A0A087XFX5_POEFO Loading...

Nocturnin

AlphaFold DB , UniProt , Accession A0A087XFX5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 445 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	29.6	Very low	30.7	Very low	248 Å²	248	159.7 Å²	159.7	100%	1.222	86%	0.86	S	S	*	*				0	126.9	0	-90.3	167.4	150.2	0	0	108.4
2	N	25.4	Very low	30.4	Very low	160 Å²	160	156 Å²	156	86%	0.856	86%	0.855	S	S	*	*			trans	-53.6	161.2	172.3	-67.5	-32.2	0	0	0	111.8
3	S	31.6	Very low	30.4	Very low	106 Å²	106	158.5 Å²	158.5	74%	0.741	86%	0.857	S	S	*	*			cis	-165.5	138.6	45.6	-111	0	0	0	0	109
4	A	35.3	Very low	30.3	Very low	82 Å²	82	159.6 Å²	159.6	68%	0.678	86%	0.859	S	S	*	*				60.4	132.3	96.1	0	0	0	0	0	113.5
5	R	36.9	Very low	30.1	Very low	221 Å²	221	157.2 Å²	157.2	83%	0.834	86%	0.858	S	S	*	*			cis	172.7	138.5	45.5	-125.7	166.8	-163.1	-159.5	3.7	104.4
6	R	31.3	Very low	30.2	Very low	220 Å²	220	155.3 Å²	155.3	83%	0.83	85%	0.852	S	S	*	*				159.9	134.9	87	-106.3	170.4	-176.7	-158.1	1.7	106.8
7	C	28.1	Very low	30.1	Very low	134 Å²	134	153.6 Å²	153.6	91%	0.905	86%	0.855	S	S	*	*				-178.6	123.4	124.6	-98.8	0	0	0	0	109.1
8	S	31.2	Very low	30.2	Very low	121 Å²	121	150.8 Å²	150.8	85%	0.846	85%	0.847	S	S	*	*			trans	-127.8	155.2	179.7	-52.7	0	0	0	0	108.2
9	A	30.1	Very low	30.2	Very low	95 Å²	95	151.2 Å²	151.2	79%	0.785	85%	0.853	S	S	*	*			trans	81.8	109.8	159.4	0	0	0	0	0	118.1
10	L	29.5	Very low	30.1	Very low	162 Å²	162	147.5 Å²	147.5	85%	0.848	85%	0.85	S	S	*	*			trans	-162.1	107.2	142.3	-103.5	148.8	0	0	0	106.8
11	F	28.6	Very low	29.9	Very low	208 Å²	208	144.5 Å²	144.5	91%	0.912	85%	0.851	S	S	*	*			trans	171.6	84	143.1	-91.6	-64.4	0	0	0	108.5
12	S	27.2	Very low	30	Very low	115 Å²	115	141.6 Å²	141.6	80%	0.804	83%	0.834	S	S	*	*			trans	-154.1	105.4	160.2	-38.3	0	0	0	0	106.8
13	Q	30.1	Very low	30.7	Very low	189 Å²	189	139.1 Å²	139.1	88%	0.883	83%	0.827	S	S	*	*			trans	161	118.6	153.1	-92.2	168.5	10.3	0	0	108.1
14	I	29.6	Very low	30.7	Very low	173 Å²	173	140 Å²	140	89%	0.887	83%	0.833	S	S	*	*				-176.8	105.2	127	-82.5	148.5	0	0	0	107.8
15	C	27.5	Very low	30.4	Very low	124 Å²	124	147.1 Å²	147.1	84%	0.838	84%	0.843	S	S	*	*			trans	-153.9	131.8	155.3	-94.9	0	0	0	0	101
16	V	30.5	Very low	30.1	Very low	126 Å²	126	142.8 Å²	142.8	76%	0.764	84%	0.841	S	S	*	*			cis	-166.4	151.1	39.9	174.1	0	0	0	0	107
17	S	29.6	Very low	30.5	Very low	128 Å²	128	137.9 Å²	137.9	90%	0.895	84%	0.838	S	S	*	*			trans	-158.7	123.3	137.7	43.7	0	0	0	0	111.2
18	S	30.9	Very low	31	Very low	102 Å²	102	139.5 Å²	139.5	71%	0.713	84%	0.836	S	S	*	*			trans	-105.6	139.8	-178	54.3	0	0	0	0	111.7
19	V	31.6	Very low	31.6	Very low	159 Å²	159	139 Å²	139	96%	0.964	83%	0.83	S	S	*	*			trans	-164	136.3	148	-172.9	0	0	0	0	105.2
20	G	27.3	Very low	32.2	Very low	77 Å²	77	140.4 Å²	140.4	79%	0.794	83%	0.831	S	S	*	*			cis	170.8	148.3	1.7	0	0	0	0	0	106.8
21	G	26.5	Very low	32.4	Very low	84 Å²	84	137.7 Å²	137.7	87%	0.866	83%	0.832	S	S	*	*			trans	156.4	102.1	173.2	0	0	0	0	0	114.5
22	Q	31	Very low	32.3	Very low	188 Å²	188	131.5 Å²	131.5	88%	0.879	83%	0.827	S	S	*	*			trans	-101.3	-178.9	171.5	-100.8	-150.1	-4.4	0	0	110.2
23	P	41.2	Very low	32.4	Very low	108 Å²	108	131.5 Å²	131.5	70%	0.701	83%	0.827	S	S	*	*				-126	167.8	-73.7	34.1	-13.7	0	0	0	111.7
24	S	29.9	Very low	32.3	Very low	125 Å²	125	127.6 Å²	127.6	87%	0.874	82%	0.82	S	S	*	*			trans	-138.3	132.9	160.5	61.5	0	0	0	0	111.9
