165 WeakPolarHBondContact O-CB 3.5Å; H161-A165 PolarHBondContact O-N 3.07Å; H161-M192 WeakPolarHBondContact NE2-CE 3.25Å
162	L	97.9	Very high	96.2	Very high	34 Å²	34	43 Å²	43	18%	0.178	23%	0.228	C	C	.	.	H	α-helix	trans	-64.2	-41	175.1	-179.5	59.7	0	0	0	112	V125 L128 I132 E158 C159 A160 A165 H166	V125-L162 HydrophobicContact CG1-CD2 4.08Å; L128-L162 HydrophobicContact CB-CD2 4.48Å; L128-L162 HydrophobicContact CD2-CD2 4.01Å; L128-L162 HydrophobicContact CG-CD2 3.93Å; I132-L162 HydrophobicContact CD1-CG 4.07Å; E158-L162 VanDerWaalsContact O-CB 3.26Å; E158-L162 WeakPolarHBondContact O-CB 3.46Å; E158-L162 PolarHBondContact O-N 3.42Å; C159-L162 PolarHBondContact O-N 3.03Å; A160-L162 VanDerWaalsContact C-N 3.35Å; A160-L162 PolarHBondContact O-N 3.34Å; L162-A165 PolarHBondContact O-N 3.01Å; L162-H166 PolarHBondContact O-CD2 3.09Å; L162-H166 PolarHBondContact O-N 3.23Å
163	L	98.3	Very high	96	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-43.5	173.9	-74.4	164.1	0	0	0	112.1	V120 L128 I132 I137 P147 L148 A151 C159 A160 H166 N167 A168	V120-L163 HydrophobicContact CG2-CD1 3.97Å; L128-L163 HydrophobicContact CD1-CD2 4.35Å; I132-L163 HydrophobicContact CD1-CD2 3.98Å; I132-L163 HydrophobicContact CD1-CG 4.49Å; I137-L163 HydrophobicContact CB-CD2 4.14Å; I137-L163 HydrophobicContact CG2-CD2 3.92Å; P147-L163 HydrophobicContact CB-CD1 3.92Å; P147-L163 HydrophobicContact CB-CD2 4.13Å; L148-L163 HydrophobicContact CB-CD1 4.26Å; L148-L163 HydrophobicContact CD1-CB 4.12Å; L148-L163 HydrophobicContact CD1-CD1 4.4Å; A151-L163 HydrophobicContact CB-CD1 4.21Å; C159-L163 WeakPolarHBondContact O-CB 3.46Å; C159-L163 WeakPolarHBondContact O-CD1 3.4Å; C159-L163 VanDerWaalsContact O-CG 3.24Å; C159-L163 WeakPolarHBondContact O-CG 3.25Å; C159-L163 PolarHBondContact O-N 2.92Å; A160-L163 PolarHBondContact O-N 2.92Å; L163-H166 CarbonylContact O-C 3.55Å; L163-H166 PolarHBondContact O-N 3.11Å; L163-N167 PolarHBondContact O-N 3.31Å; L163-A168 HydrophobicContact CB-CB 3.87Å; L163-A168 HydrophobicContact CD2-CB 4.46Å; L163-A168 WeakPolarHBondContact O-CB 3.32Å; L163-A168 PolarHBondContact O-N 2.66Å
164	L	97.6	Very high	95.9	Very high	12 Å²	12	46 Å²	46	6%	0.063	24%	0.241	C	C	.	.	H	α-helix	trans	-65	-38.8	177.9	-68	168.2	0	0	0	112.4	L148 A160 H161 H166 N167 V170 M192 A195 L196 K199	L148-L164 HydrophobicContact CD1-CD2 4.21Å; L148-L164 HydrophobicContact CD1-CG 4.08Å; L148-L164 HydrophobicContact CD2-CD2 3.82Å; A160-L164 VanDerWaalsContact O-CG 3.25Å; A160-L164 WeakPolarHBondContact O-CG 3.15Å; A160-L164 PolarHBondContact O-N 3.22Å; H161-L164 PolarHBondContact O-N 2.96Å; L164-H166 VanDerWaalsContact C-N 3.31Å; L164-H166 PolarHBondContact O-N 3.07Å; L164-N167 PolarHBondContact O-N 2.93Å; L164-V170 HydrophobicContact CD2-CG1 3.56Å; L164-M192 HydrophobicContact CD1-SD 4.25Å; L164-A195 HydrophobicContact CD1-CB 4.25Å; L164-L196 HydrophobicContact CD1-CD2 4.3Å; L164-L196 HydrophobicContact CD1-CG 4.36Å; L164-L196 HydrophobicContact CD2-CD2 3.79Å; L164-K199 HydrophobicContact CD2-CB 4.01Å; L164-K199 HydrophobicContact CD2-CG 3.82Å; L164-K199 WeakPolarHBondContact O-CE 3.44Å
165	A	96.6	Very high	95.6	Very high	82 Å²	82	47.9 Å²	47.9	68%	0.678	26%	0.26	S	S	*	.	H	α-helix	trans	-62.8	-36.5	174.7	0	0	0	0	0	112.3	H161 L162 N167	H161-A165 WeakPolarHBondContact O-CB 3.5Å; H161-A165 PolarHBondContact O-N 3.07Å; L162-A165 PolarHBondContact O-N 3.01Å; A165-N167 PolarHBondContact O-N 2.87Å
166	H	96.6	Very high	95.3	Very high	86 Å²	86	48.9 Å²	48.9	40%	0.398	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	16.3	172.6	-79.8	-89.4	0	0	0	114.2	I132 I137 L162 L163 L164 A168	I132-H166 HydrophobicContact CD1-CB 3.69Å; I132-H166 HydrophobicContact CG1-CB 4.03Å; I137-H166 HydrophobicContact CD1-CB 4.18Å; I137-H166 WeakPolarHBondContact CD1-O 3.45Å; L162-H166 PolarHBondContact O-CD2 3.09Å; L162-H166 PolarHBondContact O-N 3.23Å; L163-H166 CarbonylContact O-C 3.55Å; L163-H166 PolarHBondContact O-N 3.11Å; L164-H166 VanDerWaalsContact C-N 3.31Å; L164-H166 PolarHBondContact O-N 3.07Å; H166-A168 PolarHBondContact O-N 3.39Å
167	N	95.2	Very high	95	Very high	69 Å²	69	47.6 Å²	47.6	37%	0.369	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	36.3	178.6	-145.7	15.6	0	0	0	115.1	L163 L164 A165 K199 Q203 E206	L163-N167 PolarHBondContact O-N 3.31Å; L164-N167 PolarHBondContact O-N 2.93Å; A165-N167 PolarHBondContact O-N 2.87Å; N167-K199 WeakPolarHBondContact OD1-CE 3.45Å; N167-K199 PolarHBondContact OD1-NZ 3.01Å; N167-Q203 PolarHBondContact O-NE2 3.13Å; N167-Q203 PolarHBondContact OD1-NE2 2.92Å; N167-E206 PolarHBondContact ND2-OE2 3.33Å
168	A	96.9	Very high	94.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.246	C	C	.	.			trans	-54.8	137.8	172.1	0	0	0	0	0	111.2	I137 L148 L163 H166 V170 Q203	I137-A168 HydrophobicContact CB-CB 4.43Å; I137-A168 HydrophobicContact CD1-CB 3.94Å; I137-A168 HydrophobicContact CG1-CB 4.25Å; L148-A168 HydrophobicContact CB-CB 4.46Å; L148-A168 HydrophobicContact CD2-CB 4.21Å; L163-A168 HydrophobicContact CB-CB 3.87Å; L163-A168 HydrophobicContact CD2-CB 4.46Å; L163-A168 WeakPolarHBondContact O-CB 3.32Å; L163-A168 PolarHBondContact O-N 2.66Å; H166-A168 PolarHBondContact O-N 3.39Å; A168-V170 WeakPolarHBondContact O-CG1 3.33Å; A168-V170 PolarHBondContact O-N 2.89Å; A168-Q203 PolarHBondContact O-NE2 2.76Å
169	P	95.6	Very high	94.7	Very high	36 Å²	36	40.7 Å²	40.7	23%	0.234	23%	0.227	C	C	.	.			trans	-70.2	130.7	-172.8	27.7	-34.8	0	0	0	111.1	V172	P169-V172 HydrophobicContact CB-CG1 4.07Å; P169-V172 HydrophobicContact CB-CG2 4.2Å; P169-V172 HydrophobicContact CG-CG1 4.21Å; P169-V172 HydrophobicContact CG-CG2 4.15Å; P169-V172 VanDerWaalsContact O-CG2 3.27Å; P169-V172 WeakPolarHBondContact O-CG2 3.34Å
170	V	95.9	Very high	94.6	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.012	23%	0.227	C	C	.	.	S	Bend	trans	-107.1	-12.9	-177.4	-44.4	0	0	0	0	114.2	L148 L164 A168 L196 K199 L200	L148-V170 HydrophobicContact CD2-CB 4.48Å; L148-V170 HydrophobicContact CD2-CG1 3.75Å; L164-V170 HydrophobicContact CD2-CG1 3.56Å; A168-V170 WeakPolarHBondContact O-CG1 3.33Å; A168-V170 PolarHBondContact O-N 2.89Å; V170-L196 HydrophobicContact CB-CD2 4.34Å; V170-L196 HydrophobicContact CG1-CD2 4.06Å; V170-K199 HydrophobicContact CG1-CB 4.28Å; V170-K199 HydrophobicContact CG1-CG 4.03Å; V170-L200 HydrophobicContact CG2-CB 3.54Å; V170-L200 HydrophobicContact CG2-CD1 3.86Å; V170-L200 HydrophobicContact CG2-CG 4.29Å
171	K	92.1	Very high	94.6	Very high	156 Å²	156	41.4 Å²	41.4	68%	0.678	23%	0.231	S	C	*	.	S	Bend	trans	-87.9	-9	177.1	-166.4	168.2	-178.6	172.2	0	113.9	L200	K171-L200 HydrophobicContact CB-CD1 3.99Å; K171-L200 HydrophobicContact CD-CD1 4.45Å; K171-L200 HydrophobicContact CG-CD1 4.31Å
172	V	93.8	Very high	94.5	Very high	40 Å²	40	38 Å²	38	24%	0.242	22%	0.217	C	C	.	.			trans	-64.5	147.4	176.2	-76.4	0	0	0	0	111.7	T146 P169 S179 P180	T146-V172 HydrophobicContact CG2-CG2 4.03Å; P169-V172 HydrophobicContact CB-CG1 4.07Å; P169-V172 HydrophobicContact CB-CG2 4.2Å; P169-V172 HydrophobicContact CG-CG1 4.21Å; P169-V172 HydrophobicContact CG-CG2 4.15Å; P169-V172 VanDerWaalsContact O-CG2 3.27Å; P169-V172 WeakPolarHBondContact O-CG2 3.34Å; V172-S179 VanDerWaalsContact O-CA 3.29Å; V172-S179 WeakPolarHBondContact O-CA 3.5Å; V172-S179 WeakPolarHBondContact O-CB 3.33Å; V172-P180 WeakPolarHBondContact O-CD 3.4Å
173	K	92.4	Very high	94.3	Very high	85 Å²	85	36.9 Å²	36.9	37%	0.37	21%	0.211	S	C	.	.			trans	-108.7	142.7	172.5	-68.8	-179.3	169.7	-166.4	0	112.6	K140 G177 W178 S327	K140-K173 PolarHBondContact NZ-O 2.79Å; K173-G177 VanDerWaalsContact CD-O 3.29Å; K173-G177 WeakPolarHBondContact CD-O 3.28Å; K173-G177 WeakPolarHBondContact CE-O 3.5Å; K173-W178 CarbonylContact C-O 3.6Å; K173-W178 WeakPolarHBondContact CA-O 3.31Å; K173-S327 PolarHBondContact NZ-OG 2.88Å
174	N	92.8	Very high	94.3	Very high	10 Å²	10	36.9 Å²	36.9	5%	0.053	21%	0.212	C	C	.	.			trans	-73.2	-179.2	168.7	62.8	15.8	0	0	0	112.6	G144 N145 H149 Q176 G177 W178 E183	G144-N174 WeakPolarHBondContact O-CA 3.44Å; N145-N174 WeakPolarHBondContact OD1-CB 2.75Å; N145-N174 PolarHBondContact OD1-ND2 2.86Å; N145-N174 VanDerWaalsContact OD1-ND2 3.1Å; H149-N174 PolarHBondContact NE2-N 2.88Å; N174-Q176 PolarHBondContact O-N 2.94Å; N174-Q176 PolarHBondContact OD1-N 3.15Å; N174-Q176 PolarHBondContact OD1-OE1 3Å; N174-G177 PolarHBondContact O-N 2.86Å; N174-G177 VanDerWaalsContact O-N 3.12Å; N174-G177 PolarHBondContact OD1-N 2.99Å; N174-G177 VanDerWaalsContact OD1-N 3.14Å; N174-W178 PolarHBondContact N-O 3.22Å; N174-W178 PolarHBondContact OD1-N 2.52Å; N174-W178 PolarHBondContact OD1-O 2.6Å; N174-E183 PolarHBondContact ND2-OE1 3.4Å
175	A	89.9	Confident	94.2	Very high	67 Å²	67	36.8 Å²	36.8	55%	0.554	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-23.7	-178.2	0	0	0	0	0	113.1	H143 G177	H143-A175 WeakPolarHBondContact O-CB 3.28Å; H143-A175 PolarHBondContact O-N 3.37Å; A175-G177 VanDerWaalsContact C-N 3.34Å
176	Q	86.3	Confident	94.1	Very high	41 Å²	41	33 Å²	33	19%	0.192	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-3.9	179.3	-56.6	76.2	11.6	0	0	112.5	N174 R372 G431	N174-Q176 PolarHBondContact O-N 2.94Å; N174-Q176 PolarHBondContact OD1-N 3.15Å; N174-Q176 PolarHBondContact OD1-OE1 3Å; Q176-R372 WeakPolarHBondContact O-CD 3.24Å; Q176-R372 PolarHBondContact O-NE 2.69Å; Q176-R372 PolarHBondContact O-NH1 3.43Å; Q176-G431 PolarHBondContact NE2-O 3.48Å
177	G	89	Confident	94	Very high	14 Å²	14	30.6 Å²	30.6	14%	0.144	17%	0.167	C	C	.	.	S	Bend	trans	90.2	13.6	173.6	0	0	0	0	0	115.6	K173 N174 A175 S327	K173-G177 VanDerWaalsContact CD-O 3.29Å; K173-G177 WeakPolarHBondContact CD-O 3.28Å; K173-G177 WeakPolarHBondContact CE-O 3.5Å; N174-G177 PolarHBondContact O-N 2.86Å; N174-G177 VanDerWaalsContact O-N 3.12Å; N174-G177 PolarHBondContact OD1-N 2.99Å; N174-G177 VanDerWaalsContact OD1-N 3.14Å; A175-G177 VanDerWaalsContact C-N 3.34Å; G177-S327 PolarHBondContact O-OG 2.8Å
178	W	92.4	Very high	94	Very high	11 Å²	11	27.4 Å²	27.4	4%	0.042	15%	0.15	C	C	.	.			trans	-103.1	150.6	179.9	-52.6	119.9	0	0	0	111.6	H149 K173 N174 A182 E183 I325 R372 R374	H149-W178 PolarHBondContact NE2-O 2.87Å; K173-W178 CarbonylContact C-O 3.6Å; K173-W178 WeakPolarHBondContact CA-O 3.31Å; N174-W178 PolarHBondContact N-O 3.22Å; N174-W178 PolarHBondContact OD1-N 2.52Å; N174-W178 PolarHBondContact OD1-O 2.6Å; W178-A182 HydrophobicContact CB-CB 4.21Å; W178-A182 HydrophobicContact CE3-CB 4.25Å; W178-E183 HydrophobicContact CB-CG 4.41Å; W178-E183 WeakPolarHBondContact CB-OE1 3.38Å; W178-I325 HydrophobicContact CE3-CG2 3.93Å; W178-I325 HydrophobicContact CH2-CG2 4.44Å; W178-I325 HydrophobicContact CZ3-CG2 3.66Å; W178-R372 HydrophobicContact CH2-CB 3.55Å; W178-R372 HydrophobicContact CZ2-CB 3.53Å; W178-R374 HydrophobicContact CH2-CB 4.32Å; W178-R374 HydrophobicContact CH2-CG 4.08Å; W178-R374 HydrophobicContact CZ2-CB 4.42Å; W178-R374 HydrophobicContact CZ2-CG 3.7Å
179	S	95.2	Very high	93.9	Very high	27 Å²	27	28 Å²	28	19%	0.189	15%	0.153	C	C	.	.			trans	-101.2	167	173.9	62.7	0	0	0	0	111.4	V172 L181 A182 E183	V172-S179 VanDerWaalsContact O-CA 3.29Å; V172-S179 WeakPolarHBondContact O-CA 3.5Å; V172-S179 WeakPolarHBondContact O-CB 3.33Å; S179-L181 PolarHBondContact O-N 2.61Å; S179-A182 WeakPolarHBondContact O-CA 3.49Å; S179-A182 WeakPolarHBondContact O-CB 3.32Å; S179-A182 PolarHBondContact O-N 3.43Å; S179-A182 PolarHBondContact OG-N 3.02Å; S179-E183 PolarHBondContact O-N 3.13Å
180	P	96.9	Very high	93.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-55.3	-34.5	174.6	-26.6	35.4	0	0	0	113.8	L148 V172 E183 A184 L196	L148-P180 HydrophobicContact CB-CG 4.43Å; L148-P180 HydrophobicContact CD2-CB 3.98Å; L148-P180 HydrophobicContact CD2-CG 4.04Å; L148-P180 HydrophobicContact CG-CB 3.92Å; L148-P180 HydrophobicContact CG-CG 4.14Å; V172-P180 WeakPolarHBondContact O-CD 3.4Å; P180-E183 PolarHBondContact O-N 3.25Å; P180-A184 WeakPolarHBondContact O-CB 3.3Å; P180-A184 PolarHBondContact O-N 3.38Å; P180-L196 HydrophobicContact CB-CD2 4.07Å
181	L	97.1	Very high	93.9	Very high	15 Å²	15	33 Å²	33	8%	0.079	17%	0.173	C	C	.	.	H	α-helix	trans	-64.2	-41.7	173.5	-179.5	60.7	0	0	0	111.8	S179 A184 I185 I193 L196 L197 L200	S179-L181 PolarHBondContact O-N 2.61Å; L181-A184 PolarHBondContact O-N 2.76Å; L181-I185 HydrophobicContact CD1-CD1 4.3Å; L181-I185 HydrophobicContact CD1-CG1 4.47Å; L181-I185 HydrophobicContact CG-CD1 4.08Å; L181-I185 WeakPolarHBondContact O-CD1 3.49Å; L181-I185 VanDerWaalsContact O-CG1 3.24Å; L181-I185 WeakPolarHBondContact O-CG1 3.47Å; L181-I185 PolarHBondContact O-N 2.86Å; L181-I193 HydrophobicContact CD1-CG2 3.9Å; L181-L196 HydrophobicContact CB-CB 4.39Å; L181-L196 HydrophobicContact CD1-CB 3.79Å; L181-L197 HydrophobicContact CD2-CD1 4.36Å; L181-L200 HydrophobicContact CD2-CD2 3.76Å
182	A	95.3	Very high	94.2	Very high	11 Å²	11	26 Å²	26	9%	0.091	14%	0.142	C	C	.	.	H	α-helix	trans	-65.7	-40.9	176.9	0	0	0	0	0	112.4	W178 S179 I185 S186 I325	W178-A182 HydrophobicContact CB-CB 4.21Å; W178-A182 HydrophobicContact CE3-CB 4.25Å; S179-A182 WeakPolarHBondContact O-CA 3.49Å; S179-A182 WeakPolarHBondContact O-CB 3.32Å; S179-A182 PolarHBondContact O-N 3.43Å; S179-A182 PolarHBondContact OG-N 3.02Å; A182-I185 PolarHBondContact O-N 2.94Å; A182-S186 PolarHBondContact O-N 3.36Å; A182-S186 VanDerWaalsContact O-N 3.11Å; A182-I325 HydrophobicContact CB-CG2 3.86Å
183	E	95.6	Very high	94.4	Very high	10 Å²	10	24 Å²	24	5%	0.047	13%	0.131	C	C	.	.	H	α-helix	trans	-67	-35.4	174.8	-58.6	-61.3	167.4	0	0	111.9	V152 M153 N174 W178 S179 P180 S186 Y187 R374	V152-E183 HydrophobicContact CG2-CB 3.68Å; M153-E183 HydrophobicContact CG-CB 3.9Å; M153-E183 HydrophobicContact CG-CG 4.03Å; M153-E183 HydrophobicContact SD-CG 4.29Å; N174-E183 PolarHBondContact ND2-OE1 3.4Å; W178-E183 HydrophobicContact CB-CG 4.41Å; W178-E183 WeakPolarHBondContact CB-OE1 3.38Å; S179-E183 PolarHBondContact O-N 3.13Å; P180-E183 PolarHBondContact O-N 3.25Å; E183-S186 WeakPolarHBondContact O-CB 3.31Å; E183-S186 PolarHBondContact O-N 3Å; E183-Y187 PolarHBondContact O-N 2.71Å; E183-R374 IonicContact OE1-NH1 3.67Å; E183-R374 PolarHBondContact OE1-NH1 3.22Å; E183-R374 IonicContact OE2-CZ 3.7Å; E183-R374 VanDerWaalsContact OE2-CZ 3.24Å; E183-R374 IonicContact OE2-NH1 3.59Å; E183-R374 PolarHBondContact OE2-NH1 3.17Å; E183-R374 IonicContact OE2-NH2 2.69Å; E183-R374 PolarHBondContact OE2-NH2 2.91Å
184	A	96.5	Very high	94.6	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.008	12%	0.116	C	C	.	.	H	α-helix	trans	-69.2	-35.1	175.3	0	0	0	0	0	113.4	V152 P180 L181 Y187 G188 M192 I193 L196	V152-A184 HydrophobicContact CB-CB 4.16Å; V152-A184 HydrophobicContact CG1-CB 4.31Å; P180-A184 WeakPolarHBondContact O-CB 3.3Å; P180-A184 PolarHBondContact O-N 3.38Å; L181-A184 PolarHBondContact O-N 2.76Å; A184-Y187 PolarHBondContact O-N 3.46Å; A184-G188 PolarHBondContact O-N 3.2Å; A184-M192 HydrophobicContact CB-CG 4.21Å; A184-I193 HydrophobicContact CB-CG1 4.13Å; A184-L196 HydrophobicContact CB-CD1 3.33Å
185	I	95.9	Very high	94.8	Very high	9 Å²	9	21.3 Å²	21.3	5%	0.046	12%	0.124	C	C	.	.	H	α-helix	trans	-65.8	-41.3	172.5	-63.1	158.4	0	0	0	110.4	L181 A182 G188 I193 L320 I325 H377	L181-I185 HydrophobicContact CD1-CD1 4.3Å; L181-I185 HydrophobicContact CD1-CG1 4.47Å; L181-I185 HydrophobicContact CG-CD1 4.08Å; L181-I185 WeakPolarHBondContact O-CD1 3.49Å; L181-I185 VanDerWaalsContact O-CG1 3.24Å; L181-I185 WeakPolarHBondContact O-CG1 3.47Å; L181-I185 PolarHBondContact O-N 2.86Å; A182-I185 PolarHBondContact O-N 2.94Å; I185-G188 WeakPolarHBondContact O-CA 3.43Å; I185-G188 PolarHBondContact O-N 3.32Å; I185-I193 HydrophobicContact CB-CD1 4.46Å; I185-I193 HydrophobicContact CG1-CD1 4.16Å; I185-I193 HydrophobicContact CG1-CG1 4.07Å; I185-I193 HydrophobicContact CG1-CG2 3.92Å; I185-L320 HydrophobicContact CD1-CB 3.97Å; I185-L320 HydrophobicContact CD1-CD1 4.29Å; I185-L320 HydrophobicContact CD1-CD2 3.89Å; I185-L320 HydrophobicContact CD1-CG 4.27Å; I185-L320 HydrophobicContact CG1-CB 4.3Å; I185-L320 VanDerWaalsContact CG2-O 3.3Å; I185-L320 WeakPolarHBondContact CG2-O 3.37Å; I185-I325 HydrophobicContact CB-CD1 4.05Å; I185-I325 HydrophobicContact CB-CG1 4.19Å; I185-I325 HydrophobicContact CG2-CD1 3.81Å; I185-I325 HydrophobicContact CG2-CG1 3.74Å; I185-H377 VanDerWaalsContact O-CB 3.29Å; I185-H377 WeakPolarHBondContact O-CB 3.41Å
186	S	95	Very high	95.1	Very high	4 Å²	4	18.1 Å²	18.1	3%	0.028	10%	0.098	C	C	.	.	H	α-helix	trans	-61.9	-42.2	174.6	178.7	0	0	0	0	112.8	A182 E183 G188 R374 E376 R438	A182-S186 PolarHBondContact O-N 3.36Å; A182-S186 VanDerWaalsContact O-N 3.11Å; E183-S186 WeakPolarHBondContact O-CB 3.31Å; E183-S186 PolarHBondContact O-N 3Å; S186-G188 VanDerWaalsContact C-N 3.34Å; S186-R374 PolarHBondContact OG-NH2 2.92Å; S186-E376 WeakPolarHBondContact CB-OE1 3.46Å; S186-E376 WeakPolarHBondContact OG-CG 3.29Å; S186-E376 PolarHBondContact OG-OE1 3.38Å; S186-R438 PolarHBondContact O-NE 3.03Å
187	Y	95	Very high	95.5	Very high	35 Å²	35	16.6 Å²	16.6	14%	0.137	9%	0.091	C	C	.	.	H	α-helix	trans	-62.3	-43.5	171.9	-168.5	-80.4	0	0	0	111	V152 E183 A184 D189 P415 R438	V152-Y187 WeakPolarHBondContact O-CD2 3.46Å; E183-Y187 PolarHBondContact O-N 2.71Å; A184-Y187 PolarHBondContact O-N 3.46Å; Y187-D189 HydrophobicContact CD1-CB 3.89Å; Y187-D189 HydrophobicContact CE1-CB 4.22Å; Y187-P415 HydrophobicContact CD2-CG 4.1Å; Y187-P415 HydrophobicContact CE2-CG 3.71Å; Y187-R438 PolarHBondContact O-NH2 3.1Å
188	G	94.6	Very high	95.7	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.01	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.4	20.1	173.5	0	0	0	0	0	115.1	A184 I185 S186 R190 M321 S411 L412	A184-G188 PolarHBondContact O-N 3.2Å; I185-G188 WeakPolarHBondContact O-CA 3.43Å; I185-G188 PolarHBondContact O-N 3.32Å; S186-G188 VanDerWaalsContact C-N 3.34Å; G188-R190 PolarHBondContact O-N 3.06Å; G188-M321 WeakPolarHBondContact O-CE 3.48Å; G188-S411 CarbonylContact O-C 3.6Å; G188-S411 VanDerWaalsContact O-CA 3.29Å; G188-S411 WeakPolarHBondContact O-CA 3.49Å; G188-L412 PolarHBondContact O-N 2.89Å
189	D	94.9	Very high	95.9	Very high	12 Å²	12	21.5 Å²	21.5	6%	0.064	11%	0.106	C	C	.	.			trans	-88	103.7	177.8	179.6	38.6	0	0	0	111.7	K157 Y187 Q191 M192 I193 S411	K157-D189 WeakPolarHBondContact CE-OD2 3.38Å; K157-D189 IonicContact NZ-OD1 3.31Å; K157-D189 PolarHBondContact NZ-OD1 3.09Å; K157-D189 IonicContact NZ-OD2 2.99Å; K157-D189 PolarHBondContact NZ-OD2 2.96Å; Y187-D189 HydrophobicContact CD1-CB 3.89Å; Y187-D189 HydrophobicContact CE1-CB 4.22Å; D189-Q191 VanDerWaalsContact C-N 3.29Å; D189-Q191 PolarHBondContact O-N 3.34Å; D189-M192 HydrophobicContact CB-CB 4.16Å; D189-M192 PolarHBondContact O-N 2.91Å; D189-M192 VanDerWaalsContact O-N 3.07Å; D189-M192 WeakPolarHBondContact OD2-CB 3.33Å; D189-M192 PolarHBondContact OD2-N 3.3Å; D189-I193 VanDerWaalsContact O-CG1 3.31Å; D189-I193 WeakPolarHBondContact O-CG1 3.35Å; D189-I193 PolarHBondContact O-N 3.48Å; D189-S411 PolarHBondContact OD1-OG 3.36Å
190	R	95.6	Very high	95.7	Very high	18 Å²	18	22.4 Å²	22.4	7%	0.068	11%	0.109	C	C	.	.	H	α-helix	trans	-48.1	-49.9	-177.9	-167.6	-169.2	-174.1	71	10.5	112.5	G188 M192 I193 T194 E314 V317 D318 M321 R409 S411	G188-R190 PolarHBondContact O-N 3.06Å; R190-M192 VanDerWaalsContact C-N 3.29Å; R190-M192 PolarHBondContact O-N 3.07Å; R190-I193 PolarHBondContact O-N 3.24Å; R190-I193 VanDerWaalsContact O-N 3.12Å; R190-T194 PolarHBondContact O-N 2.78Å; R190-T194 PolarHBondContact O-OG1 2.99Å; R190-E314 IonicContact CZ-OE2 3.19Å; R190-E314 IonicContact NE-OE1 3.25Å; R190-E314 IonicContact NE-OE2 3.66Å; R190-E314 PolarHBondContact NE-OE2 2.8Å; R190-E314 VanDerWaalsContact NH2-CD 3.33Å; R190-E314 PolarHBondContact NH2-O 3.28Å; R190-E314 IonicContact NH2-OE1 2.68Å; R190-E314 IonicContact NH2-OE2 2.77Å; R190-E314 PolarHBondContact NH2-OE2 3.13Å; R190-V317 HydrophobicContact CG-CG1 3.67Å; R190-D318 IonicContact CZ-OD1 3.73Å; R190-D318 IonicContact NH1-OD1 3.46Å; R190-D318 PolarHBondContact NH1-OD1 3.25Å; R190-D318 IonicContact NH1-OD2 2.71Å; R190-D318 IonicContact NH2-OD1 2.69Å; R190-D318 PolarHBondContact NH2-OD1 3.21Å; R190-D318 IonicContact NH2-OD2 3.59Å; R190-D318 PolarHBondContact NH2-OD2 3.02Å; R190-M321 HydrophobicContact CB-SD 4.06Å; R190-M321 HydrophobicContact CG-SD 4.13Å; R190-R409 WeakPolarHBondContact CD-O 3.24Å; R190-R409 PolarHBondContact NH1-O 3.22Å; R190-S411 WeakPolarHBondContact CB-OG 3.15Å; R190-S411 PolarHBondContact N-OG 3.46Å
191	Q	96.2	Very high	95.3	Very high	127 Å²	127	24 Å²	24	59%	0.593	12%	0.116	S	C	*	.	H	α-helix	trans	-61.3	-38.1	-175.6	-67	175.9	-13.5	0	0	112.3	D189 A195	D189-Q191 VanDerWaalsContact C-N 3.29Å; D189-Q191 PolarHBondContact O-N 3.34Å; Q191-A195 WeakPolarHBondContact O-CB 3.38Å; Q191-A195 PolarHBondContact O-N 3.37Å
192	M	97.6	Very high	94.9	Very high	7 Å²	7	27.2 Å²	27.2	3%	0.034	13%	0.13	C	C	.	.	H	α-helix	trans	-72.4	-39.6	175.8	-169.1	52.7	53.7	0	0	111.9	V152 K157 A160 H161 L164 A184 D189 R190 A195 L196	V152-M192 HydrophobicContact CG1-CG 3.89Å; V152-M192 HydrophobicContact CG1-SD 4.18Å; K157-M192 HydrophobicContact CB-CE 4.14Å; K157-M192 HydrophobicContact CG-CE 4.46Å; A160-M192 HydrophobicContact CB-CE 3.6Å; A160-M192 HydrophobicContact CB-SD 3.6Å; A160-M192 VanDerWaalsContact CB-SD 3.6Å; H161-M192 WeakPolarHBondContact NE2-CE 3.25Å; L164-M192 HydrophobicContact CD1-SD 4.25Å; A184-M192 HydrophobicContact CB-CG 4.21Å; D189-M192 HydrophobicContact CB-CB 4.16Å; D189-M192 PolarHBondContact O-N 2.91Å; D189-M192 VanDerWaalsContact O-N 3.07Å; D189-M192 WeakPolarHBondContact OD2-CB 3.33Å; D189-M192 PolarHBondContact OD2-N 3.3Å; R190-M192 VanDerWaalsContact C-N 3.29Å; R190-M192 PolarHBondContact O-N 3.07Å; M192-A195 PolarHBondContact O-N 3.25Å; M192-L196 HydrophobicContact CG-CD1 3.8Å; M192-L196 WeakPolarHBondContact O-CB 3.49Å; M192-L196 WeakPolarHBondContact O-CD1 3.48Å; M192-L196 VanDerWaalsContact O-CG 3.31Å; M192-L196 WeakPolarHBondContact O-CG 3.46Å; M192-L196 PolarHBondContact O-N 3.31Å; M192-L196 HydrophobicContact SD-CD1 4.15Å; M192-L196 HydrophobicContact SD-CG 4.37Å
193	I	97.6	Very high	94.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-50.3	174.5	-58.7	161.6	0	0	0	110.1	L181 A184 I185 D189 R190 A195 L196 L197 V317 L320 M321	L181-I193 HydrophobicContact CD1-CG2 3.9Å; A184-I193 HydrophobicContact CB-CG1 4.13Å; I185-I193 HydrophobicContact CB-CD1 4.46Å; I185-I193 HydrophobicContact CG1-CD1 4.16Å; I185-I193 HydrophobicContact CG1-CG1 4.07Å; I185-I193 HydrophobicContact CG1-CG2 3.92Å; D189-I193 VanDerWaalsContact O-CG1 3.31Å; D189-I193 WeakPolarHBondContact O-CG1 3.35Å; D189-I193 PolarHBondContact O-N 3.48Å; R190-I193 PolarHBondContact O-N 3.24Å; R190-I193 VanDerWaalsContact O-N 3.12Å; I193-A195 VanDerWaalsContact C-N 3.34Å; I193-A195 PolarHBondContact O-N 3.11Å; I193-L196 PolarHBondContact O-N 3.07Å; I193-L197 VanDerWaalsContact O-CB 3.26Å; I193-L197 WeakPolarHBondContact O-CB 3.41Å; I193-L197 PolarHBondContact O-N 3.13Å; I193-V317 HydrophobicContact CB-CG1 4.32Å; I193-V317 HydrophobicContact CG2-CG1 4.04Å; I193-V317 HydrophobicContact CG2-CG2 4.16Å; I193-L320 HydrophobicContact CG2-CD1 4.33Å; I193-M321 HydrophobicContact CD1-CG 3.73Å; I193-M321 HydrophobicContact CD1-SD 3.91Å
194	T	96.4	Very high	94.1	Very high	10 Å²	10	30.2 Å²	30.2	6%	0.061	15%	0.148	C	C	.	.	H	α-helix	trans	-57	-45.2	175.6	-50.7	0	0	0	0	111.2	R190 L197 R198 T313 E314	R190-T194 PolarHBondContact O-N 2.78Å; R190-T194 PolarHBondContact O-OG1 2.99Å; T194-L197 PolarHBondContact O-N 2.85Å; T194-R198 WeakPolarHBondContact O-CB 3.46Å; T194-R198 VanDerWaalsContact O-CG 3.31Å; T194-R198 WeakPolarHBondContact O-CG 3.36Å; T194-R198 PolarHBondContact O-N 2.9Å; T194-T313 HydrophobicContact CG2-CG2 3.96Å; T194-E314 PolarHBondContact OG1-OE1 2.67Å; T194-E314 VanDerWaalsContact OG1-OE1 3.06Å
195	A	97	Very high	93.3	Very high	27 Å²	27	34.4 Å²	34.4	22%	0.223	16%	0.164	C	C	.	.	H	α-helix	trans	-64.2	-41.6	178.9	0	0	0	0	0	112.9	L164 Q191 M192 I193 K199	L164-A195 HydrophobicContact CD1-CB 4.25Å; Q191-A195 WeakPolarHBondContact O-CB 3.38Å; Q191-A195 PolarHBondContact O-N 3.37Å; M192-A195 PolarHBondContact O-N 3.25Å; I193-A195 VanDerWaalsContact C-N 3.34Å; I193-A195 PolarHBondContact O-N 3.11Å; A195-K199 WeakPolarHBondContact O-CB 3.47Å; A195-K199 PolarHBondContact O-N 2.81Å
196	L	97.4	Very high	92.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.5	-38	177	-76.8	158.7	0	0	0	112.5	L148 V152 L164 V170 P180 L181 A184 M192 I193 K199 L200	L148-L196 HydrophobicContact CD2-CD2 4Å; L148-L196 HydrophobicContact CG-CD2 4.45Å; V152-L196 HydrophobicContact CG1-CD1 3.85Å; L164-L196 HydrophobicContact CD1-CD2 4.3Å; L164-L196 HydrophobicContact CD1-CG 4.36Å; L164-L196 HydrophobicContact CD2-CD2 3.79Å; V170-L196 HydrophobicContact CB-CD2 4.34Å; V170-L196 HydrophobicContact CG1-CD2 4.06Å; P180-L196 HydrophobicContact CB-CD2 4.07Å; L181-L196 HydrophobicContact CB-CB 4.39Å; L181-L196 HydrophobicContact CD1-CB 3.79Å; A184-L196 HydrophobicContact CB-CD1 3.33Å; M192-L196 HydrophobicContact CG-CD1 3.8Å; M192-L196 WeakPolarHBondContact O-CB 3.49Å; M192-L196 WeakPolarHBondContact O-CD1 3.48Å; M192-L196 VanDerWaalsContact O-CG 3.31Å; M192-L196 WeakPolarHBondContact O-CG 3.46Å; M192-L196 PolarHBondContact O-N 3.31Å; M192-L196 HydrophobicContact SD-CD1 4.15Å; M192-L196 HydrophobicContact SD-CG 4.37Å; I193-L196 PolarHBondContact O-N 3.07Å; L196-K199 PolarHBondContact O-N 3.2Å; L196-L200 VanDerWaalsContact O-CB 3.29Å; L196-L200 WeakPolarHBondContact O-CB 3.35Å; L196-L200 PolarHBondContact O-N 2.93Å
197	L	94.6	Very high	92.3	Very high	10 Å²	10	39.8 Å²	39.8	5%	0.052	19%	0.193	C	C	.	.	H	α-helix	trans	-65.7	-50	177.4	-179	60.6	0	0	0	111.1	L181 I193 T194 K199 L200 K201 T313 E316 V317 L320	L181-L197 HydrophobicContact CD2-CD1 4.36Å; I193-L197 VanDerWaalsContact O-CB 3.26Å; I193-L197 WeakPolarHBondContact O-CB 3.41Å; I193-L197 PolarHBondContact O-N 3.13Å; T194-L197 PolarHBondContact O-N 2.85Å; L197-K199 VanDerWaalsContact C-N 3.28Å; L197-K199 PolarHBondContact O-N 3.29Å; L197-L200 WeakPolarHBondContact O-CB 3.49Å; L197-L200 PolarHBondContact O-N 3.47Å; L197-L200 VanDerWaalsContact O-N 3.16Å; L197-K201 HydrophobicContact CD1-CD 4.3Å; L197-K201 HydrophobicContact CG-CD 4.32Å; L197-K201 PolarHBondContact O-N 2.71Å; L197-T313 HydrophobicContact CD2-CG2 4.39Å; L197-E316 WeakPolarHBondContact CD1-OE2 2.99Å; L197-E316 HydrophobicContact CD2-CB 3.85Å; L197-E316 WeakPolarHBondContact CD2-OE2 2.92Å; L197-V317 HydrophobicContact CD2-CG2 3.69Å; L197-L320 HydrophobicContact CD1-CD1 4.39Å; L197-L320 HydrophobicContact CD2-CD1 4.21Å
198	R	93.6	Very high	91.5	Very high	103 Å²	103	42.1 Å²	42.1	39%	0.389	21%	0.211	S	C	.	.	H	α-helix	trans	-55.3	-43.6	172.1	-72.5	173.7	175	-177.8	-2.8	111.2	T194 K201 Q202 E310 T313	T194-R198 WeakPolarHBondContact O-CB 3.46Å; T194-R198 VanDerWaalsContact O-CG 3.31Å; T194-R198 WeakPolarHBondContact O-CG 3.36Å; T194-R198 PolarHBondContact O-N 2.9Å; R198-K201 PolarHBondContact O-N 3.08Å; R198-Q202 WeakPolarHBondContact O-CB 3.07Å; R198-Q202 PolarHBondContact O-N 2.69Å; R198-E310 IonicContact CZ-OE1 3.59Å; R198-E310 IonicContact NH1-OE1 3.17Å; R198-E310 PolarHBondContact NH1-OE1 2.69Å; R198-E310 IonicContact NH2-OE1 3.31Å; R198-E310 PolarHBondContact NH2-OE1 3Å; R198-T313 HydrophobicContact CG-CG2 3.93Å
199	K	94.8	Very high	91	Very high	25 Å²	25	46 Å²	46	11%	0.109	23%	0.229	C	C	.	.	H	α-helix	trans	-70.7	-32.4	178.6	-162.2	70.6	-166.4	163.2	0	113.5	L164 N167 V170 A195 L196 L197 Q203	L164-K199 HydrophobicContact CD2-CB 4.01Å; L164-K199 HydrophobicContact CD2-CG 3.82Å; L164-K199 WeakPolarHBondContact O-CE 3.44Å; N167-K199 WeakPolarHBondContact OD1-CE 3.45Å; N167-K199 PolarHBondContact OD1-NZ 3.01Å; V170-K199 HydrophobicContact CG1-CB 4.28Å; V170-K199 HydrophobicContact CG1-CG 4.03Å; A195-K199 WeakPolarHBondContact O-CB 3.47Å; A195-K199 PolarHBondContact O-N 2.81Å; L196-K199 PolarHBondContact O-N 3.2Å; L197-K199 VanDerWaalsContact C-N 3.28Å; L197-K199 PolarHBondContact O-N 3.29Å; K199-Q203 WeakPolarHBondContact O-CB 3.47Å; K199-Q203 WeakPolarHBondContact O-CG 3.37Å; K199-Q203 PolarHBondContact O-N 3.23Å
200	L	92.4	Very high	90.6	Very high	46 Å²	46	52.9 Å²	52.9	24%	0.241	26%	0.261	C	S	.	.	H	α-helix	trans	-66.1	-46.1	174.5	175.3	62	0	0	0	110.9	V170 K171 L181 L196 L197 Q203 S204	V170-L200 HydrophobicContact CG2-CB 3.54Å; V170-L200 HydrophobicContact CG2-CD1 3.86Å; V170-L200 HydrophobicContact CG2-CG 4.29Å; K171-L200 HydrophobicContact CB-CD1 3.99Å; K171-L200 HydrophobicContact CD-CD1 4.45Å; K171-L200 HydrophobicContact CG-CD1 4.31Å; L181-L200 HydrophobicContact CD2-CD2 3.76Å; L196-L200 VanDerWaalsContact O-CB 3.29Å; L196-L200 WeakPolarHBondContact O-CB 3.35Å; L196-L200 PolarHBondContact O-N 2.93Å; L197-L200 WeakPolarHBondContact O-CB 3.49Å; L197-L200 PolarHBondContact O-N 3.47Å; L197-L200 VanDerWaalsContact O-N 3.16Å; L200-Q203 PolarHBondContact O-N 2.67Å; L200-S204 WeakPolarHBondContact O-CB 3.36Å; L200-S204 PolarHBondContact O-N 3.4Å
201	K	87.3	Confident	90.1	Very high	34 Å²	34	55.3 Å²	55.3	15%	0.148	27%	0.272	C	S	.	.	H	α-helix	trans	-62.7	-46.1	175.8	-74.9	167.6	145.6	-179	0	111	L197 R198 S204 R205 E308 E316	L197-K201 HydrophobicContact CD1-CD 4.3Å; L197-K201 HydrophobicContact CG-CD 4.32Å; L197-K201 PolarHBondContact O-N 2.71Å; R198-K201 PolarHBondContact O-N 3.08Å; K201-S204 PolarHBondContact O-N 3.07Å; K201-R205 WeakPolarHBondContact O-CD 3.5Å; K201-R205 VanDerWaalsContact O-CG 3.25Å; K201-R205 WeakPolarHBondContact O-CG 3.5Å; K201-R205 PolarHBondContact O-N 3.22Å; K201-E308 WeakPolarHBondContact CD-OE1 3.26Å; K201-E308 WeakPolarHBondContact CD-OE2 3.34Å; K201-E308 VanDerWaalsContact CE-CD 3.49Å; K201-E308 VanDerWaalsContact CE-OE1 3.25Å; K201-E308 WeakPolarHBondContact CE-OE1 3.29Å; K201-E308 WeakPolarHBondContact CE-OE2 3.36Å; K201-E308 VanDerWaalsContact NZ-CD 3.31Å; K201-E308 IonicContact NZ-OE1 2.69Å; K201-E308 IonicContact NZ-OE2 2.67Å; K201-E308 PolarHBondContact NZ-OE2 3.35Å; K201-E316 WeakPolarHBondContact CE-OE2 3.41Å; K201-E316 IonicContact NZ-OE1 2.6Å; K201-E316 PolarHBondContact NZ-OE1 3.25Å; K201-E316 IonicContact NZ-OE2 3.34Å; K201-E316 PolarHBondContact NZ-OE2 2.99Å
202	Q	89.3	Confident	89.6	Confident	82 Å²	82	50.5 Å²	50.5	38%	0.383	25%	0.248	S	C	.	.	H	α-helix	trans	-54.9	-56.9	171.7	-177.8	-177.7	4.5	0	0	112.4	R198 S204 R205 E206	R198-Q202 WeakPolarHBondContact O-CB 3.07Å; R198-Q202 PolarHBondContact O-N 2.69Å; Q202-S204 PolarHBondContact O-N 3.25Å; Q202-R205 PolarHBondContact O-N 2.88Å; Q202-R205 VanDerWaalsContact O-N 3.11Å; Q202-E206 HydrophobicContact CG-CG 4.28Å; Q202-E206 VanDerWaalsContact CG-OE1 3.29Å; Q202-E206 WeakPolarHBondContact CG-OE1 3.32Å; Q202-E206 PolarHBondContact NE2-OE1 3.07Å; Q202-E206 WeakPolarHBondContact O-CG 3.37Å; Q202-E206 PolarHBondContact O-N 2.9Å
203	Q	90.3	Very high	89.2	Confident	30 Å²	30	54.5 Å²	54.5	14%	0.14	28%	0.275	C	S	.	.	H	α-helix	trans	-62	-30.8	-178.4	-76.9	179.3	-0.8	0	0	112.7	N167 A168 K199 L200 S207	N167-Q203 PolarHBondContact O-NE2 3.13Å; N167-Q203 PolarHBondContact OD1-NE2 2.92Å; A168-Q203 PolarHBondContact O-NE2 2.76Å; K199-Q203 WeakPolarHBondContact O-CB 3.47Å; K199-Q203 WeakPolarHBondContact O-CG 3.37Å; K199-Q203 PolarHBondContact O-N 3.23Å; L200-Q203 PolarHBondContact O-N 2.67Å; Q203-S207 VanDerWaalsContact O-CB 3.26Å; Q203-S207 WeakPolarHBondContact O-CB 3.22Å; Q203-S207 PolarHBondContact O-N 3.33Å
204	S	84.8	Confident	88.8	Confident	54 Å²	54	63.4 Å²	63.4	38%	0.378	31%	0.308	S	S	.	.	H	α-helix	trans	-68.6	-41.4	175.3	-160.3	0	0	0	0	111.8	L200 K201 Q202 V208	L200-S204 WeakPolarHBondContact O-CB 3.36Å; L200-S204 PolarHBondContact O-N 3.4Å; K201-S204 PolarHBondContact O-N 3.07Å; Q202-S204 PolarHBondContact O-N 3.25Å; S204-V208 WeakPolarHBondContact O-CG2 3.41Å; S204-V208 PolarHBondContact O-N 2.82Å
205	R	79.6	Confident	88.2	Confident	89 Å²	89	63.6 Å²	63.6	34%	0.336	31%	0.309	S	S	.	.	H	α-helix	trans	-68.1	-47.6	176.6	-63.6	159.3	-176.8	-150.6	-3.5	111.3	K201 Q202 S207 V208 E209 H306 E308	K201-R205 WeakPolarHBondContact O-CD 3.5Å; K201-R205 VanDerWaalsContact O-CG 3.25Å; K201-R205 WeakPolarHBondContact O-CG 3.5Å; K201-R205 PolarHBondContact O-N 3.22Å; Q202-R205 PolarHBondContact O-N 2.88Å; Q202-R205 VanDerWaalsContact O-N 3.11Å; R205-S207 VanDerWaalsContact C-N 3.29Å; R205-S207 PolarHBondContact O-N 3.06Å; R205-V208 PolarHBondContact O-N 2.89Å; R205-V208 VanDerWaalsContact O-N 3.1Å; R205-E209 PolarHBondContact O-N 3.23Å; R205-H306 PolarHBondContact NH1-O 3.33Å; R205-H306 PolarHBondContact NH2-O 3.32Å; R205-E308 IonicContact CZ-OE1 2.77Å; R205-E308 VanDerWaalsContact NH2-CD 3.27Å; R205-E308 IonicContact NH2-OE1 3.17Å; R205-E308 PolarHBondContact NH2-OE1 2.85Å