25	R	29.6	Very low	32.3	Very low	231 Å²	231	123.5 Å²	123.5	87%	0.872	81%	0.813	S	S	*	*			trans	-94	130.5	-171.3	-88	174.4	150.7	-176.6	-6	110.7
26	T	31	Very low	32.4	Very low	129 Å²	129	124 Å²	124	79%	0.791	81%	0.812	S	S	*	*			trans	55	167.6	137.8	58.2	0	0	0	0	119.8
27	P	39.9	Very low	32.3	Very low	118 Å²	118	121.4 Å²	121.4	77%	0.766	81%	0.81	S	S	*	*			cis	-134.2	167.1	2.8	27.8	-3.9	0	0	0	116.6
28	L	37.7	Very low	32.3	Very low	167 Å²	167	121 Å²	121	87%	0.874	80%	0.803	S	S	*	*			trans	-65.9	154.9	157.9	-81.3	151.8	0	0	0	111.9
29	P	43.4	Very low	32.4	Very low	112 Å²	112	127 Å²	127	73%	0.727	81%	0.81	S	S	*	*			trans	-146.8	-175.5	131.4	41.9	-26	0	0	0	112.4
30	P	43.4	Very low	32.2	Very low	123 Å²	123	124 Å²	124	80%	0.799	80%	0.795	S	S	*	*				-125	165.6	-68.6	35.3	-19.5	0	0	0	112.5
31	A	33.1	Very low	32.3	Very low	106 Å²	106	124.9 Å²	124.9	88%	0.876	79%	0.788	S	S	*	*			trans	-75	138.2	164.8	0	0	0	0	0	111
32	G	27.3	Very low	32.5	Very low	78 Å²	78	128.5 Å²	128.5	80%	0.804	78%	0.782	S	S	*	*			trans	-113.1	125.2	173	0	0	0	0	0	112
33	S	28.7	Very low	32.4	Very low	114 Å²	114	125.6 Å²	125.6	80%	0.797	78%	0.777	S	S	*	*			trans	-62	157.2	166.3	55.7	0	0	0	0	112
34	S	29.1	Very low	31.7	Very low	107 Å²	107	123.9 Å²	123.9	75%	0.748	78%	0.779	S	S	*	*				172.1	154.2	61.1	53.9	0	0	0	0	111.8
35	A	29.4	Very low	32.4	Very low	88 Å²	88	124.4 Å²	124.4	73%	0.727	78%	0.779	S	S	*	*			trans	69.3	139.8	144.9	0	0	0	0	0	118.8
36	T	30.2	Very low	32.3	Very low	135 Å²	135	117.3 Å²	117.3	83%	0.828	78%	0.778	S	S	*	*			cis	-162.3	136.2	34.7	33.4	0	0	0	0	108.3
37	G	27.2	Very low	32.2	Very low	70 Å²	70	115 Å²	115	72%	0.722	78%	0.78	S	S	*	*				99.3	140	108.2	0	0	0	0	0	111.5
38	T	30	Very low	31.5	Very low	120 Å²	120	113.6 Å²	113.6	74%	0.736	79%	0.787	S	S	*	*			cis	-173.4	133.1	15.5	-59.5	0	0	0	0	107.5
39	R	32.1	Very low	31.1	Very low	229 Å²	229	109.2 Å²	109.2	86%	0.864	78%	0.782	S	S	*	*			trans	52.9	152.8	143	-74.6	175.6	-173.7	-166.8	0	120.4
40	C	29.2	Very low	30.5	Very low	95 Å²	95	110.5 Å²	110.5	64%	0.642	79%	0.788	S	S	*	*			cis	-159	137.6	17	-111	0	0	0	0	106.7
41	C	27.7	Very low	29.8	Very low	96 Å²	96	116.1 Å²	116.1	65%	0.649	79%	0.793	S	S	*	*				65.7	128.9	100.7	-47.7	0	0	0	0	113.9
42	H	31.3	Very low	29.6	Very low	160 Å²	160	122.3 Å²	122.3	74%	0.741	79%	0.793	S	S	*	*			cis	-170.9	126.2	48.6	-107.4	-57.8	0	0	0	109.6
43	T	29	Very low	29.8	Very low	126 Å²	126	125.8 Å²	125.8	77%	0.773	80%	0.8	S	S	*	*				71.6	123.9	112.9	56.3	0	0	0	0	119.2
44	G	26.1	Very low	29.7	Very low	72 Å²	72	123.9 Å²	123.9	74%	0.742	80%	0.797	S	S	*	*			trans	-72.7	-136.7	166.2	0	0	0	0	0	113.2
45	P	45.7	Very low	29.7	Very low	137 Å²	137	122.2 Å²	122.2	89%	0.89	80%	0.798	S	S	*	*			cis	-145.2	-175.9	15.5	41.4	-20.6	0	0	0	116.8
46	G	27.5	Very low	30.3	Very low	82 Å²	82	123.7 Å²	123.7	85%	0.845	80%	0.8	S	S	*	*			trans	106.6	131.9	149	0	0	0	0	0	115.4
47	G	27.7	Very low	30.2	Very low	81 Å²	81	125.4 Å²	125.4	84%	0.835	80%	0.803	S	S	*	*			cis	151.7	127.4	4.3	0	0	0	0	0	110.4
48	G	27	Very low	30.4	Very low	88 Å²	88	131.4 Å²	131.4	91%	0.907	81%	0.809	S	S	*	*			trans	90.7	125.6	143.8	0	0	0	0	0	121.4
49	G	27.8	Very low	31	Very low	75 Å²	75	131.9 Å²	131.9	77%	0.773	81%	0.814	S	S	*	*				121	81.3	122	0	0	0	0	0	121.4
50	V	31	Very low	30.7	Very low	139 Å²	139	124.7 Å²	124.7	84%	0.842	81%	0.812	S	S	*	*			trans	24.4	125.9	131.5	-159	0	0	0	0	121
51	R	28.6	Very low	30.6	Very low	241 Å²	241	125.3 Å²	125.3	91%	0.909	82%	0.823	S	S	*	*				173.6	144.8	110.9	-100.5	-169.6	170.3	-164.5	-2.4	115.6