206	E	86.3	Confident	87.9	Confident	80 Å²	80	63.9 Å²	63.9	37%	0.374	31%	0.306	S	S	.	.	H	α-helix	trans	-54	-44.5	174.6	-72.6	173.9	175.9	0	0	111.6	N167 Q202 V208 E209 E210	N167-E206 PolarHBondContact ND2-OE2 3.33Å; Q202-E206 HydrophobicContact CG-CG 4.28Å; Q202-E206 VanDerWaalsContact CG-OE1 3.29Å; Q202-E206 WeakPolarHBondContact CG-OE1 3.32Å; Q202-E206 PolarHBondContact NE2-OE1 3.07Å; Q202-E206 WeakPolarHBondContact O-CG 3.37Å; Q202-E206 PolarHBondContact O-N 2.9Å; E206-V208 VanDerWaalsContact C-N 3.35Å; E206-V208 PolarHBondContact O-N 3.15Å; E206-E209 PolarHBondContact O-N 2.82Å; E206-E210 WeakPolarHBondContact O-CB 3.43Å; E206-E210 PolarHBondContact O-N 2.91Å
207	S	84	Confident	87.6	Confident	46 Å²	46	69.9 Å²	69.9	32%	0.322	33%	0.332	S	S	.	.	H	α-helix	trans	-75.3	-17.1	-179.6	-167.8	0	0	0	0	114.6	Q203 R205 K211	Q203-S207 VanDerWaalsContact O-CB 3.26Å; Q203-S207 WeakPolarHBondContact O-CB 3.22Å; Q203-S207 PolarHBondContact O-N 3.33Å; R205-S207 VanDerWaalsContact C-N 3.29Å; R205-S207 PolarHBondContact O-N 3.06Å; S207-K211 VanDerWaalsContact O-CD 3.23Å; S207-K211 WeakPolarHBondContact O-CD 3.29Å; S207-K211 WeakPolarHBondContact O-CE 3.42Å; S207-K211 VanDerWaalsContact O-CG 3.27Å; S207-K211 WeakPolarHBondContact O-CG 3.39Å
208	V	78.1	Confident	87.2	Confident	83 Å²	83	70 Å²	70	50%	0.503	34%	0.335	S	S	.	.	H	α-helix	trans	-78.6	-46.3	168.2	169	0	0	0	0	109.6	S204 R205 E206 K211 R212	S204-V208 WeakPolarHBondContact O-CG2 3.41Å; S204-V208 PolarHBondContact O-N 2.82Å; R205-V208 PolarHBondContact O-N 2.89Å; R205-V208 VanDerWaalsContact O-N 3.1Å; E206-V208 VanDerWaalsContact C-N 3.35Å; E206-V208 PolarHBondContact O-N 3.15Å; V208-K211 PolarHBondContact O-N 2.59Å; V208-K211 VanDerWaalsContact O-N 3.13Å; V208-R212 PolarHBondContact O-N 3.17Å
209	E	82.3	Confident	87.1	Confident	83 Å²	83	65.1 Å²	65.1	39%	0.388	32%	0.317	S	S	.	.	H	α-helix	trans	-68	-39.9	-177.4	-167.2	55.3	-150.4	0	0	112.6	R205 E206 K211 R212 P213 P287	R205-E209 PolarHBondContact O-N 3.23Å; E206-E209 PolarHBondContact O-N 2.82Å; E209-K211 PolarHBondContact O-N 2.89Å; E209-K211 VanDerWaalsContact O-N 3.14Å; E209-R212 WeakPolarHBondContact O-CB 3.33Å; E209-R212 PolarHBondContact O-N 3.05Å; E209-R212 WeakPolarHBondContact OE1-CD 3.13Å; E209-R212 WeakPolarHBondContact OE2-CD 3.38Å; E209-P213 WeakPolarHBondContact O-CD 3.23Å; E209-P287 WeakPolarHBondContact OE1-CG 3.38Å; E209-P287 WeakPolarHBondContact OE2-CB 3.27Å; E209-P287 WeakPolarHBondContact OE2-CG 3.44Å
210	E	87.3	Confident	86.9	Confident	156 Å²	156	71.8 Å²	71.8	73%	0.729	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-35	171.6	-174.3	-170.9	-171.1	0	0	112.2	E206	E206-E210 WeakPolarHBondContact O-CB 3.43Å; E206-E210 PolarHBondContact O-N 2.91Å
211	K	84.8	Confident	86.7	Confident	69 Å²	69	76.3 Å²	76.3	30%	0.3	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-20.7	179.1	-64.8	172.6	-169.5	168.3	0	113.6	S207 V208 E209 P213 R214 L215 E471	S207-K211 VanDerWaalsContact O-CD 3.23Å; S207-K211 WeakPolarHBondContact O-CD 3.29Å; S207-K211 WeakPolarHBondContact O-CE 3.42Å; S207-K211 VanDerWaalsContact O-CG 3.27Å; S207-K211 WeakPolarHBondContact O-CG 3.39Å; V208-K211 PolarHBondContact O-N 2.59Å; V208-K211 VanDerWaalsContact O-N 3.13Å; E209-K211 PolarHBondContact O-N 2.89Å; E209-K211 VanDerWaalsContact O-N 3.14Å; K211-P213 VanDerWaalsContact C-CD 3.47Å; K211-P213 VanDerWaalsContact C-N 3.33Å; K211-R214 WeakPolarHBondContact O-CA 3.43Å; K211-R214 WeakPolarHBondContact O-CB 3.31Å; K211-R214 PolarHBondContact O-N 3.32Å; K211-L215 HydrophobicContact CB-CD1 3.9Å; K211-L215 HydrophobicContact CB-CG 4.22Å; K211-L215 PolarHBondContact O-N 3.35Å; K211-E471 IonicContact NZ-OE1 3.2Å; K211-E471 PolarHBondContact NZ-OE1 2.9Å
212	R	86.1	Confident	86.7	Confident	27 Å²	27	75.3 Å²	75.3	10%	0.102	36%	0.362	C	S	.	.	H	α-helix	trans	-48.4	-46.4	-172.4	-173.6	-178.4	-179.8	95.3	6.6	112.5	V208 E209 R214 L215 L216 N282 G283 A285 S290	V208-R212 PolarHBondContact O-N 3.17Å; E209-R212 WeakPolarHBondContact O-CB 3.33Å; E209-R212 PolarHBondContact O-N 3.05Å; E209-R212 WeakPolarHBondContact OE1-CD 3.13Å; E209-R212 WeakPolarHBondContact OE2-CD 3.38Å; R212-R214 VanDerWaalsContact C-N 3.34Å; R212-R214 PolarHBondContact O-N 3.01Å; R212-L215 PolarHBondContact O-N 2.76Å; R212-L216 HydrophobicContact CG-CD1 3.96Å; R212-L216 HydrophobicContact CG-CG 4.2Å; R212-L216 WeakPolarHBondContact O-CG 3.44Å; R212-L216 PolarHBondContact O-N 2.79Å; R212-N282 PolarHBondContact NH2-O 3.35Å; R212-G283 PolarHBondContact NH2-O 2.64Å; R212-A285 PolarHBondContact NH2-O 3.4Å; R212-S290 PolarHBondContact NH1-OG 2.83Å; R212-S290 VanDerWaalsContact NH2-CB 3.34Å
213	P	89.3	Confident	86.8	Confident	91 Å²	91	73.1 Å²	73.1	59%	0.591	36%	0.362	S	S	*	.	H	α-helix	trans	-63.1	-35.7	178.7	-22.8	34.8	0	0	0	114	E209 K211 K217	E209-P213 WeakPolarHBondContact O-CD 3.23Å; K211-P213 VanDerWaalsContact C-CD 3.47Å; K211-P213 VanDerWaalsContact C-N 3.33Å; P213-K217 WeakPolarHBondContact O-CB 3.33Å; P213-K217 PolarHBondContact O-N 2.76Å; P213-K217 VanDerWaalsContact O-N 3.14Å
214	R	88.4	Confident	87	Confident	187 Å²	187	74.1 Å²	74.1	71%	0.706	37%	0.368	S	S	*	.	H	α-helix	trans	-71.2	-40.9	176.1	176.4	178.8	169.1	172.5	-2.6	111.2	K211 R212 K217 A218	K211-R214 WeakPolarHBondContact O-CA 3.43Å; K211-R214 WeakPolarHBondContact O-CB 3.31Å; K211-R214 PolarHBondContact O-N 3.32Å; R212-R214 VanDerWaalsContact C-N 3.34Å; R212-R214 PolarHBondContact O-N 3.01Å; R214-K217 PolarHBondContact O-N 2.87Å; R214-A218 WeakPolarHBondContact O-CB 3.25Å; R214-A218 PolarHBondContact O-N 2.82Å
215	L	85.2	Confident	87.5	Confident	14 Å²	14	71.6 Å²	71.6	7%	0.073	35%	0.35	C	S	.	.	H	α-helix	trans	-66	-49.1	179.1	-67	169.5	0	0	0	111	K211 R212 K217 A218 L219 E471 V472	K211-L215 HydrophobicContact CB-CD1 3.9Å; K211-L215 HydrophobicContact CB-CG 4.22Å; K211-L215 PolarHBondContact O-N 3.35Å; R212-L215 PolarHBondContact O-N 2.76Å; L215-K217 VanDerWaalsContact C-N 3.3Å; L215-K217 PolarHBondContact O-N 3.38Å; L215-A218 PolarHBondContact O-N 3.35Å; L215-L219 WeakPolarHBondContact O-CG 3.49Å; L215-L219 PolarHBondContact O-N 3.36Å; L215-E471 HydrophobicContact CD1-CG 4.03Å; L215-E471 HydrophobicContact CD2-CB 3.92Å; L215-E471 HydrophobicContact CD2-CG 3.84Å; L215-V472 HydrophobicContact CB-CG2 4.08Å; L215-V472 HydrophobicContact CD1-CG2 4.33Å; L215-V472 HydrophobicContact CD2-CG2 4.41Å
216	L	90.4	Very high	88.2	Confident	33 Å²	33	67.9 Å²	67.9	17%	0.173	34%	0.336	C	S	.	.	H	α-helix	trans	-59.7	-40	176.2	-65.6	-180	0	0	0	112	R212 L219 K220 I256 F281 G283	R212-L216 HydrophobicContact CG-CD1 3.96Å; R212-L216 HydrophobicContact CG-CG 4.2Å; R212-L216 WeakPolarHBondContact O-CG 3.44Å; R212-L216 PolarHBondContact O-N 2.79Å; L216-L219 PolarHBondContact O-N 2.74Å; L216-K220 WeakPolarHBondContact O-CB 3.41Å; L216-K220 PolarHBondContact O-N 2.99Å; L216-I256 HydrophobicContact CD2-CB 4.33Å; L216-I256 HydrophobicContact CD2-CD1 4.33Å; L216-I256 WeakPolarHBondContact O-CG2 3.25Å; L216-F281 HydrophobicContact CD2-CE1 3.82Å; L216-F281 HydrophobicContact CD2-CZ 3.82Å; L216-G283 WeakPolarHBondContact CD1-O 2.92Å
217	K	90.3	Very high	88.6	Confident	125 Å²	125	64 Å²	64	54%	0.543	32%	0.318	S	S	.	.	H	α-helix	trans	-60.2	-48.3	171.8	179.8	179.5	169.8	-177.8	0	111.6	P213 R214 L215 L219 K220 E221	P213-K217 WeakPolarHBondContact O-CB 3.33Å; P213-K217 PolarHBondContact O-N 2.76Å; P213-K217 VanDerWaalsContact O-N 3.14Å; R214-K217 PolarHBondContact O-N 2.87Å; L215-K217 VanDerWaalsContact C-N 3.3Å; L215-K217 PolarHBondContact O-N 3.38Å; K217-L219 VanDerWaalsContact C-N 3.33Å; K217-L219 PolarHBondContact O-N 3.03Å; K217-K220 PolarHBondContact O-N 2.94Å; K217-K220 VanDerWaalsContact O-N 3.1Å; K217-E221 WeakPolarHBondContact CE-OE1 3.27Å; K217-E221 WeakPolarHBondContact CE-OE2 3.48Å; K217-E221 IonicContact NZ-OE1 2.76Å; K217-E221 PolarHBondContact NZ-OE1 3.46Å; K217-E221 PolarHBondContact O-N 2.92Å
218	A	87.9	Confident	89.1	Confident	14 Å²	14	63.6 Å²	63.6	12%	0.116	31%	0.311	C	S	.	.	H	α-helix	trans	-64.2	-35.2	-179.5	0	0	0	0	0	112.7	R214 L215 L222 N468	R214-A218 WeakPolarHBondContact O-CB 3.25Å; R214-A218 PolarHBondContact O-N 2.82Å; L215-A218 PolarHBondContact O-N 3.35Å; A218-L222 WeakPolarHBondContact O-CB 3.43Å; A218-L222 PolarHBondContact O-N 2.91Å; A218-N468 HydrophobicContact CB-CB 4.02Å
219	L	90.1	Very high	89.7	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.5	-38.9	170.9	-65.6	-173.4	0	0	0	111.9	L215 L216 K217 L222 K253 G255 I256 I258 F281 V469 V472	L215-L219 WeakPolarHBondContact O-CG 3.49Å; L215-L219 PolarHBondContact O-N 3.36Å; L216-L219 PolarHBondContact O-N 2.74Å; K217-L219 VanDerWaalsContact C-N 3.33Å; K217-L219 PolarHBondContact O-N 3.03Å; L219-L222 HydrophobicContact CD2-CD2 4.34Å; L219-L222 WeakPolarHBondContact O-CB 3.4Å; L219-L222 PolarHBondContact O-N 3.16Å; L219-K253 WeakPolarHBondContact O-CE 3.41Å; L219-K253 PolarHBondContact O-NZ 3.49Å; L219-G255 CarbonylContact C-O 3.59Å; L219-G255 VanDerWaalsContact O-O 3.07Å; L219-I256 HydrophobicContact CB-CB 4.45Å; L219-I256 HydrophobicContact CB-CG2 4.35Å; L219-I256 WeakPolarHBondContact CD1-O 3.48Å; L219-I258 HydrophobicContact CD1-CD1 3.83Å; L219-I258 HydrophobicContact CD1-CG1 4.25Å; L219-I258 HydrophobicContact CD2-CD1 3.87Å; L219-F281 HydrophobicContact CD1-CD1 4.46Å; L219-F281 HydrophobicContact CD1-CE1 4.09Å; L219-V469 HydrophobicContact CD2-CG2 4.26Å; L219-V472 HydrophobicContact CD1-CG2 4.19Å
220	K	90.6	Very high	90.1	Very high	165 Å²	165	58.5 Å²	58.5	72%	0.717	28%	0.281	S	S	*	.	H	α-helix	trans	-70.7	-29.2	178.5	-166.6	167.3	-175.1	165.1	0	113.7	L216 K217 L222 I256	L216-K220 WeakPolarHBondContact O-CB 3.41Å; L216-K220 PolarHBondContact O-N 2.99Å; K217-K220 PolarHBondContact O-N 2.94Å; K217-K220 VanDerWaalsContact O-N 3.1Å; K220-L222 VanDerWaalsContact C-N 3.28Å; K220-I256 HydrophobicContact CB-CG2 3.73Å; K220-I256 HydrophobicContact CG-CG2 4.35Å
221	E	89.4	Confident	90.1	Very high	141 Å²	141	51.7 Å²	51.7	66%	0.659	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-10.7	172.7	-69.8	176.6	154.4	0	0	112.5	K217	K217-E221 WeakPolarHBondContact CE-OE1 3.27Å; K217-E221 WeakPolarHBondContact CE-OE2 3.48Å; K217-E221 IonicContact NZ-OE1 2.76Å; K217-E221 PolarHBondContact NZ-OE1 3.46Å; K217-E221 PolarHBondContact O-N 2.92Å
222	L	87.1	Confident	90.2	Very high	12 Å²	12	51.5 Å²	51.5	6%	0.063	25%	0.251	C	S	.	.	S	Bend	trans	-83.1	139.1	174.7	-153.9	58.7	0	0	0	110.1	A218 L219 K220 F225 K253 L461 L465 V469	A218-L222 WeakPolarHBondContact O-CB 3.43Å; A218-L222 PolarHBondContact O-N 2.91Å; L219-L222 HydrophobicContact CD2-CD2 4.34Å; L219-L222 WeakPolarHBondContact O-CB 3.4Å; L219-L222 PolarHBondContact O-N 3.16Å; K220-L222 VanDerWaalsContact C-N 3.28Å; L222-F225 HydrophobicContact CD2-CE1 3.65Å; L222-F225 HydrophobicContact CD2-CZ 4.45Å; L222-F225 HydrophobicContact CG-CE1 4.11Å; L222-K253 HydrophobicContact CD2-CD 4.39Å; L222-K253 PolarHBondContact O-NZ 3.23Å; L222-L461 HydrophobicContact CD1-CD1 3.97Å; L222-L465 HydrophobicContact CD1-CB 3.8Å; L222-L465 HydrophobicContact CD1-CD1 4.08Å; L222-L465 HydrophobicContact CD1-CD2 4.15Å; L222-L465 HydrophobicContact CD1-CG 4.23Å; L222-V469 HydrophobicContact CD2-CG2 3.47Å; L222-V469 VanDerWaalsContact CD2-CG2 3.47Å
223	G	90	Very high	90.1	Very high	37 Å²	37	51.1 Å²	51.1	38%	0.381	25%	0.25	S	S	.	.	P	Polyproline II helix	trans	-62	167.6	166.5	0	0	0	0	0	112.1	F225 K253	G223-F225 WeakPolarHBondContact O-CD1 3.4Å; G223-K253 VanDerWaalsContact O-CD 3.25Å; G223-K253 WeakPolarHBondContact O-CD 3.31Å; G223-K253 PolarHBondContact O-NZ 2.9Å
224	D	94.9	Very high	89.8	Confident	50 Å²	50	51.4 Å²	51.4	27%	0.267	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-90.4	135.2	175.8	-67.5	-14.6	0	0	0	110	K253 Q254 G255 Y517 D518	D224-K253 WeakPolarHBondContact CA-O 3.25Å; D224-K253 WeakPolarHBondContact CB-O 3.3Å; D224-K253 IonicContact OD1-NZ 3.48Å; D224-K253 PolarHBondContact OD1-NZ 2.9Å; D224-Q254 WeakPolarHBondContact OD1-CA 3.29Å; D224-Q254 WeakPolarHBondContact OD2-CG 3.27Å; D224-G255 PolarHBondContact OD1-N 2.88Å; D224-G255 PolarHBondContact OD2-N 3.31Å; D224-Y517 WeakPolarHBondContact O-CA 3.49Å; D224-Y517 WeakPolarHBondContact O-CD1 3.2Å; D224-D518 CarbonylContact C-O 3.44Å; D224-D518 PolarHBondContact O-N 2.89Å; D224-D518 VanDerWaalsContact O-N 3.12Å
225	F	95	Very high	89.4	Confident	1 Å²	1	43.3 Å²	43.3	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	156.4	-165.9	71.5	-90.8	0	0	0	114.7	L222 G223 L227 I251 K253 V469 F515 R516 Y517 F520	L222-F225 HydrophobicContact CD2-CE1 3.65Å; L222-F225 HydrophobicContact CD2-CZ 4.45Å; L222-F225 HydrophobicContact CG-CE1 4.11Å; G223-F225 WeakPolarHBondContact O-CD1 3.4Å; F225-L227 HydrophobicContact CD2-CB 3.87Å; F225-L227 HydrophobicContact CE2-CB 3.7Å; F225-L227 HydrophobicContact CE2-CD2 4.25Å; F225-I251 HydrophobicContact CE2-CG2 4.25Å; F225-I251 HydrophobicContact CZ-CG2 4.5Å; F225-K253 HydrophobicContact CD1-CB 3.89Å; F225-K253 HydrophobicContact CD1-CD 4.01Å; F225-K253 HydrophobicContact CD1-CG 4.32Å; F225-K253 HydrophobicContact CE1-CB 3.5Å; F225-K253 VanDerWaalsContact CE1-CB 3.5Å; F225-K253 HydrophobicContact CE1-CD 3.82Å; F225-K253 HydrophobicContact CE1-CG 3.77Å; F225-K253 HydrophobicContact CE2-CB 4.42Å; F225-K253 HydrophobicContact CG-CB 4.49Å; F225-K253 HydrophobicContact CZ-CB 3.79Å; F225-K253 HydrophobicContact CZ-CG 4.35Å; F225-K253 PolarHBondContact N-O 2.79Å; F225-K253 PolarHBondContact O-N 2.77Å; F225-V469 HydrophobicContact CE1-CG2 4.38Å; F225-V469 HydrophobicContact CZ-CG1 4.45Å; F225-V469 HydrophobicContact CZ-CG2 4.03Å; F225-F515 HydrophobicContact CB-CE2 3.83Å; F225-F515 HydrophobicContact CB-CZ 3.7Å; F225-F515 HydrophobicContact CD1-CE2 4.38Å; F225-F515 HydrophobicContact CD2-CD2 4.03Å; F225-F515 AromaticContact CD2-CE2 3.44Å; F225-F515 HydrophobicContact CD2-CE2 3.44Å; F225-F515 VanDerWaalsContact CD2-CE2 3.44Å; F225-F515 HydrophobicContact CD2-CZ 4.21Å; F225-F515 HydrophobicContact CE2-CE2 4.12Å; F225-F515 AromaticContact CG-CE2 3.62Å; F225-F515 HydrophobicContact CG-CE2 3.62Å; F225-F515 AromaticContact CG-CZ 3.93Å; F225-F515 HydrophobicContact CG-CZ 3.93Å; F225-R516 CarbonylContact C-O 3.45Å; F225-R516 VanDerWaalsContact CA-O 3.28Å; F225-R516 WeakPolarHBondContact CA-O 3.36Å; F225-R516 WeakPolarHBondContact CB-O 3.26Å; F225-Y517 HydrophobicContact CB-CD1 4.18Å; F225-F520 WeakPolarHBondContact O-CE2 2.97Å; F225-F520 WeakPolarHBondContact O-CZ 3.16Å
226	Y	95.8	Very high	88.6	Confident	11 Å²	11	51 Å²	51	4%	0.043	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	138	162.9	178.5	-107.7	0	0	0	110	E228 K250 I251 Y252 E514 F515 R516	Y226-E228 HydrophobicContact CE1-CB 3.92Å; Y226-E228 PolarHBondContact OH-OE2 2.83Å; Y226-K250 HydrophobicContact CE2-CB 4.06Å; Y226-K250 HydrophobicContact CE2-CD 4.37Å; Y226-K250 HydrophobicContact CE2-CG 4.28Å; Y226-K250 VanDerWaalsContact OH-CD 3.3Å; Y226-K250 WeakPolarHBondContact OH-CD 3.21Å; Y226-K250 WeakPolarHBondContact OH-CE 3.2Å; Y226-K250 WeakPolarHBondContact OH-CG 3.34Å; Y226-I251 CarbonylContact C-O 3.56Å; Y226-I251 WeakPolarHBondContact CA-O 3.44Å; Y226-Y252 AromaticContact CD2-CD1 3.79Å; Y226-Y252 HydrophobicContact CD2-CD1 3.79Å; Y226-Y252 AromaticContact CD2-CE1 3.53Å; Y226-Y252 HydrophobicContact CD2-CE1 3.53Å; Y226-Y252 HydrophobicContact CD2-CG 4.42Å; Y226-Y252 AromaticContact CD2-CZ 3.96Å; Y226-Y252 HydrophobicContact CE2-CD1 4.33Å; Y226-Y252 AromaticContact CE2-CE1 3.66Å; Y226-Y252 HydrophobicContact CE2-CE1 3.66Å; Y226-Y252 HydrophobicContact CE2-CE2 4.28Å; Y226-Y252 AromaticContact CE2-CZ 3.63Å; Y226-E514 HydrophobicContact CD1-CG 4.2Å; Y226-E514 HydrophobicContact CE1-CB 4.3Å; Y226-E514 HydrophobicContact CE1-CG 4.25Å; Y226-F515 WeakPolarHBondContact O-CA 3.13Å; Y226-R516 HydrophobicContact CD1-CG 4.43Å; Y226-R516 PolarHBondContact N-O 3.25Å; Y226-R516 PolarHBondContact O-N 2.86Å
227	L	93.8	Very high	87.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	121.5	175	162.6	58.7	0	0	0	109.6	F225 L229 I251 F459 L466 F512 E514 F515	F225-L227 HydrophobicContact CD2-CB 3.87Å; F225-L227 HydrophobicContact CE2-CB 3.7Å; F225-L227 HydrophobicContact CE2-CD2 4.25Å; L227-L229 HydrophobicContact CD2-CD2 4.21Å; L227-L229 HydrophobicContact CG-CD2 4.31Å; L227-I251 HydrophobicContact CB-CB 4.26Å; L227-I251 HydrophobicContact CD2-CD1 4.16Å; L227-I251 PolarHBondContact N-O 3.07Å; L227-I251 PolarHBondContact O-N 2.85Å; L227-F459 HydrophobicContact CD1-CZ 4.35Å; L227-L466 HydrophobicContact CD2-CD1 4.05Å; L227-F512 HydrophobicContact CD1-CD1 3.71Å; L227-F512 HydrophobicContact CD1-CE1 4.29Å; L227-E514 WeakPolarHBondContact CA-O 3.37Å; L227-F515 HydrophobicContact CB-CD2 4.22Å
228	E	94	Very high	86.4	Confident	37 Å²	37	49.8 Å²	49.8	17%	0.173	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.2	170.6	-171	167.5	147.2	0	0	110.7	Y226 H230 K250 Q513 E514	Y226-E228 HydrophobicContact CE1-CB 3.92Å; Y226-E228 PolarHBondContact OH-OE2 2.83Å; E228-H230 IonicContact OE1-CD2 2.89Å; E228-H230 IonicContact OE1-CE1 2.78Å; E228-H230 IonicContact OE1-NE2 3.15Å; E228-H230 PolarHBondContact OE1-NE2 3.38Å; E228-K250 HydrophobicContact CG-CG 4.09Å; E228-K250 WeakPolarHBondContact OE2-CE 3.44Å; E228-Q513 HydrophobicContact CG-CB 4.49Å; E228-Q513 PolarHBondContact O-N 2.86Å; E228-E514 HydrophobicContact CB-CB 4.24Å; E228-E514 PolarHBondContact N-O 3.45Å; E228-E514 PolarHBondContact O-N 3.07Å
229	L	90.7	Very high	85.4	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	134.6	176.8	65.2	92	0	0	0	111.1	L227 W231 C249 I251 F479 T511 F512	L227-L229 HydrophobicContact CD2-CD2 4.21Å; L227-L229 HydrophobicContact CG-CD2 4.31Å; L229-W231 VanDerWaalsContact CD1-NE1 3.26Å; L229-C249 HydrophobicContact CD1-CB 3.69Å; L229-C249 HydrophobicContact CG-CB 3.96Å; L229-C249 PolarHBondContact N-O 2.73Å; L229-C249 PolarHBondContact O-N 3.28Å; L229-I251 HydrophobicContact CD2-CD1 3.88Å; L229-F479 HydrophobicContact CD1-CE1 4.08Å; L229-F479 HydrophobicContact CD1-CZ 4.49Å; L229-F479 HydrophobicContact CD2-CE1 4.42Å; L229-T511 CarbonylContact C-O 3.59Å; L229-T511 WeakPolarHBondContact CA-O 3.05Å; L229-F512 HydrophobicContact CD2-CE1 4.49Å
230	H	91.3	Very high	84.2	Confident	58 Å²	58	55.9 Å²	55.9	27%	0.269	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	136.6	179.2	-64.4	-176	0	0	0	110.8	E228 D247 A248 V510 T511 Q513	E228-H230 IonicContact OE1-CD2 2.89Å; E228-H230 IonicContact OE1-CE1 2.78Å; E228-H230 IonicContact OE1-NE2 3.15Å; E228-H230 PolarHBondContact OE1-NE2 3.38Å; H230-D247 CarbonylContact C-O 3.54Å; H230-D247 VanDerWaalsContact CA-O 3.22Å; H230-D247 WeakPolarHBondContact CA-O 3.34Å; H230-A248 VanDerWaalsContact CD2-CB 3.5Å; H230-A248 WeakPolarHBondContact CD2-CB 3.5Å; H230-V510 WeakPolarHBondContact O-CA 3.38Å; H230-T511 PolarHBondContact N-O 3.5Å; H230-T511 PolarHBondContact O-N 2.78Å; H230-T511 PolarHBondContact O-OG1 3.35Å; H230-Q513 HydrophobicContact CB-CG 4.44Å
231	W	87.3	Confident	83	Confident	14 Å²	14	51 Å²	51	5%	0.053	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	136.4	169	-66.2	83.9	0	0	0	109.9	L229 F233 S246 D247 C249 H478 F479 L482 A508 T509 V510	L229-W231 VanDerWaalsContact CD1-NE1 3.26Å; W231-F233 HydrophobicContact CB-CD2 4.47Å; W231-F233 HydrophobicContact CB-CE2 3.99Å; W231-F233 HydrophobicContact CE3-CE2 4.04Å; W231-F233 HydrophobicContact CE3-CZ 4.05Å; W231-S246 CarbonylContact O-C 3.47Å; W231-S246 WeakPolarHBondContact O-CA 3.22Å; W231-S246 WeakPolarHBondContact O-CB 3.47Å; W231-D247 PolarHBondContact N-O 3.04Å; W231-D247 PolarHBondContact O-N 2.92Å; W231-C249 VanDerWaalsContact CD1-SG 3.53Å; W231-H478 HydrophobicContact CH2-CB 4.13Å; W231-H478 HydrophobicContact CZ2-CB 4.31Å; W231-H478 HydrophobicContact CZ3-CB 4.45Å; W231-F479 AromaticContact CZ2-CD1 3.8Å; W231-F479 HydrophobicContact CZ2-CD1 3.8Å; W231-F479 AromaticContact CZ2-CE1 3.84Å; W231-F479 HydrophobicContact CZ2-CE1 3.84Å; W231-F479 AromaticContact NE1-CE1 3.85Å; W231-L482 HydrophobicContact CH2-CB 3.96Å; W231-L482 HydrophobicContact CZ2-CB 4.37Å; W231-L482 HydrophobicContact CZ2-CD2 4.28Å; W231-A508 HydrophobicContact CE3-CB 4.15Å; W231-A508 HydrophobicContact CZ3-CB 4.29Å; W231-T509 CarbonylContact C-O 3.59Å; W231-T509 WeakPolarHBondContact CA-O 3.01Å; W231-V510 HydrophobicContact CD2-CG2 3.95Å; W231-V510 HydrophobicContact CE3-CG2 3.56Å; W231-V510 HydrophobicContact CH2-CG2 3.84Å; W231-V510 HydrophobicContact CZ2-CG2 4.21Å; W231-V510 HydrophobicContact CZ3-CG2 3.5Å; W231-V510 VanDerWaalsContact CZ3-CG2 3.5Å
232	D	87.6	Confident	82	Confident	64 Å²	64	54.2 Å²	54.2	34%	0.342	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	112.5	174.4	173.4	37	0	0	0	110.2	Q234 T509	D232-Q234 PolarHBondContact OD2-NE2 2.97Å; D232-T509 PolarHBondContact N-O 3.35Å; D232-T509 WeakPolarHBondContact O-CB 3.33Å; D232-T509 PolarHBondContact O-N 3.32Å; D232-T509 PolarHBondContact O-OG1 2.98Å
233	F	83.8	Confident	81.1	Confident	19 Å²	19	56.1 Å²	56.1	8%	0.083	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	116.3	-175.6	-70.1	-112	0	0	0	110.5	W231 L244 P245 H478 V502 I506 A508	W231-F233 HydrophobicContact CB-CD2 4.47Å; W231-F233 HydrophobicContact CB-CE2 3.99Å; W231-F233 HydrophobicContact CE3-CE2 4.04Å; W231-F233 HydrophobicContact CE3-CZ 4.05Å; F233-L244 HydrophobicContact CB-CB 3.93Å; F233-L244 HydrophobicContact CB-CD1 4.47Å; F233-L244 HydrophobicContact CB-CD2 4.49Å; F233-L244 WeakPolarHBondContact O-CB 3.42Å; F233-L244 WeakPolarHBondContact O-CD1 3.18Å; F233-P245 HydrophobicContact CB-CG 4.24Å; F233-P245 WeakPolarHBondContact CB-O 3.44Å; F233-P245 HydrophobicContact CD2-CG 3.78Å; F233-P245 VanDerWaalsContact CD2-O 3.31Å; F233-P245 WeakPolarHBondContact CD2-O 3.34Å; F233-P245 HydrophobicContact CE2-CG 4.2Å; F233-P245 HydrophobicContact CG-CG 3.97Å; F233-P245 PolarHBondContact N-O 3.23Å; F233-H478 AromaticContact CZ-ND1 3.79Å; F233-V502 HydrophobicContact CE1-CG1 4.47Å; F233-V502 HydrophobicContact CE1-CG2 4.26Å; F233-I506 HydrophobicContact CB-CG2 4.38Å; F233-I506 HydrophobicContact CD1-CG2 4.14Å; F233-A508 HydrophobicContact CD1-CB 3.8Å; F233-A508 HydrophobicContact CD2-CB 4.41Å; F233-A508 HydrophobicContact CE1-CB 3.72Å; F233-A508 HydrophobicContact CE2-CB 4.35Å; F233-A508 HydrophobicContact CG-CB 4.16Å; F233-A508 HydrophobicContact CZ-CB 4.01Å
234	Q	82.5	Confident	80.3	Confident	98 Å²	98	55.1 Å²	55.1	46%	0.458	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	149.4	-175.6	-59.1	-172.7	3.1	0	0	111.7	D232 I506 T507	D232-Q234 PolarHBondContact OD2-NE2 2.97Å; Q234-I506 WeakPolarHBondContact O-CA 3.45Å; Q234-T507 PolarHBondContact N-O 3.07Å; Q234-T507 PolarHBondContact O-N 2.99Å
235	S	79.4	Confident	79.5	Confident	17 Å²	17	53 Å²	53	12%	0.119	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	146.7	174.3	176.1	0	0	0	0	111.2	V237 T505	S235-V237 VanDerWaalsContact C-N 3.29Å; S235-V237 WeakPolarHBondContact OG-CB 2.84Å; S235-V237 PolarHBondContact OG-N 3.22Å; S235-T505 WeakPolarHBondContact CA-O 3.38Å; S235-T505 PolarHBondContact OG-O 3.16Å
236	W	68.1	Low	79	Confident	175 Å²	175	55.2 Å²	55.2	66%	0.663	27%	0.273	S	S	*	.	S	Bend	trans	-77.4	-17.3	171.1	70.1	-89.5	0	0	0	112.5	T505	W236-T505 HydrophobicContact CZ2-CG2 4.11Å
237	V	69.8	Low	78.5	Confident	28 Å²	28	55.4 Å²	55.4	17%	0.17	28%	0.275	C	S	.	.	S	Bend	trans	-70.8	125.1	176.5	-178.3	0	0	0	0	108.3	S235 L240 T505	S235-V237 VanDerWaalsContact C-N 3.29Å; S235-V237 WeakPolarHBondContact OG-CB 2.84Å; S235-V237 PolarHBondContact OG-N 3.22Å; V237-L240 HydrophobicContact CB-CB 4.05Å; V237-L240 HydrophobicContact CB-CD2 4.08Å; V237-L240 HydrophobicContact CG1-CB 4.21Å; V237-L240 HydrophobicContact CG1-CD2 4.43Å; V237-L240 HydrophobicContact CG2-CD2 4.39Å; V237-L240 PolarHBondContact O-N 2.86Å; V237-T505 HydrophobicContact CG2-CG2 3.81Å
238	P	65.1	Low	78.2	Confident	104 Å²	104	56.6 Å²	56.6	68%	0.675	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	146.1	178.4	-27.1	35.6	0	0	0	112.6	L240	P238-L240 PolarHBondContact O-N 3.42Å
239	L	67.3	Low	78.1	Confident	133 Å²	133	55 Å²	55	70%	0.696	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	-32.5	-176.7	-52	176.3	0	0	0	116	S241 R242	L239-S241 PolarHBondContact O-N 3.19Å; L239-R242 WeakPolarHBondContact O-CB 3.39Å; L239-R242 PolarHBondContact O-N 3.39Å
240	L	64.8	Low	78.2	Confident	10 Å²	10	58.5 Å²	58.5	5%	0.052	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-59.1	-32.3	179.3	-176.2	53.5	0	0	0	112.5	V237 P238 R242 I243 L244 M270	V237-L240 HydrophobicContact CB-CB 4.05Å; V237-L240 HydrophobicContact CB-CD2 4.08Å; V237-L240 HydrophobicContact CG1-CB 4.21Å; V237-L240 HydrophobicContact CG1-CD2 4.43Å; V237-L240 HydrophobicContact CG2-CD2 4.39Å; V237-L240 PolarHBondContact O-N 2.86Å; P238-L240 PolarHBondContact O-N 3.42Å; L240-R242 PolarHBondContact O-N 2.86Å; L240-R242 VanDerWaalsContact O-N 3.12Å; L240-I243 HydrophobicContact CD1-CD1 3.85Å; L240-I243 HydrophobicContact CD1-CG1 3.88Å; L240-I243 WeakPolarHBondContact O-CG1 3.43Å; L240-I243 PolarHBondContact O-N 3.43Å; L240-L244 HydrophobicContact CG-CD1 4.45Å; L240-L244 WeakPolarHBondContact O-CG 3.26Å; L240-L244 PolarHBondContact O-N 3.23Å; L240-M270 HydrophobicContact CD1-SD 4.47Å
241	S	66	Low	78.4	Confident	63 Å²	63	55.8 Å²	55.8	44%	0.441	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-64.8	-7.5	172.4	56.8	0	0	0	0	115.5	L239	L239-S241 PolarHBondContact O-N 3.19Å
242	R	66.9	Low	78.8	Confident	207 Å²	207	57.1 Å²	57.1	78%	0.781	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-94.2	-10.2	176.4	-65.7	-175.5	57.3	150.3	-0.4	114.5	L239 L240	L239-R242 WeakPolarHBondContact O-CB 3.39Å; L239-R242 PolarHBondContact O-N 3.39Å; L240-R242 PolarHBondContact O-N 2.86Å; L240-R242 VanDerWaalsContact O-N 3.12Å
243	I	68.6	Low	79.1	Confident	53 Å²	53	54.1 Å²	54.1	27%	0.272	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	-4.1	-176.1	64.4	178.9	0	0	0	112.8	L240 F267 M270	L240-I243 HydrophobicContact CD1-CD1 3.85Å; L240-I243 HydrophobicContact CD1-CG1 3.88Å; L240-I243 WeakPolarHBondContact O-CG1 3.43Å; L240-I243 PolarHBondContact O-N 3.43Å; I243-F267 VanDerWaalsContact O-CE2 3.32Å; I243-F267 WeakPolarHBondContact O-CE2 3.35Å; I243-M270 HydrophobicContact CD1-CB 3.78Å; I243-M270 HydrophobicContact CD1-CG 4.3Å; I243-M270 HydrophobicContact CG1-CB 4.21Å
244	L	73.8	Confident	79.6	Confident	16 Å²	16	55.4 Å²	55.4	8%	0.084	28%	0.276	C	S	.	.	S	Bend	trans	-73.7	153	170.8	-75	171	0	0	0	111.3	F233 L240 F267 I506	F233-L244 HydrophobicContact CB-CB 3.93Å; F233-L244 HydrophobicContact CB-CD1 4.47Å; F233-L244 HydrophobicContact CB-CD2 4.49Å; F233-L244 WeakPolarHBondContact O-CB 3.42Å; F233-L244 WeakPolarHBondContact O-CD1 3.18Å; L240-L244 HydrophobicContact CG-CD1 4.45Å; L240-L244 WeakPolarHBondContact O-CG 3.26Å; L240-L244 PolarHBondContact O-N 3.23Å; L244-F267 HydrophobicContact CD2-CE1 4.27Å; L244-F267 HydrophobicContact CD2-CZ 4.04Å; L244-I506 HydrophobicContact CD1-CG1 4.19Å; L244-I506 HydrophobicContact CD1-CG2 4.1Å; L244-I506 HydrophobicContact CD2-CD1 3.85Å; L244-I506 HydrophobicContact CD2-CG1 4.28Å; L244-I506 HydrophobicContact CD2-CG2 4.3Å
245	P	78.3	Confident	80.1	Confident	4 Å²	4	52.4 Å²	52.4	3%	0.026	27%	0.271	C	S	.	.			trans	-77	154.6	-174.5	30	-33.5	0	0	0	112.5	F233 L264 F267 C272	F233-P245 HydrophobicContact CB-CG 4.24Å; F233-P245 WeakPolarHBondContact CB-O 3.44Å; F233-P245 HydrophobicContact CD2-CG 3.78Å; F233-P245 VanDerWaalsContact CD2-O 3.31Å; F233-P245 WeakPolarHBondContact CD2-O 3.34Å; F233-P245 HydrophobicContact CE2-CG 4.2Å; F233-P245 HydrophobicContact CG-CG 3.97Å; F233-P245 PolarHBondContact N-O 3.23Å; P245-L264 HydrophobicContact CB-CD1 3.99Å; P245-L264 HydrophobicContact CB-CD2 3.88Å; P245-F267 HydrophobicContact CB-CD2 4.26Å; P245-F267 HydrophobicContact CB-CG 4.42Å; P245-F267 HydrophobicContact CG-CD1 4.01Å; P245-F267 HydrophobicContact CG-CD2 4.1Å; P245-F267 HydrophobicContact CG-CE1 4.21Å; P245-F267 HydrophobicContact CG-CE2 4.33Å; P245-F267 HydrophobicContact CG-CG 3.96Å; P245-F267 HydrophobicContact CG-CZ 4.39Å; P245-C272 WeakPolarHBondContact CA-SG 3.41Å
246	S	83.5	Confident	80.8	Confident	48 Å²	48	52.8 Å²	52.8	34%	0.336	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	142.5	160.8	59.2	0	0	0	0	108.5	W231 R274	W231-S246 CarbonylContact O-C 3.47Å; W231-S246 WeakPolarHBondContact O-CA 3.22Å; W231-S246 WeakPolarHBondContact O-CB 3.47Å; S246-R274 PolarHBondContact O-NH1 3.16Å; S246-R274 PolarHBondContact O-NH2 2.81Å; S246-R274 PolarHBondContact OG-NH2 3.37Å
247	D	85.7	Confident	82.1	Confident	15 Å²	15	46 Å²	46	8%	0.08	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	151.5	-177.4	-174.7	43.1	0	0	0	111.7	H230 W231 C249 T262 T263 L264	H230-D247 CarbonylContact C-O 3.54Å; H230-D247 VanDerWaalsContact CA-O 3.22Å; H230-D247 WeakPolarHBondContact CA-O 3.34Å; W231-D247 PolarHBondContact N-O 3.04Å; W231-D247 PolarHBondContact O-N 2.92Å; D247-C249 PolarHBondContact OD2-SG 2.69Å; D247-T262 PolarHBondContact OD1-OG1 3.18Å; D247-T262 WeakPolarHBondContact OD2-CB 3.28Å; D247-T262 PolarHBondContact OD2-OG1 3.27Å; D247-T263 WeakPolarHBondContact OD1-CA 3.41Å; D247-T263 WeakPolarHBondContact OD1-CB 3.48Å; D247-T263 PolarHBondContact OD1-N 3.5Å; D247-T263 PolarHBondContact OD1-OG1 2.85Å; D247-L264 HydrophobicContact CB-CB 4.01Å; D247-L264 PolarHBondContact OD1-N 3.06Å
248	A	88.1	Confident	83.2	Confident	25 Å²	25	44.8 Å²	44.8	21%	0.207	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	92.8	173	0	0	0	0	0	108.9	H230	H230-A248 VanDerWaalsContact CD2-CB 3.5Å; H230-A248 WeakPolarHBondContact CD2-CB 3.5Å
249	C	90.8	Very high	84.6	Confident	5 Å²	5	41.8 Å²	41.8	3%	0.034	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	130	175.9	-53.4	0	0	0	0	110	L229 W231 D247 L260 D261	L229-C249 HydrophobicContact CD1-CB 3.69Å; L229-C249 HydrophobicContact CG-CB 3.96Å; L229-C249 PolarHBondContact N-O 2.73Å; L229-C249 PolarHBondContact O-N 3.28Å; W231-C249 VanDerWaalsContact CD1-SG 3.53Å; D247-C249 PolarHBondContact OD2-SG 2.69Å; C249-L260 HydrophobicContact CB-CD1 3.8Å; C249-D261 CarbonylContact C-O 3.57Å; C249-D261 WeakPolarHBondContact CA-O 3.46Å
250	K	93.9	Very high	85.9	Confident	73 Å²	73	35.8 Å²	35.8	32%	0.317	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	120.4	173.7	-64.2	175.5	178.1	175.3	0	109.9	Y226 E228 Y252 L260 D261	Y226-K250 HydrophobicContact CE2-CB 4.06Å; Y226-K250 HydrophobicContact CE2-CD 4.37Å; Y226-K250 HydrophobicContact CE2-CG 4.28Å; Y226-K250 VanDerWaalsContact OH-CD 3.3Å; Y226-K250 WeakPolarHBondContact OH-CD 3.21Å; Y226-K250 WeakPolarHBondContact OH-CE 3.2Å; Y226-K250 WeakPolarHBondContact OH-CG 3.34Å; E228-K250 HydrophobicContact CG-CG 4.09Å; E228-K250 WeakPolarHBondContact OE2-CE 3.44Å; K250-Y252 HydrophobicContact CB-CE2 3.84Å; K250-L260 CarbonylContact O-C 3.43Å; K250-L260 VanDerWaalsContact O-CA 3.31Å; K250-L260 WeakPolarHBondContact O-CA 3.36Å; K250-D261 HydrophobicContact CB-CB 4.31Å; K250-D261 PolarHBondContact N-O 3.38Å; K250-D261 PolarHBondContact O-N 3.46Å
251	I	94.1	Very high	87.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120	-178.6	-62.1	169.3	0	0	0	108.4	F225 Y226 L227 L229 I258 R259 L260 V469 I473	F225-I251 HydrophobicContact CE2-CG2 4.25Å; F225-I251 HydrophobicContact CZ-CG2 4.5Å; Y226-I251 CarbonylContact C-O 3.56Å; Y226-I251 WeakPolarHBondContact CA-O 3.44Å; L227-I251 HydrophobicContact CB-CB 4.26Å; L227-I251 HydrophobicContact CD2-CD1 4.16Å; L227-I251 PolarHBondContact N-O 3.07Å; L227-I251 PolarHBondContact O-N 2.85Å; L229-I251 HydrophobicContact CD2-CD1 3.88Å; I251-I258 HydrophobicContact CG2-CG2 4.09Å; I251-R259 WeakPolarHBondContact CA-O 3.42Å; I251-L260 HydrophobicContact CG1-CD1 3.89Å; I251-V469 HydrophobicContact CG2-CG1 4.28Å; I251-I473 HydrophobicContact CD1-CD1 3.65Å; I251-I473 HydrophobicContact CG1-CD1 4.42Å
252	Y	95.9	Very high	88.4	Confident	42 Å²	42	34 Å²	34	17%	0.165	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	135	170.4	-51.6	-101.5	0	0	0	107.3	Y226 K250 I258 R259 D261 F520 I524 F525	Y226-Y252 AromaticContact CD2-CD1 3.79Å; Y226-Y252 HydrophobicContact CD2-CD1 3.79Å; Y226-Y252 AromaticContact CD2-CE1 3.53Å; Y226-Y252 HydrophobicContact CD2-CE1 3.53Å; Y226-Y252 HydrophobicContact CD2-CG 4.42Å; Y226-Y252 AromaticContact CD2-CZ 3.96Å; Y226-Y252 HydrophobicContact CE2-CD1 4.33Å; Y226-Y252 AromaticContact CE2-CE1 3.66Å; Y226-Y252 HydrophobicContact CE2-CE1 3.66Å; Y226-Y252 HydrophobicContact CE2-CE2 4.28Å; Y226-Y252 AromaticContact CE2-CZ 3.63Å; K250-Y252 HydrophobicContact CB-CE2 3.84Å; Y252-I258 WeakPolarHBondContact O-CA 3.35Å; Y252-R259 HydrophobicContact CD2-CB 4.38Å; Y252-R259 HydrophobicContact CD2-CG 4.07Å; Y252-R259 PolarHBondContact N-O 2.71Å; Y252-R259 PolarHBondContact O-N 3.02Å; Y252-D261 WeakPolarHBondContact CE2-OD2 3.49Å; Y252-F520 HydrophobicContact CD1-CD1 4.15Å; Y252-F520 AromaticContact CD1-CE1 3.74Å; Y252-F520 HydrophobicContact CD1-CE1 3.74Å; Y252-F520 HydrophobicContact CD1-CE2 4.5Å; Y252-F520 AromaticContact CD1-CZ 3.92Å; Y252-F520 HydrophobicContact CD1-CZ 3.92Å; Y252-F520 HydrophobicContact CE1-CE1 4.42Å; Y252-I524 HydrophobicContact CD1-CD1 3.93Å; Y252-I524 HydrophobicContact CG-CD1 4.1Å; Y252-F525 WeakPolarHBondContact O-CE1 3.36Å
253	K	94.9	Very high	89.4	Confident	1 Å²	1	26.7 Å²	26.7	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	129	177.3	-179.4	-91.2	165.2	-168.9	0	109.9	L219 L222 G223 D224 F225 G255 N257 I258	L219-K253 WeakPolarHBondContact O-CE 3.41Å; L219-K253 PolarHBondContact O-NZ 3.49Å; L222-K253 HydrophobicContact CD2-CD 4.39Å; L222-K253 PolarHBondContact O-NZ 3.23Å; G223-K253 VanDerWaalsContact O-CD 3.25Å; G223-K253 WeakPolarHBondContact O-CD 3.31Å; G223-K253 PolarHBondContact O-NZ 2.9Å; D224-K253 WeakPolarHBondContact CA-O 3.25Å; D224-K253 WeakPolarHBondContact CB-O 3.3Å; D224-K253 IonicContact OD1-NZ 3.48Å; D224-K253 PolarHBondContact OD1-NZ 2.9Å; F225-K253 HydrophobicContact CD1-CB 3.89Å; F225-K253 HydrophobicContact CD1-CD 4.01Å; F225-K253 HydrophobicContact CD1-CG 4.32Å; F225-K253 HydrophobicContact CE1-CB 3.5Å; F225-K253 VanDerWaalsContact CE1-CB 3.5Å; F225-K253 HydrophobicContact CE1-CD 3.82Å; F225-K253 HydrophobicContact CE1-CG 3.77Å; F225-K253 HydrophobicContact CE2-CB 4.42Å; F225-K253 HydrophobicContact CG-CB 4.49Å; F225-K253 HydrophobicContact CZ-CB 3.79Å; F225-K253 HydrophobicContact CZ-CG 4.35Å; F225-K253 PolarHBondContact N-O 2.79Å; F225-K253 PolarHBondContact O-N 2.77Å; K253-G255 WeakPolarHBondContact CE-O 3.16Å; K253-G255 PolarHBondContact NZ-O 3.06Å; K253-N257 WeakPolarHBondContact CA-O 3.29Å; K253-I258 HydrophobicContact CB-CG1 4.47Å; K253-I258 HydrophobicContact CG-CG1 4.15Å
254	Q	94.8	Very high	90	Very high	47 Å²	47	25.5 Å²	25.5	22%	0.22	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	123.4	176	-165.9	171.5	37.9	0	0	111.2	D224 I256 N257 F520 F525	D224-Q254 WeakPolarHBondContact OD1-CA 3.29Å; D224-Q254 WeakPolarHBondContact OD2-CG 3.27Å; Q254-I256 PolarHBondContact O-N 3.35Å; Q254-N257 PolarHBondContact N-O 3.28Å; Q254-N257 PolarHBondContact O-N 2.89Å; Q254-F520 HydrophobicContact CB-CD2 4.36Å; Q254-F520 PolarHBondContact NE2-O 3.19Å; Q254-F525 HydrophobicContact CB-CD2 4.16Å; Q254-F525 HydrophobicContact CB-CE1 4.31Å; Q254-F525 HydrophobicContact CB-CE2 3.43Å; Q254-F525 VanDerWaalsContact CB-CE2 3.43Å; Q254-F525 HydrophobicContact CB-CZ 3.52Å; Q254-F525 HydrophobicContact CG-CE2 4.37Å; Q254-F525 VanDerWaalsContact OE1-CE2 3.32Å
255	G	93.1	Very high	90.1	Very high	34 Å²	34	26.8 Å²	26.8	35%	0.351	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	-102.3	-178.5	0	0	0	0	0	112.8	L219 D224 K253	L219-G255 CarbonylContact C-O 3.59Å; L219-G255 VanDerWaalsContact O-O 3.07Å; D224-G255 PolarHBondContact OD1-N 2.88Å; D224-G255 PolarHBondContact OD2-N 3.31Å; K253-G255 WeakPolarHBondContact CE-O 3.16Å; K253-G255 PolarHBondContact NZ-O 3.06Å
256	I	93.2	Very high	89.5	Confident	25 Å²	25	28.8 Å²	28.8	13%	0.128	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	6.4	171.9	62.7	176.1	0	0	0	113.5	L216 L219 K220 Q254	L216-I256 HydrophobicContact CD2-CB 4.33Å; L216-I256 HydrophobicContact CD2-CD1 4.33Å; L216-I256 WeakPolarHBondContact O-CG2 3.25Å; L219-I256 HydrophobicContact CB-CB 4.45Å; L219-I256 HydrophobicContact CB-CG2 4.35Å; L219-I256 WeakPolarHBondContact CD1-O 3.48Å; K220-I256 HydrophobicContact CB-CG2 3.73Å; K220-I256 HydrophobicContact CG-CG2 4.35Å; Q254-I256 PolarHBondContact O-N 3.35Å
257	N	94.6	Very high	88.6	Confident	33 Å²	33	29 Å²	29	18%	0.176	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	146.3	-178.2	-59.4	-32.8	0	0	0	110.3	K253 Q254 F281 N282 G283 F525	K253-N257 WeakPolarHBondContact CA-O 3.29Å; Q254-N257 PolarHBondContact N-O 3.28Å; Q254-N257 PolarHBondContact O-N 2.89Å; N257-F281 WeakPolarHBondContact CA-O 3.48Å; N257-N282 WeakPolarHBondContact OD1-CA 3.37Å; N257-G283 PolarHBondContact OD1-N 2.71Å; N257-F525 HydrophobicContact CB-CB 4.25Å; N257-F525 HydrophobicContact CB-CD1 3.87Å; N257-F525 HydrophobicContact CB-CG 4.17Å
258	I	94.1	Very high	87.3	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138.3	178.8	-61.9	170.6	0	0	0	108.4	L219 I251 Y252 K253 F281 V469 V472 I473	L219-I258 HydrophobicContact CD1-CD1 3.83Å; L219-I258 HydrophobicContact CD1-CG1 4.25Å; L219-I258 HydrophobicContact CD2-CD1 3.87Å; I251-I258 HydrophobicContact CG2-CG2 4.09Å; Y252-I258 WeakPolarHBondContact O-CA 3.35Å; K253-I258 HydrophobicContact CB-CG1 4.47Å; K253-I258 HydrophobicContact CG-CG1 4.15Å; I258-F281 HydrophobicContact CB-CB 4.29Å; I258-F281 PolarHBondContact N-O 3.16Å; I258-F281 PolarHBondContact O-N 2.87Å; I258-V469 HydrophobicContact CD1-CG1 4.27Å; I258-V472 HydrophobicContact CD1-CB 4.06Å; I258-V472 HydrophobicContact CD1-CG1 3.91Å; I258-I473 HydrophobicContact CG2-CG2 4.2Å
259	R	94.9	Very high	85.9	Confident	42 Å²	42	32.9 Å²	32.9	16%	0.158	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	134.2	165.4	167.4	169.2	165.3	148.4	2.9	109	I251 Y252 D261 S278 F279 I280 I524 F525	I251-R259 WeakPolarHBondContact CA-O 3.42Å; Y252-R259 HydrophobicContact CD2-CB 4.38Å; Y252-R259 HydrophobicContact CD2-CG 4.07Å; Y252-R259 PolarHBondContact N-O 2.71Å; Y252-R259 PolarHBondContact O-N 3.02Å; R259-D261 WeakPolarHBondContact CG-OD1 3.47Å; R259-D261 IonicContact CZ-OD1 3.19Å; R259-D261 IonicContact CZ-OD2 2.74Å; R259-D261 IonicContact NE-OD1 3.76Å; R259-D261 PolarHBondContact NE-OD1 2.72Å; R259-D261 IonicContact NE-OD2 3.9Å; R259-D261 PolarHBondContact NE-OD2 3.3Å; R259-D261 VanDerWaalsContact NE-OD2 3.15Å; R259-D261 IonicContact NH2-OD1 3.67Å; R259-D261 PolarHBondContact NH2-OD1 2.81Å; R259-D261 IonicContact NH2-OD2 2.76Å; R259-D261 PolarHBondContact NH2-OD2 2.91Å; R259-S278 VanDerWaalsContact CZ-OG 3.31Å; R259-S278 PolarHBondContact NH2-OG 3.4Å; R259-F279 CarbonylContact C-O 3.58Å; R259-F279 VanDerWaalsContact CA-O 3.31Å; R259-F279 WeakPolarHBondContact CA-O 3.41Å; R259-I280 HydrophobicContact CB-CG1 4.48Å; R259-I280 HydrophobicContact CG-CG1 4.44Å; R259-I524 WeakPolarHBondContact CD-O 3.23Å; R259-I524 PolarHBondContact NH1-O 3.35Å; R259-I524 VanDerWaalsContact NH1-O 3.1Å; R259-F525 HydrophobicContact CB-CD1 3.92Å; R259-F525 HydrophobicContact CB-CE1 3.91Å
260	L	93.7	Very high	84.5	Confident	6 Å²	6	34.4 Å²	34.4	3%	0.031	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	109.3	176	162.6	63.8	0	0	0	108.1	C249 K250 I251 F279 I473 F476 F479	C249-L260 HydrophobicContact CB-CD1 3.8Å; K250-L260 CarbonylContact O-C 3.43Å; K250-L260 VanDerWaalsContact O-CA 3.31Å; K250-L260 WeakPolarHBondContact O-CA 3.36Å; I251-L260 HydrophobicContact CG1-CD1 3.89Å; L260-F279 HydrophobicContact CB-CB 4.2Å; L260-F279 PolarHBondContact N-O 3.11Å; L260-F279 PolarHBondContact O-N 3.4Å; L260-I473 HydrophobicContact CD2-CB 4.47Å; L260-I473 HydrophobicContact CD2-CD1 4.27Å; L260-I473 HydrophobicContact CD2-CG2 4.5Å; L260-F476 HydrophobicContact CD2-CD2 3.95Å; L260-F476 HydrophobicContact CD2-CE2 3.97Å; L260-F479 HydrophobicContact CD2-CE2 4.04Å
261	D	93.8	Very high	83	Confident	20 Å²	20	35.3 Å²	35.3	11%	0.107	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	139.2	171.6	-62.6	-13.8	0	0	0	109.5	C249 K250 Y252 R259 L277 S278	C249-D261 CarbonylContact C-O 3.57Å; C249-D261 WeakPolarHBondContact CA-O 3.46Å; K250-D261 HydrophobicContact CB-CB 4.31Å; K250-D261 PolarHBondContact N-O 3.38Å; K250-D261 PolarHBondContact O-N 3.46Å; Y252-D261 WeakPolarHBondContact CE2-OD2 3.49Å; R259-D261 WeakPolarHBondContact CG-OD1 3.47Å; R259-D261 IonicContact CZ-OD1 3.19Å; R259-D261 IonicContact CZ-OD2 2.74Å; R259-D261 IonicContact NE-OD1 3.76Å; R259-D261 PolarHBondContact NE-OD1 2.72Å; R259-D261 IonicContact NE-OD2 3.9Å; R259-D261 PolarHBondContact NE-OD2 3.3Å; R259-D261 VanDerWaalsContact NE-OD2 3.15Å; R259-D261 IonicContact NH2-OD1 3.67Å; R259-D261 PolarHBondContact NH2-OD1 2.81Å; R259-D261 IonicContact NH2-OD2 2.76Å; R259-D261 PolarHBondContact NH2-OD2 2.91Å; D261-L277 VanDerWaalsContact CA-O 3.32Å; D261-L277 WeakPolarHBondContact CA-O 3.35Å; D261-S278 VanDerWaalsContact OD1-CB 3.24Å; D261-S278 WeakPolarHBondContact OD1-CB 3.47Å; D261-S278 PolarHBondContact OD1-OG 3.46Å
262	T	90.4	Very high	81.8	Confident	17 Å²	17	37.3 Å²	37.3	10%	0.104	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	151.2	-179.6	174.3	0	0	0	0	111.3	D247 L264 L277 F279	D247-T262 PolarHBondContact OD1-OG1 3.18Å; D247-T262 WeakPolarHBondContact OD2-CB 3.28Å; D247-T262 PolarHBondContact OD2-OG1 3.27Å; T262-L264 PolarHBondContact OG1-N 3.48Å; T262-L277 HydrophobicContact CG2-CB 4.04Å; T262-L277 PolarHBondContact N-O 3.17Å; T262-L277 PolarHBondContact O-N 2.98Å; T262-F279 HydrophobicContact CG2-CD2 4Å; T262-F279 HydrophobicContact CG2-CE2 3.61Å
263	T	87.2	Confident	80.8	Confident	53 Å²	53	39.8 Å²	39.8	33%	0.325	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-0.4	178.7	72.4	0	0	0	0	113.5	D247 R274 G275	D247-T263 WeakPolarHBondContact OD1-CA 3.41Å; D247-T263 WeakPolarHBondContact OD1-CB 3.48Å; D247-T263 PolarHBondContact OD1-N 3.5Å; D247-T263 PolarHBondContact OD1-OG1 2.85Å; T263-R274 VanDerWaalsContact O-CA 3.22Å; T263-R274 WeakPolarHBondContact O-CA 3.36Å; T263-R274 VanDerWaalsContact O-CB 3.32Å; T263-R274 WeakPolarHBondContact O-CB 3.48Å; T263-R274 WeakPolarHBondContact O-CG 3.43Å; T263-R274 PolarHBondContact OG1-NH1 2.92Å; T263-G275 WeakPolarHBondContact CA-O 3.32Å; T263-G275 PolarHBondContact O-N 3.12Å
264	L	81.9	Confident	80.2	Confident	28 Å²	28	45.5 Å²	45.5	15%	0.147	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	105.1	-177.2	-176.4	70.4	0	0	0	109.3	P245 D247 T262 C272	P245-L264 HydrophobicContact CB-CD1 3.99Å; P245-L264 HydrophobicContact CB-CD2 3.88Å; D247-L264 HydrophobicContact CB-CB 4.01Å; D247-L264 PolarHBondContact OD1-N 3.06Å; T262-L264 PolarHBondContact OG1-N 3.48Å; L264-C272 HydrophobicContact CD1-CB 4.08Å
265	I	74.2	Confident	79.8	Confident	42 Å²	42	43.9 Å²	43.9	22%	0.215	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	-50.9	176.2	-61.3	174.2	0	0	0	109.6	Q273 R274 L277 F538	I265-Q273 HydrophobicContact CB-CB 3.98Å; I265-Q273 HydrophobicContact CG2-CB 4.45Å; I265-Q273 PolarHBondContact N-O 3.16Å; I265-R274 WeakPolarHBondContact CD1-O 3.17Å; I265-L277 HydrophobicContact CB-CD1 4.2Å; I265-L277 HydrophobicContact CG1-CD1 3.94Å; I265-L277 HydrophobicContact CG1-CD2 4.25Å; I265-L277 HydrophobicContact CG1-CG 3.94Å; I265-L277 HydrophobicContact CG2-CD1 4.29Å; I265-F538 HydrophobicContact CG2-CE1 4.43Å
266	D	67.8	Low	79.7	Confident	46 Å²	46	46 Å²	46	25%	0.246	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	160.7	-171.5	171.1	49.7	0	0	0	111.5	T268 Q273	D266-T268 PolarHBondContact OD1-N 3.35Å; D266-T268 WeakPolarHBondContact OD2-CB 3.34Å; D266-T268 WeakPolarHBondContact OD2-CG2 3.43Å; D266-T268 PolarHBondContact OD2-N 2.9Å; D266-T268 PolarHBondContact OD2-OG1 2.86Å; D266-Q273 HydrophobicContact CB-CB 4.12Å; D266-Q273 HydrophobicContact CB-CG 4.18Å; D266-Q273 PolarHBondContact O-N 3.05Å; D266-Q273 PolarHBondContact OD2-NE2 3.43Å
267	F	64.1	Low	79.7	Confident	52 Å²	52	44.9 Å²	44.9	23%	0.228	23%	0.228	C	C	.	.			trans	-136.7	53.6	173.8	-172.5	-119.2	0	0	0	113.2	I243 L244 P245 M270 K271	I243-F267 VanDerWaalsContact O-CE2 3.32Å; I243-F267 WeakPolarHBondContact O-CE2 3.35Å; L244-F267 HydrophobicContact CD2-CE1 4.27Å; L244-F267 HydrophobicContact CD2-CZ 4.04Å; P245-F267 HydrophobicContact CB-CD2 4.26Å; P245-F267 HydrophobicContact CB-CG 4.42Å; P245-F267 HydrophobicContact CG-CD1 4.01Å; P245-F267 HydrophobicContact CG-CD2 4.1Å; P245-F267 HydrophobicContact CG-CE1 4.21Å; P245-F267 HydrophobicContact CG-CE2 4.33Å; P245-F267 HydrophobicContact CG-CG 3.96Å; P245-F267 HydrophobicContact CG-CZ 4.39Å; F267-M270 HydrophobicContact CD1-CE 4.16Å; F267-M270 HydrophobicContact CE1-CE 3.29Å; F267-M270 HydrophobicContact CE1-SD 4.11Å; F267-M270 HydrophobicContact CE2-CB 4.45Å; F267-M270 HydrophobicContact CE2-CE 4.3Å; F267-M270 HydrophobicContact CZ-CB 4.3Å; F267-M270 HydrophobicContact CZ-CE 3.37Å; F267-M270 HydrophobicContact CZ-SD 3.71Å; F267-K271 WeakPolarHBondContact CA-O 3.31Å
268	T	58.2	Low	79.6	Confident	70 Å²	70	43.3 Å²	43.3	43%	0.429	22%	0.219	S	C	.	.	S	Bend	trans	-73.8	153.7	164.9	48	0	0	0	0	112.2	D266 M270 K271	D266-T268 PolarHBondContact OD1-N 3.35Å; D266-T268 WeakPolarHBondContact OD2-CB 3.34Å; D266-T268 WeakPolarHBondContact OD2-CG2 3.43Å; D266-T268 PolarHBondContact OD2-N 2.9Å; D266-T268 PolarHBondContact OD2-OG1 2.86Å; T268-M270 PolarHBondContact O-N 2.92Å; T268-K271 PolarHBondContact O-N 3.44Å
269	D	59.4	Low	79.5	Confident	52 Å²	52	44.3 Å²	44.3	28%	0.278	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	28.1	170.2	-62.5	-7.2	0	0	0	117.9	K271 I399	D269-K271 PolarHBondContact O-N 3.37Å; D269-I399 HydrophobicContact CB-CB 4.39Å; D269-I399 WeakPolarHBondContact OD1-CD1 3.38Å
270	M	60.1	Low	79.5	Confident	37 Å²	37	42.6 Å²	42.6	18%	0.182	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	26.1	-170.6	-47.6	-67.4	82.9	0	0	114.4	L240 I243 F267 T268 L393	L240-M270 HydrophobicContact CD1-SD 4.47Å; I243-M270 HydrophobicContact CD1-CB 3.78Å; I243-M270 HydrophobicContact CD1-CG 4.3Å; I243-M270 HydrophobicContact CG1-CB 4.21Å; F267-M270 HydrophobicContact CD1-CE 4.16Å; F267-M270 HydrophobicContact CE1-CE 3.29Å; F267-M270 HydrophobicContact CE1-SD 4.11Å; F267-M270 HydrophobicContact CE2-CB 4.45Å; F267-M270 HydrophobicContact CE2-CE 4.3Å; F267-M270 HydrophobicContact CZ-CB 4.3Å; F267-M270 HydrophobicContact CZ-CE 3.37Å; F267-M270 HydrophobicContact CZ-SD 3.71Å; T268-M270 PolarHBondContact O-N 2.92Å; M270-L393 HydrophobicContact CE-CD2 3.94Å; M270-L393 HydrophobicContact CG-CB 4.2Å; M270-L393 HydrophobicContact CG-CD2 3.53Å; M270-L393 HydrophobicContact CG-CG 4.48Å; M270-L393 HydrophobicContact SD-CB 4.43Å; M270-L393 HydrophobicContact SD-CD2 4.08Å
271	K	62.8	Low	79.4	Confident	93 Å²	93	42.8 Å²	42.8	40%	0.404	22%	0.218	S	C	.	.			trans	-106.3	122.7	170.4	-67	166.2	-171.2	151.5	0	108.6	F267 T268 D269 Q273 N398	F267-K271 WeakPolarHBondContact CA-O 3.31Å; T268-K271 PolarHBondContact O-N 3.44Å; D269-K271 PolarHBondContact O-N 3.37Å; K271-Q273 PolarHBondContact O-N 3.48Å; K271-N398 WeakPolarHBondContact CE-OD1 3.47Å; K271-N398 PolarHBondContact NZ-OD1 2.9Å; K271-N398 VanDerWaalsContact NZ-OD1 3.11Å
272	C	69.8	Low	79.3	Confident	42 Å²	42	44.5 Å²	44.5	28%	0.284	23%	0.227	S	C	.	.			trans	-82	106.8	171.4	-54.9	0	0	0	0	108.4	P245 L264	P245-C272 WeakPolarHBondContact CA-SG 3.41Å; L264-C272 HydrophobicContact CD1-CB 4.08Å
273	Q	74.2	Confident	79.2	Confident	94 Å²	94	43.9 Å²	43.9	44%	0.439	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	126	168.1	-57	-161.3	58.5	0	0	108.1	I265 D266 K271	I265-Q273 HydrophobicContact CB-CB 3.98Å; I265-Q273 HydrophobicContact CG2-CB 4.45Å; I265-Q273 PolarHBondContact N-O 3.16Å; D266-Q273 HydrophobicContact CB-CB 4.12Å; D266-Q273 HydrophobicContact CB-CG 4.18Å; D266-Q273 PolarHBondContact O-N 3.05Å; D266-Q273 PolarHBondContact OD2-NE2 3.43Å; K271-Q273 PolarHBondContact O-N 3.48Å
274	R	83	Confident	79.3	Confident	121 Å²	121	47.7 Å²	47.7	46%	0.457	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	152.7	179.8	-66.9	-166.9	-178.1	-83.3	0.8	111.3	S246 T263 I265	S246-R274 PolarHBondContact O-NH1 3.16Å; S246-R274 PolarHBondContact O-NH2 2.81Å; S246-R274 PolarHBondContact OG-NH2 3.37Å; T263-R274 VanDerWaalsContact O-CA 3.22Å; T263-R274 WeakPolarHBondContact O-CA 3.36Å; T263-R274 VanDerWaalsContact O-CB 3.32Å; T263-R274 WeakPolarHBondContact O-CB 3.48Å; T263-R274 WeakPolarHBondContact O-CG 3.43Å; T263-R274 PolarHBondContact OG1-NH1 2.92Å; I265-R274 WeakPolarHBondContact CD1-O 3.17Å
275	G	85.3	Confident	79.6	Confident	13 Å²	13	47.5 Å²	47.5	13%	0.134	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.3	-153.1	171.6	0	0	0	0	0	109.3	T263 E297	T263-G275 WeakPolarHBondContact CA-O 3.32Å; T263-G275 PolarHBondContact O-N 3.12Å; G275-E297 VanDerWaalsContact CA-OE1 3.24Å; G275-E297 WeakPolarHBondContact CA-OE1 3.13Å
276	D	91.5	Very high	80.1	Confident	78 Å²	78	47.7 Å²	47.7	42%	0.417	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	101.6	176.4	-174.5	-6.1	0	0	0	109.3	N296 E297	D276-N296 HydrophobicContact CB-CB 4.01Å; D276-N296 WeakPolarHBondContact O-CB 3.45Å; D276-N296 PolarHBondContact O-N 2.79Å; D276-N296 PolarHBondContact OD1-ND2 2.82Å; D276-E297 HydrophobicContact CB-CG 4.11Å
277	L	92.3	Very high	80.7	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	137.2	178.3	-61.3	-167.3	0	0	0	112	D261 T262 I265 F279 L294 D295 F538	D261-L277 VanDerWaalsContact CA-O 3.32Å; D261-L277 WeakPolarHBondContact CA-O 3.35Å; T262-L277 HydrophobicContact CG2-CB 4.04Å; T262-L277 PolarHBondContact N-O 3.17Å; T262-L277 PolarHBondContact O-N 2.98Å; I265-L277 HydrophobicContact CB-CD1 4.2Å; I265-L277 HydrophobicContact CG1-CD1 3.94Å; I265-L277 HydrophobicContact CG1-CD2 4.25Å; I265-L277 HydrophobicContact CG1-CG 3.94Å; I265-L277 HydrophobicContact CG2-CD1 4.29Å; L277-F279 HydrophobicContact CB-CE2 4.3Å; L277-F279 HydrophobicContact CD1-CE2 4.33Å; L277-F279 HydrophobicContact CD1-CZ 4.44Å; L277-L294 WeakPolarHBondContact CA-O 3.32Å; L277-D295 HydrophobicContact CD2-CB 4.23Å; L277-F538 HydrophobicContact CD1-CE1 3.89Å; L277-F538 HydrophobicContact CD1-CZ 4.29Å; L277-F538 HydrophobicContact CD2-CE1 3.83Å; L277-F538 HydrophobicContact CD2-CZ 3.64Å
278	S	93.9	Very high	81.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	119.6	171.1	-67.8	0	0	0	0	111.2	R259 D261 L294 N296	R259-S278 VanDerWaalsContact CZ-OG 3.31Å; R259-S278 PolarHBondContact NH2-OG 3.4Å; D261-S278 VanDerWaalsContact OD1-CB 3.24Å; D261-S278 WeakPolarHBondContact OD1-CB 3.47Å; D261-S278 PolarHBondContact OD1-OG 3.46Å; S278-L294 PolarHBondContact N-O 2.83Å; S278-L294 VanDerWaalsContact N-O 3.09Å; S278-L294 WeakPolarHBondContact O-CD1 3.43Å; S278-L294 PolarHBondContact O-N 3.48Å; S278-N296 PolarHBondContact OG-ND2 3.14Å
279	F	91.9	Very high	82.6	Confident	22 Å²	22	51.4 Å²	51.4	10%	0.096	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.9	169.1	-66.7	-91.8	0	0	0	109.2	R259 L260 T262 L277 V292 V293 F476 L541	R259-F279 CarbonylContact C-O 3.58Å; R259-F279 VanDerWaalsContact CA-O 3.31Å; R259-F279 WeakPolarHBondContact CA-O 3.41Å; L260-F279 HydrophobicContact CB-CB 4.2Å; L260-F279 PolarHBondContact N-O 3.11Å; L260-F279 PolarHBondContact O-N 3.4Å; T262-F279 HydrophobicContact CG2-CD2 4Å; T262-F279 HydrophobicContact CG2-CE2 3.61Å; L277-F279 HydrophobicContact CB-CE2 4.3Å; L277-F279 HydrophobicContact CD1-CE2 4.33Å; L277-F279 HydrophobicContact CD1-CZ 4.44Å; F279-V292 WeakPolarHBondContact CA-O 3.48Å; F279-V293 HydrophobicContact CD1-CB 4.24Å; F279-V293 HydrophobicContact CD1-CG1 3.95Å; F279-V293 HydrophobicContact CD1-CG2 3.73Å; F279-V293 HydrophobicContact CE1-CB 4.07Å; F279-V293 HydrophobicContact CE1-CG1 3.54Å; F279-V293 HydrophobicContact CE1-CG2 3.48Å; F279-V293 VanDerWaalsContact CE1-CG2 3.48Å; F279-V293 HydrophobicContact CE2-CG1 4.34Å; F279-V293 HydrophobicContact CZ-CG1 3.75Å; F279-V293 HydrophobicContact CZ-CG2 4.46Å; F279-F476 HydrophobicContact CB-CZ 4.23Å; F279-F476 AromaticContact CD1-CE1 3.51Å; F279-F476 HydrophobicContact CD1-CE1 3.51Å; F279-F476 HydrophobicContact CD1-CE2 4.21Å; F279-F476 AromaticContact CD1-CZ 3.25Å; F279-F476 HydrophobicContact CD1-CZ 3.25Å; F279-F476 HydrophobicContact CE1-CD1 4.23Å; F279-F476 AromaticContact CE1-CE1 3.33Å; F279-F476 HydrophobicContact CE1-CE1 3.33Å; F279-F476 AromaticContact CE1-CZ 3.64Å; F279-F476 HydrophobicContact CE1-CZ 3.64Å; F279-F476 HydrophobicContact CG-CE1 4.29Å; F279-F476 HydrophobicContact CG-CE2 4.31Å; F279-F476 AromaticContact CG-CZ 3.77Å; F279-F476 HydrophobicContact CG-CZ 3.77Å; F279-F476 HydrophobicContact CZ-CE1 4.02Å; F279-F476 HydrophobicContact CZ-CZ 4.45Å; F279-L541 HydrophobicContact CE1-CD1 4.03Å; F279-L541 HydrophobicContact CZ-CD1 4.14Å
280	I	93.3	Very high	83.9	Confident	6 Å²	6	49 Å²	49	3%	0.031	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	125.4	178	-60.2	177.3	0	0	0	109.2	R259 F291 V292 L294 F525	R259-I280 HydrophobicContact CB-CG1 4.48Å; R259-I280 HydrophobicContact CG-CG1 4.44Å; I280-F291 WeakPolarHBondContact O-CA 3.27Å; I280-V292 HydrophobicContact CB-CG1 3.81Å; I280-V292 HydrophobicContact CG2-CG1 4.47Å; I280-V292 PolarHBondContact N-O 3.03Å; I280-V292 PolarHBondContact O-N 3.34Å; I280-L294 HydrophobicContact CD1-CD1 3.82Å; I280-L294 HydrophobicContact CD1-CD2 4.23Å; I280-L294 HydrophobicContact CG1-CD1 4.11Å; I280-F525 WeakPolarHBondContact CG2-O 3.47Å
281	F	92.3	Very high	85.2	Confident	11 Å²	11	48.8 Å²	48.8	5%	0.048	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	120.9	166.3	174.4	-104.5	0	0	0	110.1	L216 L219 N257 I258 S290 F291 V472	L216-F281 HydrophobicContact CD2-CE1 3.82Å; L216-F281 HydrophobicContact CD2-CZ 3.82Å; L219-F281 HydrophobicContact CD1-CD1 4.46Å; L219-F281 HydrophobicContact CD1-CE1 4.09Å; N257-F281 WeakPolarHBondContact CA-O 3.48Å; I258-F281 HydrophobicContact CB-CB 4.29Å; I258-F281 PolarHBondContact N-O 3.16Å; I258-F281 PolarHBondContact O-N 2.87Å; F281-S290 CarbonylContact C-O 3.54Å; F281-S290 VanDerWaalsContact CA-O 3.28Å; F281-S290 WeakPolarHBondContact CA-O 3.15Å; F281-S290 VanDerWaalsContact CD2-O 3.25Å; F281-S290 WeakPolarHBondContact CD2-O 3.41Å; F281-F291 HydrophobicContact CB-CD1 4.22Å; F281-F291 HydrophobicContact CB-CE1 4Å; F281-F291 AromaticContact CD2-CD1 3.9Å; F281-F291 HydrophobicContact CD2-CD1 3.9Å; F281-F291 HydrophobicContact CD2-CD2 4.02Å; F281-F291 AromaticContact CD2-CE1 3.48Å; F281-F291 HydrophobicContact CD2-CE1 3.48Å; F281-F291 VanDerWaalsContact CD2-CE1 3.48Å; F281-F291 AromaticContact CD2-CE2 3.61Å; F281-F291 HydrophobicContact CD2-CE2 3.61Å; F281-F291 HydrophobicContact CD2-CG 4.17Å; F281-F291 AromaticContact CD2-CZ 3.32Å; F281-F291 HydrophobicContact CD2-CZ 3.32Å; F281-F291 HydrophobicContact CE2-CD2 4.36Å; F281-F291 HydrophobicContact CE2-CE1 4.33Å; F281-F291 AromaticContact CE2-CE2 3.72Å; F281-F291 HydrophobicContact CE2-CE2 3.72Å; F281-F291 AromaticContact CE2-CZ 3.71Å; F281-F291 HydrophobicContact CE2-CZ 3.71Å; F281-F291 HydrophobicContact CG-CE1 4.09Å; F281-F291 HydrophobicContact CG-CZ 4.25Å; F281-V472 HydrophobicContact CB-CG1 4.32Å; F281-V472 HydrophobicContact CD1-CG1 3.56Å; F281-V472 HydrophobicContact CD2-CG1 3.99Å; F281-V472 HydrophobicContact CE1-CG1 3.75Å; F281-V472 HydrophobicContact CE2-CG1 4.16Å; F281-V472 HydrophobicContact CG-CG1 3.67Å; F281-V472 HydrophobicContact CZ-CG1 4.04Å
282	N	91.6	Very high	86.6	Confident	56 Å²	56	44.8 Å²	44.8	30%	0.299	25%	0.247	S	C	.	.			trans	-103.7	113.3	173.1	-176.1	-29.5	0	0	0	109.6	R212 N257 D284 A285 S290	R212-N282 PolarHBondContact NH2-O 3.35Å; N257-N282 WeakPolarHBondContact OD1-CA 3.37Å; N282-D284 PolarHBondContact OD1-N 3.05Å; N282-A285 HydrophobicContact CB-CB 3.94Å; N282-A285 PolarHBondContact OD1-N 3.36Å; N282-S290 PolarHBondContact N-O 3.04Å; N282-S290 WeakPolarHBondContact O-CB 3.46Å
283	G	89.1	Confident	87.6	Confident	4 Å²	4	42.8 Å²	42.8	4%	0.041	23%	0.233	C	C	.	.	S	Bend	trans	-74.7	-28.5	-177.4	0	0	0	0	0	114.2	R212 L216 N257	R212-G283 PolarHBondContact NH2-O 2.64Å; L216-G283 WeakPolarHBondContact CD1-O 2.92Å; N257-G283 PolarHBondContact OD1-N 2.71Å
284	D	88.6	Confident	88.6	Confident	133 Å²	133	38.4 Å²	38.4	71%	0.711	21%	0.212	S	C	*	.	S	Bend	trans	-79.9	-21.3	179.2	-66.8	-67.9	0	0	0	112.7	N282	N282-D284 PolarHBondContact OD1-N 3.05Å
285	A	88.1	Confident	89.1	Confident	24 Å²	24	32.8 Å²	32.8	20%	0.198	19%	0.192	C	C	.	.	S	Bend	trans	-71.7	160	178.1	0	0	0	0	0	113.6	R212 N282 E289	R212-A285 PolarHBondContact NH2-O 3.4Å; N282-A285 HydrophobicContact CB-CB 3.94Å; N282-A285 PolarHBondContact OD1-N 3.36Å; A285-E289 HydrophobicContact CB-CB 4.38Å
286	A	85.1	Confident	89.6	Confident	45 Å²	45	33.4 Å²	33.4	37%	0.372	19%	0.192	S	C	.	.			trans	-62.4	152.1	171.2	0	0	0	0	0	111.1	S288 E289 S290	A286-S288 VanDerWaalsContact C-N 3.29Å; A286-S288 PolarHBondContact O-N 2.86Å; A286-S288 VanDerWaalsContact O-N 3.16Å; A286-E289 CarbonylContact O-C 3.48Å; A286-E289 PolarHBondContact O-N 3.27Å; A286-S290 WeakPolarHBondContact O-CB 3.12Å; A286-S290 PolarHBondContact O-N 2.89Å
287	P	80.3	Confident	89.6	Confident	60 Å²	60	36.1 Å²	36.1	39%	0.39	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-52.1	-43.1	-175.5	-29.5	36.3	0	0	0	114.4	E209 E289 S290	E209-P287 WeakPolarHBondContact OE1-CG 3.38Å; E209-P287 WeakPolarHBondContact OE2-CB 3.27Å; E209-P287 WeakPolarHBondContact OE2-CG 3.44Å; P287-E289 VanDerWaalsContact C-N 3.27Å; P287-E289 PolarHBondContact O-N 2.91Å; P287-S290 PolarHBondContact O-N 2.91Å; P287-S290 PolarHBondContact O-OG 3.43Å
288	S	77.9	Confident	89.7	Confident	71 Å²	71	41.2 Å²	41.2	50%	0.497	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-66.7	-18.4	177.4	49.7	0	0	0	0	115.4	A286	A286-S288 VanDerWaalsContact C-N 3.29Å; A286-S288 PolarHBondContact O-N 2.86Å; A286-S288 VanDerWaalsContact O-N 3.16Å
289	E	83.3	Confident	89.8	Confident	115 Å²	115	45.7 Å²	45.7	54%	0.537	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-111.4	-7.3	-179.2	-61.8	177.1	153.4	0	0	112	A285 A286 P287 F291	A285-E289 HydrophobicContact CB-CB 4.38Å; A286-E289 CarbonylContact O-C 3.48Å; A286-E289 PolarHBondContact O-N 3.27Å; P287-E289 VanDerWaalsContact C-N 3.27Å; P287-E289 PolarHBondContact O-N 2.91Å; E289-F291 VanDerWaalsContact C-N 3.28Å; E289-F291 PolarHBondContact O-N 3.18Å
290	S	86.9	Confident	89.9	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.014	25%	0.246	C	C	.	.	S	Bend	trans	-76.9	-6	-168.9	64.4	0	0	0	0	115.6	R212 F281 N282 A286 P287	R212-S290 PolarHBondContact NH1-OG 2.83Å; R212-S290 VanDerWaalsContact NH2-CB 3.34Å; F281-S290 CarbonylContact C-O 3.54Å; F281-S290 VanDerWaalsContact CA-O 3.28Å; F281-S290 WeakPolarHBondContact CA-O 3.15Å; F281-S290 VanDerWaalsContact CD2-O 3.25Å; F281-S290 WeakPolarHBondContact CD2-O 3.41Å; N282-S290 PolarHBondContact N-O 3.04Å; N282-S290 WeakPolarHBondContact O-CB 3.46Å; A286-S290 WeakPolarHBondContact O-CB 3.12Å; A286-S290 PolarHBondContact O-N 2.89Å; P287-S290 PolarHBondContact O-N 2.91Å; P287-S290 PolarHBondContact O-OG 3.43Å
291	F	88.6	Confident	90	Very high	32 Å²	32	46.7 Å²	46.7	14%	0.14	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	129.8	177.1	-73.3	-84.8	0	0	0	111.4	I280 F281 E289 I304 V472 P475	I280-F291 WeakPolarHBondContact O-CA 3.27Å; F281-F291 HydrophobicContact CB-CD1 4.22Å; F281-F291 HydrophobicContact CB-CE1 4Å; F281-F291 AromaticContact CD2-CD1 3.9Å; F281-F291 HydrophobicContact CD2-CD1 3.9Å; F281-F291 HydrophobicContact CD2-CD2 4.02Å; F281-F291 AromaticContact CD2-CE1 3.48Å; F281-F291 HydrophobicContact CD2-CE1 3.48Å; F281-F291 VanDerWaalsContact CD2-CE1 3.48Å; F281-F291 AromaticContact CD2-CE2 3.61Å; F281-F291 HydrophobicContact CD2-CE2 3.61Å; F281-F291 HydrophobicContact CD2-CG 4.17Å; F281-F291 AromaticContact CD2-CZ 3.32Å; F281-F291 HydrophobicContact CD2-CZ 3.32Å; F281-F291 HydrophobicContact CE2-CD2 4.36Å; F281-F291 HydrophobicContact CE2-CE1 4.33Å; F281-F291 AromaticContact CE2-CE2 3.72Å; F281-F291 HydrophobicContact CE2-CE2 3.72Å; F281-F291 AromaticContact CE2-CZ 3.71Å; F281-F291 HydrophobicContact CE2-CZ 3.71Å; F281-F291 HydrophobicContact CG-CE1 4.09Å; F281-F291 HydrophobicContact CG-CZ 4.25Å; E289-F291 VanDerWaalsContact C-N 3.28Å; E289-F291 PolarHBondContact O-N 3.18Å; F291-I304 HydrophobicContact CB-CB 4Å; F291-I304 HydrophobicContact CB-CD1 4.24Å; F291-I304 HydrophobicContact CB-CG1 4.39Å; F291-I304 PolarHBondContact O-N 2.95Å; F291-I304 VanDerWaalsContact O-N 3.08Å; F291-V472 HydrophobicContact CZ-CG1 4.37Å; F291-P475 HydrophobicContact CZ-CG 4.48Å
292	V	91.3	Very high	89.9	Confident	10 Å²	10	46.7 Å²	46.7	6%	0.061	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	142.5	175	63.4	0	0	0	0	110.8	F279 I280 L294 Y301 Q302 R303 I527	F279-V292 WeakPolarHBondContact CA-O 3.48Å; I280-V292 HydrophobicContact CB-CG1 3.81Å; I280-V292 HydrophobicContact CG2-CG1 4.47Å; I280-V292 PolarHBondContact N-O 3.03Å; I280-V292 PolarHBondContact O-N 3.34Å; V292-L294 HydrophobicContact CG1-CD1 3.9Å; V292-L294 HydrophobicContact CG2-CD1 4.15Å; V292-Y301 HydrophobicContact CG2-CD2 3.63Å; V292-Y301 HydrophobicContact CG2-CG 4.17Å; V292-Q302 WeakPolarHBondContact CA-O 3.4Å; V292-Q302 WeakPolarHBondContact CG2-O 3.39Å; V292-R303 HydrophobicContact CG2-CG 4.25Å; V292-I527 HydrophobicContact CG1-CD1 4.3Å; V292-I527 HydrophobicContact CG1-CG1 4.15Å; V292-I527 HydrophobicContact CG2-CD1 4.01Å; V292-I527 HydrophobicContact CG2-CG1 4.36Å
293	V	92	Very high	89.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.6	172	-163.3	0	0	0	0	108.4	F279 Y301 Q302 I304 F538 L541	F279-V293 HydrophobicContact CD1-CB 4.24Å; F279-V293 HydrophobicContact CD1-CG1 3.95Å; F279-V293 HydrophobicContact CD1-CG2 3.73Å; F279-V293 HydrophobicContact CE1-CB 4.07Å; F279-V293 HydrophobicContact CE1-CG1 3.54Å; F279-V293 HydrophobicContact CE1-CG2 3.48Å; F279-V293 VanDerWaalsContact CE1-CG2 3.48Å; F279-V293 HydrophobicContact CE2-CG1 4.34Å; F279-V293 HydrophobicContact CZ-CG1 3.75Å; F279-V293 HydrophobicContact CZ-CG2 4.46Å; V293-Y301 CarbonylContact O-C 3.56Å; V293-Y301 WeakPolarHBondContact O-CA 3.29Å; V293-Y301 WeakPolarHBondContact O-CB 3.46Å; V293-Q302 PolarHBondContact N-O 2.68Å; V293-Q302 PolarHBondContact O-N 2.83Å; V293-I304 HydrophobicContact CG2-CD1 3.77Å; V293-I304 HydrophobicContact CG2-CG1 3.79Å; V293-F538 HydrophobicContact CB-CD2 4.07Å; V293-F538 HydrophobicContact CB-CE2 3.9Å; V293-F538 HydrophobicContact CG1-CD2 4Å; V293-F538 HydrophobicContact CG1-CE1 4.41Å; V293-F538 HydrophobicContact CG1-CE2 3.58Å; V293-F538 HydrophobicContact CG1-CZ 3.81Å; V293-L541 HydrophobicContact CG2-CD1 4.21Å
294	L	94.1	Very high	89.2	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	133.8	174.2	-70.2	71.1	0	0	0	109	L277 S278 I280 V292 Y531	L277-L294 WeakPolarHBondContact CA-O 3.32Å; S278-L294 PolarHBondContact N-O 2.83Å; S278-L294 VanDerWaalsContact N-O 3.09Å; S278-L294 WeakPolarHBondContact O-CD1 3.43Å; S278-L294 PolarHBondContact O-N 3.48Å; I280-L294 HydrophobicContact CD1-CD1 3.82Å; I280-L294 HydrophobicContact CD1-CD2 4.23Å; I280-L294 HydrophobicContact CG1-CD1 4.11Å; V292-L294 HydrophobicContact CG1-CD1 3.9Å; V292-L294 HydrophobicContact CG2-CD1 4.15Å; L294-Y531 HydrophobicContact CB-CD1 4.47Å; L294-Y531 HydrophobicContact CB-CE1 4.17Å; L294-Y531 HydrophobicContact CD2-CD1 4.17Å; L294-Y531 HydrophobicContact CD2-CE1 4.01Å; L294-Y531 HydrophobicContact CG-CD1 4.37Å; L294-Y531 HydrophobicContact CG-CE1 4.4Å
295	D	93.9	Very high	88.3	Confident	4 Å²	4	46.4 Å²	46.4	2%	0.021	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	105.8	161.4	-173.8	-41.7	0	0	0	107.7	L277 E297 Q298 K299 V300 R537 F538	L277-D295 HydrophobicContact CD2-CB 4.23Å; D295-E297 VanDerWaalsContact C-N 3.31Å; D295-E297 PolarHBondContact O-N 3.04Å; D295-E297 PolarHBondContact OD1-N 2.68Å; D295-Q298 HydrophobicContact CB-CB 4.3Å; D295-Q298 PolarHBondContact OD1-N 3.28Å; D295-Q298 PolarHBondContact OD2-NE2 2.93Å; D295-K299 WeakPolarHBondContact O-CA 3.3Å; D295-K299 PolarHBondContact O-N 3.49Å; D295-V300 HydrophobicContact CB-CG2 3.88Å; D295-V300 PolarHBondContact N-O 2.78Å; D295-V300 PolarHBondContact O-N 3.44Å; D295-R537 IonicContact OD2-CZ 3.34Å; D295-R537 IonicContact OD2-NE 3.21Å; D295-R537 PolarHBondContact OD2-NE 3.5Å; D295-R537 IonicContact OD2-NH2 2.92Å; D295-R537 PolarHBondContact OD2-NH2 3.37Å; D295-F538 HydrophobicContact CB-CZ 3.98Å
296	N	94.8	Very high	87.1	Confident	25 Å²	25	49.9 Å²	49.9	13%	0.134	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-20	-174.2	-60.2	-33.2	0	0	0	112.4	D276 S278 Y531	D276-N296 HydrophobicContact CB-CB 4.01Å; D276-N296 WeakPolarHBondContact O-CB 3.45Å; D276-N296 PolarHBondContact O-N 2.79Å; D276-N296 PolarHBondContact OD1-ND2 2.82Å; S278-N296 PolarHBondContact OG-ND2 3.14Å; N296-Y531 WeakPolarHBondContact CA-OH 3.39Å; N296-Y531 PolarHBondContact OD1-OH 2.96Å
297	E	93.1	Very high	86	Confident	135 Å²	135	56.4 Å²	56.4	63%	0.631	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-42.8	176.6	-59.6	-170.6	176.7	0	0	111.5	G275 D276 D295	G275-E297 VanDerWaalsContact CA-OE1 3.24Å; G275-E297 WeakPolarHBondContact CA-OE1 3.13Å; D276-E297 HydrophobicContact CB-CG 4.11Å; D295-E297 VanDerWaalsContact C-N 3.31Å; D295-E297 PolarHBondContact O-N 3.04Å; D295-E297 PolarHBondContact OD1-N 2.68Å
298	Q	92.6	Very high	85.4	Confident	109 Å²	109	56.8 Å²	56.8	51%	0.509	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-14.1	-179.6	-60.5	-171	28.6	0	0	113.5	D295 V300	D295-Q298 HydrophobicContact CB-CB 4.3Å; D295-Q298 PolarHBondContact OD1-N 3.28Å; D295-Q298 PolarHBondContact OD2-NE2 2.93Å; Q298-V300 HydrophobicContact CB-CG2 4.1Å