52	R	29.8	Very low	30.6	Very low	235 Å²	235	125.2 Å²	125.2	89%	0.887	83%	0.829	S	S	*	*			trans	-76.1	159	170.6	-84.2	173.5	147.5	-173.6	-5.5	113.4
53	T	30.1	Very low	30.4	Very low	152 Å²	152	122.4 Å²	122.4	93%	0.933	83%	0.834	S	S	*	*			trans	145.8	144.4	137.4	45.3	0	0	0	0	107.1
54	G	28.3	Very low	30.3	Very low	73 Å²	73	122.2 Å²	122.2	75%	0.753	83%	0.833	S	S	*	*			cis	170.5	142.3	4.5	0	0	0	0	0	105
55	G	28.8	Very low	30.4	Very low	73 Å²	73	125.2 Å²	125.2	75%	0.753	84%	0.837	S	S	*	*			trans	-66.3	177	178	0	0	0	0	0	113.3
56	P	40.9	Very low	29.5	Very low	118 Å²	118	125.8 Å²	125.8	77%	0.766	83%	0.831	S	S	*	*				-151.3	160.2	83.6	34.6	-13.8	0	0	0	118
57	L	28.9	Very low	29.6	Very low	171 Å²	171	128.3 Å²	128.3	90%	0.895	83%	0.83	S	S	*	*			trans	64.2	120.4	139.5	-64.6	162.9	0	0	0	123.2
58	K	31.9	Very low	29.5	Very low	196 Å²	196	128.5 Å²	128.5	85%	0.852	82%	0.824	S	S	*	*			trans	-63.7	178.3	153.2	-81.4	-177.9	175.7	-179.8	0	111.5
59	P	41	Very low	29.6	Very low	130 Å²	130	129.7 Å²	129.7	84%	0.844	82%	0.816	S	S	*	*			cis	-141.5	173.8	15.7	35.8	-13.4	0	0	0	116.6
60	G	26.1	Very low	29.6	Very low	79 Å²	79	132.8 Å²	132.8	81%	0.814	82%	0.819	S	S	*	*			trans	-174.9	107.9	166.3	0	0	0	0	0	112.4
61	A	27.4	Very low	29.3	Very low	107 Å²	107	131.3 Å²	131.3	88%	0.884	81%	0.814	S	S	*	*			trans	-82	144.1	175.6	0	0	0	0	0	111.2
62	A	27.5	Very low	29.3	Very low	94 Å²	94	125.6 Å²	125.6	78%	0.777	81%	0.808	S	S	*	*			trans	-163.2	114.9	147.8	0	0	0	0	0	109.5
63	A	28.2	Very low	29.2	Very low	101 Å²	101	123.1 Å²	123.1	84%	0.835	81%	0.809	S	S	*	*			trans	-68.6	133.2	165	0	0	0	0	0	109.1
64	T	26.7	Very low	29	Very low	122 Å²	122	119.5 Å²	119.5	75%	0.748	80%	0.801	S	S	*	*			trans	-140.3	112.7	160.1	-27.6	0	0	0	0	108.9	I66	T64-I66 PolarHBondContact O-N 3.22Å
65	T	27	Very low	29.3	Very low	135 Å²	135	121.6 Å²	121.6	83%	0.828	80%	0.804	S	S	*	*			trans	-64	119.1	173	-18.3	0	0	0	0	108.9
66	I	27.6	Very low	29.4	Very low	149 Å²	149	123.7 Å²	123.7	76%	0.764	81%	0.807	S	S	*	*			trans	-127.1	106.2	164.4	-60.4	-179.6	0	0	0	107.1	T64 A68	T64-I66 PolarHBondContact O-N 3.22Å; I66-A68 PolarHBondContact O-N 3.1Å
67	T	28.9	Very low	29.1	Very low	135 Å²	135	123.7 Å²	123.7	83%	0.828	81%	0.81	S	S	*	*			trans	-66.7	112.4	166.2	43.2	0	0	0	0	108.9
68	A	26.8	Very low	29.5	Very low	85 Å²	85	119 Å²	119	70%	0.702	79%	0.792	S	S	*	*			trans	-103.4	141.4	166.8	0	0	0	0	0	109.3	I66	I66-A68 PolarHBondContact O-N 3.1Å
69	P	27.7	Very low	30.1	Very low	114 Å²	114	111.5 Å²	111.5	74%	0.74	76%	0.764	S	S	*	*			trans	-76.7	144	-165.1	32.2	-34.8	0	0	0	112.1	C71	P69-C71 PolarHBondContact O-N 2.79Å
70	V	28.4	Very low	30.5	Very low	139 Å²	139	116.7 Å²	116.7	84%	0.842	77%	0.767	S	S	*	*			trans	-60.2	114.3	166.5	175.4	0	0	0	0	108.5
71	C	24.8	Very low	31.4	Very low	109 Å²	109	116 Å²	116	74%	0.736	74%	0.744	S	S	*	*			trans	-91.1	134	164.8	-71.7	0	0	0	0	108.8	P69	P69-C71 PolarHBondContact O-N 2.79Å
72	P	27.8	Very low	32.3	Very low	120 Å²	120	112.5 Å²	112.5	78%	0.779	71%	0.709	S	S	*	*			trans	-71.9	144.4	-172.2	28.6	-30.8	0	0	0	111.1	G74	P72-G74 PolarHBondContact O-N 3.31Å
73	M	28.5	Very low	33.1	Very low	184 Å²	184	109.6 Å²	109.6	91%	0.906	69%	0.688	S	S	*	*			trans	-45.9	122	172.6	-65.8	-114.5	-71.2	0	0	110.7	S75	M73-S75 PolarHBondContact O-N 3.18Å
74	G	25.1	Very low	33.8	Very low	75 Å²	75	107.5 Å²	107.5	77%	0.773	67%	0.667	S	S	*	*			trans	-62.1	106.2	168.3	0	0	0	0	0	109.2	P72 S76	P72-G74 PolarHBondContact O-N 3.31Å; G74-S76 VanDerWaalsContact C-N 3.32Å; G74-S76 PolarHBondContact O-N 3.13Å