299	K	95.9	Very high	85.4	Confident	94 Å²	94	55.3 Å²	55.3	41%	0.409	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	46.5	-173.6	-57.9	-169.1	170.2	-162.2	0	112.9	D295 D530 Y531 K532	D295-K299 WeakPolarHBondContact O-CA 3.3Å; D295-K299 PolarHBondContact O-N 3.49Å; K299-D530 WeakPolarHBondContact CD-OD2 3.27Å; K299-D530 IonicContact NZ-OD2 3.28Å; K299-D530 PolarHBondContact NZ-OD2 2.64Å; K299-Y531 HydrophobicContact CB-CD1 4.35Å; K299-Y531 HydrophobicContact CB-CD2 4.08Å; K299-Y531 HydrophobicContact CB-CE1 4.44Å; K299-Y531 HydrophobicContact CB-CE2 4.18Å; K299-Y531 HydrophobicContact CB-CG 4.17Å; K299-Y531 HydrophobicContact CD-CE2 4.32Å; K299-Y531 HydrophobicContact CG-CD2 4.38Å; K299-Y531 HydrophobicContact CG-CE2 4.02Å; K299-Y531 VanDerWaalsContact O-CA 3.29Å; K299-Y531 WeakPolarHBondContact O-CA 3.23Å; K299-K532 PolarHBondContact O-N 3.42Å
300	V	95.4	Very high	85.5	Confident	20 Å²	20	56.4 Å²	56.4	12%	0.121	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	161.4	172.4	-60.1	0	0	0	0	111	D295 Q298 K532 D534 R537	D295-V300 HydrophobicContact CB-CG2 3.88Å; D295-V300 PolarHBondContact N-O 2.78Å; D295-V300 PolarHBondContact O-N 3.44Å; Q298-V300 HydrophobicContact CB-CG2 4.1Å; V300-K532 CarbonylContact C-O 3.42Å; V300-K532 WeakPolarHBondContact CA-O 3.33Å; V300-K532 WeakPolarHBondContact CB-O 3.41Å; V300-D534 HydrophobicContact CB-CB 3.99Å; V300-D534 HydrophobicContact CG1-CB 4.25Å; V300-D534 HydrophobicContact CG2-CB 4.29Å; V300-R537 HydrophobicContact CG2-CB 4.22Å; V300-R537 HydrophobicContact CG2-CG 3.74Å
301	Y	94.1	Very high	85.3	Confident	30 Å²	30	61.8 Å²	61.8	12%	0.118	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	152.6	175	73	-95.4	0	0	0	111.8	V292 V293 R303 I527 K532 E533 D534	V292-Y301 HydrophobicContact CG2-CD2 3.63Å; V292-Y301 HydrophobicContact CG2-CG 4.17Å; V293-Y301 CarbonylContact O-C 3.56Å; V293-Y301 WeakPolarHBondContact O-CA 3.29Å; V293-Y301 WeakPolarHBondContact O-CB 3.46Å; Y301-R303 HydrophobicContact CE2-CG 4.33Å; Y301-R303 PolarHBondContact OH-NH2 2.98Å; Y301-I527 HydrophobicContact CD1-CD1 4.47Å; Y301-I527 HydrophobicContact CD1-CG2 3.46Å; Y301-I527 VanDerWaalsContact CD1-CG2 3.46Å; Y301-I527 HydrophobicContact CD2-CD1 3.89Å; Y301-I527 HydrophobicContact CE1-CD1 4.37Å; Y301-I527 HydrophobicContact CE1-CG2 3.64Å; Y301-I527 HydrophobicContact CE2-CD1 3.77Å; Y301-I527 HydrophobicContact CG-CD1 4.22Å; Y301-I527 HydrophobicContact CG-CG2 4.02Å; Y301-K532 WeakPolarHBondContact CD1-O 3.42Å; Y301-K532 PolarHBondContact N-O 2.83Å; Y301-E533 HydrophobicContact CD2-CB 4.39Å; Y301-E533 HydrophobicContact CD2-CG 4.15Å; Y301-E533 HydrophobicContact CE1-CB 4.04Å; Y301-E533 HydrophobicContact CE2-CB 3.76Å; Y301-E533 HydrophobicContact CE2-CG 3.6Å; Y301-E533 VanDerWaalsContact CE2-OE1 3.31Å; Y301-E533 WeakPolarHBondContact CE2-OE1 3.43Å; Y301-E533 CarbonylContact O-C 3.52Å; Y301-E533 WeakPolarHBondContact O-CA 3.09Å; Y301-D534 PolarHBondContact O-N 3.44Å
302	Q	90.8	Very high	85	Confident	11 Å²	11	64.2 Å²	64.2	5%	0.051	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	125.9	174.6	179.3	170.2	-39.9	0	0	108.9	V292 V293 F538 L541	V292-Q302 WeakPolarHBondContact CA-O 3.4Å; V292-Q302 WeakPolarHBondContact CG2-O 3.39Å; V293-Q302 PolarHBondContact N-O 2.68Å; V293-Q302 PolarHBondContact O-N 2.83Å; Q302-F538 HydrophobicContact CB-CD2 3.94Å; Q302-F538 PolarHBondContact NE2-O 3.09Å; Q302-L541 PolarHBondContact NE2-OXT 3.35Å
303	R	87.6	Confident	84.9	Confident	65 Å²	65	64.1 Å²	64.1	25%	0.245	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	133	169.2	-63.7	174.7	-158.4	-74	-9.9	108.8	V292 Y301 H305 E533	V292-R303 HydrophobicContact CG2-CG 4.25Å; Y301-R303 HydrophobicContact CE2-CG 4.33Å; Y301-R303 PolarHBondContact OH-NH2 2.98Å; R303-H305 VanDerWaalsContact C-N 3.28Å; R303-H305 PolarHBondContact O-N 2.92Å; R303-H305 PolarHBondContact O-ND1 3.37Å; R303-E533 WeakPolarHBondContact CD-OE1 3.27Å; R303-E533 WeakPolarHBondContact CG-OE1 3.27Å; R303-E533 IonicContact CZ-OE1 3.96Å; R303-E533 IonicContact NE-OE1 3.62Å; R303-E533 PolarHBondContact NE-OE1 3.31Å; R303-E533 IonicContact NH2-OE1 2.62Å
304	I	78.1	Confident	84.8	Confident	16 Å²	16	65.9 Å²	65.9	8%	0.082	31%	0.311	C	S	.	.			trans	-73.9	87.1	177.7	-65.1	-176.5	0	0	0	107.5	F291 V293	F291-I304 HydrophobicContact CB-CB 4Å; F291-I304 HydrophobicContact CB-CD1 4.24Å; F291-I304 HydrophobicContact CB-CG1 4.39Å; F291-I304 PolarHBondContact O-N 2.95Å; F291-I304 VanDerWaalsContact O-N 3.08Å; V293-I304 HydrophobicContact CG2-CD1 3.77Å; V293-I304 HydrophobicContact CG2-CG1 3.79Å
305	H	69.6	Low	84.4	Confident	106 Å²	106	69.4 Å²	69.4	49%	0.491	33%	0.328	S	S	.	.			trans	-82.1	132.5	177.6	-71.8	93.2	0	0	0	109.6	R303 E307	R303-H305 VanDerWaalsContact C-N 3.28Å; R303-H305 PolarHBondContact O-N 2.92Å; R303-H305 PolarHBondContact O-ND1 3.37Å; H305-E307 PolarHBondContact O-N 2.91Å
306	H	62.9	Low	84.2	Confident	96 Å²	96	72.6 Å²	72.6	44%	0.444	34%	0.342	S	S	.	.			trans	-89.7	28.4	175	-67.5	-21.6	0	0	0	112.7	R205	R205-H306 PolarHBondContact NH1-O 3.33Å; R205-H306 PolarHBondContact NH2-O 3.32Å
307	E	63.4	Low	84.1	Confident	182 Å²	182	71.4 Å²	71.4	85%	0.85	34%	0.336	S	S	*	.			trans	-102.4	85.5	174.2	-64.1	-158.6	162.1	0	0	110	H305	H305-E307 PolarHBondContact O-N 2.91Å
308	E	67.1	Low	84	Confident	68 Å²	68	65.6 Å²	65.6	32%	0.318	31%	0.309	S	S	.	.			trans	-76.2	139	176.4	-61.7	165.9	-150.9	0	0	110.3	K201 R205 E312	K201-E308 WeakPolarHBondContact CD-OE1 3.26Å; K201-E308 WeakPolarHBondContact CD-OE2 3.34Å; K201-E308 VanDerWaalsContact CE-CD 3.49Å; K201-E308 VanDerWaalsContact CE-OE1 3.25Å; K201-E308 WeakPolarHBondContact CE-OE1 3.29Å; K201-E308 WeakPolarHBondContact CE-OE2 3.36Å; K201-E308 VanDerWaalsContact NZ-CD 3.31Å; K201-E308 IonicContact NZ-OE1 2.69Å; K201-E308 IonicContact NZ-OE2 2.67Å; K201-E308 PolarHBondContact NZ-OE2 3.35Å; R205-E308 IonicContact CZ-OE1 2.77Å; R205-E308 VanDerWaalsContact NH2-CD 3.27Å; R205-E308 IonicContact NH2-OE1 3.17Å; R205-E308 PolarHBondContact NH2-OE1 2.85Å; E308-E312 WeakPolarHBondContact CA-OE2 3.33Å
309	S	78.7	Confident	83.8	Confident	41 Å²	41	65.2 Å²	65.2	29%	0.287	31%	0.31	S	S	.	.			trans	-75.7	162.5	174.3	78.9	0	0	0	0	112.7	M311 E312 T313	S309-M311 PolarHBondContact O-N 3.46Å; S309-M311 WeakPolarHBondContact OG-CB 3.4Å; S309-M311 PolarHBondContact OG-N 2.76Å; S309-M311 VanDerWaalsContact OG-N 3.15Å; S309-E312 WeakPolarHBondContact CB-OE1 3.38Å; S309-E312 VanDerWaalsContact N-CD 3.31Å; S309-E312 PolarHBondContact N-OE1 2.78Å; S309-E312 PolarHBondContact N-OE2 2.81Å; S309-E312 VanDerWaalsContact OG-CD 3.22Å; S309-E312 PolarHBondContact OG-N 3.29Å; S309-E312 PolarHBondContact OG-OE1 2.8Å; S309-T313 PolarHBondContact O-N 3.06Å; S309-T313 PolarHBondContact O-OG1 2.72Å; S309-T313 VanDerWaalsContact O-OG1 3.07Å
310	E	83.9	Confident	83.7	Confident	137 Å²	137	63.1 Å²	63.1	64%	0.64	30%	0.303	S	S	*	.	H	α-helix	trans	-63.3	-21	168.6	-65.8	-148.5	107.6	0	0	112.4	R198 E314	R198-E310 IonicContact CZ-OE1 3.59Å; R198-E310 IonicContact NH1-OE1 3.17Å; R198-E310 PolarHBondContact NH1-OE1 2.69Å; R198-E310 IonicContact NH2-OE1 3.31Å; R198-E310 PolarHBondContact NH2-OE1 3Å; E310-E314 WeakPolarHBondContact O-CB 3.21Å; E310-E314 WeakPolarHBondContact O-CG 3.5Å; E310-E314 PolarHBondContact O-N 3.39Å
311	M	83.4	Confident	83.6	Confident	116 Å²	116	62.5 Å²	62.5	57%	0.571	30%	0.299	S	S	*	.	H	α-helix	trans	-72.6	-54.3	178.7	-165	174.9	77.4	0	0	110.7	S309 T313 E314 E315	S309-M311 PolarHBondContact O-N 3.46Å; S309-M311 WeakPolarHBondContact OG-CB 3.4Å; S309-M311 PolarHBondContact OG-N 2.76Å; S309-M311 VanDerWaalsContact OG-N 3.15Å; M311-T313 VanDerWaalsContact C-N 3.31Å; M311-T313 PolarHBondContact O-N 3.27Å; M311-E314 PolarHBondContact O-N 2.9Å; M311-E315 WeakPolarHBondContact CG-OE1 3.36Å; M311-E315 WeakPolarHBondContact O-CG 3.44Å; M311-E315 PolarHBondContact O-N 3.3Å
312	E	83.1	Confident	83.4	Confident	83 Å²	83	62 Å²	62	39%	0.388	30%	0.3	S	S	.	.	H	α-helix	trans	-56.4	-44.3	175.8	-65.9	131.1	-121.8	0	0	111.7	E308 S309 E314 E315 E316	E308-E312 WeakPolarHBondContact CA-OE2 3.33Å; S309-E312 WeakPolarHBondContact CB-OE1 3.38Å; S309-E312 VanDerWaalsContact N-CD 3.31Å; S309-E312 PolarHBondContact N-OE1 2.78Å; S309-E312 PolarHBondContact N-OE2 2.81Å; S309-E312 VanDerWaalsContact OG-CD 3.22Å; S309-E312 PolarHBondContact OG-N 3.29Å; S309-E312 PolarHBondContact OG-OE1 2.8Å; E312-E314 VanDerWaalsContact C-N 3.25Å; E312-E314 PolarHBondContact O-N 3.21Å; E312-E315 PolarHBondContact O-N 3.47Å; E312-E316 PolarHBondContact O-N 2.94Å
313	T	88.4	Confident	83.4	Confident	8 Å²	8	63.6 Å²	63.6	5%	0.049	31%	0.312	C	S	.	.	H	α-helix	trans	-58	-41.3	177.9	-59.7	0	0	0	0	111.4	T194 L197 R198 S309 M311 V317	T194-T313 HydrophobicContact CG2-CG2 3.96Å; L197-T313 HydrophobicContact CD2-CG2 4.39Å; R198-T313 HydrophobicContact CG-CG2 3.93Å; S309-T313 PolarHBondContact O-N 3.06Å; S309-T313 PolarHBondContact O-OG1 2.72Å; S309-T313 VanDerWaalsContact O-OG1 3.07Å; M311-T313 VanDerWaalsContact C-N 3.31Å; M311-T313 PolarHBondContact O-N 3.27Å; T313-V317 VanDerWaalsContact O-CG2 3.28Å; T313-V317 WeakPolarHBondContact O-CG2 3.46Å; T313-V317 PolarHBondContact O-N 3.12Å
314	E	89.3	Confident	83.5	Confident	36 Å²	36	61.8 Å²	61.8	17%	0.168	31%	0.307	C	S	.	.	H	α-helix	trans	-79.7	-29.6	-177.9	-74.6	-82.2	118.3	0	0	112.6	R190 T194 E310 M311 E312 V317 D318 R408	R190-E314 IonicContact CZ-OE2 3.19Å; R190-E314 IonicContact NE-OE1 3.25Å; R190-E314 IonicContact NE-OE2 3.66Å; R190-E314 PolarHBondContact NE-OE2 2.8Å; R190-E314 VanDerWaalsContact NH2-CD 3.33Å; R190-E314 PolarHBondContact NH2-O 3.28Å; R190-E314 IonicContact NH2-OE1 2.68Å; R190-E314 IonicContact NH2-OE2 2.77Å; R190-E314 PolarHBondContact NH2-OE2 3.13Å; T194-E314 PolarHBondContact OG1-OE1 2.67Å; T194-E314 VanDerWaalsContact OG1-OE1 3.06Å; E310-E314 WeakPolarHBondContact O-CB 3.21Å; E310-E314 WeakPolarHBondContact O-CG 3.5Å; E310-E314 PolarHBondContact O-N 3.39Å; M311-E314 PolarHBondContact O-N 2.9Å; E312-E314 VanDerWaalsContact C-N 3.25Å; E312-E314 PolarHBondContact O-N 3.21Å; E314-V317 PolarHBondContact O-N 3.23Å; E314-D318 PolarHBondContact O-N 2.86Å; E314-R408 VanDerWaalsContact CB-NH2 3.26Å; E314-R408 IonicContact OE2-CZ 2.7Å; E314-R408 IonicContact OE2-NE 2.78Å; E314-R408 PolarHBondContact OE2-NE 3.01Å; E314-R408 VanDerWaalsContact OE2-NE 3.07Å; E314-R408 IonicContact OE2-NH2 2.71Å
315	E	86.4	Confident	84.2	Confident	75 Å²	75	61.7 Å²	61.7	35%	0.35	31%	0.307	S	S	.	.	H	α-helix	trans	-68.5	-41.9	171.6	-74.1	171.5	-176.4	0	0	111.6	M311 E312 V317 D318 I319	M311-E315 WeakPolarHBondContact CG-OE1 3.36Å; M311-E315 WeakPolarHBondContact O-CG 3.44Å; M311-E315 PolarHBondContact O-N 3.3Å; E312-E315 PolarHBondContact O-N 3.47Å; E315-V317 VanDerWaalsContact C-N 3.25Å; E315-V317 PolarHBondContact O-N 3.22Å; E315-D318 WeakPolarHBondContact O-CB 3.37Å; E315-D318 PolarHBondContact O-N 2.95Å; E315-D318 VanDerWaalsContact O-N 3.09Å; E315-I319 WeakPolarHBondContact O-CG1 3.42Å; E315-I319 PolarHBondContact O-N 3.27Å
316	E	88.8	Confident	85	Confident	71 Å²	71	61 Å²	61	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-57	-39.5	169.1	-83.3	-174.1	-162.7	0	0	111.8	L197 K201 E312 I319 L320	L197-E316 WeakPolarHBondContact CD1-OE2 2.99Å; L197-E316 HydrophobicContact CD2-CB 3.85Å; L197-E316 WeakPolarHBondContact CD2-OE2 2.92Å; K201-E316 WeakPolarHBondContact CE-OE2 3.41Å; K201-E316 IonicContact NZ-OE1 2.6Å; K201-E316 PolarHBondContact NZ-OE1 3.25Å; K201-E316 IonicContact NZ-OE2 3.34Å; K201-E316 PolarHBondContact NZ-OE2 2.99Å; E312-E316 PolarHBondContact O-N 2.94Å; E316-I319 PolarHBondContact O-N 3.49Å; E316-L320 WeakPolarHBondContact O-CB 2.98Å; E316-L320 WeakPolarHBondContact O-CG 3.16Å; E316-L320 PolarHBondContact O-N 3Å
317	V	93.4	Very high	86	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-67.5	-37.1	176.1	175.3	0	0	0	0	111.5	R190 I193 L197 T313 E314 E315 L320 M321	R190-V317 HydrophobicContact CG-CG1 3.67Å; I193-V317 HydrophobicContact CB-CG1 4.32Å; I193-V317 HydrophobicContact CG2-CG1 4.04Å; I193-V317 HydrophobicContact CG2-CG2 4.16Å; L197-V317 HydrophobicContact CD2-CG2 3.69Å; T313-V317 VanDerWaalsContact O-CG2 3.28Å; T313-V317 WeakPolarHBondContact O-CG2 3.46Å; T313-V317 PolarHBondContact O-N 3.12Å; E314-V317 PolarHBondContact O-N 3.23Å; E315-V317 VanDerWaalsContact C-N 3.25Å; E315-V317 PolarHBondContact O-N 3.22Å; V317-L320 PolarHBondContact O-N 3.16Å; V317-M321 HydrophobicContact CG1-CG 4.32Å; V317-M321 HydrophobicContact CG1-SD 4.01Å; V317-M321 WeakPolarHBondContact O-CB 3.29Å; V317-M321 VanDerWaalsContact O-CG 3.29Å; V317-M321 WeakPolarHBondContact O-CG 3.36Å; V317-M321 PolarHBondContact O-N 3.01Å
318	D	90.9	Very high	86.7	Confident	13 Å²	13	50.1 Å²	50.1	7%	0.07	26%	0.258	C	S	.	.	H	α-helix	trans	-64.8	-38.2	173.6	-73.4	-38.9	0	0	0	112.4	R190 E314 E315 S322 R408 R409	R190-D318 IonicContact CZ-OD1 3.73Å; R190-D318 IonicContact NH1-OD1 3.46Å; R190-D318 PolarHBondContact NH1-OD1 3.25Å; R190-D318 IonicContact NH1-OD2 2.71Å; R190-D318 IonicContact NH2-OD1 2.69Å; R190-D318 PolarHBondContact NH2-OD1 3.21Å; R190-D318 IonicContact NH2-OD2 3.59Å; R190-D318 PolarHBondContact NH2-OD2 3.02Å; E314-D318 PolarHBondContact O-N 2.86Å; E315-D318 WeakPolarHBondContact O-CB 3.37Å; E315-D318 PolarHBondContact O-N 2.95Å; E315-D318 VanDerWaalsContact O-N 3.09Å; D318-S322 PolarHBondContact O-N 3.11Å; D318-S322 PolarHBondContact O-OG 3.19Å; D318-R408 IonicContact OD2-CZ 3.69Å; D318-R408 IonicContact OD2-NE 2.76Å; D318-R408 IonicContact OD2-NH1 3.72Å; D318-R408 PolarHBondContact OD2-NH1 2.7Å; D318-R409 HydrophobicContact CB-CG 4.38Å; D318-R409 WeakPolarHBondContact OD1-CA 3.48Å; D318-R409 WeakPolarHBondContact OD1-CB 3.39Å; D318-R409 WeakPolarHBondContact OD1-CG 3.41Å; D318-R409 PolarHBondContact OD1-N 2.85Å
319	I	89	Confident	87.3	Confident	101 Å²	101	50 Å²	50	52%	0.518	26%	0.262	S	S	.	.	H	α-helix	trans	-66.2	-46.8	172.4	-66.5	165.7	0	0	0	110.7	E315 E316 M321 S322 S323	E315-I319 WeakPolarHBondContact O-CG1 3.42Å; E315-I319 PolarHBondContact O-N 3.27Å; E316-I319 PolarHBondContact O-N 3.49Å; I319-M321 VanDerWaalsContact C-N 3.32Å; I319-M321 PolarHBondContact O-N 3.49Å; I319-S322 PolarHBondContact O-N 2.86Å; I319-S322 VanDerWaalsContact O-N 3.17Å; I319-S322 PolarHBondContact O-OG 2.93Å; I319-S323 WeakPolarHBondContact O-CB 3.47Å; I319-S323 PolarHBondContact O-N 3.02Å; I319-S323 PolarHBondContact O-OG 3.23Å
320	L	92.6	Very high	87.2	Confident	50 Å²	50	50.3 Å²	50.3	26%	0.262	26%	0.26	S	S	.	.	H	α-helix	trans	-63.1	-36.6	179.1	-71.8	169.5	0	0	0	112.3	I185 I193 L197 E316 V317 S322	I185-L320 HydrophobicContact CD1-CB 3.97Å; I185-L320 HydrophobicContact CD1-CD1 4.29Å; I185-L320 HydrophobicContact CD1-CD2 3.89Å; I185-L320 HydrophobicContact CD1-CG 4.27Å; I185-L320 HydrophobicContact CG1-CB 4.3Å; I185-L320 VanDerWaalsContact CG2-O 3.3Å; I185-L320 WeakPolarHBondContact CG2-O 3.37Å; I193-L320 HydrophobicContact CG2-CD1 4.33Å; L197-L320 HydrophobicContact CD1-CD1 4.39Å; L197-L320 HydrophobicContact CD2-CD1 4.21Å; E316-L320 WeakPolarHBondContact O-CB 2.98Å; E316-L320 WeakPolarHBondContact O-CG 3.16Å; E316-L320 PolarHBondContact O-N 3Å; V317-L320 PolarHBondContact O-N 3.16Å; L320-S322 VanDerWaalsContact C-N 3.29Å; L320-S322 PolarHBondContact O-N 3.43Å
321	M	93.6	Very high	86.9	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.034	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-3.4	177.2	-69.3	-174	73	0	0	114.6	G188 R190 I193 V317 I319 R409 Q410 L412	G188-M321 WeakPolarHBondContact O-CE 3.48Å; R190-M321 HydrophobicContact CB-SD 4.06Å; R190-M321 HydrophobicContact CG-SD 4.13Å; I193-M321 HydrophobicContact CD1-CG 3.73Å; I193-M321 HydrophobicContact CD1-SD 3.91Å; V317-M321 HydrophobicContact CG1-CG 4.32Å; V317-M321 HydrophobicContact CG1-SD 4.01Å; V317-M321 WeakPolarHBondContact O-CB 3.29Å; V317-M321 VanDerWaalsContact O-CG 3.29Å; V317-M321 WeakPolarHBondContact O-CG 3.36Å; V317-M321 PolarHBondContact O-N 3.01Å; I319-M321 VanDerWaalsContact C-N 3.32Å; I319-M321 PolarHBondContact O-N 3.49Å; M321-R409 HydrophobicContact CB-CB 4.16Å; M321-R409 HydrophobicContact CB-CG 4.11Å; M321-R409 HydrophobicContact CE-CB 4.33Å; M321-R409 PolarHBondContact O-NH1 3.44Å; M321-R409 HydrophobicContact SD-CB 4.05Å; M321-Q410 VanDerWaalsContact CE-O 3.32Å; M321-Q410 WeakPolarHBondContact CE-O 3.32Å; M321-L412 HydrophobicContact CE-CG 4.42Å
322	S	90.6	Very high	86.3	Confident	20 Å²	20	42.9 Å²	42.9	14%	0.14	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-13.8	175	55.3	0	0	0	0	113.7	D318 I319 L320 L378 N386	D318-S322 PolarHBondContact O-N 3.11Å; D318-S322 PolarHBondContact O-OG 3.19Å; I319-S322 PolarHBondContact O-N 2.86Å; I319-S322 VanDerWaalsContact O-N 3.17Å; I319-S322 PolarHBondContact O-OG 2.93Å; L320-S322 VanDerWaalsContact C-N 3.29Å; L320-S322 PolarHBondContact O-N 3.43Å; S322-L378 VanDerWaalsContact C-CD2 3.47Å; S322-L378 VanDerWaalsContact O-CD2 3.3Å; S322-L378 WeakPolarHBondContact O-CD2 3.38Å; S322-N386 PolarHBondContact O-ND2 3.09Å
323	S	89.6	Confident	85.8	Confident	44 Å²	44	48.5 Å²	48.5	31%	0.308	25%	0.254	S	S	.	.	S	Bend	trans	-89.7	152.3	177.5	-62.4	0	0	0	0	112.8	I319 H377	I319-S323 WeakPolarHBondContact O-CB 3.47Å; I319-S323 PolarHBondContact O-N 3.02Å; I319-S323 PolarHBondContact O-OG 3.23Å; S323-H377 PolarHBondContact O-CE1 2.9Å; S323-H377 PolarHBondContact O-NE2 2.98Å
324	D	90.2	Very high	85.2	Confident	28 Å²	28	51.4 Å²	51.4	15%	0.15	28%	0.275	C	S	.	.			trans	-66.4	132.5	172.5	-56.7	-68.6	0	0	0	111.8	Y326 K373 R375 L378	D324-Y326 PolarHBondContact O-N 3.05Å; D324-Y326 VanDerWaalsContact O-N 3.16Å; D324-K373 HydrophobicContact CB-CD 4.32Å; D324-K373 HydrophobicContact CB-CG 4.12Å; D324-K373 WeakPolarHBondContact OD2-CE 3.43Å; D324-K373 IonicContact OD2-NZ 3.89Å; D324-K373 PolarHBondContact OD2-NZ 2.83Å; D324-R375 VanDerWaalsContact OD1-CD 3.23Å; D324-R375 WeakPolarHBondContact OD1-CD 3.38Å; D324-R375 WeakPolarHBondContact OD1-CG 3.3Å; D324-R375 IonicContact OD1-CZ 2.76Å; D324-R375 VanDerWaalsContact OD1-CZ 3.25Å; D324-R375 IonicContact OD1-NE 3.67Å; D324-R375 PolarHBondContact OD1-NE 3.29Å; D324-R375 IonicContact OD1-NH1 3.71Å; D324-R375 PolarHBondContact OD1-NH1 3.35Å; D324-R375 IonicContact OD2-CZ 2.94Å; D324-R375 IonicContact OD2-NH1 2.69Å; D324-R375 PolarHBondContact OD2-NH1 3.24Å; D324-L378 VanDerWaalsContact OD1-CD1 3.23Å; D324-L378 WeakPolarHBondContact OD1-CD1 3.31Å
325	I	92.3	Very high	84.9	Confident	13 Å²	13	51.4 Å²	51.4	7%	0.067	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	111.2	175.7	-60.9	157.4	0	0	0	108.2	W178 A182 I185 K373 R374 H377	W178-I325 HydrophobicContact CE3-CG2 3.93Å; W178-I325 HydrophobicContact CH2-CG2 4.44Å; W178-I325 HydrophobicContact CZ3-CG2 3.66Å; A182-I325 HydrophobicContact CB-CG2 3.86Å; I185-I325 HydrophobicContact CB-CD1 4.05Å; I185-I325 HydrophobicContact CB-CG1 4.19Å; I185-I325 HydrophobicContact CG2-CD1 3.81Å; I185-I325 HydrophobicContact CG2-CG1 3.74Å; I325-K373 CarbonylContact O-C 3.59Å; I325-K373 WeakPolarHBondContact O-CA 3.1Å; I325-R374 HydrophobicContact CB-CB 4.01Å; I325-R374 HydrophobicContact CD1-CB 4.34Å; I325-R374 HydrophobicContact CG2-CB 4.47Å; I325-R374 PolarHBondContact N-O 3.2Å; I325-R374 PolarHBondContact O-N 3.17Å; I325-H377 WeakPolarHBondContact CD1-ND1 3.11Å; I325-H377 VanDerWaalsContact CG1-CE1 3.47Å; I325-H377 WeakPolarHBondContact CG1-CE1 3.39Å
326	Y	86.7	Confident	85	Confident	92 Å²	92	50.7 Å²	50.7	36%	0.361	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.8	-174.7	-172.2	-112.7	0	0	0	112.5	D324 A328 S371 R372 K373 F503	D324-Y326 PolarHBondContact O-N 3.05Å; D324-Y326 VanDerWaalsContact O-N 3.16Å; Y326-A328 HydrophobicContact CE1-CB 3.8Å; Y326-S371 WeakPolarHBondContact OH-CB 3.35Å; Y326-R372 WeakPolarHBondContact CD2-O 3.41Å; Y326-K373 HydrophobicContact CD2-CB 4.24Å; Y326-K373 HydrophobicContact CD2-CG 4.43Å; Y326-F503 HydrophobicContact CE1-CE2 4.2Å
327	S	84.9	Confident	85.1	Confident	10 Å²	10	49.9 Å²	49.9	7%	0.07	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	126.3	171.1	-167.2	0	0	0	0	109	K173 G177 S371 R372	K173-S327 PolarHBondContact NZ-OG 2.88Å; G177-S327 PolarHBondContact O-OG 2.8Å; S327-S371 CarbonylContact O-C 3.54Å; S327-S371 WeakPolarHBondContact O-CA 3.4Å; S327-R372 PolarHBondContact N-O 3.05Å; S327-R372 PolarHBondContact O-N 2.76Å
328	A	78.6	Confident	85.1	Confident	40 Å²	40	53 Å²	53	33%	0.331	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	142.7	173.8	0	0	0	0	0	109.7	Y326 L369 E370	Y326-A328 HydrophobicContact CE1-CB 3.8Å; A328-L369 HydrophobicContact CB-CD1 4.29Å; A328-E370 CarbonylContact C-O 3.49Å; A328-E370 WeakPolarHBondContact CA-O 3.12Å
329	T	78.1	Confident	85.2	Confident	65 Å²	65	55.3 Å²	55.3	40%	0.399	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	129.7	178	48.4	0	0	0	0	110.2	S331 E370	T329-S331 PolarHBondContact O-N 2.89Å; T329-E370 PolarHBondContact N-O 3.17Å; T329-E370 PolarHBondContact O-N 2.7Å
330	L	77.6	Confident	85.3	Confident	48 Å²	48	51 Å²	51	25%	0.251	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	113.8	175.1	-165.6	60.8	0	0	0	109.1	T332 L367 L369 F485 M488 P501	L330-T332 PolarHBondContact O-N 3Å; L330-L367 HydrophobicContact CD1-CD1 3.65Å; L330-L367 HydrophobicContact CD1-CG 3.96Å; L330-L367 HydrophobicContact CD2-CD1 4.06Å; L330-L367 HydrophobicContact CG-CD1 3.83Å; L330-L369 HydrophobicContact CD1-CD1 4.38Å; L330-F485 HydrophobicContact CD2-CD2 3.9Å; L330-F485 HydrophobicContact CD2-CE2 4.22Å; L330-M488 HydrophobicContact CD2-SD 4.4Å; L330-P501 HydrophobicContact CD1-CG 3.68Å
331	S	76.7	Confident	85.1	Confident	20 Å²	20	53.3 Å²	53.3	14%	0.14	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	114.2	-178.7	-170.8	0	0	0	0	110.4	T329 V368	T329-S331 PolarHBondContact O-N 2.89Å; S331-V368 WeakPolarHBondContact CB-O 3.34Å; S331-V368 PolarHBondContact N-O 3.24Å
332	T	70.6	Confident	84.7	Confident	76 Å²	76	55.8 Å²	55.8	47%	0.466	31%	0.306	S	S	.	.			trans	-98.6	-7	-176.5	60	0	0	0	0	114	L330 S334 I335 M488	L330-T332 PolarHBondContact O-N 3Å; T332-S334 PolarHBondContact O-N 3.12Å; T332-S334 VanDerWaalsContact O-N 3.07Å; T332-I335 HydrophobicContact CG2-CD1 3.94Å; T332-I335 PolarHBondContact O-N 3.07Å; T332-M488 HydrophobicContact CG2-CG 3.99Å; T332-M488 HydrophobicContact CG2-SD 3.46Å; T332-M488 WeakPolarHBondContact CG2-SD 3.08Å
333	K	73.8	Confident	84	Confident	201 Å²	201	57.6 Å²	57.6	87%	0.874	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.7	-169.4	-62	178.1	-178	173.6	0	114.6
334	S	74.8	Confident	82.8	Confident	69 Å²	69	67.4 Å²	67.4	48%	0.483	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.6	15.6	-174.1	48.9	0	0	0	0	113.5	T332 S336 G366	T332-S334 PolarHBondContact O-N 3.12Å; T332-S334 VanDerWaalsContact O-N 3.07Å; S334-S336 PolarHBondContact O-N 3.31Å; S334-G366 PolarHBondContact OG-O 3.45Å; S334-G366 VanDerWaalsContact OG-O 3.12Å
335	I	84.7	Confident	81.8	Confident	36 Å²	36	73.2 Å²	73.2	19%	0.185	39%	0.388	C	S	.	.			trans	-67.4	133.2	-179	-69.1	175.9	0	0	0	110.5	T332 F337 V364 N365 L367 M488	T332-I335 HydrophobicContact CG2-CD1 3.94Å; T332-I335 PolarHBondContact O-N 3.07Å; I335-F337 HydrophobicContact CG2-CD2 4.32Å; I335-F337 HydrophobicContact CG2-CE1 4.25Å; I335-F337 HydrophobicContact CG2-CE2 3.59Å; I335-F337 HydrophobicContact CG2-CZ 3.55Å; I335-V364 HydrophobicContact CG2-CG1 3.83Å; I335-N365 WeakPolarHBondContact CA-O 3.44Å; I335-L367 HydrophobicContact CD1-CD1 3.55Å; I335-L367 HydrophobicContact CG1-CD1 4.12Å; I335-M488 HydrophobicContact CD1-CE 4.31Å; I335-M488 HydrophobicContact CD1-SD 3.56Å; I335-M488 VanDerWaalsContact CD1-SD 3.56Å
336	S	88	Confident	81.1	Confident	61 Å²	61	80.2 Å²	80.2	43%	0.427	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	147.1	170.2	52.5	0	0	0	0	110.7	S334 N365	S334-S336 PolarHBondContact O-N 3.31Å; S336-N365 PolarHBondContact N-O 2.93Å; S336-N365 PolarHBondContact O-N 3.47Å; S336-N365 PolarHBondContact O-ND2 2.95Å
337	F	90.6	Very high	80.7	Confident	53 Å²	53	85.1 Å²	85.1	23%	0.232	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127.5	-176.2	-57.6	-90.4	0	0	0	109.9	I335 Y362 L363 V364 I453 K489 L490 P491	I335-F337 HydrophobicContact CG2-CD2 4.32Å; I335-F337 HydrophobicContact CG2-CE1 4.25Å; I335-F337 HydrophobicContact CG2-CE2 3.59Å; I335-F337 HydrophobicContact CG2-CZ 3.55Å; F337-Y362 HydrophobicContact CB-CD1 4.13Å; F337-Y362 HydrophobicContact CB-CG 4.5Å; F337-L363 WeakPolarHBondContact CA-O 3.28Å; F337-V364 HydrophobicContact CD1-CG1 4.43Å; F337-V364 HydrophobicContact CD1-CG2 4.01Å; F337-V364 HydrophobicContact CE1-CB 4.41Å; F337-V364 HydrophobicContact CE1-CG1 3.97Å; F337-V364 HydrophobicContact CE1-CG2 3.82Å; F337-I453 HydrophobicContact CD1-CG2 3.96Å; F337-I453 HydrophobicContact CE1-CG2 4.08Å; F337-K489 WeakPolarHBondContact CE2-O 3.11Å; F337-L490 HydrophobicContact CZ-CD2 4.46Å; F337-P491 HydrophobicContact CB-CG 3.95Å; F337-P491 HydrophobicContact CD1-CG 3.74Å; F337-P491 HydrophobicContact CD2-CG 4.13Å; F337-P491 HydrophobicContact CE1-CG 4.26Å; F337-P491 HydrophobicContact CG-CG 3.66Å
338	T	92.4	Very high	80.8	Confident	67 Å²	67	91.2 Å²	91.2	41%	0.411	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139	173	52.2	0	0	0	0	109.1	A340 Y362 L363 N365	T338-A340 PolarHBondContact O-N 2.94Å; T338-Y362 CarbonylContact O-C 3.55Å; T338-Y362 VanDerWaalsContact O-CA 3.3Å; T338-Y362 WeakPolarHBondContact O-CA 3.46Å; T338-L363 PolarHBondContact N-O 3.47Å; T338-L363 VanDerWaalsContact N-O 3.08Å; T338-L363 PolarHBondContact O-N 3.22Å; T338-N365 WeakPolarHBondContact CG2-ND2 3.36Å; T338-N365 PolarHBondContact OG1-ND2 2.77Å
339	R	93.7	Very high	81.4	Confident	61 Å²	61	92.8 Å²	92.8	23%	0.23	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	128.4	175.4	-66.8	-72.1	-69.5	157.2	-17.7	110.4	D349 D360 F361 Y362	R339-D349 WeakPolarHBondContact CB-OD2 3.32Å; R339-D349 WeakPolarHBondContact CG-OD2 3.43Å; R339-D349 IonicContact CZ-OD2 2.67Å; R339-D349 IonicContact NE-OD2 2.74Å; R339-D349 PolarHBondContact NE-OD2 3.33Å; R339-D349 IonicContact NH2-OD2 2.78Å; R339-D360 IonicContact CZ-OD1 2.98Å; R339-D360 VanDerWaalsContact CZ-OD1 3.29Å; R339-D360 VanDerWaalsContact NH1-CG 3.25Å; R339-D360 IonicContact NH1-OD1 3.59Å; R339-D360 PolarHBondContact NH1-OD1 3Å; R339-D360 IonicContact NH2-OD1 2.82Å; R339-D360 PolarHBondContact NH2-OD1 2.68Å; R339-D360 IonicContact NH2-OD2 3.68Å; R339-F361 PolarHBondContact NH1-O 3.19Å; R339-F361 VanDerWaalsContact NH1-O 3.16Å; R339-Y362 HydrophobicContact CG-CD1 4.4Å; R339-Y362 HydrophobicContact CG-CE1 4.15Å
340	A	90.4	Very high	82.1	Confident	9 Å²	9	91.7 Å²	91.7	7%	0.074	46%	0.457	C	S	.	.			trans	-69.8	147.2	169.1	0	0	0	0	0	108.1	T338 K350 F361 L363	T338-A340 PolarHBondContact O-N 2.94Å; A340-K350 HydrophobicContact CB-CB 4.05Å; A340-K350 HydrophobicContact CB-CD 4.47Å; A340-K350 VanDerWaalsContact O-CB 3.29Å; A340-K350 WeakPolarHBondContact O-CB 3.26Å; A340-K350 PolarHBondContact O-N 2.81Å; A340-F361 HydrophobicContact CB-CB 3.79Å; A340-F361 PolarHBondContact N-O 2.84Å; A340-L363 HydrophobicContact CB-CD2 4.48Å; A340-L363 HydrophobicContact CB-CG 4.2Å
341	Q	89.7	Confident	82.9	Confident	99 Å²	99	92.5 Å²	92.5	46%	0.463	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	146.6	-176.8	-64.6	-167.9	-36.4	0	0	111.7	R347 E348 D349	Q341-R347 HydrophobicContact CB-CB 4.37Å; Q341-E348 CarbonylContact C-O 3.59Å; Q341-E348 VanDerWaalsContact CA-O 3.28Å; Q341-E348 WeakPolarHBondContact CA-O 3.43Å; Q341-D349 PolarHBondContact NE2-OD1 3.27Å
342	T	84.6	Confident	83.7	Confident	60 Å²	60	95.9 Å²	95.9	37%	0.368	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	154.2	-177.8	32.7	0	0	0	0	111	R347 E348 K350	T342-R347 WeakPolarHBondContact O-CA 3.4Å; T342-E348 PolarHBondContact N-O 2.8Å; T342-E348 PolarHBondContact O-N 2.94Å; T342-E348 PolarHBondContact OG1-O 2.95Å; T342-K350 HydrophobicContact CG2-CB 4.2Å; T342-K350 HydrophobicContact CG2-CD 3.93Å; T342-K350 HydrophobicContact CG2-CG 3.85Å
343	G	75.3	Confident	84.7	Confident	58 Å²	58	99.7 Å²	99.7	60%	0.598	48%	0.483	S	S	*	.			trans	98.5	145.2	-178.6	0	0	0	0	0	114.2	F346	G343-F346 CarbonylContact C-O 3.46Å; G343-F346 VanDerWaalsContact C-O 3.32Å; G343-F346 VanDerWaalsContact CA-O 3.28Å; G343-F346 WeakPolarHBondContact CA-O 3.24Å
344	W	65.3	Low	85.6	Confident	249 Å²	249	90.8 Å²	90.8	94%	0.943	45%	0.445	S	S	*	.	S	Bend	trans	-91.6	-40.4	-173.3	-174.3	-64.8	0	0	0	113.2
345	L	69.7	Low	86.3	Confident	150 Å²	150	88.9 Å²	88.9	79%	0.785	44%	0.437	S	S	*	.	S	Bend	trans	-101.2	-40.9	179.4	-74.5	90.9	0	0	0	112.5
346	F	76.4	Confident	86.6	Confident	161 Å²	161	91.8 Å²	91.8	71%	0.706	45%	0.453	S	S	*	.	S	Bend	trans	-107.6	130.1	170.2	-54.9	-73.8	0	0	0	107	G343	G343-F346 CarbonylContact C-O 3.46Å; G343-F346 VanDerWaalsContact C-O 3.32Å; G343-F346 VanDerWaalsContact CA-O 3.28Å; G343-F346 WeakPolarHBondContact CA-O 3.24Å
347	R	79.6	Confident	86.8	Confident	194 Å²	194	89.5 Å²	89.5	73%	0.732	44%	0.435	S	S	*	.			trans	-98	113.8	173.7	-70.5	-172.4	-175.8	177.2	1.5	108.2	Q341 T342	Q341-R347 HydrophobicContact CB-CB 4.37Å; T342-R347 WeakPolarHBondContact O-CA 3.4Å
348	E	87.1	Confident	87.1	Confident	139 Å²	139	90.5 Å²	90.5	65%	0.65	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	147.2	174.4	-67.6	176.7	177.7	0	0	108.8	Q341 T342	Q341-E348 CarbonylContact C-O 3.59Å; Q341-E348 VanDerWaalsContact CA-O 3.28Å; Q341-E348 WeakPolarHBondContact CA-O 3.43Å; T342-E348 PolarHBondContact N-O 2.8Å; T342-E348 PolarHBondContact O-N 2.94Å; T342-E348 PolarHBondContact OG1-O 2.95Å
349	D	90.9	Very high	87.3	Confident	73 Å²	73	87.3 Å²	87.3	39%	0.39	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	135.6	178.7	-95.4	23.7	0	0	0	110.7	R339 Q341 T351	R339-D349 WeakPolarHBondContact CB-OD2 3.32Å; R339-D349 WeakPolarHBondContact CG-OD2 3.43Å; R339-D349 IonicContact CZ-OD2 2.67Å; R339-D349 IonicContact NE-OD2 2.74Å; R339-D349 PolarHBondContact NE-OD2 3.33Å; R339-D349 IonicContact NH2-OD2 2.78Å; Q341-D349 PolarHBondContact NE2-OD1 3.27Å; D349-T351 PolarHBondContact O-N 3.42Å
350	K	92.8	Very high	87.4	Confident	42 Å²	42	86.5 Å²	86.5	18%	0.183	42%	0.423	C	S	.	.			trans	-83.5	111.5	-170.4	-171.6	-173.7	-176.9	-165.8	0	111.7	A340 T342 E352 F361	A340-K350 HydrophobicContact CB-CB 4.05Å; A340-K350 HydrophobicContact CB-CD 4.47Å; A340-K350 VanDerWaalsContact O-CB 3.29Å; A340-K350 WeakPolarHBondContact O-CB 3.26Å; A340-K350 PolarHBondContact O-N 2.81Å; T342-K350 HydrophobicContact CG2-CB 4.2Å; T342-K350 HydrophobicContact CG2-CD 3.93Å; T342-K350 HydrophobicContact CG2-CG 3.85Å; K350-E352 WeakPolarHBondContact CE-OE1 3.25Å; K350-E352 WeakPolarHBondContact CE-OE2 3.27Å; K350-E352 IonicContact NZ-OE1 3.7Å; K350-E352 PolarHBondContact NZ-OE1 2.97Å; K350-E352 IonicContact NZ-OE2 2.73Å; K350-E352 PolarHBondContact NZ-OE2 2.86Å; K350-F361 HydrophobicContact CB-CB 4.12Å; K350-F361 HydrophobicContact CD-CB 3.96Å; K350-F361 HydrophobicContact CD-CD1 4.18Å; K350-F361 HydrophobicContact CD-CD2 4.25Å; K350-F361 HydrophobicContact CD-CG 3.87Å; K350-F361 HydrophobicContact CG-CB 4.12Å; K350-F361 HydrophobicContact CG-CD2 4.24Å; K350-F361 HydrophobicContact CG-CG 4.21Å; K350-F361 PolarHBondContact O-N 3.46Å
351	T	93.2	Very high	87.6	Confident	65 Å²	65	86.7 Å²	86.7	40%	0.399	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	121.9	168.5	-47	0	0	0	0	108.8	D349 L358 A359 D360	D349-T351 PolarHBondContact O-N 3.42Å; T351-L358 HydrophobicContact CG2-CD1 3.86Å; T351-L358 HydrophobicContact CG2-CD2 4.38Å; T351-L358 HydrophobicContact CG2-CG 3.87Å; T351-A359 WeakPolarHBondContact CA-O 3.33Å; T351-A359 WeakPolarHBondContact CG2-O 3.29Å; T351-D360 PolarHBondContact OG1-OD1 3.4Å
352	E	93.8	Very high	87.8	Confident	91 Å²	91	83.6 Å²	83.6	43%	0.425	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	168.1	179.6	-76.3	176.8	-176	0	0	109.7	K350 A359 F361	K350-E352 WeakPolarHBondContact CE-OE1 3.25Å; K350-E352 WeakPolarHBondContact CE-OE2 3.27Å; K350-E352 IonicContact NZ-OE1 3.7Å; K350-E352 PolarHBondContact NZ-OE1 2.97Å; K350-E352 IonicContact NZ-OE2 2.73Å; K350-E352 PolarHBondContact NZ-OE2 2.86Å; E352-A359 PolarHBondContact N-O 2.81Å; E352-A359 WeakPolarHBondContact O-CA 3.44Å; E352-A359 PolarHBondContact O-N 2.92Å; E352-A359 VanDerWaalsContact O-O 3.11Å; E352-F361 HydrophobicContact CB-CD2 4.48Å; E352-F361 HydrophobicContact CB-CE2 3.74Å; E352-F361 HydrophobicContact CB-CZ 4.3Å
353	R	92.9	Very high	88.1	Confident	156 Å²	156	84.5 Å²	84.5	59%	0.589	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	137.3	170.4	-74.6	-173.1	172.1	-77.7	-6.6	111.3	N356 F357 L358	R353-N356 PolarHBondContact NH1-O 2.92Å; R353-F357 CarbonylContact C-O 3.57Å; R353-F357 VanDerWaalsContact CA-O 3.27Å; R353-F357 WeakPolarHBondContact CA-O 3.13Å; R353-L358 HydrophobicContact CG-CD1 4.25Å
354	V	91.9	Very high	88.7	Confident	13 Å²	13	81.9 Å²	81.9	8%	0.079	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	112.8	165.5	177.4	0	0	0	0	106.3	N356 F357 A359 F361 A454 V496 K497 T511	V354-N356 PolarHBondContact O-N 2.96Å; V354-F357 PolarHBondContact N-O 3.45Å; V354-F357 PolarHBondContact O-N 3.02Å; V354-A359 HydrophobicContact CB-CB 4.31Å; V354-A359 HydrophobicContact CG2-CB 3.93Å; V354-F361 HydrophobicContact CG2-CE2 4.17Å; V354-F361 HydrophobicContact CG2-CZ 3.71Å; V354-A454 HydrophobicContact CG2-CB 4.08Å; V354-V496 HydrophobicContact CB-CB 4.44Å; V354-V496 HydrophobicContact CB-CG2 3.92Å; V354-V496 HydrophobicContact CG1-CB 4.35Å; V354-V496 HydrophobicContact CG1-CG2 4.29Å; V354-V496 WeakPolarHBondContact CG1-O 3.5Å; V354-V496 HydrophobicContact CG2-CG2 4.33Å; V354-K497 HydrophobicContact CG1-CB 4.17Å; V354-K497 HydrophobicContact CG2-CB 4.24Å; V354-T511 HydrophobicContact CG1-CG2 4.22Å
355	G	88.9	Confident	89.8	Confident	29 Å²	29	73 Å²	73	30%	0.299	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	-128.7	-165.7	0	0	0	0	0	111.2	F357 Q513	G355-F357 VanDerWaalsContact C-N 3.33Å; G355-F357 PolarHBondContact O-N 3.2Å; G355-Q513 WeakPolarHBondContact CA-O 3.36Å
356	N	91.3	Very high	90.5	Very high	98 Å²	98	67.1 Å²	67.1	52%	0.524	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-6.3	178.7	-70	-26.1	0	0	0	115	R353 V354 Q513	R353-N356 PolarHBondContact NH1-O 2.92Å; V354-N356 PolarHBondContact O-N 2.96Å; N356-Q513 PolarHBondContact N-O 3.09Å
357	F	93.5	Very high	90.9	Very high	13 Å²	13	59.5 Å²	59.5	6%	0.057	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	136.5	-169.3	-50.2	-74.4	0	0	0	112.5	R353 V354 G355 F459 V496 F515	R353-F357 CarbonylContact C-O 3.57Å; R353-F357 VanDerWaalsContact CA-O 3.27Å; R353-F357 WeakPolarHBondContact CA-O 3.13Å; V354-F357 PolarHBondContact N-O 3.45Å; V354-F357 PolarHBondContact O-N 3.02Å; G355-F357 VanDerWaalsContact C-N 3.33Å; G355-F357 PolarHBondContact O-N 3.2Å; F357-F459 AromaticContact CD1-CD2 3.75Å; F357-F459 HydrophobicContact CD1-CD2 3.75Å; F357-F459 HydrophobicContact CD1-CE2 4.49Å; F357-F459 AromaticContact CD2-CD2 3.94Å; F357-F459 HydrophobicContact CD2-CD2 3.94Å; F357-F459 HydrophobicContact CD2-CE2 4.12Å; F357-F459 AromaticContact CE1-CD2 3.52Å; F357-F459 HydrophobicContact CE1-CD2 3.52Å; F357-F459 AromaticContact CE1-CE2 3.95Å; F357-F459 HydrophobicContact CE1-CE2 3.95Å; F357-F459 HydrophobicContact CE1-CG 4.43Å; F357-F459 AromaticContact CE2-CD2 3.74Å; F357-F459 HydrophobicContact CE2-CD2 3.74Å; F357-F459 AromaticContact CE2-CE2 3.54Å; F357-F459 HydrophobicContact CE2-CE2 3.54Å; F357-F459 AromaticContact CG-CD2 3.97Å; F357-F459 HydrophobicContact CG-CD2 3.97Å; F357-F459 AromaticContact CZ-CD2 3.52Å; F357-F459 HydrophobicContact CZ-CD2 3.52Å; F357-F459 AromaticContact CZ-CE2 3.44Å; F357-F459 HydrophobicContact CZ-CE2 3.44Å; F357-F459 VanDerWaalsContact CZ-CE2 3.44Å; F357-V496 HydrophobicContact CB-CG1 4.05Å; F357-V496 HydrophobicContact CD2-CG1 3.98Å; F357-V496 HydrophobicContact CG-CG1 4.01Å; F357-F515 HydrophobicContact CZ-CB 3.85Å
358	L	95.3	Very high	91.1	Very high	74 Å²	74	51.5 Å²	51.5	39%	0.387	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	127.3	166.7	-170.9	64.3	0	0	0	109	T351 R353 S456 E458	T351-L358 HydrophobicContact CG2-CD1 3.86Å; T351-L358 HydrophobicContact CG2-CD2 4.38Å; T351-L358 HydrophobicContact CG2-CG 3.87Å; R353-L358 HydrophobicContact CG-CD1 4.25Å; L358-S456 WeakPolarHBondContact O-CB 3.42Å; L358-S456 PolarHBondContact O-OG 3.38Å; L358-E458 VanDerWaalsContact CB-OE2 3.27Å; L358-E458 WeakPolarHBondContact CB-OE2 3.49Å; L358-E458 PolarHBondContact N-OE2 3.13Å
359	A	96.4	Very high	90.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	133.5	-166.7	0	0	0	0	0	112.9	T351 E352 V354 F361 A454 M455 V496	T351-A359 WeakPolarHBondContact CA-O 3.33Å; T351-A359 WeakPolarHBondContact CG2-O 3.29Å; E352-A359 PolarHBondContact N-O 2.81Å; E352-A359 WeakPolarHBondContact O-CA 3.44Å; E352-A359 PolarHBondContact O-N 2.92Å; E352-A359 VanDerWaalsContact O-O 3.11Å; V354-A359 HydrophobicContact CB-CB 4.31Å; V354-A359 HydrophobicContact CG2-CB 3.93Å; A359-F361 HydrophobicContact CB-CE2 4.28Å; A359-F361 WeakPolarHBondContact O-CD2 3.29Å; A359-A454 HydrophobicContact CB-CB 3.85Å; A359-M455 CarbonylContact C-O 3.55Å; A359-M455 WeakPolarHBondContact CA-O 3.4Å; A359-V496 HydrophobicContact CB-CG2 3.48Å; A359-V496 VanDerWaalsContact CB-CG2 3.48Å
360	D	95.9	Very high	90.6	Very high	44 Å²	44	44.1 Å²	44.1	24%	0.235	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	119.2	178.8	-99.6	-25.3	0	0	0	110.8	R339 T351 Y362 A454 M455	R339-D360 IonicContact CZ-OD1 2.98Å; R339-D360 VanDerWaalsContact CZ-OD1 3.29Å; R339-D360 VanDerWaalsContact NH1-CG 3.25Å; R339-D360 IonicContact NH1-OD1 3.59Å; R339-D360 PolarHBondContact NH1-OD1 3Å; R339-D360 IonicContact NH2-OD1 2.82Å; R339-D360 PolarHBondContact NH2-OD1 2.68Å; R339-D360 IonicContact NH2-OD2 3.68Å; T351-D360 PolarHBondContact OG1-OD1 3.4Å; D360-Y362 HydrophobicContact CB-CE2 3.98Å; D360-Y362 VanDerWaalsContact O-CD2 3.3Å; D360-Y362 WeakPolarHBondContact O-CD2 3.37Å; D360-Y362 WeakPolarHBondContact O-CE2 3.41Å; D360-A454 WeakPolarHBondContact O-CA 3.4Å; D360-M455 PolarHBondContact N-O 2.77Å; D360-M455 PolarHBondContact O-N 2.6Å
361	F	95	Very high	90.3	Very high	12 Å²	12	42.6 Å²	42.6	5%	0.053	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	137.7	-174	-73.7	-111	0	0	0	112.1	R339 A340 K350 E352 V354 A359 T452 I453 A454	R339-F361 PolarHBondContact NH1-O 3.19Å; R339-F361 VanDerWaalsContact NH1-O 3.16Å; A340-F361 HydrophobicContact CB-CB 3.79Å; A340-F361 PolarHBondContact N-O 2.84Å; K350-F361 HydrophobicContact CB-CB 4.12Å; K350-F361 HydrophobicContact CD-CB 3.96Å; K350-F361 HydrophobicContact CD-CD1 4.18Å; K350-F361 HydrophobicContact CD-CD2 4.25Å; K350-F361 HydrophobicContact CD-CG 3.87Å; K350-F361 HydrophobicContact CG-CB 4.12Å; K350-F361 HydrophobicContact CG-CD2 4.24Å; K350-F361 HydrophobicContact CG-CG 4.21Å; K350-F361 PolarHBondContact O-N 3.46Å; E352-F361 HydrophobicContact CB-CD2 4.48Å; E352-F361 HydrophobicContact CB-CE2 3.74Å; E352-F361 HydrophobicContact CB-CZ 4.3Å; V354-F361 HydrophobicContact CG2-CE2 4.17Å; V354-F361 HydrophobicContact CG2-CZ 3.71Å; A359-F361 HydrophobicContact CB-CE2 4.28Å; A359-F361 WeakPolarHBondContact O-CD2 3.29Å; F361-T452 HydrophobicContact CD1-CG2 3.92Å; F361-I453 WeakPolarHBondContact CA-O 3.49Å; F361-A454 HydrophobicContact CD1-CB 3.99Å; F361-A454 HydrophobicContact CD2-CB 4.01Å; F361-A454 HydrophobicContact CE1-CB 3.85Å; F361-A454 HydrophobicContact CE2-CB 3.84Å; F361-A454 HydrophobicContact CG-CB 4.07Å; F361-A454 HydrophobicContact CZ-CB 3.77Å
362	Y	93.4	Very high	90.1	Very high	35 Å²	35	42.1 Å²	42.1	14%	0.137	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	142.3	174.4	-57.7	-102.7	0	0	0	110.1	F337 T338 R339 D360 T452 I453 M455 P491	F337-Y362 HydrophobicContact CB-CD1 4.13Å; F337-Y362 HydrophobicContact CB-CG 4.5Å; T338-Y362 CarbonylContact O-C 3.55Å; T338-Y362 VanDerWaalsContact O-CA 3.3Å; T338-Y362 WeakPolarHBondContact O-CA 3.46Å; R339-Y362 HydrophobicContact CG-CD1 4.4Å; R339-Y362 HydrophobicContact CG-CE1 4.15Å; D360-Y362 HydrophobicContact CB-CE2 3.98Å; D360-Y362 VanDerWaalsContact O-CD2 3.3Å; D360-Y362 WeakPolarHBondContact O-CD2 3.37Å; D360-Y362 WeakPolarHBondContact O-CE2 3.41Å; Y362-T452 WeakPolarHBondContact O-CA 3.3Å; Y362-T452 WeakPolarHBondContact O-CG2 3.21Å; Y362-I453 PolarHBondContact N-O 2.85Å; Y362-I453 PolarHBondContact O-N 2.75Å; Y362-M455 HydrophobicContact CD2-CG 3.98Å; Y362-M455 HydrophobicContact CE2-CB 4.15Å; Y362-M455 HydrophobicContact CE2-CG 3.9Å; Y362-P491 HydrophobicContact CD1-CG 4.23Å; Y362-P491 HydrophobicContact CD2-CB 4.39Å; Y362-P491 HydrophobicContact CD2-CG 4.04Å; Y362-P491 HydrophobicContact CE1-CB 4.24Å; Y362-P491 HydrophobicContact CE1-CG 4.38Å; Y362-P491 HydrophobicContact CE2-CB 4.05Å; Y362-P491 HydrophobicContact CE2-CG 4.21Å; Y362-P491 HydrophobicContact CG-CG 4.07Å
363	L	91.1	Very high	89.9	Confident	78 Å²	78	39.4 Å²	39.4	41%	0.408	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	131.7	164.2	-59.6	174.1	0	0	0	108.7	F337 T338 A340 N365	F337-L363 WeakPolarHBondContact CA-O 3.28Å; T338-L363 PolarHBondContact N-O 3.47Å; T338-L363 VanDerWaalsContact N-O 3.08Å; T338-L363 PolarHBondContact O-N 3.22Å; A340-L363 HydrophobicContact CB-CD2 4.48Å; A340-L363 HydrophobicContact CB-CG 4.2Å; L363-N365 PolarHBondContact O-ND2 3.05Å
364	V	88.9	Confident	90	Very high	3 Å²	3	32.2 Å²	32.2	2%	0.018	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	109.6	176	-168	0	0	0	0	108.4	I335 F337 L367 A451 I453	I335-V364 HydrophobicContact CG2-CG1 3.83Å; F337-V364 HydrophobicContact CD1-CG1 4.43Å; F337-V364 HydrophobicContact CD1-CG2 4.01Å; F337-V364 HydrophobicContact CE1-CB 4.41Å; F337-V364 HydrophobicContact CE1-CG1 3.97Å; F337-V364 HydrophobicContact CE1-CG2 3.82Å; V364-L367 HydrophobicContact CG1-CB 4.19Å; V364-L367 HydrophobicContact CG1-CD2 4.42Å; V364-A451 HydrophobicContact CB-CB 4.15Å; V364-A451 HydrophobicContact CG2-CB 4.24Å; V364-A451 PolarHBondContact N-O 3.17Å; V364-I453 HydrophobicContact CG2-CB 4.22Å; V364-I453 HydrophobicContact CG2-CG2 3.85Å
365	N	88.1	Confident	90.1	Very high	62 Å²	62	33.7 Å²	33.7	33%	0.332	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	151.6	179.7	-54.7	-72.8	0	0	0	110.6	I335 S336 T338 L363 L367	I335-N365 WeakPolarHBondContact CA-O 3.44Å; S336-N365 PolarHBondContact N-O 2.93Å; S336-N365 PolarHBondContact O-N 3.47Å; S336-N365 PolarHBondContact O-ND2 2.95Å; T338-N365 WeakPolarHBondContact CG2-ND2 3.36Å; T338-N365 PolarHBondContact OG1-ND2 2.77Å; L363-N365 PolarHBondContact O-ND2 3.05Å; N365-L367 PolarHBondContact O-N 3Å
366	G	84.4	Confident	90.3	Very high	28 Å²	28	33.2 Å²	33.2	29%	0.289	17%	0.17	S	C	.	.	S	Bend	trans	73.2	11.7	178.1	0	0	0	0	0	114.8	S334 V368	S334-G366 PolarHBondContact OG-O 3.45Å; S334-G366 VanDerWaalsContact OG-O 3.12Å; G366-V368 PolarHBondContact O-N 2.89Å
367	L	84	Confident	90.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.			trans	-76.4	114.5	174.7	-170.2	69.1	0	0	0	110.2	L330 I335 V364 N365 T448 F449 A451 P501	L330-L367 HydrophobicContact CD1-CD1 3.65Å; L330-L367 HydrophobicContact CD1-CG 3.96Å; L330-L367 HydrophobicContact CD2-CD1 4.06Å; L330-L367 HydrophobicContact CG-CD1 3.83Å; I335-L367 HydrophobicContact CD1-CD1 3.55Å; I335-L367 HydrophobicContact CG1-CD1 4.12Å; V364-L367 HydrophobicContact CG1-CB 4.19Å; V364-L367 HydrophobicContact CG1-CD2 4.42Å; N365-L367 PolarHBondContact O-N 3Å; L367-T448 WeakPolarHBondContact O-CA 3.38Å; L367-F449 HydrophobicContact CD2-CB 4.26Å; L367-F449 PolarHBondContact O-N 2.9Å; L367-A451 HydrophobicContact CD2-CB 3.69Å; L367-P501 HydrophobicContact CD2-CG 4.16Å
368	V	84.5	Confident	90.5	Very high	26 Å²	26	29.1 Å²	29.1	16%	0.158	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.2	-179.5	-179.1	0	0	0	0	109.8	S331 G366 E370 K446	S331-V368 WeakPolarHBondContact CB-O 3.34Å; S331-V368 PolarHBondContact N-O 3.24Å; G366-V368 PolarHBondContact O-N 2.89Å; V368-E370 HydrophobicContact CG1-CG 4.02Å; V368-K446 HydrophobicContact CG1-CB 4.18Å
369	L	82.4	Confident	90.3	Very high	10 Å²	10	28 Å²	28	5%	0.052	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	115	163.7	-170	68.2	0	0	0	107.6	A328 L330 K446 K447 F449 P504	A328-L369 HydrophobicContact CB-CD1 4.29Å; L330-L369 HydrophobicContact CD1-CD1 4.38Å; L369-K446 WeakPolarHBondContact O-CA 3.46Å; L369-K447 PolarHBondContact N-O 2.77Å; L369-K447 PolarHBondContact O-N 3.47Å; L369-F449 HydrophobicContact CB-CD2 3.98Å; L369-F449 HydrophobicContact CB-CE2 3.61Å; L369-F449 HydrophobicContact CD2-CE2 4.04Å; L369-F449 HydrophobicContact CD2-CZ 4.39Å; L369-F449 HydrophobicContact CG-CE2 4.49Å; L369-P504 HydrophobicContact CD2-CG 4.39Å
370	E	85.6	Confident	89.9	Confident	48 Å²	48	35.7 Å²	35.7	22%	0.224	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.6	168.4	-57.3	-164.7	149.3	0	0	107.6	A328 T329 V368 K446	A328-E370 CarbonylContact C-O 3.49Å; A328-E370 WeakPolarHBondContact CA-O 3.12Å; T329-E370 PolarHBondContact N-O 3.17Å; T329-E370 PolarHBondContact O-N 2.7Å; V368-E370 HydrophobicContact CG1-CG 4.02Å; E370-K446 HydrophobicContact CG-CD 4.11Å; E370-K446 HydrophobicContact CG-CG 4.14Å; E370-K446 WeakPolarHBondContact OE1-CD 3.34Å; E370-K446 VanDerWaalsContact OE1-CE 3.28Å; E370-K446 WeakPolarHBondContact OE1-CE 3.31Å; E370-K446 IonicContact OE1-NZ 3.36Å; E370-K446 PolarHBondContact OE1-NZ 2.84Å; E370-K446 IonicContact OE2-NZ 3.45Å
371	S	86.1	Confident	89.5	Confident	9 Å²	9	40.5 Å²	40.5	6%	0.063	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	146.9	179.7	63.6	0	0	0	0	112	Y326 S327 E444 S445	Y326-S371 WeakPolarHBondContact OH-CB 3.35Å; S327-S371 CarbonylContact O-C 3.54Å; S327-S371 WeakPolarHBondContact O-CA 3.4Å; S371-E444 CarbonylContact O-C 3.55Å; S371-E444 WeakPolarHBondContact O-CA 3.32Å; S371-S445 PolarHBondContact N-O 2.83Å; S371-S445 PolarHBondContact O-N 3.35Å; S371-S445 PolarHBondContact OG-O 3.18Å
372	R	88.9	Confident	89.3	Confident	55 Å²	55	40 Å²	40	21%	0.208	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	135.9	-173.7	-59.5	176.9	167.4	-109.5	-17.9	108.2	Q176 W178 Y326 S327 E444	Q176-R372 WeakPolarHBondContact O-CD 3.24Å; Q176-R372 PolarHBondContact O-NE 2.69Å; Q176-R372 PolarHBondContact O-NH1 3.43Å; W178-R372 HydrophobicContact CH2-CB 3.55Å; W178-R372 HydrophobicContact CZ2-CB 3.53Å; Y326-R372 WeakPolarHBondContact CD2-O 3.41Å; S327-R372 PolarHBondContact N-O 3.05Å; S327-R372 PolarHBondContact O-N 2.76Å; R372-E444 HydrophobicContact CG-CG 4.14Å; R372-E444 IonicContact CZ-OE1 3.91Å; R372-E444 IonicContact CZ-OE2 2.71Å; R372-E444 VanDerWaalsContact CZ-OE2 3.24Å; R372-E444 IonicContact NE-OE1 3.7Å; R372-E444 IonicContact NE-OE2 3.29Å; R372-E444 IonicContact NH1-OE1 2.71Å; R372-E444 PolarHBondContact NH1-OE1 3.19Å; R372-E444 IonicContact NH1-OE2 3.04Å; R372-E444 IonicContact NH2-OE1 2.89Å; R372-E444 PolarHBondContact NH2-OE1 3.34Å; R372-E444 IonicContact NH2-OE2 2.7Å; R372-E444 PolarHBondContact NH2-OE2 2.96Å
373	K	90.3	Very high	89	Confident	34 Å²	34	40.3 Å²	40.3	15%	0.148	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	113.3	-175.7	-169.5	168.1	-174.2	170.8	0	110.3	D324 I325 Y326 C442 K443	D324-K373 HydrophobicContact CB-CD 4.32Å; D324-K373 HydrophobicContact CB-CG 4.12Å; D324-K373 WeakPolarHBondContact OD2-CE 3.43Å; D324-K373 IonicContact OD2-NZ 3.89Å; D324-K373 PolarHBondContact OD2-NZ 2.83Å; I325-K373 CarbonylContact O-C 3.59Å; I325-K373 WeakPolarHBondContact O-CA 3.1Å; Y326-K373 HydrophobicContact CD2-CB 4.24Å; Y326-K373 HydrophobicContact CD2-CG 4.43Å; K373-C442 CarbonylContact O-C 3.59Å; K373-C442 WeakPolarHBondContact O-CA 3.47Å; K373-K443 PolarHBondContact N-O 2.84Å; K373-K443 PolarHBondContact O-N 3.22Å
374	R	93.6	Very high	88.8	Confident	5 Å²	5	41.8 Å²	41.8	2%	0.019	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	144.7	178.4	-86	164.5	74.2	171.6	4.9	110.9	W178 E183 S186 I325 E376 V441 C442	W178-R374 HydrophobicContact CH2-CB 4.32Å; W178-R374 HydrophobicContact CH2-CG 4.08Å; W178-R374 HydrophobicContact CZ2-CB 4.42Å; W178-R374 HydrophobicContact CZ2-CG 3.7Å; E183-R374 IonicContact OE1-NH1 3.67Å; E183-R374 PolarHBondContact OE1-NH1 3.22Å; E183-R374 IonicContact OE2-CZ 3.7Å; E183-R374 VanDerWaalsContact OE2-CZ 3.24Å; E183-R374 IonicContact OE2-NH1 3.59Å; E183-R374 PolarHBondContact OE2-NH1 3.17Å; E183-R374 IonicContact OE2-NH2 2.69Å; E183-R374 PolarHBondContact OE2-NH2 2.91Å; S186-R374 PolarHBondContact OG-NH2 2.92Å; I325-R374 HydrophobicContact CB-CB 4.01Å; I325-R374 HydrophobicContact CD1-CB 4.34Å; I325-R374 HydrophobicContact CG2-CB 4.47Å; I325-R374 PolarHBondContact N-O 3.2Å; I325-R374 PolarHBondContact O-N 3.17Å; R374-E376 WeakPolarHBondContact CB-OE2 3.43Å; R374-E376 IonicContact CZ-OE1 2.73Å; R374-E376 IonicContact NE-OE1 3.91Å; R374-E376 PolarHBondContact NE-OE1 3.37Å; R374-E376 IonicContact NH2-OE1 2.73Å; R374-E376 PolarHBondContact NH2-OE1 3.42Å; R374-V441 WeakPolarHBondContact CA-O 3.42Å; R374-C442 HydrophobicContact CG-CB 4.04Å
375	R	94.9	Very high	88.5	Confident	45 Å²	45	45.5 Å²	45.5	17%	0.17	23%	0.226	C	C	.	.			trans	-143.6	2.8	-172.6	-56.2	-161.3	-164.4	-132.6	20	114.7	D324 H377 L378 V441	D324-R375 VanDerWaalsContact OD1-CD 3.23Å; D324-R375 WeakPolarHBondContact OD1-CD 3.38Å; D324-R375 WeakPolarHBondContact OD1-CG 3.3Å; D324-R375 IonicContact OD1-CZ 2.76Å; D324-R375 VanDerWaalsContact OD1-CZ 3.25Å; D324-R375 IonicContact OD1-NE 3.67Å; D324-R375 PolarHBondContact OD1-NE 3.29Å; D324-R375 IonicContact OD1-NH1 3.71Å; D324-R375 PolarHBondContact OD1-NH1 3.35Å; D324-R375 IonicContact OD2-CZ 2.94Å; D324-R375 IonicContact OD2-NH1 2.69Å; D324-R375 PolarHBondContact OD2-NH1 3.24Å; R375-H377 PolarHBondContact O-N 2.88Å; R375-H377 VanDerWaalsContact O-N 3.08Å; R375-L378 HydrophobicContact CB-CD1 4.19Å; R375-L378 HydrophobicContact CB-CG 4.5Å; R375-L378 HydrophobicContact CG-CD1 4.33Å; R375-L378 WeakPolarHBondContact O-CB 3.44Å; R375-L378 PolarHBondContact O-N 2.92Å; R375-V441 HydrophobicContact CB-CB 4.38Å; R375-V441 HydrophobicContact CB-CG1 4.22Å; R375-V441 PolarHBondContact N-O 3.42Å
376	E	93.6	Very high	88.3	Confident	19 Å²	19	43.4 Å²	43.4	9%	0.089	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.9	-174.7	58.5	-77.9	174.7	0	0	115	S186 R374 R438 E439 L440 V441	S186-E376 WeakPolarHBondContact CB-OE1 3.46Å; S186-E376 WeakPolarHBondContact OG-CG 3.29Å; S186-E376 PolarHBondContact OG-OE1 3.38Å; R374-E376 WeakPolarHBondContact CB-OE2 3.43Å; R374-E376 IonicContact CZ-OE1 2.73Å; R374-E376 IonicContact NE-OE1 3.91Å; R374-E376 PolarHBondContact NE-OE1 3.37Å; R374-E376 IonicContact NH2-OE1 2.73Å; R374-E376 PolarHBondContact NH2-OE1 3.42Å; E376-R438 HydrophobicContact CB-CG 4.42Å; E376-R438 WeakPolarHBondContact O-CD 3.49Å; E376-E439 WeakPolarHBondContact CB-O 3.28Å; E376-L440 HydrophobicContact CG-CD2 4.4Å; E376-V441 HydrophobicContact CB-CB 4.22Å; E376-V441 HydrophobicContact CB-CG2 3.99Å; E376-V441 PolarHBondContact OE2-N 3.42Å; E376-V441 VanDerWaalsContact OE2-N 3.11Å
377	H	93.9	Very high	88.3	Confident	7 Å²	7	47.4 Å²	47.4	3%	0.032	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-8.5	173.1	66.3	-60.3	0	0	0	113.9	I185 S323 I325 R375 L412	I185-H377 VanDerWaalsContact O-CB 3.29Å; I185-H377 WeakPolarHBondContact O-CB 3.41Å; S323-H377 PolarHBondContact O-CE1 2.9Å; S323-H377 PolarHBondContact O-NE2 2.98Å; I325-H377 WeakPolarHBondContact CD1-ND1 3.11Å; I325-H377 VanDerWaalsContact CG1-CE1 3.47Å; I325-H377 WeakPolarHBondContact CG1-CE1 3.39Å; R375-H377 PolarHBondContact O-N 2.88Å; R375-H377 VanDerWaalsContact O-N 3.08Å; H377-L412 HydrophobicContact CB-CD1 3.82Å; H377-L412 WeakPolarHBondContact O-CD1 3.48Å
378	L	93.5	Very high	88	Confident	18 Å²	18	50.1 Å²	50.1	9%	0.094	25%	0.247	C	C	.	.			trans	-91.1	143.6	-175.6	-63.4	-172.7	0	0	0	112.4	S322 D324 R375 D382 I383	S322-L378 VanDerWaalsContact C-CD2 3.47Å; S322-L378 VanDerWaalsContact O-CD2 3.3Å; S322-L378 WeakPolarHBondContact O-CD2 3.38Å; D324-L378 VanDerWaalsContact OD1-CD1 3.23Å; D324-L378 WeakPolarHBondContact OD1-CD1 3.31Å; R375-L378 HydrophobicContact CB-CD1 4.19Å; R375-L378 HydrophobicContact CB-CG 4.5Å; R375-L378 HydrophobicContact CG-CD1 4.33Å; R375-L378 WeakPolarHBondContact O-CB 3.44Å; R375-L378 PolarHBondContact O-N 2.92Å; L378-D382 HydrophobicContact CB-CB 3.97Å; L378-D382 HydrophobicContact CD1-CB 4.45Å; L378-D382 HydrophobicContact CD2-CB 3.99Å; L378-D382 HydrophobicContact CG-CB 4.36Å; L378-I383 HydrophobicContact CB-CD1 4.32Å; L378-I383 HydrophobicContact CB-CG1 3.87Å; L378-I383 HydrophobicContact CD1-CG1 4.23Å
379	S	90.9	Very high	87.4	Confident	50 Å²	50	51.9 Å²	51.9	35%	0.35	26%	0.255	S	S	.	.			trans	-74.9	165.7	166.7	69	0	0	0	0	111.7	E381 D382 I383	S379-E381 PolarHBondContact O-N 3.24Å; S379-E381 PolarHBondContact OG-N 3.09Å; S379-D382 WeakPolarHBondContact CB-OD2 3.05Å; S379-D382 PolarHBondContact N-OD2 3.2Å; S379-D382 VanDerWaalsContact N-OD2 3.09Å; S379-D382 PolarHBondContact O-N 3.27Å; S379-D382 VanDerWaalsContact O-N 3.15Å; S379-D382 PolarHBondContact OG-N 3.04Å; S379-D382 VanDerWaalsContact OG-N 3.12Å; S379-D382 PolarHBondContact OG-OD2 2.93Å; S379-I383 WeakPolarHBondContact O-CG1 3.47Å; S379-I383 PolarHBondContact O-N 3.44Å
380	E	89.6	Confident	86.8	Confident	162 Å²	162	55.1 Å²	55.1	76%	0.757	27%	0.271	S	S	*	.	H	α-helix	trans	-58.4	-37.1	171.1	-63.4	-173.5	166.8	0	0	111.9	D382 I383 L384	E380-D382 PolarHBondContact O-N 2.98Å; E380-I383 PolarHBondContact O-N 2.87Å; E380-L384 WeakPolarHBondContact O-CB 3.3Å; E380-L384 VanDerWaalsContact O-CG 3.26Å; E380-L384 WeakPolarHBondContact O-CG 3.31Å; E380-L384 PolarHBondContact O-N 2.96Å
381	E	87.6	Confident	86	Confident	144 Å²	144	57.5 Å²	57.5	67%	0.673	28%	0.282	S	S	*	.	H	α-helix	trans	-62.2	-41.2	175.1	-62.2	-175.5	-172.1	0	0	112	S379 L384 R385	S379-E381 PolarHBondContact O-N 3.24Å; S379-E381 PolarHBondContact OG-N 3.09Å; E381-L384 PolarHBondContact O-N 3.39Å; E381-R385 WeakPolarHBondContact O-CB 3.29Å; E381-R385 PolarHBondContact O-N 2.96Å
382	D	89.1	Confident	85	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-68.5	-40.3	175.5	-61.6	-51.6	0	0	0	111.6	L378 S379 E380 L384 R385 N386 R409	L378-D382 HydrophobicContact CB-CB 3.97Å; L378-D382 HydrophobicContact CD1-CB 4.45Å; L378-D382 HydrophobicContact CD2-CB 3.99Å; L378-D382 HydrophobicContact CG-CB 4.36Å; S379-D382 WeakPolarHBondContact CB-OD2 3.05Å; S379-D382 PolarHBondContact N-OD2 3.2Å; S379-D382 VanDerWaalsContact N-OD2 3.09Å; S379-D382 PolarHBondContact O-N 3.27Å; S379-D382 VanDerWaalsContact O-N 3.15Å; S379-D382 PolarHBondContact OG-N 3.04Å; S379-D382 VanDerWaalsContact OG-N 3.12Å; S379-D382 PolarHBondContact OG-OD2 2.93Å; E380-D382 PolarHBondContact O-N 2.98Å; D382-L384 VanDerWaalsContact C-N 3.33Å; D382-L384 PolarHBondContact O-N 3.21Å; D382-R385 PolarHBondContact O-N 3.18Å; D382-N386 VanDerWaalsContact O-CB 3.24Å; D382-N386 WeakPolarHBondContact O-CB 3.32Å; D382-N386 PolarHBondContact O-N 3.08Å; D382-N386 PolarHBondContact O-ND2 2.97Å; D382-R409 VanDerWaalsContact CG-NH1 3.28Å; D382-R409 IonicContact OD1-CZ 3.38Å; D382-R409 IonicContact OD1-NH1 3.61Å; D382-R409 PolarHBondContact OD1-NH1 2.81Å; D382-R409 VanDerWaalsContact OD1-NH1 3.17Å; D382-R409 IonicContact OD1-NH2 2.73Å; D382-R409 PolarHBondContact OD1-NH2 2.9Å; D382-R409 IonicContact OD2-CZ 2.76Å; D382-R409 IonicContact OD2-NH1 3.84Å; D382-R409 PolarHBondContact OD2-NH1 3.48Å; D382-R409 IonicContact OD2-NH2 3.24Å
383	I	88.4	Confident	83.6	Confident	42 Å²	42	58 Å²	58	22%	0.215	29%	0.29	C	S	.	.	H	α-helix	trans	-64.2	-40.5	176.8	-68.3	168.5	0	0	0	110.3	L378 S379 E380 K387	L378-I383 HydrophobicContact CB-CD1 4.32Å; L378-I383 HydrophobicContact CB-CG1 3.87Å; L378-I383 HydrophobicContact CD1-CG1 4.23Å; S379-I383 WeakPolarHBondContact O-CG1 3.47Å; S379-I383 PolarHBondContact O-N 3.44Å; E380-I383 PolarHBondContact O-N 2.87Å; I383-K387 HydrophobicContact CG2-CD 4.27Å; I383-K387 VanDerWaalsContact O-CB 3.3Å; I383-K387 WeakPolarHBondContact O-CB 3.46Å; I383-K387 WeakPolarHBondContact O-CG 3.36Å; I383-K387 PolarHBondContact O-N 3.31Å
384	L	86.7	Confident	82.2	Confident	110 Å²	110	59 Å²	59	58%	0.576	30%	0.301	S	S	*	.	H	α-helix	trans	-67.7	-44	174.3	-71.9	170.1	0	0	0	111.8	E380 E381 D382 K387 A388	E380-L384 WeakPolarHBondContact O-CB 3.3Å; E380-L384 VanDerWaalsContact O-CG 3.26Å; E380-L384 WeakPolarHBondContact O-CG 3.31Å; E380-L384 PolarHBondContact O-N 2.96Å; E381-L384 PolarHBondContact O-N 3.39Å; D382-L384 VanDerWaalsContact C-N 3.33Å; D382-L384 PolarHBondContact O-N 3.21Å; L384-K387 WeakPolarHBondContact O-CB 3.17Å; L384-K387 PolarHBondContact O-N 3.48Å; L384-A388 WeakPolarHBondContact O-CB 3.3Å; L384-A388 PolarHBondContact O-N 3.38Å
385	R	83.3	Confident	80.6	Confident	80 Å²	80	66 Å²	66	30%	0.302	33%	0.332	S	S	.	.	H	α-helix	trans	-58.7	-50.5	174.7	-172.8	-171.5	-56.6	-161.7	-1.1	111.4	E381 D382 K387 A388 I389	E381-R385 WeakPolarHBondContact O-CB 3.29Å; E381-R385 PolarHBondContact O-N 2.96Å; D382-R385 PolarHBondContact O-N 3.18Å; R385-K387 VanDerWaalsContact C-N 3.33Å; R385-K387 PolarHBondContact O-N 3.46Å; R385-A388 PolarHBondContact O-N 3.15Å; R385-I389 HydrophobicContact CG-CD1 3.97Å; R385-I389 WeakPolarHBondContact O-CB 3.35Å; R385-I389 VanDerWaalsContact O-CG1 3.3Å; R385-I389 WeakPolarHBondContact O-CG1 3.21Å; R385-I389 PolarHBondContact O-N 3.07Å
386	N	83.6	Confident	78.6	Confident	18 Å²	18	65.7 Å²	65.7	10%	0.096	34%	0.344	C	S	.	.	H	α-helix	trans	-69.2	-30.1	-179.2	-65.4	-14.5	0	0	0	112.2	S322 D382 M390	S322-N386 PolarHBondContact O-ND2 3.09Å; D382-N386 VanDerWaalsContact O-CB 3.24Å; D382-N386 WeakPolarHBondContact O-CB 3.32Å; D382-N386 PolarHBondContact O-N 3.08Å; D382-N386 PolarHBondContact O-ND2 2.97Å; N386-M390 WeakPolarHBondContact O-CG 3.3Å; N386-M390 PolarHBondContact O-N 2.86Å
387	K	83.5	Confident	76.7	Confident	112 Å²	112	66.1 Å²	66.1	49%	0.487	35%	0.353	S	S	.	.	H	α-helix	trans	-64.5	-52.9	166.8	-80.3	172.9	178	-176.7	0	111	I383 L384 R385 I389 M390 E391	I383-K387 HydrophobicContact CG2-CD 4.27Å; I383-K387 VanDerWaalsContact O-CB 3.3Å; I383-K387 WeakPolarHBondContact O-CB 3.46Å; I383-K387 WeakPolarHBondContact O-CG 3.36Å; I383-K387 PolarHBondContact O-N 3.31Å; L384-K387 WeakPolarHBondContact O-CB 3.17Å; L384-K387 PolarHBondContact O-N 3.48Å; R385-K387 VanDerWaalsContact C-N 3.33Å; R385-K387 PolarHBondContact O-N 3.46Å; K387-I389 VanDerWaalsContact C-N 3.34Å; K387-I389 PolarHBondContact O-N 2.92Å; K387-M390 PolarHBondContact O-N 2.87Å; K387-E391 WeakPolarHBondContact O-CB 3.36Å; K387-E391 PolarHBondContact O-N 3.3Å
388	A	77.8	Confident	74.7	Confident	58 Å²	58	70.9 Å²	70.9	48%	0.479	38%	0.379	S	S	.	.	H	α-helix	trans	-62.8	-37.9	-177.5	0	0	0	0	0	112.8	L384 R385 E391 S392	L384-A388 WeakPolarHBondContact O-CB 3.3Å; L384-A388 PolarHBondContact O-N 3.38Å; R385-A388 PolarHBondContact O-N 3.15Å; A388-E391 PolarHBondContact O-N 3.27Å; A388-S392 WeakPolarHBondContact O-CB 3.45Å; A388-S392 PolarHBondContact O-N 3.38Å
389	I	72.6	Confident	72.8	Confident	62 Å²	62	72.1 Å²	72.1	32%	0.318	39%	0.385	S	S	.	.	H	α-helix	trans	-58.7	-59.3	170.3	-72.3	167.9	0	0	0	109.5	R385 K387 E391 S392 L393 I399	R385-I389 HydrophobicContact CG-CD1 3.97Å; R385-I389 WeakPolarHBondContact O-CB 3.35Å; R385-I389 VanDerWaalsContact O-CG1 3.3Å; R385-I389 WeakPolarHBondContact O-CG1 3.21Å; R385-I389 PolarHBondContact O-N 3.07Å; K387-I389 VanDerWaalsContact C-N 3.34Å; K387-I389 PolarHBondContact O-N 2.92Å; I389-E391 PolarHBondContact O-N 2.85Å; I389-S392 PolarHBondContact O-N 3.17Å; I389-S392 VanDerWaalsContact O-N 3.17Å; I389-L393 HydrophobicContact CG2-CD1 3.76Å; I389-L393 HydrophobicContact CG2-CG 4.27Å; I389-L393 WeakPolarHBondContact O-CB 3.42Å; I389-L393 WeakPolarHBondContact O-CG 3.2Å; I389-L393 PolarHBondContact O-N 2.68Å; I389-I399 HydrophobicContact CG2-CD1 4.06Å
390	M	68.6	Low	70.5	Confident	78 Å²	78	76.9 Å²	76.9	38%	0.384	40%	0.403	S	S	.	.	H	α-helix	trans	-60	-33.8	-179.8	-70.1	-157.6	-40.8	0	0	113.3	N386 K387 S394	N386-M390 WeakPolarHBondContact O-CG 3.3Å; N386-M390 PolarHBondContact O-N 2.86Å; K387-M390 PolarHBondContact O-N 2.87Å; M390-S394 VanDerWaalsContact O-CB 3.32Å; M390-S394 WeakPolarHBondContact O-CB 3.48Å; M390-S394 PolarHBondContact O-N 3.33Å; M390-S394 PolarHBondContact O-OG 3.21Å
391	E	69.4	Low	68.4	Low	99 Å²	99	77.2 Å²	77.2	46%	0.463	41%	0.405	S	S	.	.	H	α-helix	trans	-66.2	-48	175.7	-169.9	176.8	168.4	0	0	111.6	K387 A388 I389 S394 K395	K387-E391 WeakPolarHBondContact O-CB 3.36Å; K387-E391 PolarHBondContact O-N 3.3Å; A388-E391 PolarHBondContact O-N 3.27Å; I389-E391 PolarHBondContact O-N 2.85Å; E391-S394 PolarHBondContact O-N 3.45Å; E391-S394 PolarHBondContact O-OG 3.22Å; E391-K395 HydrophobicContact CG-CD 4.05Å; E391-K395 WeakPolarHBondContact O-CB 3.32Å; E391-K395 WeakPolarHBondContact O-CG 3.39Å; E391-K395 PolarHBondContact O-N 3.24Å; E391-K395 WeakPolarHBondContact OE1-CE 3.4Å; E391-K395 IonicContact OE1-NZ 3.79Å; E391-K395 PolarHBondContact OE1-NZ 3.4Å
392	S	65.1	Low	66.3	Low	31 Å²	31	76.5 Å²	76.5	22%	0.217	40%	0.402	C	S	.	.	H	α-helix	trans	-59.4	-48.3	175.3	-164	0	0	0	0	111.4	A388 I389 S394 K395 G396 G397 N398	A388-S392 WeakPolarHBondContact O-CB 3.45Å; A388-S392 PolarHBondContact O-N 3.38Å; I389-S392 PolarHBondContact O-N 3.17Å; I389-S392 VanDerWaalsContact O-N 3.17Å; S392-S394 VanDerWaalsContact C-N 3.32Å; S392-S394 PolarHBondContact O-N 2.82Å; S392-K395 CarbonylContact O-C 3.55Å; S392-K395 PolarHBondContact O-N 3.12Å; S392-K395 VanDerWaalsContact O-N 3.09Å; S392-G396 PolarHBondContact O-N 3.39Å; S392-G397 PolarHBondContact O-N 3.25Å; S392-G397 PolarHBondContact OG-O 3.07Å; S392-N398 PolarHBondContact OG-O 2.84Å
393	L	60.7	Low	63.9	Low	43 Å²	43	84.2 Å²	84.2	23%	0.225	44%	0.443	C	S	.	.	H	α-helix	trans	-55.3	-45.6	175	-64.8	174	0	0	0	111.2	M270 I389 K395 G396 I399	M270-L393 HydrophobicContact CE-CD2 3.94Å; M270-L393 HydrophobicContact CG-CB 4.2Å; M270-L393 HydrophobicContact CG-CD2 3.53Å; M270-L393 HydrophobicContact CG-CG 4.48Å; M270-L393 HydrophobicContact SD-CB 4.43Å; M270-L393 HydrophobicContact SD-CD2 4.08Å; I389-L393 HydrophobicContact CG2-CD1 3.76Å; I389-L393 HydrophobicContact CG2-CG 4.27Å; I389-L393 WeakPolarHBondContact O-CB 3.42Å; I389-L393 WeakPolarHBondContact O-CG 3.2Å; I389-L393 PolarHBondContact O-N 2.68Å; L393-K395 VanDerWaalsContact C-N 3.29Å; L393-K395 PolarHBondContact O-N 3.5Å; L393-G396 PolarHBondContact O-N 2.94Å; L393-I399 HydrophobicContact CD2-CD1 3.73Å; L393-I399 HydrophobicContact CG-CD1 4.17Å
394	S	60.5	Low	62.1	Low	54 Å²	54	88.1 Å²	88.1	38%	0.378	46%	0.458	S	S	.	.	H	α-helix	trans	-67.3	-26.3	179.2	76.5	0	0	0	0	114.5	M390 E391 S392	M390-S394 VanDerWaalsContact O-CB 3.32Å; M390-S394 WeakPolarHBondContact O-CB 3.48Å; M390-S394 PolarHBondContact O-N 3.33Å; M390-S394 PolarHBondContact O-OG 3.21Å; E391-S394 PolarHBondContact O-N 3.45Å; E391-S394 PolarHBondContact O-OG 3.22Å; S392-S394 VanDerWaalsContact C-N 3.32Å; S392-S394 PolarHBondContact O-N 2.82Å
395	K	59.3	Low	60.2	Low	152 Å²	152	91 Å²	91	66%	0.661	47%	0.469	S	S	*	.	H	α-helix	trans	-97.1	-3.5	-178.8	-69.6	178.2	178.6	178.6	0	113	E391 S392 L393 G397	E391-K395 HydrophobicContact CG-CD 4.05Å; E391-K395 WeakPolarHBondContact O-CB 3.32Å; E391-K395 WeakPolarHBondContact O-CG 3.39Å; E391-K395 PolarHBondContact O-N 3.24Å; E391-K395 WeakPolarHBondContact OE1-CE 3.4Å; E391-K395 IonicContact OE1-NZ 3.79Å; E391-K395 PolarHBondContact OE1-NZ 3.4Å; S392-K395 CarbonylContact O-C 3.55Å; S392-K395 PolarHBondContact O-N 3.12Å; S392-K395 VanDerWaalsContact O-N 3.09Å; L393-K395 VanDerWaalsContact C-N 3.29Å; L393-K395 PolarHBondContact O-N 3.5Å; K395-G397 VanDerWaalsContact C-N 3.28Å
396	G	52.2	Low	58.9	Low	40 Å²	40	92.1 Å²	92.1	41%	0.412	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	27.8	-174.8	0	0	0	0	0	113.6	S392 L393	S392-G396 PolarHBondContact O-N 3.39Å; L393-G396 PolarHBondContact O-N 2.94Å
397	G	53.6	Low	58.1	Low	28 Å²	28	98.1 Å²	98.1	29%	0.289	52%	0.517	S	S	.	.			trans	-75.8	146.8	172.3	0	0	0	0	0	111	S392 K395 I399	S392-G397 PolarHBondContact O-N 3.25Å; S392-G397 PolarHBondContact OG-O 3.07Å; K395-G397 VanDerWaalsContact C-N 3.28Å; G397-I399 PolarHBondContact O-N 3.49Å
398	N	51.7	Low	58.1	Low	107 Å²	107	97.5 Å²	97.5	57%	0.572	51%	0.512	S	S	*	.			trans	-58	129.6	162.1	-76.9	-44.7	0	0	0	108.2	K271 S392 M400	K271-N398 WeakPolarHBondContact CE-OD1 3.47Å; K271-N398 PolarHBondContact NZ-OD1 2.9Å; K271-N398 VanDerWaalsContact NZ-OD1 3.11Å; S392-N398 PolarHBondContact OG-O 2.84Å; N398-M400 PolarHBondContact O-N 3.46Å; N398-M400 VanDerWaalsContact O-N 3.13Å
399	I	53.9	Low	58.5	Low	43 Å²	43	97.6 Å²	97.6	22%	0.221	50%	0.5	C	S	.	.			trans	-66.6	109.6	150.9	-67.3	170.6	0	0	0	104.7	D269 I389 L393 G397	D269-I399 HydrophobicContact CB-CB 4.39Å; D269-I399 WeakPolarHBondContact OD1-CD1 3.38Å; I389-I399 HydrophobicContact CG2-CD1 4.06Å; L393-I399 HydrophobicContact CD2-CD1 3.73Å; L393-I399 HydrophobicContact CG-CD1 4.17Å; G397-I399 PolarHBondContact O-N 3.49Å
400	M	44.3	Very low	59.4	Low	150 Å²	150	101.4 Å²	101.4	74%	0.739	52%	0.516	S	S	*	.			trans	-77.1	124.4	160	-77	-177.4	64.6	0	0	106.2	N398 Q402	N398-M400 PolarHBondContact O-N 3.46Å; N398-M400 VanDerWaalsContact O-N 3.13Å; M400-Q402 PolarHBondContact O-N 3.02Å
401	E	44.8	Very low	60.6	Low	170 Å²	170	100 Å²	100	79%	0.794	51%	0.514	S	S	*	.			trans	-58.4	88.2	153.2	-63.1	178.3	134.5	0	0	107.6
402	Q	43.3	Very low	61.8	Low	129 Å²	129	98.1 Å²	98.1	60%	0.603	51%	0.507	S	S	*	.			trans	-62.6	132.8	153.2	-61.7	-178.9	6.7	0	0	105.4	M400 F404	M400-Q402 PolarHBondContact O-N 3.02Å; Q402-F404 VanDerWaalsContact C-N 3.27Å; Q402-F404 HydrophobicContact CB-CD2 4.38Å; Q402-F404 HydrophobicContact CB-CE2 3.82Å; Q402-F404 HydrophobicContact CB-CZ 3.93Å; Q402-F404 WeakPolarHBondContact O-CD2 3.5Å; Q402-F404 WeakPolarHBondContact O-CG 3.44Å; Q402-F404 PolarHBondContact O-N 3.08Å