75	S	35.5	Very low	34.6	Very low	117 Å²	117	104.9 Å²	104.9	82%	0.818	65%	0.647	S	S	*	*			trans	-61.6	93.9	162.2	45.1	0	0	0	0	108.5	M73	M73-S75 PolarHBondContact O-N 3.18Å
76	S	30.7	Very low	35.3	Very low	117 Å²	117	101.2 Å²	101.2	82%	0.818	63%	0.631	S	S	*	*			trans	-82.5	120.8	166.9	-161.4	0	0	0	0	108.1	G74 S78	G74-S76 VanDerWaalsContact C-N 3.32Å; G74-S76 PolarHBondContact O-N 3.13Å; S76-S78 PolarHBondContact O-N 2.76Å
77	S	35.6	Very low	35.8	Very low	119 Å²	119	101.5 Å²	101.5	83%	0.832	63%	0.629	S	S	*	*			trans	-52.8	98	-175.9	-51	0	0	0	0	112.1
78	S	36.7	Very low	36.2	Very low	72 Å²	72	98.4 Å²	98.4	50%	0.503	62%	0.617	S	S	.	*			trans	-62.7	137.9	162.3	-161.4	0	0	0	0	108.2	S76 R80	S76-S78 PolarHBondContact O-N 2.76Å; S78-R80 PolarHBondContact O-N 2.84Å
79	S	44.3	Very low	37	Very low	39 Å²	39	99.6 Å²	99.6	27%	0.273	61%	0.611	S	S	.	*			trans	-44.9	133.5	-177.4	46.7	0	0	0	0	111.5	L81 F82 G83	S79-L81 PolarHBondContact O-N 3Å; S79-F82 PolarHBondContact O-N 3.42Å; S79-F82 VanDerWaalsContact O-N 3.09Å; S79-F82 WeakPolarHBondContact OG-CD2 3.23Å; S79-G83 PolarHBondContact O-N 3.36Å
80	R	48.8	Very low	37.4	Very low	239 Å²	239	98.7 Å²	98.7	90%	0.902	61%	0.607	S	S	*	*	H	α-helix	trans	-57.7	-16.8	-170.3	-66.6	-177.8	-175.8	-171.3	0.8	113.8	S78 S84	S78-R80 PolarHBondContact O-N 2.84Å; R80-S84 PolarHBondContact O-N 2.92Å; R80-S84 PolarHBondContact O-OG 3.39Å
81	L	45.3	Very low	37.6	Very low	64 Å²	64	96.9 Å²	96.9	34%	0.335	60%	0.601	S	S	.	*	H	α-helix	trans	-88.3	-38.9	177.3	-83.4	156.3	0	0	0	114.4	S79 G83 S84 M85 E118	S79-L81 PolarHBondContact O-N 3Å; L81-G83 VanDerWaalsContact C-N 3.29Å; L81-G83 PolarHBondContact O-N 2.82Å; L81-S84 WeakPolarHBondContact CA-OG 3.38Å; L81-S84 PolarHBondContact O-N 3.44Å; L81-S84 PolarHBondContact O-OG 2.95Å; L81-M85 VanDerWaalsContact O-CG 3.29Å; L81-M85 WeakPolarHBondContact O-CG 3.5Å; L81-M85 PolarHBondContact O-N 3.41Å; L81-E118 WeakPolarHBondContact CD1-OE1 3.26Å
82	F	45.8	Very low	38.3	Very low	34 Å²	34	95.9 Å²	95.9	15%	0.149	60%	0.595	C	S	.	*	H	α-helix	trans	-67.8	-33.8	173.3	-84.2	-90.4	0	0	0	111.4	S79 A86 L115 Y185	S79-F82 PolarHBondContact O-N 3.42Å; S79-F82 VanDerWaalsContact O-N 3.09Å; S79-F82 WeakPolarHBondContact OG-CD2 3.23Å; F82-A86 VanDerWaalsContact O-CB 3.26Å; F82-A86 WeakPolarHBondContact O-CB 3.48Å; F82-A86 PolarHBondContact O-N 3.49Å; F82-L115 HydrophobicContact CE2-CD1 4.18Å; F82-L115 HydrophobicContact CZ-CD1 4.45Å; F82-Y185 HydrophobicContact CD2-CE1 4.31Å; F82-Y185 HydrophobicContact CE1-CE1 4.5Å; F82-Y185 AromaticContact CE2-CE1 3.6Å; F82-Y185 HydrophobicContact CE2-CE1 3.6Å; F82-Y185 AromaticContact CZ-CE1 3.7Å; F82-Y185 HydrophobicContact CZ-CE1 3.7Å
83	G	45.5	Very low	38.4	Very low	32 Å²	32	95.5 Å²	95.5	33%	0.33	60%	0.595	S	S	.	*	H	α-helix	trans	-66	-40.1	171.4	0	0	0	0	0	113.5	S79 L81 Q87	S79-G83 PolarHBondContact O-N 3.36Å; L81-G83 VanDerWaalsContact C-N 3.29Å; L81-G83 PolarHBondContact O-N 2.82Å; G83-Q87 WeakPolarHBondContact O-CB 3.49Å; G83-Q87 PolarHBondContact O-N 2.84Å
84	S	42.8	Very low	39.2	Very low	57 Å²	57	95.2 Å²	95.2	40%	0.399	60%	0.596	S	S	.	*	H	α-helix	trans	-73.9	-35.7	178.6	62.2	0	0	0	0	112.9	R80 L81 A88	R80-S84 PolarHBondContact O-N 2.92Å; R80-S84 PolarHBondContact O-OG 3.39Å; L81-S84 WeakPolarHBondContact CA-OG 3.38Å; L81-S84 PolarHBondContact O-N 3.44Å; L81-S84 PolarHBondContact O-OG 2.95Å; S84-A88 PolarHBondContact O-N 3.23Å