403	N	37.7	Very low	63.1	Low	163 Å²	163	102 Å²	102	87%	0.872	53%	0.53	S	S	*	.			trans	-59.6	83.6	-170.5	-63.5	3.1	0	0	0	112.4
404	F	50.8	Low	64.5	Low	123 Å²	123	104.2 Å²	104.2	54%	0.539	55%	0.547	S	S	.	.			trans	-96.6	91.3	173.2	-62.5	-56.2	0	0	0	107.6	Q402	Q402-F404 VanDerWaalsContact C-N 3.27Å; Q402-F404 HydrophobicContact CB-CD2 4.38Å; Q402-F404 HydrophobicContact CB-CE2 3.82Å; Q402-F404 HydrophobicContact CB-CZ 3.93Å; Q402-F404 WeakPolarHBondContact O-CD2 3.5Å; Q402-F404 WeakPolarHBondContact O-CG 3.44Å; Q402-F404 PolarHBondContact O-N 3.08Å
405	E	48.1	Very low	65.9	Low	171 Å²	171	102.6 Å²	102.6	80%	0.799	53%	0.534	S	S	*	.			trans	-52.4	133.2	162.5	-65.7	-177.8	157.9	0	0	108.2	I407	E405-I407 VanDerWaalsContact C-N 3.32Å; E405-I407 PolarHBondContact O-N 3.24Å
406	P	54.4	Low	67.3	Low	103 Å²	103	101.1 Å²	101.1	67%	0.669	54%	0.541	S	S	*	.			trans	-70.4	87.8	-176.2	26.4	-33.5	0	0	0	110.8	R408	P406-R408 PolarHBondContact O-N 2.97Å
407	I	67.6	Low	68.7	Low	144 Å²	144	108.2 Å²	108.2	74%	0.738	56%	0.563	S	S	*	*			trans	-66.2	104.4	176.4	-57.9	176.7	0	0	0	108.9	E405 R409	E405-I407 VanDerWaalsContact C-N 3.32Å; E405-I407 PolarHBondContact O-N 3.24Å; I407-R409 PolarHBondContact O-N 2.98Å
408	R	83.3	Confident	70.2	Confident	100 Å²	100	109.2 Å²	109.2	38%	0.377	56%	0.562	S	S	.	*			trans	-45.7	109.5	174.6	173.5	62.4	94	-99.5	-6.3	111.6	E314 D318 P406 Q410	E314-R408 VanDerWaalsContact CB-NH2 3.26Å; E314-R408 IonicContact OE2-CZ 2.7Å; E314-R408 IonicContact OE2-NE 2.78Å; E314-R408 PolarHBondContact OE2-NE 3.01Å; E314-R408 VanDerWaalsContact OE2-NE 3.07Å; E314-R408 IonicContact OE2-NH2 2.71Å; D318-R408 IonicContact OD2-CZ 3.69Å; D318-R408 IonicContact OD2-NE 2.76Å; D318-R408 IonicContact OD2-NH1 3.72Å; D318-R408 PolarHBondContact OD2-NH1 2.7Å; P406-R408 PolarHBondContact O-N 2.97Å; R408-Q410 PolarHBondContact O-N 3.37Å
409	R	85.8	Confident	72	Confident	59 Å²	59	110.5 Å²	110.5	22%	0.223	57%	0.574	C	S	.	*	P	Polyproline II helix	trans	-66.3	120.7	-179.6	-66.7	-90.9	162.1	149.3	-11.3	110.2	R190 D318 M321 D382 I407	R190-R409 WeakPolarHBondContact CD-O 3.24Å; R190-R409 PolarHBondContact NH1-O 3.22Å; D318-R409 HydrophobicContact CB-CG 4.38Å; D318-R409 WeakPolarHBondContact OD1-CA 3.48Å; D318-R409 WeakPolarHBondContact OD1-CB 3.39Å; D318-R409 WeakPolarHBondContact OD1-CG 3.41Å; D318-R409 PolarHBondContact OD1-N 2.85Å; M321-R409 HydrophobicContact CB-CB 4.16Å; M321-R409 HydrophobicContact CB-CG 4.11Å; M321-R409 HydrophobicContact CE-CB 4.33Å; M321-R409 PolarHBondContact O-NH1 3.44Å; M321-R409 HydrophobicContact SD-CB 4.05Å; D382-R409 VanDerWaalsContact CG-NH1 3.28Å; D382-R409 IonicContact OD1-CZ 3.38Å; D382-R409 IonicContact OD1-NH1 3.61Å; D382-R409 PolarHBondContact OD1-NH1 2.81Å; D382-R409 VanDerWaalsContact OD1-NH1 3.17Å; D382-R409 IonicContact OD1-NH2 2.73Å; D382-R409 PolarHBondContact OD1-NH2 2.9Å; D382-R409 IonicContact OD2-CZ 2.76Å; D382-R409 IonicContact OD2-NH1 3.84Å; D382-R409 PolarHBondContact OD2-NH1 3.48Å; D382-R409 IonicContact OD2-NH2 3.24Å; I407-R409 PolarHBondContact O-N 2.98Å
410	Q	91.8	Very high	73.9	Confident	143 Å²	143	110.3 Å²	110.3	67%	0.668	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-75.4	158.2	167.2	-60.3	-56.2	-43.4	0	0	110.5	M321 R408	M321-Q410 VanDerWaalsContact CE-O 3.32Å; M321-Q410 WeakPolarHBondContact CE-O 3.32Å; R408-Q410 PolarHBondContact O-N 3.37Å
411	S	94.5	Very high	76.2	Confident	49 Å²	49	106.1 Å²	106.1	34%	0.343	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-55.7	140.4	170.3	-65.7	0	0	0	0	110.6	G188 D189 R190	G188-S411 CarbonylContact O-C 3.6Å; G188-S411 VanDerWaalsContact O-CA 3.29Å; G188-S411 WeakPolarHBondContact O-CA 3.49Å; D189-S411 PolarHBondContact OD1-OG 3.36Å; R190-S411 WeakPolarHBondContact CB-OG 3.15Å; R190-S411 PolarHBondContact N-OG 3.46Å
412	L	93.6	Very high	78.5	Confident	59 Å²	59	99 Å²	99	31%	0.309	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-64.9	158.5	172.3	-57.5	-174.6	0	0	0	110.6	G188 M321 H377 P414	G188-L412 PolarHBondContact O-N 2.89Å; M321-L412 HydrophobicContact CE-CG 4.42Å; H377-L412 HydrophobicContact CB-CD1 3.82Å; H377-L412 WeakPolarHBondContact O-CD1 3.48Å; L412-P414 WeakPolarHBondContact O-CD 3.24Å
413	T	92.8	Very high	80.9	Confident	113 Å²	113	97.6 Å²	97.6	69%	0.693	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-59.2	128.2	167.6	43.7	0	0	0	0	109.5	R438	T413-R438 PolarHBondContact O-NH1 3.35Å; T413-R438 PolarHBondContact O-NH2 3.49Å
414	P	91.5	Very high	83.5	Confident	89 Å²	89	94.9 Å²	94.9	58%	0.578	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-54.1	147	176.5	-29.6	37.1	0	0	0	112.2	L412	L412-P414 WeakPolarHBondContact O-CD 3.24Å
415	P	89.8	Confident	85.5	Confident	19 Å²	19	89 Å²	89	12%	0.123	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-61.9	162.3	170.6	28.8	-34.8	0	0	0	111.1	Y187 R438	Y187-P415 HydrophobicContact CD2-CG 4.1Å; Y187-P415 HydrophobicContact CE2-CG 3.71Å; P415-R438 HydrophobicContact CB-CB 4.33Å
416	P	87.1	Confident	87.6	Confident	122 Å²	122	82.3 Å²	82.3	79%	0.792	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-52.4	152.4	170.2	-24.7	34.9	0	0	0	111.9	N418	P416-N418 PolarHBondContact O-N 2.81Å
417	Q	82.8	Confident	89.4	Confident	188 Å²	188	82 Å²	82	88%	0.879	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-59.3	127	177.7	-73	-174.9	-25.6	0	0	110.8	T419	Q417-T419 PolarHBondContact O-N 2.86Å
418	N	85.3	Confident	90.4	Very high	50 Å²	50	76.2 Å²	76.2	27%	0.267	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-60.2	126.7	175.3	171.9	42	0	0	0	110.8	L154 P416 I420	L154-N418 HydrophobicContact CD2-CB 3.93Å; P416-N418 PolarHBondContact O-N 2.81Å; N418-I420 PolarHBondContact ND2-O 3.17Å; N418-I420 VanDerWaalsContact ND2-O 3.09Å; N418-I420 VanDerWaalsContact OD1-CB 3.27Å; N418-I420 WeakPolarHBondContact OD1-CB 3.49Å; N418-I420 WeakPolarHBondContact OD1-CD1 3.3Å; N418-I420 PolarHBondContact OD1-N 2.88Å
419	T	89.1	Confident	90.7	Very high	134 Å²	134	77.2 Å²	77.2	82%	0.822	42%	0.424	S	S	*	.			trans	-94.1	-13.4	176.9	52.5	0	0	0	0	113.7	Q417 T421	Q417-T419 PolarHBondContact O-N 2.86Å; T419-T421 PolarHBondContact O-N 3.45Å
420	I	92.9	Very high	90.5	Very high	39 Å²	39	80.2 Å²	80.2	20%	0.2	44%	0.444	C	S	.	.			trans	-69.5	127.1	-178.6	-62.7	151.2	0	0	0	109.5	F121 N418 E424 P434 H435 L436	F121-I420 VanDerWaalsContact CE1-O 3.23Å; F121-I420 WeakPolarHBondContact CE1-O 3.43Å; F121-I420 HydrophobicContact CZ-CG2 4.47Å; F121-I420 VanDerWaalsContact CZ-O 3.29Å; F121-I420 WeakPolarHBondContact CZ-O 3.46Å; N418-I420 PolarHBondContact ND2-O 3.17Å; N418-I420 VanDerWaalsContact ND2-O 3.09Å; N418-I420 VanDerWaalsContact OD1-CB 3.27Å; N418-I420 WeakPolarHBondContact OD1-CB 3.49Å; N418-I420 WeakPolarHBondContact OD1-CD1 3.3Å; N418-I420 PolarHBondContact OD1-N 2.88Å; I420-E424 HydrophobicContact CG2-CB 3.98Å; I420-P434 HydrophobicContact CD1-CB 3.63Å; I420-P434 HydrophobicContact CG1-CB 4.24Å; I420-P434 HydrophobicContact CG2-CB 3.89Å; I420-P434 HydrophobicContact CG2-CG 4.37Å; I420-H435 VanDerWaalsContact CD1-O 3.27Å; I420-H435 WeakPolarHBondContact CD1-O 3.43Å; I420-L436 HydrophobicContact CB-CD2 4.4Å; I420-L436 HydrophobicContact CD1-CD2 4.18Å; I420-L436 HydrophobicContact CG2-CD2 4.44Å
421	T	93.8	Very high	89.7	Confident	61 Å²	61	74.9 Å²	74.9	37%	0.374	43%	0.427	S	S	.	.			trans	-73.9	162.3	174.5	62.4	0	0	0	0	112.3	T419 E423 E424 Y425	T419-T421 PolarHBondContact O-N 3.45Å; T421-E423 PolarHBondContact O-N 2.94Å; T421-E424 WeakPolarHBondContact CB-OE2 3.36Å; T421-E424 WeakPolarHBondContact CG2-OE2 3.39Å; T421-E424 PolarHBondContact N-OE2 3.11Å; T421-E424 PolarHBondContact O-N 3.44Å; T421-E424 WeakPolarHBondContact OG1-CB 3.45Å; T421-E424 VanDerWaalsContact OG1-CD 3.25Å; T421-E424 VanDerWaalsContact OG1-CG 3.23Å; T421-E424 WeakPolarHBondContact OG1-CG 3.42Å; T421-E424 PolarHBondContact OG1-N 2.87Å; T421-E424 VanDerWaalsContact OG1-N 3.13Å; T421-E424 PolarHBondContact OG1-OE2 2.97Å; T421-Y425 WeakPolarHBondContact O-CB 3.43Å; T421-Y425 PolarHBondContact O-N 3.16Å
422	W	93.2	Very high	89.1	Confident	22 Å²	22	78.8 Å²	78.8	8%	0.083	44%	0.438	C	S	.	.	H	α-helix	trans	-61.2	-36.4	174	166.1	-105.9	0	0	0	111.3	H117 E118 F121 K122 L150 Y425 I426	H117-W422 HydrophobicContact CB-CH2 3.46Å; H117-W422 VanDerWaalsContact CB-CH2 3.46Å; H117-W422 HydrophobicContact CB-CZ2 4.45Å; H117-W422 HydrophobicContact CB-CZ3 3.79Å; E118-W422 HydrophobicContact CB-CD2 4.02Å; E118-W422 HydrophobicContact CB-CG 4.36Å; E118-W422 HydrophobicContact CB-CZ2 4.03Å; E118-W422 HydrophobicContact CG-CD2 4.09Å; E118-W422 HydrophobicContact CG-CG 3.89Å; F121-W422 HydrophobicContact CB-CE3 3.74Å; F121-W422 HydrophobicContact CB-CZ3 4.33Å; F121-W422 HydrophobicContact CD1-CB 3.9Å; F121-W422 HydrophobicContact CD1-CE3 4.47Å; F121-W422 AromaticContact CD2-CE3 3.76Å; F121-W422 HydrophobicContact CD2-CE3 3.76Å; F121-W422 HydrophobicContact CD2-CZ3 4.29Å; F121-W422 HydrophobicContact CE1-CB 4.22Å; F121-W422 HydrophobicContact CE2-CE3 4.48Å; F121-W422 HydrophobicContact CG-CB 4.32Å; F121-W422 AromaticContact CG-CE3 3.75Å; F121-W422 HydrophobicContact CG-CE3 3.75Å; K122-W422 VanDerWaalsContact CE-CB 3.41Å; L150-W422 HydrophobicContact CD1-CZ3 4.18Å; W422-Y425 AromaticContact CE3-CD1 3.93Å; W422-Y425 HydrophobicContact CE3-CD1 3.93Å; W422-Y425 HydrophobicContact CH2-CD1 4.48Å; W422-Y425 AromaticContact CZ3-CD1 3.68Å; W422-Y425 HydrophobicContact CZ3-CD1 3.68Å; W422-Y425 AromaticContact CZ3-CE1 3.95Å; W422-Y425 HydrophobicContact CZ3-CE1 3.95Å; W422-Y425 PolarHBondContact O-N 2.82Å; W422-I426 HydrophobicContact CH2-CB 4.35Å; W422-I426 HydrophobicContact CH2-CD1 3.73Å; W422-I426 HydrophobicContact CH2-CG1 4.2Å; W422-I426 HydrophobicContact CZ2-CB 4.03Å; W422-I426 HydrophobicContact CZ2-CD1 3.92Å; W422-I426 HydrophobicContact CZ2-CG1 3.9Å; W422-I426 HydrophobicContact CZ2-CG2 4.46Å; W422-I426 HydrophobicContact CZ3-CD1 4.48Å; W422-I426 WeakPolarHBondContact O-CG2 3.22Å; W422-I426 PolarHBondContact O-N 3.4Å
423	E	92.7	Very high	88.6	Confident	98 Å²	98	77.3 Å²	77.3	46%	0.458	43%	0.434	S	S	.	.	H	α-helix	trans	-69.4	-40.1	-177.3	-65.7	68.1	-154.1	0	0	111.2	K122 T421 S427	K122-E423 IonicContact NZ-OE1 2.68Å; K122-E423 PolarHBondContact NZ-OE1 3.19Å; K122-E423 IonicContact NZ-OE2 3.63Å; T421-E423 PolarHBondContact O-N 2.94Å; E423-S427 VanDerWaalsContact O-CB 3.27Å; E423-S427 WeakPolarHBondContact O-CB 3.27Å; E423-S427 PolarHBondContact O-N 2.87Å; E423-S427 PolarHBondContact O-OG 2.85Å
424	E	92.9	Very high	88.3	Confident	106 Å²	106	73.5 Å²	73.5	50%	0.495	41%	0.412	S	S	.	.	H	α-helix	trans	-68.9	-38	169.8	-71.6	161.7	134.6	0	0	112.4	I420 T421 S427	I420-E424 HydrophobicContact CG2-CB 3.98Å; T421-E424 WeakPolarHBondContact CB-OE2 3.36Å; T421-E424 WeakPolarHBondContact CG2-OE2 3.39Å; T421-E424 PolarHBondContact N-OE2 3.11Å; T421-E424 PolarHBondContact O-N 3.44Å; T421-E424 WeakPolarHBondContact OG1-CB 3.45Å; T421-E424 VanDerWaalsContact OG1-CD 3.25Å; T421-E424 VanDerWaalsContact OG1-CG 3.23Å; T421-E424 WeakPolarHBondContact OG1-CG 3.42Å; T421-E424 PolarHBondContact OG1-N 2.87Å; T421-E424 VanDerWaalsContact OG1-N 3.13Å; T421-E424 PolarHBondContact OG1-OE2 2.97Å; E424-S427 PolarHBondContact O-OG 2.76Å
425	Y	93.5	Very high	88	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-60.8	-56.4	175	175.4	-95.5	0	0	0	111.3	F121 D141 H143 N145 L150 T421 W422 S427 A428 A433 L436	F121-Y425 HydrophobicContact CD2-CD1 4.36Å; F121-Y425 HydrophobicContact CD2-CG 4.29Å; F121-Y425 HydrophobicContact CE2-CD1 4.15Å; F121-Y425 AromaticContact CE2-CD2 3.97Å; F121-Y425 HydrophobicContact CE2-CD2 3.97Å; F121-Y425 AromaticContact CE2-CG 3.64Å; F121-Y425 HydrophobicContact CE2-CG 3.64Å; F121-Y425 HydrophobicContact CZ-CG 4.41Å; D141-Y425 WeakPolarHBondContact OD2-CE1 3.13Å; D141-Y425 PolarHBondContact OD2-OH 3.26Å; H143-Y425 AromaticContact CD2-CE1 3.8Å; H143-Y425 AromaticContact CD2-CE2 3.96Å; H143-Y425 AromaticContact CD2-CZ 3.51Å; H143-Y425 PolarHBondContact NE2-O 3.16Å; H143-Y425 VanDerWaalsContact NE2-O 3.07Å; N145-Y425 PolarHBondContact ND2-OH 3.37Å; L150-Y425 HydrophobicContact CD1-CE1 4.5Å; L150-Y425 HydrophobicContact CD2-CE1 4.18Å; L150-Y425 HydrophobicContact CD2-CE2 4.15Å; T421-Y425 WeakPolarHBondContact O-CB 3.43Å; T421-Y425 PolarHBondContact O-N 3.16Å; W422-Y425 AromaticContact CE3-CD1 3.93Å; W422-Y425 HydrophobicContact CE3-CD1 3.93Å; W422-Y425 HydrophobicContact CH2-CD1 4.48Å; W422-Y425 AromaticContact CZ3-CD1 3.68Å; W422-Y425 HydrophobicContact CZ3-CD1 3.68Å; W422-Y425 AromaticContact CZ3-CE1 3.95Å; W422-Y425 HydrophobicContact CZ3-CE1 3.95Å; W422-Y425 PolarHBondContact O-N 2.82Å; Y425-S427 VanDerWaalsContact C-N 3.32Å; Y425-S427 PolarHBondContact O-N 3.02Å; Y425-A428 WeakPolarHBondContact O-CB 3.17Å; Y425-A428 PolarHBondContact O-N 3.09Å; Y425-A433 HydrophobicContact CE2-CB 3.92Å; Y425-L436 HydrophobicContact CD2-CD1 4Å; Y425-L436 HydrophobicContact CD2-CD2 4.04Å; Y425-L436 HydrophobicContact CD2-CG 4.32Å; Y425-L436 HydrophobicContact CE2-CD1 3.85Å; Y425-L436 HydrophobicContact CE2-CG 4.42Å
426	I	91.8	Very high	87.9	Confident	31 Å²	31	72.8 Å²	72.8	16%	0.159	40%	0.399	C	S	.	.	H	α-helix	trans	-76.9	-15.4	-171	-157	68.3	0	0	0	114.1	Y114 D141 N142 W422	Y114-I426 HydrophobicContact CD2-CD1 3.56Å; Y114-I426 HydrophobicContact CD2-CG1 4.23Å; Y114-I426 HydrophobicContact CE2-CD1 3.9Å; D141-I426 HydrophobicContact CB-CD1 4.37Å; N142-I426 PolarHBondContact ND2-O 2.76Å; N142-I426 WeakPolarHBondContact OD1-CD1 3.5Å; W422-I426 HydrophobicContact CH2-CB 4.35Å; W422-I426 HydrophobicContact CH2-CD1 3.73Å; W422-I426 HydrophobicContact CH2-CG1 4.2Å; W422-I426 HydrophobicContact CZ2-CB 4.03Å; W422-I426 HydrophobicContact CZ2-CD1 3.92Å; W422-I426 HydrophobicContact CZ2-CG1 3.9Å; W422-I426 HydrophobicContact CZ2-CG2 4.46Å; W422-I426 HydrophobicContact CZ3-CD1 4.48Å; W422-I426 WeakPolarHBondContact O-CG2 3.22Å; W422-I426 PolarHBondContact O-N 3.4Å
427	S	90.7	Very high	87.8	Confident	96 Å²	96	68.1 Å²	68.1	67%	0.671	37%	0.373	S	S	*	.	H	α-helix	trans	-89.4	-7.2	174.6	60.1	0	0	0	0	114.1	E423 E424 Y425	E423-S427 VanDerWaalsContact O-CB 3.27Å; E423-S427 WeakPolarHBondContact O-CB 3.27Å; E423-S427 PolarHBondContact O-N 2.87Å; E423-S427 PolarHBondContact O-OG 2.85Å; E424-S427 PolarHBondContact O-OG 2.76Å; Y425-S427 VanDerWaalsContact C-N 3.32Å; Y425-S427 PolarHBondContact O-N 3.02Å
428	A	90.6	Very high	88.1	Confident	23 Å²	23	61.4 Å²	61.4	19%	0.19	34%	0.34	C	S	.	.	S	Bend	trans	-69	157.7	177.5	0	0	0	0	0	113.1	Y425 N430 P434	Y425-A428 WeakPolarHBondContact O-CB 3.17Å; Y425-A428 PolarHBondContact O-N 3.09Å; A428-N430 PolarHBondContact O-N 2.67Å; A428-P434 HydrophobicContact CB-CG 3.83Å
429	E	88.4	Confident	88.3	Confident	121 Å²	121	67 Å²	67	57%	0.565	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-59.8	134.8	-178.5	-168.7	-170.7	145.5	0	0	111.5	H143 G431 K432	H143-E429 PolarHBondContact CE1-O 2.92Å; H143-E429 PolarHBondContact ND1-O 2.92Å; E429-G431 PolarHBondContact O-N 3.48Å; E429-K432 HydrophobicContact CB-CB 4.31Å; E429-K432 HydrophobicContact CB-CD 4.3Å; E429-K432 VanDerWaalsContact CD-CE 3.44Å; E429-K432 HydrophobicContact CG-CD 4.42Å; E429-K432 CarbonylContact O-C 3.53Å; E429-K432 WeakPolarHBondContact O-CA 3.39Å; E429-K432 PolarHBondContact O-N 2.62Å; E429-K432 WeakPolarHBondContact OE1-CE 3.15Å; E429-K432 IonicContact OE1-NZ 2.76Å; E429-K432 PolarHBondContact OE1-NZ 3.35Å; E429-K432 WeakPolarHBondContact OE2-CD 3.36Å; E429-K432 WeakPolarHBondContact OE2-CE 3.45Å; E429-K432 IonicContact OE2-NZ 2.7Å; E429-K432 PolarHBondContact OE2-NZ 3.31Å
430	N	81.9	Confident	88.3	Confident	122 Å²	122	64.3 Å²	64.3	65%	0.652	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	126.7	-175.2	-65.7	-7.2	0	0	0	112	A428 K432	A428-N430 PolarHBondContact O-N 2.67Å; N430-K432 PolarHBondContact O-N 2.68Å
431	G	73.8	Confident	88.2	Confident	30 Å²	30	66.5 Å²	66.5	31%	0.309	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	-12.8	-175.3	0	0	0	0	0	116.6	N142 H143 Q176 E429	N142-G431 PolarHBondContact O-N 3.34Å; H143-G431 PolarHBondContact ND1-N 3.12Å; Q176-G431 PolarHBondContact NE2-O 3.48Å; E429-G431 PolarHBondContact O-N 3.48Å
432	K	82.5	Confident	88	Confident	131 Å²	131	66 Å²	66	57%	0.57	36%	0.358	S	S	*	.			trans	-101.1	59	171.3	-56.8	-176.2	-165.4	163.6	0	110.8	E429 N430	E429-K432 HydrophobicContact CB-CB 4.31Å; E429-K432 HydrophobicContact CB-CD 4.3Å; E429-K432 VanDerWaalsContact CD-CE 3.44Å; E429-K432 HydrophobicContact CG-CD 4.42Å; E429-K432 CarbonylContact O-C 3.53Å; E429-K432 WeakPolarHBondContact O-CA 3.39Å; E429-K432 PolarHBondContact O-N 2.62Å; E429-K432 WeakPolarHBondContact OE1-CE 3.15Å; E429-K432 IonicContact OE1-NZ 2.76Å; E429-K432 PolarHBondContact OE1-NZ 3.35Å; E429-K432 WeakPolarHBondContact OE2-CD 3.36Å; E429-K432 WeakPolarHBondContact OE2-CE 3.45Å; E429-K432 IonicContact OE2-NZ 2.7Å; E429-K432 PolarHBondContact OE2-NZ 3.31Å; N430-K432 PolarHBondContact O-N 2.68Å
433	A	83.3	Confident	87.9	Confident	29 Å²	29	71.6 Å²	71.6	24%	0.24	38%	0.382	C	S	.	.			trans	-58.2	140.9	177.8	0	0	0	0	0	111.5	H143 Y425	H143-A433 HydrophobicContact CB-CB 3.93Å; H143-A433 PolarHBondContact ND1-N 3.33Å; Y425-A433 HydrophobicContact CE2-CB 3.92Å
434	P	86.3	Confident	87.7	Confident	33 Å²	33	71.3 Å²	71.3	21%	0.214	38%	0.381	C	S	.	.			trans	-57.6	147.6	164.2	-27.3	39.2	0	0	0	111	I420 A428 L436	I420-P434 HydrophobicContact CD1-CB 3.63Å; I420-P434 HydrophobicContact CG1-CB 4.24Å; I420-P434 HydrophobicContact CG2-CB 3.89Å; I420-P434 HydrophobicContact CG2-CG 4.37Å; A428-P434 HydrophobicContact CB-CG 3.83Å; P434-L436 PolarHBondContact O-N 3.47Å
435	H	84.6	Confident	87.5	Confident	85 Å²	85	69 Å²	69	39%	0.394	38%	0.377	S	S	.	.			trans	-85.8	113.5	-169.8	176.9	-98.1	0	0	0	112.2	I420 G437 R438	I420-H435 VanDerWaalsContact CD1-O 3.27Å; I420-H435 WeakPolarHBondContact CD1-O 3.43Å; H435-G437 PolarHBondContact CE1-O 3.3Å; H435-R438 PolarHBondContact CE1-O 2.94Å; H435-R438 PolarHBondContact NE2-O 2.86Å
436	L	88.6	Confident	87.2	Confident	7 Å²	7	75 Å²	75	4%	0.037	40%	0.403	C	S	.	.			trans	-95.4	-8.5	-167.8	-55.4	-178.6	0	0	0	116.1	F121 L150 M153 L154 I420 Y425 P434	F121-L436 HydrophobicContact CD2-CD1 4.45Å; F121-L436 HydrophobicContact CE2-CD1 3.91Å; F121-L436 HydrophobicContact CE2-CD2 3.78Å; F121-L436 HydrophobicContact CZ-CD2 3.98Å; L150-L436 HydrophobicContact CD2-CD1 3.73Å; M153-L436 HydrophobicContact CB-CB 4.4Å; M153-L436 HydrophobicContact CE-CB 4.38Å; M153-L436 HydrophobicContact CE-CD1 4.31Å; M153-L436 HydrophobicContact CE-CG 4.48Å; L154-L436 HydrophobicContact CD2-CB 3.95Å; L154-L436 HydrophobicContact CD2-CD1 4.26Å; L154-L436 HydrophobicContact CD2-CD2 4.43Å; L154-L436 HydrophobicContact CD2-CG 4.44Å; L154-L436 HydrophobicContact CG-CD1 4.32Å; I420-L436 HydrophobicContact CB-CD2 4.4Å; I420-L436 HydrophobicContact CD1-CD2 4.18Å; I420-L436 HydrophobicContact CG2-CD2 4.44Å; Y425-L436 HydrophobicContact CD2-CD1 4Å; Y425-L436 HydrophobicContact CD2-CD2 4.04Å; Y425-L436 HydrophobicContact CD2-CG 4.32Å; Y425-L436 HydrophobicContact CE2-CD1 3.85Å; Y425-L436 HydrophobicContact CE2-CG 4.42Å; P434-L436 PolarHBondContact O-N 3.47Å
437	G	85.3	Confident	86.8	Confident	24 Å²	24	76.9 Å²	76.9	25%	0.247	41%	0.41	C	S	.	.	S	Bend	trans	-128.3	-136.8	-165.1	0	0	0	0	0	115	H435	H435-G437 PolarHBondContact CE1-O 3.3Å
438	R	89.3	Confident	86.5	Confident	48 Å²	48	77 Å²	77	18%	0.181	41%	0.407	C	S	.	.	S	Bend	trans	-84.8	134.2	173.9	-171.6	-171.3	-53.3	-77.3	-6.1	110.3	S186 Y187 E376 T413 P415 H435 L440	S186-R438 PolarHBondContact O-NE 3.03Å; Y187-R438 PolarHBondContact O-NH2 3.1Å; E376-R438 HydrophobicContact CB-CG 4.42Å; E376-R438 WeakPolarHBondContact O-CD 3.49Å; T413-R438 PolarHBondContact O-NH1 3.35Å; T413-R438 PolarHBondContact O-NH2 3.49Å; P415-R438 HydrophobicContact CB-CB 4.33Å; H435-R438 PolarHBondContact CE1-O 2.94Å; H435-R438 PolarHBondContact NE2-O 2.86Å; R438-L440 PolarHBondContact O-N 2.8Å
439	E	88.6	Confident	86	Confident	166 Å²	166	76.9 Å²	76.9	78%	0.776	40%	0.402	S	S	*	.			trans	-50.6	128.6	-174.7	-174.9	172.6	-172.3	0	0	113	E376 V441	E376-E439 WeakPolarHBondContact CB-O 3.28Å; E439-V441 PolarHBondContact O-N 2.83Å
440	L	88.8	Confident	85.5	Confident	79 Å²	79	81 Å²	81	41%	0.414	42%	0.418	S	S	.	.			trans	-82.5	112.7	-164.8	-59.2	-177	0	0	0	113.5	E376 R438 C442	E376-L440 HydrophobicContact CG-CD2 4.4Å; R438-L440 PolarHBondContact O-N 2.8Å; L440-C442 VanDerWaalsContact C-N 3.28Å; L440-C442 PolarHBondContact O-N 3.15Å; L440-C442 VanDerWaalsContact O-N 3.08Å
441	V	91.6	Very high	85.6	Confident	85 Å²	85	75.3 Å²	75.3	52%	0.515	39%	0.388	S	S	.	.			trans	-88.5	70.3	171.8	-174.5	0	0	0	0	108.6	R374 R375 E376 E439	R374-V441 WeakPolarHBondContact CA-O 3.42Å; R375-V441 HydrophobicContact CB-CB 4.38Å; R375-V441 HydrophobicContact CB-CG1 4.22Å; R375-V441 PolarHBondContact N-O 3.42Å; E376-V441 HydrophobicContact CB-CB 4.22Å; E376-V441 HydrophobicContact CB-CG2 3.99Å; E376-V441 PolarHBondContact OE2-N 3.42Å; E376-V441 VanDerWaalsContact OE2-N 3.11Å; E439-V441 PolarHBondContact O-N 2.83Å
442	C	89.6	Confident	86.3	Confident	51 Å²	51	75.6 Å²	75.6	35%	0.345	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	121.8	-174.7	-170.2	0	0	0	0	112.7	K373 R374 L440	K373-C442 CarbonylContact O-C 3.59Å; K373-C442 WeakPolarHBondContact O-CA 3.47Å; R374-C442 HydrophobicContact CG-CB 4.04Å; L440-C442 VanDerWaalsContact C-N 3.28Å; L440-C442 PolarHBondContact O-N 3.15Å; L440-C442 VanDerWaalsContact O-N 3.08Å
443	K	90.6	Very high	86.8	Confident	138 Å²	138	69.4 Å²	69.4	60%	0.6	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	116.5	164.6	-171.7	164.3	-177.2	168.4	0	109.4	K373	K373-K443 PolarHBondContact N-O 2.84Å; K373-K443 PolarHBondContact O-N 3.22Å
444	E	89.9	Confident	87.4	Confident	92 Å²	92	68 Å²	68	43%	0.43	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	147.9	169.7	-58.9	-157.7	-167.9	0	0	111	S371 R372	S371-E444 CarbonylContact O-C 3.55Å; S371-E444 WeakPolarHBondContact O-CA 3.32Å; R372-E444 HydrophobicContact CG-CG 4.14Å; R372-E444 IonicContact CZ-OE1 3.91Å; R372-E444 IonicContact CZ-OE2 2.71Å; R372-E444 VanDerWaalsContact CZ-OE2 3.24Å; R372-E444 IonicContact NE-OE1 3.7Å; R372-E444 IonicContact NE-OE2 3.29Å; R372-E444 IonicContact NH1-OE1 2.71Å; R372-E444 PolarHBondContact NH1-OE1 3.19Å; R372-E444 IonicContact NH1-OE2 3.04Å; R372-E444 IonicContact NH2-OE1 2.89Å; R372-E444 PolarHBondContact NH2-OE1 3.34Å; R372-E444 IonicContact NH2-OE2 2.7Å; R372-E444 PolarHBondContact NH2-OE2 2.96Å
445	S	86.9	Confident	87.8	Confident	58 Å²	58	66.5 Å²	66.5	41%	0.406	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	136.7	172.2	-170.2	0	0	0	0	110.2	S371	S371-S445 PolarHBondContact N-O 2.83Å; S371-S445 PolarHBondContact O-N 3.35Å; S371-S445 PolarHBondContact OG-O 3.18Å
446	K	88.1	Confident	88.3	Confident	126 Å²	126	62.5 Å²	62.5	55%	0.548	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	119.1	174.5	-58.8	-166.8	179.3	-157.5	0	108.1	V368 L369 E370	V368-K446 HydrophobicContact CG1-CB 4.18Å; L369-K446 WeakPolarHBondContact O-CA 3.46Å; E370-K446 HydrophobicContact CG-CD 4.11Å; E370-K446 HydrophobicContact CG-CG 4.14Å; E370-K446 WeakPolarHBondContact OE1-CD 3.34Å; E370-K446 VanDerWaalsContact OE1-CE 3.28Å; E370-K446 WeakPolarHBondContact OE1-CE 3.31Å; E370-K446 IonicContact OE1-NZ 3.36Å; E370-K446 PolarHBondContact OE1-NZ 2.84Å; E370-K446 IonicContact OE2-NZ 3.45Å
447	K	84	Confident	88.5	Confident	70 Å²	70	68.2 Å²	68.2	30%	0.304	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	120.1	-179.9	-171	168.1	-176.7	173.1	0	110.4	L369 F449 P504	L369-K447 PolarHBondContact N-O 2.77Å; L369-K447 PolarHBondContact O-N 3.47Å; K447-F449 HydrophobicContact CB-CE2 3.95Å; K447-F449 HydrophobicContact CD-CE2 4.18Å; K447-F449 HydrophobicContact CD-CZ 4.14Å; K447-F449 HydrophobicContact CG-CD2 4.38Å; K447-F449 HydrophobicContact CG-CE2 3.94Å; K447-F449 HydrophobicContact CG-CZ 4.38Å; K447-F449 VanDerWaalsContact O-CD2 3.29Å; K447-F449 WeakPolarHBondContact O-CD2 3.41Å; K447-P504 WeakPolarHBondContact CD-O 3.33Å; K447-P504 WeakPolarHBondContact CE-O 3.42Å; K447-P504 PolarHBondContact NZ-O 2.73Å
448	T	84.4	Confident	88.8	Confident	99 Å²	99	72 Å²	72	61%	0.607	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	129.5	170.3	-50.2	0	0	0	0	109.2	L367	L367-T448 WeakPolarHBondContact O-CA 3.38Å
449	F	78.9	Confident	88.8	Confident	20 Å²	20	70.5 Å²	70.5	9%	0.088	35%	0.35	C	S	.	.			trans	-105	141.5	176.4	-79.6	-96.7	0	0	0	110.8	L367 L369 K447 P501	L367-F449 HydrophobicContact CD2-CB 4.26Å; L367-F449 PolarHBondContact O-N 2.9Å; L369-F449 HydrophobicContact CB-CD2 3.98Å; L369-F449 HydrophobicContact CB-CE2 3.61Å; L369-F449 HydrophobicContact CD2-CE2 4.04Å; L369-F449 HydrophobicContact CD2-CZ 4.39Å; L369-F449 HydrophobicContact CG-CE2 4.49Å; K447-F449 HydrophobicContact CB-CE2 3.95Å; K447-F449 HydrophobicContact CD-CE2 4.18Å; K447-F449 HydrophobicContact CD-CZ 4.14Å; K447-F449 HydrophobicContact CG-CD2 4.38Å; K447-F449 HydrophobicContact CG-CE2 3.94Å; K447-F449 HydrophobicContact CG-CZ 4.38Å; K447-F449 VanDerWaalsContact O-CD2 3.29Å; K447-F449 WeakPolarHBondContact O-CD2 3.41Å; F449-P501 HydrophobicContact CB-CB 4.33Å; F449-P501 HydrophobicContact CD1-CB 3.57Å; F449-P501 HydrophobicContact CD2-CB 3.8Å; F449-P501 HydrophobicContact CD2-CG 4.36Å; F449-P501 HydrophobicContact CE1-CB 3.65Å; F449-P501 HydrophobicContact CE2-CB 3.91Å; F449-P501 HydrophobicContact CG-CB 3.62Å; F449-P501 HydrophobicContact CG-CG 4.23Å; F449-P501 HydrophobicContact CZ-CB 3.82Å
450	K	78.3	Confident	88.8	Confident	207 Å²	207	65.7 Å²	65.7	90%	0.9	33%	0.333	S	S	*	.			trans	-90	116.1	159.9	-67.3	179.1	179.8	178.2	0	106.4
451	A	84.9	Confident	88.6	Confident	4 Å²	4	62.2 Å²	62.2	3%	0.033	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	146.5	174.8	0	0	0	0	0	109.3	V364 L367 D499	V364-A451 HydrophobicContact CB-CB 4.15Å; V364-A451 HydrophobicContact CG2-CB 4.24Å; V364-A451 PolarHBondContact N-O 3.17Å; L367-A451 HydrophobicContact CD2-CB 3.69Å; A451-D499 HydrophobicContact CB-CB 4.02Å; A451-D499 VanDerWaalsContact CB-O 3.31Å; A451-D499 WeakPolarHBondContact CB-O 3.09Å
452	T	88.7	Confident	88.2	Confident	36 Å²	36	59.9 Å²	59.9	22%	0.221	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	148.6	170.8	-28.2	0	0	0	0	109.2	F361 Y362 D499	F361-T452 HydrophobicContact CD1-CG2 3.92Å; Y362-T452 WeakPolarHBondContact O-CA 3.3Å; Y362-T452 WeakPolarHBondContact O-CG2 3.21Å; T452-D499 WeakPolarHBondContact CA-OD2 3.12Å; T452-D499 WeakPolarHBondContact CB-OD2 3.39Å; T452-D499 PolarHBondContact N-OD2 3.08Å; T452-D499 PolarHBondContact O-N 3.38Å; T452-D499 PolarHBondContact OG1-OD2 3.11Å
453	I	92.9	Very high	88	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	137.6	168.6	-170.9	170.9	0	0	0	108.6	F337 F361 Y362 V364 M455 F485 L490 P495 K497 L498	F337-I453 HydrophobicContact CD1-CG2 3.96Å; F337-I453 HydrophobicContact CE1-CG2 4.08Å; F361-I453 WeakPolarHBondContact CA-O 3.49Å; Y362-I453 PolarHBondContact N-O 2.85Å; Y362-I453 PolarHBondContact O-N 2.75Å; V364-I453 HydrophobicContact CG2-CB 4.22Å; V364-I453 HydrophobicContact CG2-CG2 3.85Å; I453-M455 HydrophobicContact CD1-SD 3.46Å; I453-M455 WeakPolarHBondContact CD1-SD 3.18Å; I453-M455 HydrophobicContact CG1-CG 4.47Å; I453-M455 HydrophobicContact CG1-SD 3.58Å; I453-M455 VanDerWaalsContact CG1-SD 3.58Å; I453-F485 HydrophobicContact CD1-CE1 4.48Å; I453-L490 HydrophobicContact CD1-CD1 4.09Å; I453-L490 HydrophobicContact CD1-CD2 3.8Å; I453-L490 HydrophobicContact CD1-CG 4.35Å; I453-P495 HydrophobicContact CD1-CB 4.08Å; I453-P495 HydrophobicContact CG1-CB 4.29Å; I453-K497 WeakPolarHBondContact CA-O 3.4Å; I453-K497 WeakPolarHBondContact CG1-O 3.36Å; I453-L498 HydrophobicContact CD1-CD2 3.59Å; I453-L498 HydrophobicContact CG1-CD2 3.8Å
454	A	95	Very high	87.5	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122.7	173.3	0	0	0	0	0	109.3	V354 A359 D360 F361 P495 V496 K497	V354-A454 HydrophobicContact CG2-CB 4.08Å; A359-A454 HydrophobicContact CB-CB 3.85Å; D360-A454 WeakPolarHBondContact O-CA 3.4Å; F361-A454 HydrophobicContact CD1-CB 3.99Å; F361-A454 HydrophobicContact CD2-CB 4.01Å; F361-A454 HydrophobicContact CE1-CB 3.85Å; F361-A454 HydrophobicContact CE2-CB 3.84Å; F361-A454 HydrophobicContact CG-CB 4.07Å; F361-A454 HydrophobicContact CZ-CB 3.77Å; A454-P495 CarbonylContact O-C 3.58Å; A454-P495 WeakPolarHBondContact O-CA 3.42Å; A454-V496 HydrophobicContact CB-CG2 4.37Å; A454-V496 WeakPolarHBondContact O-CG2 3.33Å; A454-V496 PolarHBondContact O-N 2.94Å; A454-K497 HydrophobicContact CB-CB 3.8Å; A454-K497 PolarHBondContact N-O 2.99Å; A454-K497 PolarHBondContact O-N 2.85Å
455	M	95.1	Very high	87	Confident	1 Å²	1	59 Å²	59	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	131.6	-174.6	-56.1	-58.6	-57.4	0	0	110	A359 D360 Y362 I453 L490 P491 G493 F494 P495	A359-M455 CarbonylContact C-O 3.55Å; A359-M455 WeakPolarHBondContact CA-O 3.4Å; D360-M455 PolarHBondContact N-O 2.77Å; D360-M455 PolarHBondContact O-N 2.6Å; Y362-M455 HydrophobicContact CD2-CG 3.98Å; Y362-M455 HydrophobicContact CE2-CB 4.15Å; Y362-M455 HydrophobicContact CE2-CG 3.9Å; I453-M455 HydrophobicContact CD1-SD 3.46Å; I453-M455 WeakPolarHBondContact CD1-SD 3.18Å; I453-M455 HydrophobicContact CG1-CG 4.47Å; I453-M455 HydrophobicContact CG1-SD 3.58Å; I453-M455 VanDerWaalsContact CG1-SD 3.58Å; M455-L490 HydrophobicContact CE-CB 4.16Å; M455-L490 HydrophobicContact CE-CD1 4.36Å; M455-P491 WeakPolarHBondContact CE-O 3.17Å; M455-P491 HydrophobicContact CG-CB 4.08Å; M455-P491 HydrophobicContact CG-CG 4.08Å; M455-G493 VanDerWaalsContact CE-C 3.45Å; M455-G493 WeakPolarHBondContact CE-O 3.45Å; M455-F494 CarbonylContact C-O 3.6Å; M455-F494 WeakPolarHBondContact CA-O 3.33Å; M455-P495 HydrophobicContact CE-CB 4.15Å; M455-P495 HydrophobicContact SD-CB 3.84Å
456	S	95.1	Very high	86.7	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	139.1	173	-171	0	0	0	0	111	L358 E458 G493 F494	L358-S456 WeakPolarHBondContact O-CB 3.42Å; L358-S456 PolarHBondContact O-OG 3.38Å; S456-E458 VanDerWaalsContact C-N 3.31Å; S456-E458 WeakPolarHBondContact OG-CB 3.29Å; S456-E458 PolarHBondContact OG-N 3.04Å; S456-E458 VanDerWaalsContact OG-N 3.08Å; S456-G493 CarbonylContact O-C 3.6Å; S456-G493 WeakPolarHBondContact O-CA 3.46Å; S456-F494 PolarHBondContact N-O 2.73Å; S456-F494 PolarHBondContact O-N 3.36Å
457	Q	92.8	Very high	86.5	Confident	126 Å²	126	51 Å²	51	59%	0.589	26%	0.263	S	S	*	.	S	Bend	trans	-85.7	-7.5	167.5	-46.4	-52.7	-35.7	0	0	111.9	P492	Q457-P492 PolarHBondContact NE2-O 2.7Å
458	E	91	Very high	86.4	Confident	105 Å²	105	49 Å²	49	49%	0.491	26%	0.255	S	S	.	.			trans	-93.3	-9.2	-173.4	-54.5	179.6	152.1	0	0	113.1	L358 S456 P460	L358-E458 VanDerWaalsContact CB-OE2 3.27Å; L358-E458 WeakPolarHBondContact CB-OE2 3.49Å; L358-E458 PolarHBondContact N-OE2 3.13Å; S456-E458 VanDerWaalsContact C-N 3.31Å; S456-E458 WeakPolarHBondContact OG-CB 3.29Å; S456-E458 PolarHBondContact OG-N 3.04Å; S456-E458 VanDerWaalsContact OG-N 3.08Å; E458-P460 WeakPolarHBondContact O-CD 3.47Å