85	M	42	Very low	39.5	Very low	68 Å²	68	95.7 Å²	95.7	34%	0.335	59%	0.593	S	S	.	*	H	α-helix	trans	-67.9	-39	173	-65.9	-125.8	-66.8	0	0	111.6	L81 L89 V214	L81-M85 VanDerWaalsContact O-CG 3.29Å; L81-M85 WeakPolarHBondContact O-CG 3.5Å; L81-M85 PolarHBondContact O-N 3.41Å; M85-L89 VanDerWaalsContact O-CD1 3.31Å; M85-L89 WeakPolarHBondContact O-CD1 3.31Å; M85-L89 VanDerWaalsContact O-CG 3.27Å; M85-L89 WeakPolarHBondContact O-CG 3.17Å; M85-V214 HydrophobicContact CE-CG2 4.12Å
86	A	42.2	Very low	40	Very low	58 Å²	58	99.4 Å²	99.4	48%	0.479	60%	0.597	S	S	.	*	H	α-helix	trans	-71.4	-31.7	177.1	0	0	0	0	0	114	F82 L89 S90	F82-A86 VanDerWaalsContact O-CB 3.26Å; F82-A86 WeakPolarHBondContact O-CB 3.48Å; F82-A86 PolarHBondContact O-N 3.49Å; A86-L89 PolarHBondContact O-N 3.28Å; A86-S90 PolarHBondContact O-N 3.03Å; A86-S90 PolarHBondContact O-OG 2.64Å
87	Q	37.6	Very low	40.2	Very low	154 Å²	154	99 Å²	99	72%	0.72	59%	0.592	S	S	*	*	H	α-helix	trans	-73	-33.5	177.2	-95.7	-178.8	-20.2	0	0	113.6	G83 L89 S90	G83-Q87 WeakPolarHBondContact O-CB 3.49Å; G83-Q87 PolarHBondContact O-N 2.84Å; Q87-L89 PolarHBondContact O-N 3.19Å; Q87-S90 PolarHBondContact O-OG 3.49Å
88	A	38.8	Very low	40.6	Very low	70 Å²	70	101 Å²	101	58%	0.579	59%	0.593	S	S	*	*	H	α-helix	trans	-67.9	-23.4	174.5	0	0	0	0	0	112.8	S84 S91	S84-A88 PolarHBondContact O-N 3.23Å; A88-S91 PolarHBondContact O-OG 3.06Å
89	L	43.3	Very low	40.6	Very low	111 Å²	111	103 Å²	103	58%	0.581	61%	0.605	S	S	*	*	H	α-helix	trans	-93.1	-11.3	-176.2	-65.3	169.9	0	0	0	114	M85 A86 Q87 S92	M85-L89 VanDerWaalsContact O-CD1 3.31Å; M85-L89 WeakPolarHBondContact O-CD1 3.31Å; M85-L89 VanDerWaalsContact O-CG 3.27Å; M85-L89 WeakPolarHBondContact O-CG 3.17Å; A86-L89 PolarHBondContact O-N 3.28Å; Q87-L89 PolarHBondContact O-N 3.19Å; L89-S92 PolarHBondContact O-OG 3.08Å
90	S	36.2	Very low	40.2	Very low	94 Å²	94	107 Å²	107	66%	0.657	62%	0.623	S	S	*	*	S	Bend	trans	-87.2	-5.6	178.8	21	0	0	0	0	113.8	A86 Q87	A86-S90 PolarHBondContact O-N 3.03Å; A86-S90 PolarHBondContact O-OG 2.64Å; Q87-S90 PolarHBondContact O-OG 3.49Å
91	S	32.8	Very low	40	Very low	102 Å²	102	100.5 Å²	100.5	71%	0.713	61%	0.612	S	S	*	*	S	Bend	trans	-91.8	-8.3	176.4	49.3	0	0	0	0	115.1	A88 S93	A88-S91 PolarHBondContact O-OG 3.06Å; S91-S93 PolarHBondContact O-N 3.43Å
92	S	38.4	Very low	39.9	Very low	88 Å²	88	104.3 Å²	104.3	62%	0.615	63%	0.633	S	S	*	*			trans	-97.3	93.3	177	52.6	0	0	0	0	111.1	L89	L89-S92 PolarHBondContact O-OG 3.08Å
93	S	31.1	Very low	39.8	Very low	111 Å²	111	110.1 Å²	110.1	78%	0.776	66%	0.66	S	S	*	*			trans	-52.8	137.3	168	167.9	0	0	0	0	111.9	S91 A95	S91-S93 PolarHBondContact O-N 3.43Å; S93-A95 PolarHBondContact O-N 3.05Å; S93-A95 VanDerWaalsContact O-N 3.13Å
94	L	45.2	Very low	39.8	Very low	178 Å²	178	115.8 Å²	115.8	93%	0.932	68%	0.683	S	S	*	*			trans	-45.4	109.9	171.3	-80.8	149	0	0	0	112.8
95	A	31.1	Very low	40.3	Very low	85 Å²	85	120.3 Å²	120.3	70%	0.702	70%	0.698	S	S	*	*			trans	-153.1	118	151.5	0	0	0	0	0	108.1	S93 P97	S93-A95 PolarHBondContact O-N 3.05Å; S93-A95 VanDerWaalsContact O-N 3.13Å; A95-P97 VanDerWaalsContact O-CD 3.23Å; A95-P97 WeakPolarHBondContact O-CD 3.47Å
96	Q	45.1	Very low	40.9	Very low	196 Å²	196	125 Å²	125	92%	0.916	72%	0.724	S	S	*	*			trans	-67.6	128	168.7	-74.4	-158.4	-30	0	0	109.5