459	F	90.5	Very high	86.2	Confident	15 Å²	15	44.3 Å²	44.3	7%	0.066	23%	0.226	C	C	.	.			trans	-71.5	123.6	-176.3	-158.5	-95.4	0	0	0	110.7	L227 F357 L461 F494 V496 F512 F515	L227-F459 HydrophobicContact CD1-CZ 4.35Å; F357-F459 AromaticContact CD1-CD2 3.75Å; F357-F459 HydrophobicContact CD1-CD2 3.75Å; F357-F459 HydrophobicContact CD1-CE2 4.49Å; F357-F459 AromaticContact CD2-CD2 3.94Å; F357-F459 HydrophobicContact CD2-CD2 3.94Å; F357-F459 HydrophobicContact CD2-CE2 4.12Å; F357-F459 AromaticContact CE1-CD2 3.52Å; F357-F459 HydrophobicContact CE1-CD2 3.52Å; F357-F459 AromaticContact CE1-CE2 3.95Å; F357-F459 HydrophobicContact CE1-CE2 3.95Å; F357-F459 HydrophobicContact CE1-CG 4.43Å; F357-F459 AromaticContact CE2-CD2 3.74Å; F357-F459 HydrophobicContact CE2-CD2 3.74Å; F357-F459 AromaticContact CE2-CE2 3.54Å; F357-F459 HydrophobicContact CE2-CE2 3.54Å; F357-F459 AromaticContact CG-CD2 3.97Å; F357-F459 HydrophobicContact CG-CD2 3.97Å; F357-F459 AromaticContact CZ-CD2 3.52Å; F357-F459 HydrophobicContact CZ-CD2 3.52Å; F357-F459 AromaticContact CZ-CE2 3.44Å; F357-F459 HydrophobicContact CZ-CE2 3.44Å; F357-F459 VanDerWaalsContact CZ-CE2 3.44Å; F459-L461 HydrophobicContact CD1-CB 3.89Å; F459-L461 HydrophobicContact CE1-CB 3.71Å; F459-L461 PolarHBondContact O-N 3.31Å; F459-L461 VanDerWaalsContact O-N 3.11Å; F459-F494 HydrophobicContact CB-CB 3.58Å; F459-F494 HydrophobicContact CB-CD1 3.86Å; F459-F494 HydrophobicContact CB-CG 3.79Å; F459-F494 HydrophobicContact CD1-CB 4.17Å; F459-F494 AromaticContact CD1-CD1 3.41Å; F459-F494 HydrophobicContact CD1-CD1 3.41Å; F459-F494 VanDerWaalsContact CD1-CD1 3.41Å; F459-F494 AromaticContact CD1-CD2 3.59Å; F459-F494 HydrophobicContact CD1-CD2 3.59Å; F459-F494 AromaticContact CD1-CE1 3.53Å; F459-F494 HydrophobicContact CD1-CE1 3.53Å; F459-F494 AromaticContact CD1-CE2 3.68Å; F459-F494 HydrophobicContact CD1-CE2 3.68Å; F459-F494 AromaticContact CD1-CG 3.44Å; F459-F494 HydrophobicContact CD1-CG 3.44Å; F459-F494 VanDerWaalsContact CD1-CG 3.44Å; F459-F494 AromaticContact CD1-CZ 3.63Å; F459-F494 HydrophobicContact CD1-CZ 3.63Å; F459-F494 AromaticContact CD2-CD1 3.86Å; F459-F494 HydrophobicContact CD2-CD1 3.86Å; F459-F494 HydrophobicContact CD2-CE1 4.03Å; F459-F494 AromaticContact CE1-CD1 3.87Å; F459-F494 HydrophobicContact CE1-CD1 3.87Å; F459-F494 HydrophobicContact CE1-CD2 4.1Å; F459-F494 AromaticContact CE1-CE1 3.43Å; F459-F494 HydrophobicContact CE1-CE1 3.43Å; F459-F494 VanDerWaalsContact CE1-CE1 3.43Å; F459-F494 AromaticContact CE1-CE2 3.67Å; F459-F494 HydrophobicContact CE1-CE2 3.67Å; F459-F494 HydrophobicContact CE1-CG 4.17Å; F459-F494 AromaticContact CE1-CZ 3.3Å; F459-F494 HydrophobicContact CE1-CZ 3.3Å; F459-F494 HydrophobicContact CE2-CD1 4.26Å; F459-F494 AromaticContact CE2-CE1 3.95Å; F459-F494 HydrophobicContact CE2-CE1 3.95Å; F459-F494 HydrophobicContact CG-CB 4.07Å; F459-F494 AromaticContact CG-CD1 3.42Å; F459-F494 HydrophobicContact CG-CD1 3.42Å; F459-F494 VanDerWaalsContact CG-CD1 3.42Å; F459-F494 HydrophobicContact CG-CD2 4.3Å; F459-F494 AromaticContact CG-CE1 3.84Å; F459-F494 HydrophobicContact CG-CE1 3.84Å; F459-F494 AromaticContact CG-CG 3.68Å; F459-F494 HydrophobicContact CG-CG 3.68Å; F459-F494 HydrophobicContact CG-CZ 4.4Å; F459-F494 HydrophobicContact CZ-CD1 4.27Å; F459-F494 AromaticContact CZ-CE1 3.66Å; F459-F494 HydrophobicContact CZ-CE1 3.66Å; F459-F494 AromaticContact CZ-CZ 3.83Å; F459-F494 HydrophobicContact CZ-CZ 3.83Å; F459-V496 HydrophobicContact CB-CG1 4.41Å; F459-V496 HydrophobicContact CD2-CG1 3.65Å; F459-V496 HydrophobicContact CE2-CG1 4.29Å; F459-V496 HydrophobicContact CG-CG1 4.29Å; F459-F512 HydrophobicContact CE2-CB 4.03Å; F459-F512 HydrophobicContact CE2-CD1 4.35Å; F459-F512 HydrophobicContact CZ-CB 4.46Å; F459-F512 AromaticContact CZ-CD1 3.94Å; F459-F512 HydrophobicContact CZ-CD1 3.94Å; F459-F515 HydrophobicContact CE1-CB 4.42Å; F459-F515 HydrophobicContact CE1-CD2 4.22Å; F459-F515 HydrophobicContact CE1-CG 4.33Å; F459-F515 HydrophobicContact CE2-CB 3.81Å; F459-F515 HydrophobicContact CZ-CB 3.66Å; F459-F515 HydrophobicContact CZ-CD2 4.05Å; F459-F515 HydrophobicContact CZ-CG 4.02Å
460	P	86.9	Confident	86.3	Confident	66 Å²	66	43.3 Å²	43.3	43%	0.429	22%	0.222	S	C	.	.	S	Bend	trans	-71.9	-7.8	-169.7	-21.9	34.7	0	0	0	116.2	E458 F515 Y517	E458-P460 WeakPolarHBondContact O-CD 3.47Å; P460-F515 HydrophobicContact CB-CD1 4.01Å; P460-F515 HydrophobicContact CB-CE1 3.76Å; P460-F515 HydrophobicContact CG-CD1 3.74Å; P460-F515 HydrophobicContact CG-CE1 3.99Å; P460-Y517 HydrophobicContact CB-CE2 3.79Å; P460-Y517 PolarHBondContact O-OH 2.7Å
461	L	84.8	Confident	86.3	Confident	6 Å²	6	35.2 Å²	35.2	3%	0.031	19%	0.188	C	C	.	.	S	Bend	trans	-111.5	135.3	-174.1	-160.7	70	0	0	0	112.2	L222 F459 L465 L466 F494 F515	L222-L461 HydrophobicContact CD1-CD1 3.97Å; F459-L461 HydrophobicContact CD1-CB 3.89Å; F459-L461 HydrophobicContact CE1-CB 3.71Å; F459-L461 PolarHBondContact O-N 3.31Å; F459-L461 VanDerWaalsContact O-N 3.11Å; L461-L465 HydrophobicContact CD1-CB 3.91Å; L461-L465 HydrophobicContact CD1-CD1 4.06Å; L461-L465 HydrophobicContact CG-CB 4.07Å; L461-L466 HydrophobicContact CD2-CB 4.11Å; L461-L466 HydrophobicContact CD2-CD1 4.42Å; L461-F494 WeakPolarHBondContact O-CD2 3.4Å; L461-F515 HydrophobicContact CB-CE2 4.18Å; L461-F515 HydrophobicContact CB-CZ 4.33Å; L461-F515 HydrophobicContact CD1-CE2 4.43Å; L461-F515 HydrophobicContact CD1-CZ 4.37Å; L461-F515 HydrophobicContact CD2-CE2 4.11Å; L461-F515 HydrophobicContact CG-CE2 4.48Å
462	G	84.7	Confident	85.8	Confident	36 Å²	36	35.4 Å²	35.4	37%	0.371	19%	0.188	S	C	.	.			trans	-74.9	149.9	171.5	0	0	0	0	0	113	E464 L465 L466	G462-E464 VanDerWaalsContact C-N 3.32Å; G462-E464 PolarHBondContact O-N 3.39Å; G462-L465 WeakPolarHBondContact O-CB 3.35Å; G462-L465 PolarHBondContact O-N 2.82Å; G462-L466 PolarHBondContact O-N 3.47Å
463	I	83.5	Confident	84.9	Confident	41 Å²	41	33.9 Å²	33.9	21%	0.21	18%	0.179	C	C	.	.	H	α-helix	trans	-59.2	-41.9	178.5	-58.3	174.2	0	0	0	111.4	L465 L466 L467 V486 L490 F494	I463-L465 PolarHBondContact O-N 3.05Å; I463-L466 PolarHBondContact O-N 3.26Å; I463-L467 HydrophobicContact CG2-CD1 4.07Å; I463-L467 HydrophobicContact CG2-CG 4.36Å; I463-L467 WeakPolarHBondContact O-CB 3.4Å; I463-L467 VanDerWaalsContact O-CG 3.31Å; I463-L467 WeakPolarHBondContact O-CG 3.39Å; I463-L467 PolarHBondContact O-N 3.06Å; I463-V486 HydrophobicContact CG2-CB 4Å; I463-V486 HydrophobicContact CG2-CG2 4.01Å; I463-L490 HydrophobicContact CD1-CD1 4.12Å; I463-F494 HydrophobicContact CG1-CD2 3.99Å
464	E	80.2	Confident	83.4	Confident	148 Å²	148	34.7 Å²	34.7	69%	0.692	19%	0.185	S	C	*	.	H	α-helix	trans	-52.7	-37.3	172.5	-69.9	-73.1	153.2	0	0	112.8	G462 N468	G462-E464 VanDerWaalsContact C-N 3.32Å; G462-E464 PolarHBondContact O-N 3.39Å; E464-N468 PolarHBondContact O-ND2 3.3Å
465	L	80.4	Confident	81.5	Confident	73 Å²	73	38.4 Å²	38.4	38%	0.382	21%	0.209	S	C	.	.	H	α-helix	trans	-78.8	-43.1	-178.1	-62.1	178.9	0	0	0	111.5	L222 L461 G462 I463 L467 N468 V469	L222-L465 HydrophobicContact CD1-CB 3.8Å; L222-L465 HydrophobicContact CD1-CD1 4.08Å; L222-L465 HydrophobicContact CD1-CD2 4.15Å; L222-L465 HydrophobicContact CD1-CG 4.23Å; L461-L465 HydrophobicContact CD1-CB 3.91Å; L461-L465 HydrophobicContact CD1-CD1 4.06Å; L461-L465 HydrophobicContact CG-CB 4.07Å; G462-L465 WeakPolarHBondContact O-CB 3.35Å; G462-L465 PolarHBondContact O-N 2.82Å; I463-L465 PolarHBondContact O-N 3.05Å; L465-L467 PolarHBondContact O-N 3.4Å; L465-N468 PolarHBondContact O-N 2.89Å; L465-V469 PolarHBondContact O-N 3.48Å
466	L	80.8	Confident	79.9	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-55.8	-40.8	170.1	-179.8	73.6	0	0	0	111	L227 L461 G462 I463 N468 V469 L470 F494 F512	L227-L466 HydrophobicContact CD2-CD1 4.05Å; L461-L466 HydrophobicContact CD2-CB 4.11Å; L461-L466 HydrophobicContact CD2-CD1 4.42Å; G462-L466 PolarHBondContact O-N 3.47Å; I463-L466 PolarHBondContact O-N 3.26Å; L466-N468 VanDerWaalsContact C-N 3.26Å; L466-N468 PolarHBondContact O-N 3.25Å; L466-V469 WeakPolarHBondContact O-CB 3.29Å; L466-V469 PolarHBondContact O-N 3.45Å; L466-V469 VanDerWaalsContact O-N 3.13Å; L466-L470 HydrophobicContact CD1-CD1 4.45Å; L466-L470 HydrophobicContact CD1-CG 4.26Å; L466-L470 HydrophobicContact CD2-CD1 3.91Å; L466-L470 HydrophobicContact CG-CD1 3.81Å; L466-L470 HydrophobicContact CG-CG 3.99Å; L466-L470 WeakPolarHBondContact O-CB 3.28Å; L466-L470 WeakPolarHBondContact O-CG 3.43Å; L466-L470 PolarHBondContact O-N 3.22Å; L466-F494 HydrophobicContact CB-CE2 4.32Å; L466-F494 HydrophobicContact CD2-CE2 4Å; L466-F494 HydrophobicContact CD2-CZ 3.82Å; L466-F512 HydrophobicContact CD1-CE1 4.21Å; L466-F512 HydrophobicContact CD2-CE1 4.04Å; L466-F512 HydrophobicContact CD2-CZ 3.89Å
467	L	82.5	Confident	78	Confident	16 Å²	16	47.7 Å²	47.7	8%	0.084	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-29.1	-179.2	-80.2	170.4	0	0	0	113.8	I463 L465 E471 R483 V486 Q487	I463-L467 HydrophobicContact CG2-CD1 4.07Å; I463-L467 HydrophobicContact CG2-CG 4.36Å; I463-L467 WeakPolarHBondContact O-CB 3.4Å; I463-L467 VanDerWaalsContact O-CG 3.31Å; I463-L467 WeakPolarHBondContact O-CG 3.39Å; I463-L467 PolarHBondContact O-N 3.06Å; L465-L467 PolarHBondContact O-N 3.4Å; L467-E471 WeakPolarHBondContact O-CB 3.49Å; L467-E471 PolarHBondContact O-N 3.32Å; L467-R483 HydrophobicContact CD2-CB 4.29Å; L467-R483 HydrophobicContact CD2-CG 3.72Å; L467-V486 HydrophobicContact CD2-CG2 3.73Å; L467-V486 HydrophobicContact CG-CG2 4.15Å; L467-Q487 HydrophobicContact CD1-CG 3.77Å; L467-Q487 HydrophobicContact CD2-CG 3.94Å
468	N	82.6	Confident	76.5	Confident	27 Å²	27	45.8 Å²	45.8	14%	0.144	24%	0.241	C	C	.	.	H	α-helix	trans	-71.8	-42.6	173.4	-60.7	-55.3	0	0	0	111.3	A218 E464 L465 L466 E471 V472	A218-N468 HydrophobicContact CB-CB 4.02Å; E464-N468 PolarHBondContact O-ND2 3.3Å; L465-N468 PolarHBondContact O-N 2.89Å; L466-N468 VanDerWaalsContact C-N 3.26Å; L466-N468 PolarHBondContact O-N 3.25Å; N468-E471 PolarHBondContact O-N 2.98Å; N468-V472 PolarHBondContact O-N 2.84Å
469	V	80.9	Confident	75.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-48	174.7	179.1	0	0	0	0	110.3	L219 L222 F225 I251 I258 L465 L466 E471 V472 I473	L219-V469 HydrophobicContact CD2-CG2 4.26Å; L222-V469 HydrophobicContact CD2-CG2 3.47Å; L222-V469 VanDerWaalsContact CD2-CG2 3.47Å; F225-V469 HydrophobicContact CE1-CG2 4.38Å; F225-V469 HydrophobicContact CZ-CG1 4.45Å; F225-V469 HydrophobicContact CZ-CG2 4.03Å; I251-V469 HydrophobicContact CG2-CG1 4.28Å; I258-V469 HydrophobicContact CD1-CG1 4.27Å; L465-V469 PolarHBondContact O-N 3.48Å; L466-V469 WeakPolarHBondContact O-CB 3.29Å; L466-V469 PolarHBondContact O-N 3.45Å; L466-V469 VanDerWaalsContact O-N 3.13Å; V469-E471 PolarHBondContact O-N 2.9Å; V469-V472 PolarHBondContact O-N 2.9Å; V469-V472 VanDerWaalsContact O-N 3.09Å; V469-I473 PolarHBondContact O-N 2.81Å; V469-I473 VanDerWaalsContact O-N 3.07Å
470	L	80.3	Confident	74.4	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.3	-21.6	176.5	-68.2	-177.8	0	0	0	113.8	L466 I473 A474 F479 L482	L466-L470 HydrophobicContact CD1-CD1 4.45Å; L466-L470 HydrophobicContact CD1-CG 4.26Å; L466-L470 HydrophobicContact CD2-CD1 3.91Å; L466-L470 HydrophobicContact CG-CD1 3.81Å; L466-L470 HydrophobicContact CG-CG 3.99Å; L466-L470 WeakPolarHBondContact O-CB 3.28Å; L466-L470 WeakPolarHBondContact O-CG 3.43Å; L466-L470 PolarHBondContact O-N 3.22Å; L470-I473 HydrophobicContact CD2-CD1 4.11Å; L470-I473 HydrophobicContact CD2-CG1 4.27Å; L470-A474 WeakPolarHBondContact O-CA 3.43Å; L470-A474 WeakPolarHBondContact O-CB 3.24Å; L470-A474 PolarHBondContact O-N 2.98Å; L470-A474 VanDerWaalsContact O-N 3.13Å; L470-F479 HydrophobicContact CD2-CB 4.37Å; L470-F479 HydrophobicContact CD2-CD1 3.57Å; L470-F479 HydrophobicContact CD2-CE1 4.17Å; L470-F479 HydrophobicContact CD2-CG 4.16Å; L470-L482 HydrophobicContact CD1-CD2 3.96Å; L470-L482 HydrophobicContact CD1-CG 4.1Å; L470-L482 HydrophobicContact CD2-CD2 4.3Å
471	E	78.6	Confident	73.6	Confident	37 Å²	37	44.5 Å²	44.5	17%	0.173	23%	0.229	C	C	.	.	H	α-helix	trans	-79	-26.7	171.9	-176.5	148.9	-131.7	0	0	112.4	K211 L215 L467 N468 V469 A474 R483	K211-E471 IonicContact NZ-OE1 3.2Å; K211-E471 PolarHBondContact NZ-OE1 2.9Å; L215-E471 HydrophobicContact CD1-CG 4.03Å; L215-E471 HydrophobicContact CD2-CB 3.92Å; L215-E471 HydrophobicContact CD2-CG 3.84Å; L467-E471 WeakPolarHBondContact O-CB 3.49Å; L467-E471 PolarHBondContact O-N 3.32Å; N468-E471 PolarHBondContact O-N 2.98Å; V469-E471 PolarHBondContact O-N 2.9Å; E471-A474 VanDerWaalsContact O-CB 3.25Å; E471-A474 WeakPolarHBondContact O-CB 2.9Å; E471-R483 VanDerWaalsContact CD-CZ 3.45Å; E471-R483 IonicContact OE1-CZ 2.71Å; E471-R483 VanDerWaalsContact OE1-CZ 3.31Å; E471-R483 IonicContact OE1-NH1 3.98Å; E471-R483 PolarHBondContact OE1-NH1 3.3Å; E471-R483 IonicContact OE1-NH2 3.81Å; E471-R483 PolarHBondContact OE1-NH2 2.82Å; E471-R483 IonicContact OE2-CZ 2.7Å; E471-R483 IonicContact OE2-NH1 3.35Å; E471-R483 IonicContact OE2-NH2 3.64Å; E471-R483 PolarHBondContact OE2-NH2 3.4Å
472	V	73.8	Confident	73.2	Confident	8 Å²	8	44.2 Å²	44.2	5%	0.048	23%	0.228	C	C	.	.	H	α-helix	trans	-78.7	-40.2	173.9	177.9	0	0	0	0	111.5	L215 L219 I258 F281 F291 N468 V469 A474 P475	L215-V472 HydrophobicContact CB-CG2 4.08Å; L215-V472 HydrophobicContact CD1-CG2 4.33Å; L215-V472 HydrophobicContact CD2-CG2 4.41Å; L219-V472 HydrophobicContact CD1-CG2 4.19Å; I258-V472 HydrophobicContact CD1-CB 4.06Å; I258-V472 HydrophobicContact CD1-CG1 3.91Å; F281-V472 HydrophobicContact CB-CG1 4.32Å; F281-V472 HydrophobicContact CD1-CG1 3.56Å; F281-V472 HydrophobicContact CD2-CG1 3.99Å; F281-V472 HydrophobicContact CE1-CG1 3.75Å; F281-V472 HydrophobicContact CE2-CG1 4.16Å; F281-V472 HydrophobicContact CG-CG1 3.67Å; F281-V472 HydrophobicContact CZ-CG1 4.04Å; F291-V472 HydrophobicContact CZ-CG1 4.37Å; N468-V472 PolarHBondContact O-N 2.84Å; V469-V472 PolarHBondContact O-N 2.9Å; V469-V472 VanDerWaalsContact O-N 3.09Å; V472-A474 PolarHBondContact O-N 3.25Å; V472-P475 WeakPolarHBondContact O-CD 3.42Å
473	I	71.5	Confident	72.8	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	22%	0.219	C	C	.	.	S	Bend	trans	-86.8	17.1	170.9	70.1	172.5	0	0	0	113.5	I251 I258 L260 V469 L470 F476 F479	I251-I473 HydrophobicContact CD1-CD1 3.65Å; I251-I473 HydrophobicContact CG1-CD1 4.42Å; I258-I473 HydrophobicContact CG2-CG2 4.2Å; L260-I473 HydrophobicContact CD2-CB 4.47Å; L260-I473 HydrophobicContact CD2-CD1 4.27Å; L260-I473 HydrophobicContact CD2-CG2 4.5Å; V469-I473 PolarHBondContact O-N 2.81Å; V469-I473 VanDerWaalsContact O-N 3.07Å; L470-I473 HydrophobicContact CD2-CD1 4.11Å; L470-I473 HydrophobicContact CD2-CG1 4.27Å; I473-F476 HydrophobicContact CB-CD2 4.24Å; I473-F476 HydrophobicContact CB-CE2 4.3Å; I473-F476 VanDerWaalsContact O-CD2 3.3Å; I473-F476 WeakPolarHBondContact O-CD2 3.23Å; I473-F479 HydrophobicContact CD1-CD1 4.31Å; I473-F479 HydrophobicContact CD1-CD2 3.96Å; I473-F479 HydrophobicContact CD1-CE1 4.11Å; I473-F479 HydrophobicContact CD1-CE2 3.76Å; I473-F479 HydrophobicContact CD1-CG 4.25Å; I473-F479 HydrophobicContact CD1-CZ 3.85Å; I473-F479 HydrophobicContact CG1-CD2 4.11Å; I473-F479 HydrophobicContact CG1-CE2 4.38Å; I473-F479 HydrophobicContact CG1-CG 4.36Å
474	A	59.9	Low	72.4	Confident	17 Å²	17	49.2 Å²	49.2	14%	0.14	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-17.3	177.3	0	0	0	0	0	117.5	L470 E471 V472 F476 N480	L470-A474 WeakPolarHBondContact O-CA 3.43Å; L470-A474 WeakPolarHBondContact O-CB 3.24Å; L470-A474 PolarHBondContact O-N 2.98Å; L470-A474 VanDerWaalsContact O-N 3.13Å; E471-A474 VanDerWaalsContact O-CB 3.25Å; E471-A474 WeakPolarHBondContact O-CB 2.9Å; V472-A474 PolarHBondContact O-N 3.25Å; A474-F476 PolarHBondContact O-N 2.84Å; A474-N480 PolarHBondContact O-ND2 3.46Å
475	P	56.2	Low	72.1	Confident	77 Å²	77	42.3 Å²	42.3	50%	0.5	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-31.7	173.8	-29.9	37.8	0	0	0	113	F291 V472 K477	F291-P475 HydrophobicContact CZ-CG 4.48Å; V472-P475 WeakPolarHBondContact O-CD 3.42Å; P475-K477 PolarHBondContact O-N 2.63Å
476	F	60.5	Low	71.9	Confident	30 Å²	30	39 Å²	39	13%	0.132	19%	0.189	C	C	.	.	S	Bend	trans	-76.3	122	-179.6	-44.9	-59.3	0	0	0	111.3	L260 F279 I473 A474 H478 F479	L260-F476 HydrophobicContact CD2-CD2 3.95Å; L260-F476 HydrophobicContact CD2-CE2 3.97Å; F279-F476 HydrophobicContact CB-CZ 4.23Å; F279-F476 AromaticContact CD1-CE1 3.51Å; F279-F476 HydrophobicContact CD1-CE1 3.51Å; F279-F476 HydrophobicContact CD1-CE2 4.21Å; F279-F476 AromaticContact CD1-CZ 3.25Å; F279-F476 HydrophobicContact CD1-CZ 3.25Å; F279-F476 HydrophobicContact CE1-CD1 4.23Å; F279-F476 AromaticContact CE1-CE1 3.33Å; F279-F476 HydrophobicContact CE1-CE1 3.33Å; F279-F476 AromaticContact CE1-CZ 3.64Å; F279-F476 HydrophobicContact CE1-CZ 3.64Å; F279-F476 HydrophobicContact CG-CE1 4.29Å; F279-F476 HydrophobicContact CG-CE2 4.31Å; F279-F476 AromaticContact CG-CZ 3.77Å; F279-F476 HydrophobicContact CG-CZ 3.77Å; F279-F476 HydrophobicContact CZ-CE1 4.02Å; F279-F476 HydrophobicContact CZ-CZ 4.45Å; I473-F476 HydrophobicContact CB-CD2 4.24Å; I473-F476 HydrophobicContact CB-CE2 4.3Å; I473-F476 VanDerWaalsContact O-CD2 3.3Å; I473-F476 WeakPolarHBondContact O-CD2 3.23Å; A474-F476 PolarHBondContact O-N 2.84Å; F476-H478 PolarHBondContact O-N 2.9Å; F476-F479 HydrophobicContact CB-CD2 4.14Å; F476-F479 HydrophobicContact CD2-CD2 4.49Å; F476-F479 PolarHBondContact O-N 2.96Å
477	K	56	Low	71.7	Confident	168 Å²	168	44.2 Å²	44.2	73%	0.73	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-24	-165.3	-64.6	164.3	-174.8	161.9	0	114.3	P475	P475-K477 PolarHBondContact O-N 2.63Å
478	H	61.8	Low	71.4	Confident	87 Å²	87	44.8 Å²	44.8	40%	0.403	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-39.6	-176.7	-56.6	-75.4	0	0	0	114.6	W231 F233 F476 N480 K481	W231-H478 HydrophobicContact CH2-CB 4.13Å; W231-H478 HydrophobicContact CZ2-CB 4.31Å; W231-H478 HydrophobicContact CZ3-CB 4.45Å; F233-H478 AromaticContact CZ-ND1 3.79Å; F476-H478 PolarHBondContact O-N 2.9Å; H478-N480 PolarHBondContact O-N 3.42Å; H478-K481 PolarHBondContact O-N 3.07Å
479	F	69.1	Low	71.2	Confident	9 Å²	9	52.9 Å²	52.9	4%	0.039	25%	0.25	C	S	.	.	H	α-helix	trans	-66.7	-24.3	-174.6	-71.7	-67.3	0	0	0	113.5	L229 W231 L260 L470 I473 F476 K481 L482 R483	L229-F479 HydrophobicContact CD1-CE1 4.08Å; L229-F479 HydrophobicContact CD1-CZ 4.49Å; L229-F479 HydrophobicContact CD2-CE1 4.42Å; W231-F479 AromaticContact CZ2-CD1 3.8Å; W231-F479 HydrophobicContact CZ2-CD1 3.8Å; W231-F479 AromaticContact CZ2-CE1 3.84Å; W231-F479 HydrophobicContact CZ2-CE1 3.84Å; W231-F479 AromaticContact NE1-CE1 3.85Å; L260-F479 HydrophobicContact CD2-CE2 4.04Å; L470-F479 HydrophobicContact CD2-CB 4.37Å; L470-F479 HydrophobicContact CD2-CD1 3.57Å; L470-F479 HydrophobicContact CD2-CE1 4.17Å; L470-F479 HydrophobicContact CD2-CG 4.16Å; I473-F479 HydrophobicContact CD1-CD1 4.31Å; I473-F479 HydrophobicContact CD1-CD2 3.96Å; I473-F479 HydrophobicContact CD1-CE1 4.11Å; I473-F479 HydrophobicContact CD1-CE2 3.76Å; I473-F479 HydrophobicContact CD1-CG 4.25Å; I473-F479 HydrophobicContact CD1-CZ 3.85Å; I473-F479 HydrophobicContact CG1-CD2 4.11Å; I473-F479 HydrophobicContact CG1-CE2 4.38Å; I473-F479 HydrophobicContact CG1-CG 4.36Å; F476-F479 HydrophobicContact CB-CD2 4.14Å; F476-F479 HydrophobicContact CD2-CD2 4.49Å; F476-F479 PolarHBondContact O-N 2.96Å; F479-K481 VanDerWaalsContact C-N 3.32Å; F479-K481 PolarHBondContact O-N 3.31Å; F479-L482 HydrophobicContact CD1-CD2 4.17Å; F479-L482 WeakPolarHBondContact O-CB 3.44Å; F479-L482 PolarHBondContact O-N 3.1Å; F479-R483 WeakPolarHBondContact O-CB 3.3Å; F479-R483 PolarHBondContact O-N 3.3Å
480	N	68.1	Low	71.4	Confident	60 Å²	60	54.2 Å²	54.2	32%	0.321	26%	0.257	S	S	.	.	H	α-helix	trans	-61.5	-36.3	174.8	-71.2	-70.8	0	0	0	112.9	A474 H478 R483 E484	A474-N480 PolarHBondContact O-ND2 3.46Å; H478-N480 PolarHBondContact O-N 3.42Å; N480-R483 WeakPolarHBondContact O-CB 3.5Å; N480-R483 PolarHBondContact O-N 2.92Å; N480-E484 WeakPolarHBondContact O-CG 3.19Å; N480-E484 PolarHBondContact O-N 2.98Å
481	K	70.3	Confident	71.7	Confident	90 Å²	90	55 Å²	55	39%	0.391	26%	0.262	S	S	.	.	H	α-helix	trans	-70.8	-35.2	175	-71.8	-171.8	176.8	179.1	0	112.3	H478 F479 F485 V502	H478-K481 PolarHBondContact O-N 3.07Å; F479-K481 VanDerWaalsContact C-N 3.32Å; F479-K481 PolarHBondContact O-N 3.31Å; K481-F485 WeakPolarHBondContact O-CB 3.23Å; K481-F485 PolarHBondContact O-N 2.73Å; K481-F485 VanDerWaalsContact O-N 3.12Å; K481-V502 HydrophobicContact CD-CG1 4.4Å; K481-V502 HydrophobicContact CD-CG2 4.45Å; K481-V502 PolarHBondContact NZ-O 3.45Å
482	L	75.1	Confident	72.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64	-46.2	172	176.5	61.9	0	0	0	110.8	W231 L470 F479 F485 V486 L498 I500 V510	W231-L482 HydrophobicContact CH2-CB 3.96Å; W231-L482 HydrophobicContact CZ2-CB 4.37Å; W231-L482 HydrophobicContact CZ2-CD2 4.28Å; L470-L482 HydrophobicContact CD1-CD2 3.96Å; L470-L482 HydrophobicContact CD1-CG 4.1Å; L470-L482 HydrophobicContact CD2-CD2 4.3Å; F479-L482 HydrophobicContact CD1-CD2 4.17Å; F479-L482 WeakPolarHBondContact O-CB 3.44Å; F479-L482 PolarHBondContact O-N 3.1Å; L482-F485 PolarHBondContact O-N 3.06Å; L482-F485 VanDerWaalsContact O-N 3.16Å; L482-V486 HydrophobicContact CD1-CG1 3.88Å; L482-V486 HydrophobicContact CG-CG1 4.49Å; L482-V486 PolarHBondContact O-N 3.36Å; L482-L498 HydrophobicContact CD1-CD1 3.4Å; L482-L498 VanDerWaalsContact CD1-CD1 3.4Å; L482-I500 HydrophobicContact CB-CD1 4.4Å; L482-I500 HydrophobicContact CD1-CD1 4.04Å; L482-V510 HydrophobicContact CD1-CB 4.49Å; L482-V510 HydrophobicContact CD1-CG1 4.36Å; L482-V510 HydrophobicContact CD1-CG2 4.32Å; L482-V510 HydrophobicContact CD2-CG1 4.33Å
483	R	77.4	Confident	72.9	Confident	47 Å²	47	58.9 Å²	58.9	18%	0.177	30%	0.296	C	S	.	.	H	α-helix	trans	-55.6	-51.5	175.8	172.7	170.9	-168.2	-174.3	8.9	112.4	L467 E471 F479 N480 F485 V486 Q487	L467-R483 HydrophobicContact CD2-CB 4.29Å; L467-R483 HydrophobicContact CD2-CG 3.72Å; E471-R483 VanDerWaalsContact CD-CZ 3.45Å; E471-R483 IonicContact OE1-CZ 2.71Å; E471-R483 VanDerWaalsContact OE1-CZ 3.31Å; E471-R483 IonicContact OE1-NH1 3.98Å; E471-R483 PolarHBondContact OE1-NH1 3.3Å; E471-R483 IonicContact OE1-NH2 3.81Å; E471-R483 PolarHBondContact OE1-NH2 2.82Å; E471-R483 IonicContact OE2-CZ 2.7Å; E471-R483 IonicContact OE2-NH1 3.35Å; E471-R483 IonicContact OE2-NH2 3.64Å; E471-R483 PolarHBondContact OE2-NH2 3.4Å; F479-R483 WeakPolarHBondContact O-CB 3.3Å; F479-R483 PolarHBondContact O-N 3.3Å; N480-R483 WeakPolarHBondContact O-CB 3.5Å; N480-R483 PolarHBondContact O-N 2.92Å; R483-F485 VanDerWaalsContact C-N 3.27Å; R483-F485 PolarHBondContact O-N 3.37Å; R483-V486 PolarHBondContact O-N 3.14Å; R483-Q487 WeakPolarHBondContact O-CB 3.32Å; R483-Q487 VanDerWaalsContact O-CG 3.27Å; R483-Q487 WeakPolarHBondContact O-CG 3.39Å; R483-Q487 PolarHBondContact O-N 3.12Å
484	E	74.3	Confident	73.9	Confident	135 Å²	135	59 Å²	59	63%	0.631	30%	0.297	S	S	*	.	H	α-helix	trans	-59.5	-37.6	176.4	-74.1	178.1	178.8	0	0	112.1	N480	N480-E484 WeakPolarHBondContact O-CG 3.19Å; N480-E484 PolarHBondContact O-N 2.98Å
485	F	74.6	Confident	75.4	Confident	3 Å²	3	58.2 Å²	58.2	1%	0.013	29%	0.29	C	S	.	.	H	α-helix	trans	-73.4	-43.4	-179.3	-159.8	-73.2	0	0	0	112.7	L330 I453 K481 L482 R483 Q487 M488 L498 I500	L330-F485 HydrophobicContact CD2-CD2 3.9Å; L330-F485 HydrophobicContact CD2-CE2 4.22Å; I453-F485 HydrophobicContact CD1-CE1 4.48Å; K481-F485 WeakPolarHBondContact O-CB 3.23Å; K481-F485 PolarHBondContact O-N 2.73Å; K481-F485 VanDerWaalsContact O-N 3.12Å; L482-F485 PolarHBondContact O-N 3.06Å; L482-F485 VanDerWaalsContact O-N 3.16Å; R483-F485 VanDerWaalsContact C-N 3.27Å; R483-F485 PolarHBondContact O-N 3.37Å; F485-Q487 VanDerWaalsContact C-N 3.26Å; F485-Q487 PolarHBondContact O-N 2.76Å; F485-M488 HydrophobicContact CB-CE 4.44Å; F485-M488 HydrophobicContact CD1-CE 3.4Å; F485-M488 HydrophobicContact CD2-CE 3.68Å; F485-M488 HydrophobicContact CE1-CE 3.38Å; F485-M488 HydrophobicContact CE2-CE 3.68Å; F485-M488 HydrophobicContact CG-CE 3.57Å; F485-M488 HydrophobicContact CZ-CE 3.54Å; F485-M488 VanDerWaalsContact O-CB 3.29Å; F485-M488 WeakPolarHBondContact O-CB 3.37Å; F485-M488 WeakPolarHBondContact O-CE 3.5Å; F485-M488 VanDerWaalsContact O-CG 3.3Å; F485-M488 WeakPolarHBondContact O-CG 3.35Å; F485-M488 PolarHBondContact O-N 3.39Å; F485-M488 VanDerWaalsContact O-N 3.16Å; F485-L498 HydrophobicContact CD1-CD2 3.52Å; F485-L498 HydrophobicContact CE1-CD2 3.41Å; F485-L498 VanDerWaalsContact CE1-CD2 3.41Å; F485-L498 HydrophobicContact CZ-CD2 4.46Å; F485-I500 HydrophobicContact CB-CD1 4.07Å; F485-I500 HydrophobicContact CB-CG1 4.41Å; F485-I500 HydrophobicContact CD2-CB 4.29Å; F485-I500 HydrophobicContact CD2-CD1 4.41Å; F485-I500 HydrophobicContact CD2-CG1 3.83Å; F485-I500 HydrophobicContact CD2-CG2 4.02Å; F485-I500 HydrophobicContact CE2-CG1 4.19Å; F485-I500 HydrophobicContact CG-CD1 4.22Å; F485-I500 HydrophobicContact CG-CG1 4.04Å
486	V	76.8	Confident	77.2	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.024	27%	0.266	C	S	.	.	H	α-helix	trans	-75.3	-15	179.7	-55.6	0	0	0	0	113.5	I463 L467 L482 R483 M488 P495 L498	I463-V486 HydrophobicContact CG2-CB 4Å; I463-V486 HydrophobicContact CG2-CG2 4.01Å; L467-V486 HydrophobicContact CD2-CG2 3.73Å; L467-V486 HydrophobicContact CG-CG2 4.15Å; L482-V486 HydrophobicContact CD1-CG1 3.88Å; L482-V486 HydrophobicContact CG-CG1 4.49Å; L482-V486 PolarHBondContact O-N 3.36Å; R483-V486 PolarHBondContact O-N 3.14Å; V486-M488 PolarHBondContact O-N 2.69Å; V486-P495 HydrophobicContact CG1-CG 3.98Å; V486-L498 HydrophobicContact CG1-CD1 3.76Å
487	Q	75.2	Confident	78.8	Confident	110 Å²	110	55.6 Å²	55.6	51%	0.514	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-4.9	168.7	-74.9	177.9	-17.9	0	0	113.7	L467 R483 F485	L467-Q487 HydrophobicContact CD1-CG 3.77Å; L467-Q487 HydrophobicContact CD2-CG 3.94Å; R483-Q487 WeakPolarHBondContact O-CB 3.32Å; R483-Q487 VanDerWaalsContact O-CG 3.27Å; R483-Q487 WeakPolarHBondContact O-CG 3.39Å; R483-Q487 PolarHBondContact O-N 3.12Å; F485-Q487 VanDerWaalsContact C-N 3.26Å; F485-Q487 PolarHBondContact O-N 2.76Å
488	M	75.8	Confident	80.4	Confident	27 Å²	27	47.6 Å²	47.6	13%	0.133	24%	0.236	C	C	.	.	S	Bend	trans	-70.4	162.8	171.3	-62.6	-166.5	-61.2	0	0	111.7	L330 T332 I335 F485 V486 L490	L330-M488 HydrophobicContact CD2-SD 4.4Å; T332-M488 HydrophobicContact CG2-CG 3.99Å; T332-M488 HydrophobicContact CG2-SD 3.46Å; T332-M488 WeakPolarHBondContact CG2-SD 3.08Å; I335-M488 HydrophobicContact CD1-CE 4.31Å; I335-M488 HydrophobicContact CD1-SD 3.56Å; I335-M488 VanDerWaalsContact CD1-SD 3.56Å; F485-M488 HydrophobicContact CB-CE 4.44Å; F485-M488 HydrophobicContact CD1-CE 3.4Å; F485-M488 HydrophobicContact CD2-CE 3.68Å; F485-M488 HydrophobicContact CE1-CE 3.38Å; F485-M488 HydrophobicContact CE2-CE 3.68Å; F485-M488 HydrophobicContact CG-CE 3.57Å; F485-M488 HydrophobicContact CZ-CE 3.54Å; F485-M488 VanDerWaalsContact O-CB 3.29Å; F485-M488 WeakPolarHBondContact O-CB 3.37Å; F485-M488 WeakPolarHBondContact O-CE 3.5Å; F485-M488 VanDerWaalsContact O-CG 3.3Å; F485-M488 WeakPolarHBondContact O-CG 3.35Å; F485-M488 PolarHBondContact O-N 3.39Å; F485-M488 VanDerWaalsContact O-N 3.16Å; V486-M488 PolarHBondContact O-N 2.69Å; M488-L490 VanDerWaalsContact C-N 3.29Å; M488-L490 HydrophobicContact CB-CD2 4.06Å; M488-L490 HydrophobicContact CE-CD2 4.41Å; M488-L490 PolarHBondContact O-N 3.34Å
489	K	78.5	Confident	81.7	Confident	198 Å²	198	44.4 Å²	44.4	86%	0.861	22%	0.222	S	C	*	.			trans	-73.2	83	170.5	-67.4	-173.4	178.2	-176	0	110.4	F337	F337-K489 WeakPolarHBondContact CE2-O 3.11Å
490	L	85.6	Confident	82.1	Confident	28 Å²	28	44.2 Å²	44.2	15%	0.147	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-71.2	167.7	175.9	-51.9	-173.3	0	0	0	111.6	F337 I453 M455 I463 M488 P495	F337-L490 HydrophobicContact CZ-CD2 4.46Å; I453-L490 HydrophobicContact CD1-CD1 4.09Å; I453-L490 HydrophobicContact CD1-CD2 3.8Å; I453-L490 HydrophobicContact CD1-CG 4.35Å; M455-L490 HydrophobicContact CE-CB 4.16Å; M455-L490 HydrophobicContact CE-CD1 4.36Å; I463-L490 HydrophobicContact CD1-CD1 4.12Å; M488-L490 VanDerWaalsContact C-N 3.29Å; M488-L490 HydrophobicContact CB-CD2 4.06Å; M488-L490 HydrophobicContact CE-CD2 4.41Å; M488-L490 PolarHBondContact O-N 3.34Å; L490-P495 HydrophobicContact CD1-CB 3.87Å; L490-P495 HydrophobicContact CD1-CG 3.71Å
491	P	86.9	Confident	82.4	Confident	17 Å²	17	41.8 Å²	41.8	11%	0.11	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-62.9	171.8	165.4	-14.5	29.1	0	0	0	111.6	F337 Y362 M455	F337-P491 HydrophobicContact CB-CG 3.95Å; F337-P491 HydrophobicContact CD1-CG 3.74Å; F337-P491 HydrophobicContact CD2-CG 4.13Å; F337-P491 HydrophobicContact CE1-CG 4.26Å; F337-P491 HydrophobicContact CG-CG 3.66Å; Y362-P491 HydrophobicContact CD1-CG 4.23Å; Y362-P491 HydrophobicContact CD2-CB 4.39Å; Y362-P491 HydrophobicContact CD2-CG 4.04Å; Y362-P491 HydrophobicContact CE1-CB 4.24Å; Y362-P491 HydrophobicContact CE1-CG 4.38Å; Y362-P491 HydrophobicContact CE2-CB 4.05Å; Y362-P491 HydrophobicContact CE2-CG 4.21Å; Y362-P491 HydrophobicContact CG-CG 4.07Å; M455-P491 WeakPolarHBondContact CE-O 3.17Å; M455-P491 HydrophobicContact CG-CB 4.08Å; M455-P491 HydrophobicContact CG-CG 4.08Å
492	P	88.3	Confident	82.4	Confident	96 Å²	96	39 Å²	39	62%	0.623	20%	0.199	S	C	*	.	S	Bend	trans	-60.5	144	177.5	-23.1	34.4	0	0	0	113.2	Q457	Q457-P492 PolarHBondContact NE2-O 2.7Å
493	G	89.6	Confident	82.1	Confident	30 Å²	30	42.7 Å²	42.7	31%	0.309	22%	0.215	S	C	.	.	S	Bend	trans	102.1	-167.4	179.8	0	0	0	0	0	113.4	M455 S456	M455-G493 VanDerWaalsContact CE-C 3.45Å; M455-G493 WeakPolarHBondContact CE-O 3.45Å; S456-G493 CarbonylContact O-C 3.6Å; S456-G493 WeakPolarHBondContact O-CA 3.46Å
494	F	92.1	Very high	81.5	Confident	7 Å²	7	41.8 Å²	41.8	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	138.6	179.3	-177.2	-84.2	0	0	0	111.5	M455 S456 F459 L461 I463 L466 V496 F512	M455-F494 CarbonylContact C-O 3.6Å; M455-F494 WeakPolarHBondContact CA-O 3.33Å; S456-F494 PolarHBondContact N-O 2.73Å; S456-F494 PolarHBondContact O-N 3.36Å; F459-F494 HydrophobicContact CB-CB 3.58Å; F459-F494 HydrophobicContact CB-CD1 3.86Å; F459-F494 HydrophobicContact CB-CG 3.79Å; F459-F494 HydrophobicContact CD1-CB 4.17Å; F459-F494 AromaticContact CD1-CD1 3.41Å; F459-F494 HydrophobicContact CD1-CD1 3.41Å; F459-F494 VanDerWaalsContact CD1-CD1 3.41Å; F459-F494 AromaticContact CD1-CD2 3.59Å; F459-F494 HydrophobicContact CD1-CD2 3.59Å; F459-F494 AromaticContact CD1-CE1 3.53Å; F459-F494 HydrophobicContact CD1-CE1 3.53Å; F459-F494 AromaticContact CD1-CE2 3.68Å; F459-F494 HydrophobicContact CD1-CE2 3.68Å; F459-F494 AromaticContact CD1-CG 3.44Å; F459-F494 HydrophobicContact CD1-CG 3.44Å; F459-F494 VanDerWaalsContact CD1-CG 3.44Å; F459-F494 AromaticContact CD1-CZ 3.63Å; F459-F494 HydrophobicContact CD1-CZ 3.63Å; F459-F494 AromaticContact CD2-CD1 3.86Å; F459-F494 HydrophobicContact CD2-CD1 3.86Å; F459-F494 HydrophobicContact CD2-CE1 4.03Å; F459-F494 AromaticContact CE1-CD1 3.87Å; F459-F494 HydrophobicContact CE1-CD1 3.87Å; F459-F494 HydrophobicContact CE1-CD2 4.1Å; F459-F494 AromaticContact CE1-CE1 3.43Å; F459-F494 HydrophobicContact CE1-CE1 3.43Å; F459-F494 VanDerWaalsContact CE1-CE1 3.43Å; F459-F494 AromaticContact CE1-CE2 3.67Å; F459-F494 HydrophobicContact CE1-CE2 3.67Å; F459-F494 HydrophobicContact CE1-CG 4.17Å; F459-F494 AromaticContact CE1-CZ 3.3Å; F459-F494 HydrophobicContact CE1-CZ 3.3Å; F459-F494 HydrophobicContact CE2-CD1 4.26Å; F459-F494 AromaticContact CE2-CE1 3.95Å; F459-F494 HydrophobicContact CE2-CE1 3.95Å; F459-F494 HydrophobicContact CG-CB 4.07Å; F459-F494 AromaticContact CG-CD1 3.42Å; F459-F494 HydrophobicContact CG-CD1 3.42Å; F459-F494 VanDerWaalsContact CG-CD1 3.42Å; F459-F494 HydrophobicContact CG-CD2 4.3Å; F459-F494 AromaticContact CG-CE1 3.84Å; F459-F494 HydrophobicContact CG-CE1 3.84Å; F459-F494 AromaticContact CG-CG 3.68Å; F459-F494 HydrophobicContact CG-CG 3.68Å; F459-F494 HydrophobicContact CG-CZ 4.4Å; F459-F494 HydrophobicContact CZ-CD1 4.27Å; F459-F494 AromaticContact CZ-CE1 3.66Å; F459-F494 HydrophobicContact CZ-CE1 3.66Å; F459-F494 AromaticContact CZ-CZ 3.83Å; F459-F494 HydrophobicContact CZ-CZ 3.83Å; L461-F494 WeakPolarHBondContact O-CD2 3.4Å; I463-F494 HydrophobicContact CG1-CD2 3.99Å; L466-F494 HydrophobicContact CB-CE2 4.32Å; L466-F494 HydrophobicContact CD2-CE2 4Å; L466-F494 HydrophobicContact CD2-CZ 3.82Å; F494-V496 HydrophobicContact CD1-CG1 3.85Å; F494-V496 HydrophobicContact CE1-CG1 4.41Å; F494-V496 PolarHBondContact O-N 2.59Å; F494-V496 VanDerWaalsContact O-N 3.07Å; F494-F512 AromaticContact CE1-CD1 3.69Å; F494-F512 HydrophobicContact CE1-CD1 3.69Å; F494-F512 HydrophobicContact CE1-CD2 4.06Å; F494-F512 AromaticContact CE1-CE1 3.81Å; F494-F512 HydrophobicContact CE1-CE1 3.81Å; F494-F512 HydrophobicContact CE1-CE2 4.15Å; F494-F512 AromaticContact CE1-CG 3.86Å; F494-F512 HydrophobicContact CE1-CG 3.86Å; F494-F512 HydrophobicContact CE1-CZ 4.04Å; F494-F512 AromaticContact CZ-CD1 3.89Å; F494-F512 HydrophobicContact CZ-CD1 3.89Å; F494-F512 AromaticContact CZ-CE1 3.61Å; F494-F512 HydrophobicContact CZ-CE1 3.61Å; F494-F512 HydrophobicContact CZ-CG 4.49Å; F494-F512 AromaticContact CZ-CZ 3.95Å; F494-F512 HydrophobicContact CZ-CZ 3.95Å
495	P	92.6	Very high	81.3	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	85.6	-174.7	33.9	-37.2	0	0	0	113.1	I453 A454 M455 V486 L490 K497 L498 F512	I453-P495 HydrophobicContact CD1-CB 4.08Å; I453-P495 HydrophobicContact CG1-CB 4.29Å; A454-P495 CarbonylContact O-C 3.58Å; A454-P495 WeakPolarHBondContact O-CA 3.42Å; M455-P495 HydrophobicContact CE-CB 4.15Å; M455-P495 HydrophobicContact SD-CB 3.84Å; V486-P495 HydrophobicContact CG1-CG 3.98Å; L490-P495 HydrophobicContact CD1-CB 3.87Å; L490-P495 HydrophobicContact CD1-CG 3.71Å; P495-K497 VanDerWaalsContact C-N 3.32Å; P495-K497 PolarHBondContact O-N 2.86Å; P495-L498 HydrophobicContact CB-CD1 4.04Å; P495-L498 HydrophobicContact CB-CD2 3.76Å; P495-L498 HydrophobicContact CB-CG 3.9Å; P495-L498 HydrophobicContact CG-CD1 4.18Å; P495-L498 HydrophobicContact CG-CD2 4.5Å; P495-F512 VanDerWaalsContact O-CD2 3.29Å; P495-F512 WeakPolarHBondContact O-CD2 3.33Å; P495-F512 VanDerWaalsContact O-CE2 3.29Å; P495-F512 WeakPolarHBondContact O-CE2 3.48Å