97	P	36	Very low	42.2	Very low	109 Å²	109	125.8 Å²	125.8	71%	0.708	72%	0.719	S	S	*	*				-130.2	149.4	121.5	32	-19.3	0	0	0	110.5	A95 P99	A95-P97 VanDerWaalsContact O-CD 3.23Å; A95-P97 WeakPolarHBondContact O-CD 3.47Å; P97-P99 WeakPolarHBondContact O-CD 3.49Å; P97-P99 VanDerWaalsContact O-N 3.13Å
98	N	42.5	Very low	44	Very low	159 Å²	159	124 Å²	124	85%	0.85	72%	0.719	S	S	*	*			trans	-44.5	118.8	171.7	-80.8	-21.9	0	0	0	110.4
99	P	38.5	Very low	46	Very low	115 Å²	115	128.3 Å²	128.3	75%	0.747	73%	0.727	S	S	*	*			trans	-80.9	126.1	168.5	29.9	-23.6	0	0	0	108	P97	P97-P99 WeakPolarHBondContact O-CD 3.49Å; P97-P99 VanDerWaalsContact O-N 3.13Å
100	D	34.5	Very low	48.1	Very low	124 Å²	124	124.5 Å²	124.5	66%	0.663	71%	0.708	S	S	*	*			trans	-50.3	129.3	156.7	-143.6	-8.2	0	0	0	108	D102	D100-D102 PolarHBondContact O-N 3.23Å; D100-D102 VanDerWaalsContact O-N 3.1Å
101	P	45.1	Very low	50.6	Low	102 Å²	102	126.1 Å²	126.1	66%	0.662	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	0.2	-167.8	29	-34.5	0	0	0	115
102	D	43.6	Very low	53.5	Low	144 Å²	144	122.9 Å²	122.9	77%	0.77	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	15.8	-173.5	-79.6	-14.1	0	0	0	114.7	D100 D104	D100-D102 PolarHBondContact O-N 3.23Å; D100-D102 VanDerWaalsContact O-N 3.1Å; D102-D104 PolarHBondContact O-N 2.9Å
103	Q	44.2	Very low	56.1	Low	155 Å²	155	122.6 Å²	122.6	72%	0.724	67%	0.671	S	S	*	*			trans	-84.3	95	166.7	-71.6	-173.3	13	0	0	109.7	Q105	Q103-Q105 PolarHBondContact O-N 3.15Å
104	D	44.5	Very low	59	Low	152 Å²	152	120.8 Å²	120.8	81%	0.813	65%	0.65	S	S	*	*			trans	-55.8	83.6	158.5	-77.2	-30.8	0	0	0	108.3	D102	D102-D104 PolarHBondContact O-N 2.9Å
105	Q	53.2	Low	61.3	Low	152 Å²	152	112.9 Å²	112.9	71%	0.71	61%	0.609	S	S	*	*			trans	-59.5	144.3	155.7	-67.4	-179.3	6.8	0	0	106.4	Q103 I107	Q103-Q105 PolarHBondContact O-N 3.15Å; Q105-I107 WeakPolarHBondContact O-CG1 3.41Å; Q105-I107 PolarHBondContact O-N 3.04Å
106	D	55.3	Low	64.3	Low	167 Å²	167	110 Å²	110	89%	0.893	58%	0.582	S	S	*	*			trans	-60.1	81.1	175.6	-69.3	-46.2	0	0	0	109.9	V108	D106-V108 PolarHBondContact O-N 2.97Å
107	I	68.8	Low	66.7	Low	73 Å²	73	107.4 Å²	107.4	37%	0.374	56%	0.564	S	S	.	*			trans	-71.9	112.8	176.3	-66.1	163.4	0	0	0	105.6	Q105 E109 A216	Q105-I107 WeakPolarHBondContact O-CG1 3.41Å; Q105-I107 PolarHBondContact O-N 3.04Å; I107-E109 PolarHBondContact O-N 2.81Å; I107-A216 HydrophobicContact CD1-CB 4.32Å
108	V	76.6	Confident	69.4	Low	117 Å²	117	104 Å²	104	71%	0.709	54%	0.538	S	S	*	.			trans	-66.2	107.4	171.3	-178.1	0	0	0	0	107.6	D106 V110 S217	D106-V108 PolarHBondContact O-N 2.97Å; V108-V110 PolarHBondContact O-N 3.49Å; V108-S217 WeakPolarHBondContact O-CB 3.49Å
109	E	80.3	Confident	71.9	Confident	160 Å²	160	96.4 Å²	96.4	75%	0.748	50%	0.497	S	S	*	.			trans	-65.1	133.1	174	-67.3	-168.5	158	0	0	109.8	I107 S217	I107-E109 PolarHBondContact O-N 2.81Å; E109-S217 WeakPolarHBondContact CA-O 3.15Å
110	V	86.6	Confident	74.5	Confident	31 Å²	31	95.4 Å²	95.4	19%	0.188	48%	0.483	C	S	.	.			trans	-108	129.9	178.4	174.5	0	0	0	0	108.3	V108 P112 L115 S217	V108-V110 PolarHBondContact O-N 3.49Å; V110-P112 VanDerWaalsContact O-CD 3.3Å; V110-P112 WeakPolarHBondContact O-CD 3.31Å; V110-L115 HydrophobicContact CG1-CB 4.19Å; V110-S217 PolarHBondContact N-O 3.23Å
111	E	89.9	Confident	77.3	Confident	128 Å²	128	94.5 Å²	94.5	60%	0.598	48%	0.475	S	S	*	.			trans	-59.6	117.6	172.7	-71.8	-65.6	156.9	0	0	110.1	E113 Q114 L115	E111-E113 PolarHBondContact O-N 3.35Å; E111-E113 VanDerWaalsContact O-N 3.15Å; E111-Q114 HydrophobicContact CB-CB 4.21Å; E111-Q114 WeakPolarHBondContact O-CB 3.43Å; E111-Q114 PolarHBondContact O-N 2.82Å; E111-L115 PolarHBondContact O-N 3.31Å
112	P	92.4	Very high	79.6	Confident	35 Å²	35	92 Å²	92	23%	0.227	46%	0.463	C	S	.	.	H	α-helix	trans	-55.8	-35.8	-175.8	-27.3	35.1	0	0	0	113.6	V110 Q114 L115 L116 L192 L218	V110-P112 VanDerWaalsContact O-CD 3.3Å; V110-P112 WeakPolarHBondContact O-CD 3.31Å; P112-Q114 VanDerWaalsContact C-N 3.27Å; P112-Q114 PolarHBondContact O-N 2.82Å; P112-L115 PolarHBondContact O-N 3.48Å; P112-L116 WeakPolarHBondContact O-CB 3.23Å; P112-L116 PolarHBondContact O-N 2.95Å; P112-L192 HydrophobicContact CB-CD2 4Å; P112-L218 HydrophobicContact CB-CD2 3.99Å; P112-L218 HydrophobicContact CG-CD2 3.92Å
113	E	92.9	Very high	82	Confident	81 Å²	81	85.9 Å²	85.9	38%	0.379	43%	0.43	S	S	.	.	H	α-helix	trans	-61.8	-34.1	175.9	-73.8	70.9	-162.2	0	0	112.4	E111 R117 R195	E111-E113 PolarHBondContact O-N 3.35Å; E111-E113 VanDerWaalsContact O-N 3.15Å; E113-R117 WeakPolarHBondContact O-CG 3.46Å; E113-R117 PolarHBondContact O-N 2.92Å; E113-R117 PolarHBondContact O-NH1 2.82Å; E113-R195 IonicContact OE1-CZ 3.37Å; E113-R195 VanDerWaalsContact OE1-CZ 3.3Å; E113-R195 IonicContact OE1-NE 3.56Å; E113-R195 IonicContact OE1-NH1 2.67Å; E113-R195 IonicContact OE1-NH2 3.37Å; E113-R195 PolarHBondContact OE1-NH2 2.72Å; E113-R195 IonicContact OE2-NH2 3.83Å
114	Q	93.1	Very high	84.3	Confident	74 Å²	74	86.4 Å²	86.4	35%	0.346	43%	0.425	S	S	.	.	H	α-helix	trans	-70.9	-48.4	177.1	179.2	177.3	-13.6	0	0	110.8	E111 P112 L116 R117 E118	E111-Q114 HydrophobicContact CB-CB 4.21Å; E111-Q114 WeakPolarHBondContact O-CB 3.43Å; E111-Q114 PolarHBondContact O-N 2.82Å; P112-Q114 VanDerWaalsContact C-N 3.27Å; P112-Q114 PolarHBondContact O-N 2.82Å; Q114-L116 VanDerWaalsContact C-N 3.26Å; Q114-L116 PolarHBondContact O-N 3.45Å; Q114-R117 PolarHBondContact O-N 2.79Å; Q114-E118 PolarHBondContact NE2-OE1 2.82Å; Q114-E118 PolarHBondContact O-N 2.83Å
115	L	93.8	Very high	86.6	Confident	12 Å²	12	86.3 Å²	86.3	6%	0.063	42%	0.424	C	S	.	.	H	α-helix	trans	-63.7	-35	178.4	-174.4	62.7	0	0	0	111.8	F82 V110 E111 P112 E118 C119 L192 V214 L218	F82-L115 HydrophobicContact CE2-CD1 4.18Å; F82-L115 HydrophobicContact CZ-CD1 4.45Å; V110-L115 HydrophobicContact CG1-CB 4.19Å; E111-L115 PolarHBondContact O-N 3.31Å; P112-L115 PolarHBondContact O-N 3.48Å; L115-E118 WeakPolarHBondContact O-CB 3.32Å; L115-E118 PolarHBondContact O-N 2.93Å; L115-C119 PolarHBondContact O-N 2.88Å; L115-C119 PolarHBondContact O-SG 3.15Å; L115-L192 HydrophobicContact CB-CD1 4.07Å; L115-L192 HydrophobicContact CD2-CD1 3.87Å; L115-L192 HydrophobicContact CD2-CD2 4.4Å; L115-L192 HydrophobicContact CG-CD1 3.72Å; L115-V214 HydrophobicContact CD2-CG1 3.6Å; L115-L218 HydrophobicContact CD2-CD1 4.02Å; L115-L218 HydrophobicContact CD2-CD2 4.15Å; L115-L218 HydrophobicContact CD2-CG 4.33Å
116	L	94.4	Very high	88.5	Confident	25 Å²	25	82.4 Å²	82.4	13%	0.131	40%	0.402	C	S	.	.	H	α-helix	trans	-61.1	-47.9	174.2	179.8	58.7	0	0	0	111	P112 Q114 E118 C119 E120 E189 L192	P112-L116 WeakPolarHBondContact O-CB 3.23Å; P112-L116 PolarHBondContact O-N 2.95Å; Q114-L116 VanDerWaalsContact C-N 3.26Å; Q114-L116 PolarHBondContact O-N 3.45Å; L116-E118 PolarHBondContact O-N 2.78Å; L116-C119 WeakPolarHBondContact O-CB 3.47Å; L116-C119 PolarHBondContact O-N 2.82Å; L116-C119 VanDerWaalsContact O-N 3.09Å; L116-E120 HydrophobicContact CD1-CG 4.45Å; L116-E120 WeakPolarHBondContact O-CG 3.42Å; L116-E120 PolarHBondContact O-N 2.97Å; L116-E189 HydrophobicContact CD1-CG 3.88Å; L116-L192 HydrophobicContact CB-CB 4.21Å; L116-L192 HydrophobicContact CB-CD1 4.32Å; L116-L192 HydrophobicContact CD1-CB 3.99Å