496	V	93.7	Very high	81.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	-17.2	179.5	-62.7	0	0	0	0	114.3	V354 F357 A359 A454 F459 F494 T511 F512	V354-V496 HydrophobicContact CB-CB 4.44Å; V354-V496 HydrophobicContact CB-CG2 3.92Å; V354-V496 HydrophobicContact CG1-CB 4.35Å; V354-V496 HydrophobicContact CG1-CG2 4.29Å; V354-V496 WeakPolarHBondContact CG1-O 3.5Å; V354-V496 HydrophobicContact CG2-CG2 4.33Å; F357-V496 HydrophobicContact CB-CG1 4.05Å; F357-V496 HydrophobicContact CD2-CG1 3.98Å; F357-V496 HydrophobicContact CG-CG1 4.01Å; A359-V496 HydrophobicContact CB-CG2 3.48Å; A359-V496 VanDerWaalsContact CB-CG2 3.48Å; A454-V496 HydrophobicContact CB-CG2 4.37Å; A454-V496 WeakPolarHBondContact O-CG2 3.33Å; A454-V496 PolarHBondContact O-N 2.94Å; F459-V496 HydrophobicContact CB-CG1 4.41Å; F459-V496 HydrophobicContact CD2-CG1 3.65Å; F459-V496 HydrophobicContact CE2-CG1 4.29Å; F459-V496 HydrophobicContact CG-CG1 4.29Å; F494-V496 HydrophobicContact CD1-CG1 3.85Å; F494-V496 HydrophobicContact CE1-CG1 4.41Å; F494-V496 PolarHBondContact O-N 2.59Å; F494-V496 VanDerWaalsContact O-N 3.07Å; V496-T511 CarbonylContact O-C 3.59Å; V496-T511 WeakPolarHBondContact O-CA 3.35Å; V496-F512 HydrophobicContact CB-CB 4.34Å; V496-F512 HydrophobicContact CG1-CB 4.49Å; V496-F512 PolarHBondContact O-N 2.85Å
497	K	93.9	Very high	81.6	Confident	51 Å²	51	39.6 Å²	39.6	22%	0.222	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	139.3	164	175.2	168.4	167.5	147.6	0	111.7	V354 I453 A454 P495 D499 T509 V510 T511	V354-K497 HydrophobicContact CG1-CB 4.17Å; V354-K497 HydrophobicContact CG2-CB 4.24Å; I453-K497 WeakPolarHBondContact CA-O 3.4Å; I453-K497 WeakPolarHBondContact CG1-O 3.36Å; A454-K497 HydrophobicContact CB-CB 3.8Å; A454-K497 PolarHBondContact N-O 2.99Å; A454-K497 PolarHBondContact O-N 2.85Å; P495-K497 VanDerWaalsContact C-N 3.32Å; P495-K497 PolarHBondContact O-N 2.86Å; K497-D499 WeakPolarHBondContact CE-OD1 3.45Å; K497-D499 IonicContact NZ-OD1 3.24Å; K497-T509 HydrophobicContact CD-CG2 4.26Å; K497-T509 VanDerWaalsContact CE-CG2 3.48Å; K497-T509 HydrophobicContact CG-CG2 4.37Å; K497-T509 VanDerWaalsContact NZ-CG2 3.34Å; K497-V510 CarbonylContact C-O 3.59Å; K497-V510 WeakPolarHBondContact CA-O 3.1Å; K497-T511 HydrophobicContact CB-CG2 4Å; K497-T511 HydrophobicContact CD-CG2 3.86Å; K497-T511 HydrophobicContact CG-CG2 3.79Å
498	L	89.8	Confident	82.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	120.7	-177.1	-69.5	160.5	0	0	0	111.6	I453 L482 F485 V486 P495 I500 T509 V510 F512	I453-L498 HydrophobicContact CD1-CD2 3.59Å; I453-L498 HydrophobicContact CG1-CD2 3.8Å; L482-L498 HydrophobicContact CD1-CD1 3.4Å; L482-L498 VanDerWaalsContact CD1-CD1 3.4Å; F485-L498 HydrophobicContact CD1-CD2 3.52Å; F485-L498 HydrophobicContact CE1-CD2 3.41Å; F485-L498 VanDerWaalsContact CE1-CD2 3.41Å; F485-L498 HydrophobicContact CZ-CD2 4.46Å; V486-L498 HydrophobicContact CG1-CD1 3.76Å; P495-L498 HydrophobicContact CB-CD1 4.04Å; P495-L498 HydrophobicContact CB-CD2 3.76Å; P495-L498 HydrophobicContact CB-CG 3.9Å; P495-L498 HydrophobicContact CG-CD1 4.18Å; P495-L498 HydrophobicContact CG-CD2 4.5Å; L498-I500 HydrophobicContact CB-CD1 4.46Å; L498-I500 HydrophobicContact CB-CG1 4.2Å; L498-T509 CarbonylContact O-C 3.32Å; L498-T509 WeakPolarHBondContact O-CA 3.49Å; L498-V510 HydrophobicContact CB-CB 4.32Å; L498-V510 PolarHBondContact N-O 2.78Å; L498-V510 PolarHBondContact O-N 3.25Å; L498-F512 HydrophobicContact CD1-CE2 4.33Å
499	D	87.6	Confident	82.7	Confident	20 Å²	20	33.5 Å²	33.5	11%	0.107	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	104.7	168.9	-56.7	-14.8	0	0	0	109.7	A451 T452 K497 T507	A451-D499 HydrophobicContact CB-CB 4.02Å; A451-D499 VanDerWaalsContact CB-O 3.31Å; A451-D499 WeakPolarHBondContact CB-O 3.09Å; T452-D499 WeakPolarHBondContact CA-OD2 3.12Å; T452-D499 WeakPolarHBondContact CB-OD2 3.39Å; T452-D499 PolarHBondContact N-OD2 3.08Å; T452-D499 PolarHBondContact O-N 3.38Å; T452-D499 PolarHBondContact OG1-OD2 3.11Å; K497-D499 WeakPolarHBondContact CE-OD1 3.45Å; K497-D499 IonicContact NZ-OD1 3.24Å; D499-T507 HydrophobicContact CB-CG2 4.08Å
500	I	78.3	Confident	83.3	Confident	5 Å²	5	24.1 Å²	24.1	3%	0.026	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	120.6	-173.9	-55.2	-177.9	0	0	0	110.8	L482 F485 L498 V502 T507 A508 V510	L482-I500 HydrophobicContact CB-CD1 4.4Å; L482-I500 HydrophobicContact CD1-CD1 4.04Å; F485-I500 HydrophobicContact CB-CD1 4.07Å; F485-I500 HydrophobicContact CB-CG1 4.41Å; F485-I500 HydrophobicContact CD2-CB 4.29Å; F485-I500 HydrophobicContact CD2-CD1 4.41Å; F485-I500 HydrophobicContact CD2-CG1 3.83Å; F485-I500 HydrophobicContact CD2-CG2 4.02Å; F485-I500 HydrophobicContact CE2-CG1 4.19Å; F485-I500 HydrophobicContact CG-CD1 4.22Å; F485-I500 HydrophobicContact CG-CG1 4.04Å; L498-I500 HydrophobicContact CB-CD1 4.46Å; L498-I500 HydrophobicContact CB-CG1 4.2Å; I500-V502 PolarHBondContact O-N 2.91Å; I500-V502 VanDerWaalsContact O-N 3.14Å; I500-T507 CarbonylContact O-C 3.51Å; I500-T507 WeakPolarHBondContact O-CA 3.28Å; I500-T507 WeakPolarHBondContact O-CG2 3.49Å; I500-A508 PolarHBondContact N-O 3.32Å; I500-A508 PolarHBondContact O-N 3.18Å; I500-V510 HydrophobicContact CD1-CG2 4.04Å
501	P	74.5	Confident	83.6	Confident	9 Å²	9	23.7 Å²	23.7	6%	0.058	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	107.3	175.2	29.8	-34.1	0	0	0	110.9	L330 L367 F449	L330-P501 HydrophobicContact CD1-CG 3.68Å; L367-P501 HydrophobicContact CD2-CG 4.16Å; F449-P501 HydrophobicContact CB-CB 4.33Å; F449-P501 HydrophobicContact CD1-CB 3.57Å; F449-P501 HydrophobicContact CD2-CB 3.8Å; F449-P501 HydrophobicContact CD2-CG 4.36Å; F449-P501 HydrophobicContact CE1-CB 3.65Å; F449-P501 HydrophobicContact CE2-CB 3.91Å; F449-P501 HydrophobicContact CG-CB 3.62Å; F449-P501 HydrophobicContact CG-CG 4.23Å; F449-P501 HydrophobicContact CZ-CB 3.82Å
502	V	70.7	Confident	83.9	Confident	33 Å²	33	22.9 Å²	22.9	20%	0.2	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-35.4	-176.6	175.4	0	0	0	0	111.6	F233 K481 I500 I506 A508	F233-V502 HydrophobicContact CE1-CG1 4.47Å; F233-V502 HydrophobicContact CE1-CG2 4.26Å; K481-V502 HydrophobicContact CD-CG1 4.4Å; K481-V502 HydrophobicContact CD-CG2 4.45Å; K481-V502 PolarHBondContact NZ-O 3.45Å; I500-V502 PolarHBondContact O-N 2.91Å; I500-V502 VanDerWaalsContact O-N 3.14Å; V502-I506 PolarHBondContact N-O 2.86Å; V502-A508 HydrophobicContact CG2-CB 3.46Å; V502-A508 VanDerWaalsContact CG2-CB 3.46Å
503	F	67.6	Low	84.1	Confident	76 Å²	76	20.9 Å²	20.9	33%	0.333	12%	0.117	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	160.2	-178.5	-160.8	-110.8	0	0	0	110.1	Y326 T505 I506	Y326-F503 HydrophobicContact CE1-CE2 4.2Å; F503-T505 PolarHBondContact O-N 3.46Å; F503-I506 HydrophobicContact CB-CB 4.13Å; F503-I506 HydrophobicContact CB-CD1 4.45Å; F503-I506 PolarHBondContact N-O 3.34Å; F503-I506 PolarHBondContact O-N 2.72Å; F503-I506 VanDerWaalsContact O-O 3.08Å
504	P	66.2	Low	84.3	Confident	28 Å²	28	21.9 Å²	21.9	18%	0.182	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-20.3	177.6	-33.8	39	0	0	0	117	L369 K447	L369-P504 HydrophobicContact CD2-CG 4.39Å; K447-P504 WeakPolarHBondContact CD-O 3.33Å; K447-P504 WeakPolarHBondContact CE-O 3.42Å; K447-P504 PolarHBondContact NZ-O 2.73Å
505	T	70.1	Confident	84.4	Confident	36 Å²	36	22.2 Å²	22.2	22%	0.221	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-16.4	174.6	48.3	0	0	0	0	114.9	S235 W236 V237 F503	S235-T505 WeakPolarHBondContact CA-O 3.38Å; S235-T505 PolarHBondContact OG-O 3.16Å; W236-T505 HydrophobicContact CZ2-CG2 4.11Å; V237-T505 HydrophobicContact CG2-CG2 3.81Å; F503-T505 PolarHBondContact O-N 3.46Å
506	I	75.6	Confident	84.5	Confident	26 Å²	26	27.2 Å²	27.2	13%	0.133	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.7	-166.3	-57.1	164.6	0	0	0	111.3	F233 Q234 L244 V502 F503	F233-I506 HydrophobicContact CB-CG2 4.38Å; F233-I506 HydrophobicContact CD1-CG2 4.14Å; Q234-I506 WeakPolarHBondContact O-CA 3.45Å; L244-I506 HydrophobicContact CD1-CG1 4.19Å; L244-I506 HydrophobicContact CD1-CG2 4.1Å; L244-I506 HydrophobicContact CD2-CD1 3.85Å; L244-I506 HydrophobicContact CD2-CG1 4.28Å; L244-I506 HydrophobicContact CD2-CG2 4.3Å; V502-I506 PolarHBondContact N-O 2.86Å; F503-I506 HydrophobicContact CB-CB 4.13Å; F503-I506 HydrophobicContact CB-CD1 4.45Å; F503-I506 PolarHBondContact N-O 3.34Å; F503-I506 PolarHBondContact O-N 2.72Å; F503-I506 VanDerWaalsContact O-O 3.08Å
507	T	81.3	Confident	84.5	Confident	35 Å²	35	33.4 Å²	33.4	22%	0.215	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	130	170.9	-58.7	0	0	0	0	108.7	Q234 D499 I500	Q234-T507 PolarHBondContact N-O 3.07Å; Q234-T507 PolarHBondContact O-N 2.99Å; D499-T507 HydrophobicContact CB-CG2 4.08Å; I500-T507 CarbonylContact O-C 3.51Å; I500-T507 WeakPolarHBondContact O-CA 3.28Å; I500-T507 WeakPolarHBondContact O-CG2 3.49Å
508	A	85	Confident	84.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	127	167.3	0	0	0	0	0	109.7	W231 F233 I500 V502	W231-A508 HydrophobicContact CE3-CB 4.15Å; W231-A508 HydrophobicContact CZ3-CB 4.29Å; F233-A508 HydrophobicContact CD1-CB 3.8Å; F233-A508 HydrophobicContact CD2-CB 4.41Å; F233-A508 HydrophobicContact CE1-CB 3.72Å; F233-A508 HydrophobicContact CE2-CB 4.35Å; F233-A508 HydrophobicContact CG-CB 4.16Å; F233-A508 HydrophobicContact CZ-CB 4.01Å; I500-A508 PolarHBondContact N-O 3.32Å; I500-A508 PolarHBondContact O-N 3.18Å; V502-A508 HydrophobicContact CG2-CB 3.46Å; V502-A508 VanDerWaalsContact CG2-CB 3.46Å
509	T	89.4	Confident	84.6	Confident	9 Å²	9	41.6 Å²	41.6	6%	0.055	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.2	171.1	-50.2	0	0	0	0	108.2	W231 D232 K497 L498 T511	W231-T509 CarbonylContact C-O 3.59Å; W231-T509 WeakPolarHBondContact CA-O 3.01Å; D232-T509 PolarHBondContact N-O 3.35Å; D232-T509 WeakPolarHBondContact O-CB 3.33Å; D232-T509 PolarHBondContact O-N 3.32Å; D232-T509 PolarHBondContact O-OG1 2.98Å; K497-T509 HydrophobicContact CD-CG2 4.26Å; K497-T509 VanDerWaalsContact CE-CG2 3.48Å; K497-T509 HydrophobicContact CG-CG2 4.37Å; K497-T509 VanDerWaalsContact NZ-CG2 3.34Å; L498-T509 CarbonylContact O-C 3.32Å; L498-T509 WeakPolarHBondContact O-CA 3.49Å; T509-T511 HydrophobicContact CG2-CG2 4.29Å
510	V	90.5	Very high	84.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	134.2	169.6	-170.8	0	0	0	0	108.5	H230 W231 L482 K497 L498 I500 F512	H230-V510 WeakPolarHBondContact O-CA 3.38Å; W231-V510 HydrophobicContact CD2-CG2 3.95Å; W231-V510 HydrophobicContact CE3-CG2 3.56Å; W231-V510 HydrophobicContact CH2-CG2 3.84Å; W231-V510 HydrophobicContact CZ2-CG2 4.21Å; W231-V510 HydrophobicContact CZ3-CG2 3.5Å; W231-V510 VanDerWaalsContact CZ3-CG2 3.5Å; L482-V510 HydrophobicContact CD1-CB 4.49Å; L482-V510 HydrophobicContact CD1-CG1 4.36Å; L482-V510 HydrophobicContact CD1-CG2 4.32Å; L482-V510 HydrophobicContact CD2-CG1 4.33Å; K497-V510 CarbonylContact C-O 3.59Å; K497-V510 WeakPolarHBondContact CA-O 3.1Å; L498-V510 HydrophobicContact CB-CB 4.32Å; L498-V510 PolarHBondContact N-O 2.78Å; L498-V510 PolarHBondContact O-N 3.25Å; I500-V510 HydrophobicContact CD1-CG2 4.04Å; V510-F512 HydrophobicContact CG1-CE2 4.22Å
511	T	92.9	Very high	85.6	Confident	20 Å²	20	47.3 Å²	47.3	12%	0.123	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	131.5	176.2	45.1	0	0	0	0	111.1	L229 H230 V354 V496 K497 T509 Q513	L229-T511 CarbonylContact C-O 3.59Å; L229-T511 WeakPolarHBondContact CA-O 3.05Å; H230-T511 PolarHBondContact N-O 3.5Å; H230-T511 PolarHBondContact O-N 2.78Å; H230-T511 PolarHBondContact O-OG1 3.35Å; V354-T511 HydrophobicContact CG1-CG2 4.22Å; V496-T511 CarbonylContact O-C 3.59Å; V496-T511 WeakPolarHBondContact O-CA 3.35Å; K497-T511 HydrophobicContact CB-CG2 4Å; K497-T511 HydrophobicContact CD-CG2 3.86Å; K497-T511 HydrophobicContact CG-CG2 3.79Å; T509-T511 HydrophobicContact CG2-CG2 4.29Å; T511-Q513 PolarHBondContact OG1-NE2 3.27Å
512	F	93	Very high	86.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	109.4	174.4	-66.3	-106.2	0	0	0	107.4	L227 L229 F459 L466 F494 P495 V496 L498 V510	L227-F512 HydrophobicContact CD1-CD1 3.71Å; L227-F512 HydrophobicContact CD1-CE1 4.29Å; L229-F512 HydrophobicContact CD2-CE1 4.49Å; F459-F512 HydrophobicContact CE2-CB 4.03Å; F459-F512 HydrophobicContact CE2-CD1 4.35Å; F459-F512 HydrophobicContact CZ-CB 4.46Å; F459-F512 AromaticContact CZ-CD1 3.94Å; F459-F512 HydrophobicContact CZ-CD1 3.94Å; L466-F512 HydrophobicContact CD1-CE1 4.21Å; L466-F512 HydrophobicContact CD2-CE1 4.04Å; L466-F512 HydrophobicContact CD2-CZ 3.89Å; F494-F512 AromaticContact CE1-CD1 3.69Å; F494-F512 HydrophobicContact CE1-CD1 3.69Å; F494-F512 HydrophobicContact CE1-CD2 4.06Å; F494-F512 AromaticContact CE1-CE1 3.81Å; F494-F512 HydrophobicContact CE1-CE1 3.81Å; F494-F512 HydrophobicContact CE1-CE2 4.15Å; F494-F512 AromaticContact CE1-CG 3.86Å; F494-F512 HydrophobicContact CE1-CG 3.86Å; F494-F512 HydrophobicContact CE1-CZ 4.04Å; F494-F512 AromaticContact CZ-CD1 3.89Å; F494-F512 HydrophobicContact CZ-CD1 3.89Å; F494-F512 AromaticContact CZ-CE1 3.61Å; F494-F512 HydrophobicContact CZ-CE1 3.61Å; F494-F512 HydrophobicContact CZ-CG 4.49Å; F494-F512 AromaticContact CZ-CZ 3.95Å; F494-F512 HydrophobicContact CZ-CZ 3.95Å; P495-F512 VanDerWaalsContact O-CD2 3.29Å; P495-F512 WeakPolarHBondContact O-CD2 3.33Å; P495-F512 VanDerWaalsContact O-CE2 3.29Å; P495-F512 WeakPolarHBondContact O-CE2 3.48Å; V496-F512 HydrophobicContact CB-CB 4.34Å; V496-F512 HydrophobicContact CG1-CB 4.49Å; V496-F512 PolarHBondContact O-N 2.85Å; L498-F512 HydrophobicContact CD1-CE2 4.33Å; V510-F512 HydrophobicContact CG1-CE2 4.22Å
513	Q	92.6	Very high	87.4	Confident	53 Å²	53	49.7 Å²	49.7	25%	0.248	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-48.4	-171.3	-62.9	-65	-12.1	0	0	111.4	E228 H230 G355 N356 T511	E228-Q513 HydrophobicContact CG-CB 4.49Å; E228-Q513 PolarHBondContact O-N 2.86Å; H230-Q513 HydrophobicContact CB-CG 4.44Å; G355-Q513 WeakPolarHBondContact CA-O 3.36Å; N356-Q513 PolarHBondContact N-O 3.09Å; T511-Q513 PolarHBondContact OG1-NE2 3.27Å
514	E	93.8	Very high	88.7	Confident	52 Å²	52	48.1 Å²	48.1	24%	0.243	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	144.1	179.4	-174.7	173.1	171.4	0	0	110.8	Y226 L227 E228 R516	Y226-E514 HydrophobicContact CD1-CG 4.2Å; Y226-E514 HydrophobicContact CE1-CB 4.3Å; Y226-E514 HydrophobicContact CE1-CG 4.25Å; L227-E514 WeakPolarHBondContact CA-O 3.37Å; E228-E514 HydrophobicContact CB-CB 4.24Å; E228-E514 PolarHBondContact N-O 3.45Å; E228-E514 PolarHBondContact O-N 3.07Å; E514-R516 WeakPolarHBondContact OE1-CD 3.39Å; E514-R516 IonicContact OE1-CZ 4Å; E514-R516 IonicContact OE1-NE 2.69Å; E514-R516 IonicContact OE1-NH1 2.78Å; E514-R516 PolarHBondContact OE1-NH1 3.07Å; E514-R516 IonicContact OE2-NH1 3.49Å
515	F	94.2	Very high	90.1	Very high	14 Å²	14	47.2 Å²	47.2	6%	0.061	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	135.5	163.5	176.8	-80.5	0	0	0	107.6	F225 Y226 L227 F357 F459 P460 L461 Y517	F225-F515 HydrophobicContact CB-CE2 3.83Å; F225-F515 HydrophobicContact CB-CZ 3.7Å; F225-F515 HydrophobicContact CD1-CE2 4.38Å; F225-F515 HydrophobicContact CD2-CD2 4.03Å; F225-F515 AromaticContact CD2-CE2 3.44Å; F225-F515 HydrophobicContact CD2-CE2 3.44Å; F225-F515 VanDerWaalsContact CD2-CE2 3.44Å; F225-F515 HydrophobicContact CD2-CZ 4.21Å; F225-F515 HydrophobicContact CE2-CE2 4.12Å; F225-F515 AromaticContact CG-CE2 3.62Å; F225-F515 HydrophobicContact CG-CE2 3.62Å; F225-F515 AromaticContact CG-CZ 3.93Å; F225-F515 HydrophobicContact CG-CZ 3.93Å; Y226-F515 WeakPolarHBondContact O-CA 3.13Å; L227-F515 HydrophobicContact CB-CD2 4.22Å; F357-F515 HydrophobicContact CZ-CB 3.85Å; F459-F515 HydrophobicContact CE1-CB 4.42Å; F459-F515 HydrophobicContact CE1-CD2 4.22Å; F459-F515 HydrophobicContact CE1-CG 4.33Å; F459-F515 HydrophobicContact CE2-CB 3.81Å; F459-F515 HydrophobicContact CZ-CB 3.66Å; F459-F515 HydrophobicContact CZ-CD2 4.05Å; F459-F515 HydrophobicContact CZ-CG 4.02Å; P460-F515 HydrophobicContact CB-CD1 4.01Å; P460-F515 HydrophobicContact CB-CE1 3.76Å; P460-F515 HydrophobicContact CG-CD1 3.74Å; P460-F515 HydrophobicContact CG-CE1 3.99Å; L461-F515 HydrophobicContact CB-CE2 4.18Å; L461-F515 HydrophobicContact CB-CZ 4.33Å; L461-F515 HydrophobicContact CD1-CE2 4.43Å; L461-F515 HydrophobicContact CD1-CZ 4.37Å; L461-F515 HydrophobicContact CD2-CE2 4.11Å; L461-F515 HydrophobicContact CG-CE2 4.48Å; F515-Y517 HydrophobicContact CE1-CD1 4.34Å; F515-Y517 HydrophobicContact CE1-CD2 4.12Å; F515-Y517 HydrophobicContact CE1-CE1 4.11Å; F515-Y517 AromaticContact CE1-CE2 3.88Å; F515-Y517 HydrophobicContact CE1-CE2 3.88Å; F515-Y517 HydrophobicContact CE1-CG 4.33Å; F515-Y517 AromaticContact CE1-CZ 3.87Å; F515-Y517 HydrophobicContact CZ-CD1 4.23Å; F515-Y517 AromaticContact CZ-CE1 3.84Å; F515-Y517 HydrophobicContact CZ-CE1 3.84Å; F515-Y517 HydrophobicContact CZ-CE2 4.4Å; F515-Y517 AromaticContact CZ-CZ 3.93Å
516	R	93.9	Very high	91.2	Very high	104 Å²	104	49 Å²	49	39%	0.392	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	144	168.8	58.9	179.1	-162.1	-103.2	-3.9	110.4	F225 Y226 E514 D518	F225-R516 CarbonylContact C-O 3.45Å; F225-R516 VanDerWaalsContact CA-O 3.28Å; F225-R516 WeakPolarHBondContact CA-O 3.36Å; F225-R516 WeakPolarHBondContact CB-O 3.26Å; Y226-R516 HydrophobicContact CD1-CG 4.43Å; Y226-R516 PolarHBondContact N-O 3.25Å; Y226-R516 PolarHBondContact O-N 2.86Å; E514-R516 WeakPolarHBondContact OE1-CD 3.39Å; E514-R516 IonicContact OE1-CZ 4Å; E514-R516 IonicContact OE1-NE 2.69Å; E514-R516 IonicContact OE1-NH1 2.78Å; E514-R516 PolarHBondContact OE1-NH1 3.07Å; E514-R516 IonicContact OE2-NH1 3.49Å; R516-D518 HydrophobicContact CG-CB 4.36Å; R516-D518 IonicContact CZ-OD2 3.44Å; R516-D518 IonicContact NE-OD2 2.68Å; R516-D518 PolarHBondContact NE-OD2 3.21Å; R516-D518 IonicContact NH2-OD2 3.49Å; R516-D518 PolarHBondContact NH2-OD2 3.37Å
517	Y	94.2	Very high	92.1	Very high	131 Å²	131	49.9 Å²	49.9	51%	0.514	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	133.8	162.4	-64.3	-70.9	0	0	0	108.1	D224 F225 P460 F515	D224-Y517 WeakPolarHBondContact O-CA 3.49Å; D224-Y517 WeakPolarHBondContact O-CD1 3.2Å; F225-Y517 HydrophobicContact CB-CD1 4.18Å; P460-Y517 HydrophobicContact CB-CE2 3.79Å; P460-Y517 PolarHBondContact O-OH 2.7Å; F515-Y517 HydrophobicContact CE1-CD1 4.34Å; F515-Y517 HydrophobicContact CE1-CD2 4.12Å; F515-Y517 HydrophobicContact CE1-CE1 4.11Å; F515-Y517 AromaticContact CE1-CE2 3.88Å; F515-Y517 HydrophobicContact CE1-CE2 3.88Å; F515-Y517 HydrophobicContact CE1-CG 4.33Å; F515-Y517 AromaticContact CE1-CZ 3.87Å; F515-Y517 HydrophobicContact CZ-CD1 4.23Å; F515-Y517 AromaticContact CZ-CE1 3.84Å; F515-Y517 HydrophobicContact CZ-CE1 3.84Å; F515-Y517 HydrophobicContact CZ-CE2 4.4Å; F515-Y517 AromaticContact CZ-CZ 3.93Å
518	D	93.4	Very high	92.7	Very high	51 Å²	51	50.5 Å²	50.5	27%	0.273	26%	0.261	S	S	.	.			trans	-157.1	154.4	-168.2	-151.8	-2	0	0	0	110.1	D224 R516 F520	D224-D518 CarbonylContact C-O 3.44Å; D224-D518 PolarHBondContact O-N 2.89Å; D224-D518 VanDerWaalsContact O-N 3.12Å; R516-D518 HydrophobicContact CG-CB 4.36Å; R516-D518 IonicContact CZ-OD2 3.44Å; R516-D518 IonicContact NE-OD2 2.68Å; R516-D518 PolarHBondContact NE-OD2 3.21Å; R516-D518 IonicContact NH2-OD2 3.49Å; R516-D518 PolarHBondContact NH2-OD2 3.37Å; D518-F520 HydrophobicContact CB-CE1 3.87Å; D518-F520 HydrophobicContact CB-CZ 3.78Å
519	E	92.3	Very high	93.2	Very high	171 Å²	171	59 Å²	59	80%	0.799	31%	0.306	S	S	*	.			trans	-113.9	137	175.8	-72.8	-177.2	-167.6	0	0	109.8
520	F	94.2	Very high	93.5	Very high	32 Å²	32	62.8 Å²	62.8	14%	0.14	33%	0.326	C	S	.	.			trans	-117.6	157.3	-173.4	-51.9	-62.3	0	0	0	111.6	F225 Y252 Q254 D518 G522 I524 F525	F225-F520 WeakPolarHBondContact O-CE2 2.97Å; F225-F520 WeakPolarHBondContact O-CZ 3.16Å; Y252-F520 HydrophobicContact CD1-CD1 4.15Å; Y252-F520 AromaticContact CD1-CE1 3.74Å; Y252-F520 HydrophobicContact CD1-CE1 3.74Å; Y252-F520 HydrophobicContact CD1-CE2 4.5Å; Y252-F520 AromaticContact CD1-CZ 3.92Å; Y252-F520 HydrophobicContact CD1-CZ 3.92Å; Y252-F520 HydrophobicContact CE1-CE1 4.42Å; Q254-F520 HydrophobicContact CB-CD2 4.36Å; Q254-F520 PolarHBondContact NE2-O 3.19Å; D518-F520 HydrophobicContact CB-CE1 3.87Å; D518-F520 HydrophobicContact CB-CZ 3.78Å; F520-G522 PolarHBondContact O-N 3.08Å; F520-I524 HydrophobicContact CB-CD1 3.88Å; F520-I524 HydrophobicContact CB-CG1 4.46Å; F520-I524 HydrophobicContact CD1-CD1 4.29Å; F520-I524 HydrophobicContact CG-CD1 4.03Å; F520-F525 HydrophobicContact CB-CE2 4Å; F520-F525 HydrophobicContact CD2-CE2 4.11Å; F520-F525 AromaticContact CD2-CZ 3.97Å; F520-F525 HydrophobicContact CD2-CZ 3.97Å; F520-F525 HydrophobicContact CG-CE2 4.39Å
521	D	92.6	Very high	93.8	Very high	113 Å²	113	64.5 Å²	64.5	60%	0.604	33%	0.333	S	S	*	.			trans	-68.5	126.5	160.6	179.3	6.8	0	0	0	108.8	S523 I524	D521-S523 PolarHBondContact O-N 3.09Å; D521-S523 PolarHBondContact OD1-N 3.4Å; D521-S523 VanDerWaalsContact OD1-N 3.09Å; D521-S523 PolarHBondContact OD1-OG 3.2Å; D521-S523 WeakPolarHBondContact OD2-CB 3.29Å; D521-S523 PolarHBondContact OD2-OG 3.42Å; D521-I524 WeakPolarHBondContact O-CG1 3.21Å; D521-I524 PolarHBondContact O-N 3.22Å; D521-I524 VanDerWaalsContact O-N 3.15Å
522	G	90	Very high	93.9	Very high	35 Å²	35	71 Å²	71	36%	0.361	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-58.4	-20.9	178.9	0	0	0	0	0	113.4	F520 I524 F525	F520-G522 PolarHBondContact O-N 3.08Å; G522-I524 PolarHBondContact O-N 3.3Å; G522-F525 PolarHBondContact O-N 2.66Å; G522-F525 VanDerWaalsContact O-N 3.1Å
523	S	93	Very high	94	Very high	58 Å²	58	75.2 Å²	75.2	41%	0.406	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-54.2	-32.8	174.4	71.7	0	0	0	0	113.3	D521 F525 T526	D521-S523 PolarHBondContact O-N 3.09Å; D521-S523 PolarHBondContact OD1-N 3.4Å; D521-S523 VanDerWaalsContact OD1-N 3.09Å; D521-S523 PolarHBondContact OD1-OG 3.2Å; D521-S523 WeakPolarHBondContact OD2-CB 3.29Å; D521-S523 PolarHBondContact OD2-OG 3.42Å; S523-F525 PolarHBondContact O-N 3.24Å; S523-T526 PolarHBondContact O-N 2.88Å; S523-T526 PolarHBondContact O-OG1 3.33Å
524	I	94.3	Very high	93.9	Very high	43 Å²	43	74.9 Å²	74.9	22%	0.221	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-68	-19.4	-178.2	79.5	174.1	0	0	0	113	Y252 R259 F520 D521 G522 T526	Y252-I524 HydrophobicContact CD1-CD1 3.93Å; Y252-I524 HydrophobicContact CG-CD1 4.1Å; R259-I524 WeakPolarHBondContact CD-O 3.23Å; R259-I524 PolarHBondContact NH1-O 3.35Å; R259-I524 VanDerWaalsContact NH1-O 3.1Å; F520-I524 HydrophobicContact CB-CD1 3.88Å; F520-I524 HydrophobicContact CB-CG1 4.46Å; F520-I524 HydrophobicContact CD1-CD1 4.29Å; F520-I524 HydrophobicContact CG-CD1 4.03Å; D521-I524 WeakPolarHBondContact O-CG1 3.21Å; D521-I524 PolarHBondContact O-N 3.22Å; D521-I524 VanDerWaalsContact O-N 3.15Å; G522-I524 PolarHBondContact O-N 3.3Å; I524-T526 VanDerWaalsContact C-N 3.34Å
525	F	94.8	Very high	93.5	Very high	8 Å²	8	76.9 Å²	76.9	4%	0.035	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-95.6	16.1	176.3	-57.1	-87.9	0	0	0	112.5	Y252 Q254 N257 R259 I280 F520 G522 S523	Y252-F525 WeakPolarHBondContact O-CE1 3.36Å; Q254-F525 HydrophobicContact CB-CD2 4.16Å; Q254-F525 HydrophobicContact CB-CE1 4.31Å; Q254-F525 HydrophobicContact CB-CE2 3.43Å; Q254-F525 VanDerWaalsContact CB-CE2 3.43Å; Q254-F525 HydrophobicContact CB-CZ 3.52Å; Q254-F525 HydrophobicContact CG-CE2 4.37Å; Q254-F525 VanDerWaalsContact OE1-CE2 3.32Å; N257-F525 HydrophobicContact CB-CB 4.25Å; N257-F525 HydrophobicContact CB-CD1 3.87Å; N257-F525 HydrophobicContact CB-CG 4.17Å; R259-F525 HydrophobicContact CB-CD1 3.92Å; R259-F525 HydrophobicContact CB-CE1 3.91Å; I280-F525 WeakPolarHBondContact CG2-O 3.47Å; F520-F525 HydrophobicContact CB-CE2 4Å; F520-F525 HydrophobicContact CD2-CE2 4.11Å; F520-F525 AromaticContact CD2-CZ 3.97Å; F520-F525 HydrophobicContact CD2-CZ 3.97Å; F520-F525 HydrophobicContact CG-CE2 4.39Å; G522-F525 PolarHBondContact O-N 2.66Å; G522-F525 VanDerWaalsContact O-N 3.1Å; S523-F525 PolarHBondContact O-N 3.24Å
526	T	93.8	Very high	93	Very high	75 Å²	75	80.5 Å²	80.5	46%	0.46	42%	0.423	S	S	.	.	S	Bend	trans	-124.1	160.8	176.6	64.5	0	0	0	0	111.1	S523 I524	S523-T526 PolarHBondContact O-N 2.88Å; S523-T526 PolarHBondContact O-OG1 3.33Å; I524-T526 VanDerWaalsContact C-N 3.34Å
527	I	94.6	Very high	92.6	Very high	43 Å²	43	78.1 Å²	78.1	22%	0.221	41%	0.414	C	S	.	.			trans	-77.2	125	172.6	-58	166.6	0	0	0	107.3	V292 Y301	V292-I527 HydrophobicContact CG1-CD1 4.3Å; V292-I527 HydrophobicContact CG1-CG1 4.15Å; V292-I527 HydrophobicContact CG2-CD1 4.01Å; V292-I527 HydrophobicContact CG2-CG1 4.36Å; Y301-I527 HydrophobicContact CD1-CD1 4.47Å; Y301-I527 HydrophobicContact CD1-CG2 3.46Å; Y301-I527 VanDerWaalsContact CD1-CG2 3.46Å; Y301-I527 HydrophobicContact CD2-CD1 3.89Å; Y301-I527 HydrophobicContact CE1-CD1 4.37Å; Y301-I527 HydrophobicContact CE1-CG2 3.64Å; Y301-I527 HydrophobicContact CE2-CD1 3.77Å; Y301-I527 HydrophobicContact CG-CD1 4.22Å; Y301-I527 HydrophobicContact CG-CG2 4.02Å
528	P	95.1	Very high	91.8	Very high	49 Å²	49	72.5 Å²	72.5	32%	0.318	39%	0.392	S	S	.	.			trans	-67.1	144.5	179.6	-19.1	32	0	0	0	112.5	D530 Y531	P528-D530 PolarHBondContact O-N 3.36Å; P528-Y531 HydrophobicContact CB-CD2 3.67Å; P528-Y531 HydrophobicContact CB-CE2 3.85Å; P528-Y531 HydrophobicContact CG-CD2 3.82Å; P528-Y531 HydrophobicContact CG-CE2 3.68Å; P528-Y531 HydrophobicContact CG-CG 4.47Å; P528-Y531 WeakPolarHBondContact O-CB 3.41Å; P528-Y531 PolarHBondContact O-N 3.13Å
529	D	93.9	Very high	90.5	Very high	178 Å²	178	75.5 Å²	75.5	95%	0.952	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-19.1	-174.2	-66.2	-46.1	0	0	0	114.9
530	D	95.7	Very high	89	Confident	88 Å²	88	73.4 Å²	73.4	47%	0.471	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	0.8	179	72.5	-39.1	0	0	0	114.4	K299 P528	K299-D530 WeakPolarHBondContact CD-OD2 3.27Å; K299-D530 IonicContact NZ-OD2 3.28Å; K299-D530 PolarHBondContact NZ-OD2 2.64Å; P528-D530 PolarHBondContact O-N 3.36Å
531	Y	96.8	Very high	87.4	Confident	37 Å²	37	75.5 Å²	75.5	15%	0.145	42%	0.421	C	S	.	.			trans	-89.7	151	177.5	-75.7	-130.5	0	0	0	111.7	L294 N296 K299 P528	L294-Y531 HydrophobicContact CB-CD1 4.47Å; L294-Y531 HydrophobicContact CB-CE1 4.17Å; L294-Y531 HydrophobicContact CD2-CD1 4.17Å; L294-Y531 HydrophobicContact CD2-CE1 4.01Å; L294-Y531 HydrophobicContact CG-CD1 4.37Å; L294-Y531 HydrophobicContact CG-CE1 4.4Å; N296-Y531 WeakPolarHBondContact CA-OH 3.39Å; N296-Y531 PolarHBondContact OD1-OH 2.96Å; K299-Y531 HydrophobicContact CB-CD1 4.35Å; K299-Y531 HydrophobicContact CB-CD2 4.08Å; K299-Y531 HydrophobicContact CB-CE1 4.44Å; K299-Y531 HydrophobicContact CB-CE2 4.18Å; K299-Y531 HydrophobicContact CB-CG 4.17Å; K299-Y531 HydrophobicContact CD-CE2 4.32Å; K299-Y531 HydrophobicContact CG-CD2 4.38Å; K299-Y531 HydrophobicContact CG-CE2 4.02Å; K299-Y531 VanDerWaalsContact O-CA 3.29Å; K299-Y531 WeakPolarHBondContact O-CA 3.23Å; P528-Y531 HydrophobicContact CB-CD2 3.67Å; P528-Y531 HydrophobicContact CB-CE2 3.85Å; P528-Y531 HydrophobicContact CG-CD2 3.82Å; P528-Y531 HydrophobicContact CG-CE2 3.68Å; P528-Y531 HydrophobicContact CG-CG 4.47Å; P528-Y531 WeakPolarHBondContact O-CB 3.41Å; P528-Y531 PolarHBondContact O-N 3.13Å
532	K	96.5	Very high	87.2	Confident	155 Å²	155	73.7 Å²	73.7	67%	0.674	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.8	147.2	-179.9	-64.2	177.3	-175.6	172.6	0	112.1	K299 V300 Y301 D534	K299-K532 PolarHBondContact O-N 3.42Å; V300-K532 CarbonylContact C-O 3.42Å; V300-K532 WeakPolarHBondContact CA-O 3.33Å; V300-K532 WeakPolarHBondContact CB-O 3.41Å; Y301-K532 WeakPolarHBondContact CD1-O 3.42Å; Y301-K532 PolarHBondContact N-O 2.83Å; K532-D534 PolarHBondContact O-N 3.46Å
533	E	94.4	Very high	87	Confident	89 Å²	89	75.7 Å²	75.7	42%	0.416	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	125.4	173.3	-162.5	153.6	-138.8	0	0	110	Y301 R303 P535	Y301-E533 HydrophobicContact CD2-CB 4.39Å; Y301-E533 HydrophobicContact CD2-CG 4.15Å; Y301-E533 HydrophobicContact CE1-CB 4.04Å; Y301-E533 HydrophobicContact CE2-CB 3.76Å; Y301-E533 HydrophobicContact CE2-CG 3.6Å; Y301-E533 VanDerWaalsContact CE2-OE1 3.31Å; Y301-E533 WeakPolarHBondContact CE2-OE1 3.43Å; Y301-E533 CarbonylContact O-C 3.52Å; Y301-E533 WeakPolarHBondContact O-CA 3.09Å; R303-E533 WeakPolarHBondContact CD-OE1 3.27Å; R303-E533 WeakPolarHBondContact CG-OE1 3.27Å; R303-E533 IonicContact CZ-OE1 3.96Å; R303-E533 IonicContact NE-OE1 3.62Å; R303-E533 PolarHBondContact NE-OE1 3.31Å; R303-E533 IonicContact NH2-OE1 2.62Å; E533-P535 HydrophobicContact CG-CG 4.36Å
534	D	91.4	Very high	86.7	Confident	46 Å²	46	76.7 Å²	76.7	25%	0.246	42%	0.416	C	S	.	.			trans	-129.6	94.1	170.6	-177.9	-6.5	0	0	0	108.5	V300 Y301 K532 S536 R537	V300-D534 HydrophobicContact CB-CB 3.99Å; V300-D534 HydrophobicContact CG1-CB 4.25Å; V300-D534 HydrophobicContact CG2-CB 4.29Å; Y301-D534 PolarHBondContact O-N 3.44Å; K532-D534 PolarHBondContact O-N 3.46Å; D534-S536 PolarHBondContact O-N 2.82Å; D534-S536 WeakPolarHBondContact OD1-CA 3.4Å; D534-S536 WeakPolarHBondContact OD1-CB 3.47Å; D534-S536 PolarHBondContact OD1-N 2.97Å; D534-S536 PolarHBondContact OD1-OG 3.35Å; D534-R537 HydrophobicContact CB-CB 4.14Å; D534-R537 PolarHBondContact O-N 2.76Å; D534-R537 PolarHBondContact OD1-N 3.17Å
535	P	84.8	Confident	86.3	Confident	95 Å²	95	78.6 Å²	78.6	62%	0.617	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-1.4	177.4	-21.9	34.4	0	0	0	115.1	E533	E533-P535 HydrophobicContact CG-CG 4.36Å
536	S	83.6	Confident	85.7	Confident	89 Å²	89	83.1 Å²	83.1	62%	0.622	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-0.4	-179.6	68.2	0	0	0	0	113.7	D534 F538	D534-S536 PolarHBondContact O-N 2.82Å; D534-S536 WeakPolarHBondContact OD1-CA 3.4Å; D534-S536 WeakPolarHBondContact OD1-CB 3.47Å; D534-S536 PolarHBondContact OD1-N 2.97Å; D534-S536 PolarHBondContact OD1-OG 3.35Å; S536-F538 PolarHBondContact O-N 2.98Å
537	R	84.6	Confident	85.2	Confident	55 Å²	55	83.6 Å²	83.6	21%	0.208	45%	0.451	C	S	.	.	S	Bend	trans	-66.7	-35.3	-173.1	179.8	63.1	-164.8	96.1	-1.2	113.1	D295 V300 D534	D295-R537 IonicContact OD2-CZ 3.34Å; D295-R537 IonicContact OD2-NE 3.21Å; D295-R537 PolarHBondContact OD2-NE 3.5Å; D295-R537 IonicContact OD2-NH2 2.92Å; D295-R537 PolarHBondContact OD2-NH2 3.37Å; V300-R537 HydrophobicContact CG2-CB 4.22Å; V300-R537 HydrophobicContact CG2-CG 3.74Å; D534-R537 HydrophobicContact CB-CB 4.14Å; D534-R537 PolarHBondContact O-N 2.76Å; D534-R537 PolarHBondContact OD1-N 3.17Å
538	F	78.4	Confident	84.5	Confident	12 Å²	12	86.5 Å²	86.5	5%	0.053	47%	0.467	C	S	.	.			trans	-132.9	78.6	-177.1	-52.2	-78.7	0	0	0	110.1	I265 L277 V293 D295 Q302 S536 D540 L541	I265-F538 HydrophobicContact CG2-CE1 4.43Å; L277-F538 HydrophobicContact CD1-CE1 3.89Å; L277-F538 HydrophobicContact CD1-CZ 4.29Å; L277-F538 HydrophobicContact CD2-CE1 3.83Å; L277-F538 HydrophobicContact CD2-CZ 3.64Å; V293-F538 HydrophobicContact CB-CD2 4.07Å; V293-F538 HydrophobicContact CB-CE2 3.9Å; V293-F538 HydrophobicContact CG1-CD2 4Å; V293-F538 HydrophobicContact CG1-CE1 4.41Å; V293-F538 HydrophobicContact CG1-CE2 3.58Å; V293-F538 HydrophobicContact CG1-CZ 3.81Å; D295-F538 HydrophobicContact CB-CZ 3.98Å; Q302-F538 HydrophobicContact CB-CD2 3.94Å; Q302-F538 PolarHBondContact NE2-O 3.09Å; S536-F538 PolarHBondContact O-N 2.98Å; F538-D540 PolarHBondContact O-N 3.49Å; F538-L541 HydrophobicContact CB-CB 4.08Å; F538-L541 HydrophobicContact CB-CD1 4Å; F538-L541 HydrophobicContact CB-CG 4.31Å; F538-L541 HydrophobicContact CD1-CD1 4.45Å; F538-L541 HydrophobicContact CG-CD1 4.28Å; F538-L541 PolarHBondContact O-N 2.7Å; F538-L541 VanDerWaalsContact O-N 3.15Å
539	P	65.3	Low	83.7	Confident	114 Å²	114	89.4 Å²	89.4	74%	0.74	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-15.7	-174.3	25.2	-35.1	0	0	0	114.7
540	D	62.2	Low	82.9	Confident	127 Å²	127	82 Å²	82	68%	0.679	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	6.1	178.9	-60.9	-87.8	0	0	0	115.4	F538	F538-D540 PolarHBondContact O-N 3.49Å
541	L	60.7	Low	81.7	Confident	77 Å²	77	81.5 Å²	81.5	40%	0.403	44%	0.437	S	S	.	.			trans	-131.7	0	-170.3	-66.5	178.9	0	0	0	115.7	F279 V293 Q302 F538	F279-L541 HydrophobicContact CE1-CD1 4.03Å; F279-L541 HydrophobicContact CZ-CD1 4.14Å; V293-L541 HydrophobicContact CG2-CD1 4.21Å; Q302-L541 PolarHBondContact NE2-OXT 3.35Å; F538-L541 HydrophobicContact CB-CB 4.08Å; F538-L541 HydrophobicContact CB-CD1 4Å; F538-L541 HydrophobicContact CB-CG 4.31Å; F538-L541 HydrophobicContact CD1-CD1 4.45Å; F538-L541 HydrophobicContact CG-CD1 4.28Å; F538-L541 PolarHBondContact O-N 2.7Å; F538-L541 VanDerWaalsContact O-N 3.15Å

Retrieved 541 of 541 residues in 103.7 ms (Link to these results)

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