117	R	94.3	Very high	90.3	Very high	141 Å²	141	78 Å²	78	53%	0.532	38%	0.383	S	S	.	.	H	α-helix	trans	-59.7	-34.9	175	-73.7	-173.8	-61.5	-90.9	3.2	112.7	E113 Q114 E120 E121	E113-R117 WeakPolarHBondContact O-CG 3.46Å; E113-R117 PolarHBondContact O-N 2.92Å; E113-R117 PolarHBondContact O-NH1 2.82Å; Q114-R117 PolarHBondContact O-N 2.79Å; R117-E120 PolarHBondContact O-N 2.98Å; R117-E121 WeakPolarHBondContact O-CB 3.49Å; R117-E121 PolarHBondContact O-N 2.94Å
118	E	93.3	Very high	91.3	Very high	36 Å²	36	78.9 Å²	78.9	17%	0.168	40%	0.401	C	S	.	.	H	α-helix	trans	-68.3	-38.3	175.5	-71.6	178	-150.5	0	0	112.3	L81 Q114 L115 L116 A122	L81-E118 WeakPolarHBondContact CD1-OE1 3.26Å; Q114-E118 PolarHBondContact NE2-OE1 2.82Å; Q114-E118 PolarHBondContact O-N 2.83Å; L115-E118 WeakPolarHBondContact O-CB 3.32Å; L115-E118 PolarHBondContact O-N 2.93Å; L116-E118 PolarHBondContact O-N 2.78Å; E118-A122 WeakPolarHBondContact O-CB 3.36Å; E118-A122 PolarHBondContact O-N 2.81Å
119	C	94.8	Very high	91.9	Very high	0 Å²	0	76 Å²	76	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-64.2	-47.7	172.5	-61.5	0	0	0	0	110.6	L115 L116 E121 A122 L123 Y185 E189	L115-C119 PolarHBondContact O-N 2.88Å; L115-C119 PolarHBondContact O-SG 3.15Å; L116-C119 WeakPolarHBondContact O-CB 3.47Å; L116-C119 PolarHBondContact O-N 2.82Å; L116-C119 VanDerWaalsContact O-N 3.09Å; C119-E121 VanDerWaalsContact C-N 3.32Å; C119-E121 PolarHBondContact O-N 3.48Å; C119-A122 PolarHBondContact O-N 2.89Å; C119-L123 WeakPolarHBondContact O-CB 3.4Å; C119-L123 VanDerWaalsContact O-CG 3.26Å; C119-L123 WeakPolarHBondContact O-CG 3.49Å; C119-L123 PolarHBondContact O-N 3.18Å; C119-Y185 HydrophobicContact CB-CD1 4.46Å; C119-E189 HydrophobicContact CB-CB 4.11Å
120	E	93.1	Very high	92.3	Very high	95 Å²	95	69 Å²	69	44%	0.444	35%	0.346	S	S	.	.	H	α-helix	trans	-58.2	-42.6	177.4	-70.7	170.8	168.1	0	0	111.5	L116 R117 L123 R124	L116-E120 HydrophobicContact CD1-CG 4.45Å; L116-E120 WeakPolarHBondContact O-CG 3.42Å; L116-E120 PolarHBondContact O-N 2.97Å; R117-E120 PolarHBondContact O-N 2.98Å; E120-L123 CarbonylContact O-C 3.58Å; E120-L123 PolarHBondContact O-N 2.71Å; E120-R124 WeakPolarHBondContact O-CA 3.36Å; E120-R124 PolarHBondContact O-N 3.02Å
121	E	93.9	Very high	92.5	Very high	105 Å²	105	74.4 Å²	74.4	49%	0.491	37%	0.369	S	S	.	.	H	α-helix	trans	-67.9	-41.2	177	-177.8	61.1	-159.3	0	0	112	R117 C119 L123 R124	R117-E121 WeakPolarHBondContact O-CB 3.49Å; R117-E121 PolarHBondContact O-N 2.94Å; C119-E121 VanDerWaalsContact C-N 3.32Å; C119-E121 PolarHBondContact O-N 3.48Å; E121-L123 PolarHBondContact O-N 3.11Å; E121-R124 WeakPolarHBondContact O-CB 3.39Å; E121-R124 WeakPolarHBondContact O-CD 3.34Å; E121-R124 VanDerWaalsContact O-CG 3.26Å; E121-R124 WeakPolarHBondContact O-CG 3.48Å; E121-R124 PolarHBondContact O-N 2.97Å; E121-R124 WeakPolarHBondContact OE1-CD 3.41Å; E121-R124 IonicContact OE1-CZ 3.34Å; E121-R124 IonicContact OE1-NE 3.17Å; E121-R124 IonicContact OE1-NH1 2.66Å; E121-R124 PolarHBondContact OE1-NH1 3.37Å
122	A	92.9	Very high	92.8	Very high	50 Å²	50	68.9 Å²	68.9	41%	0.413	34%	0.343	S	S	.	.	H	α-helix	trans	-62.8	-31.2	175	0	0	0	0	0	112	E118 C119 Y185	E118-A122 WeakPolarHBondContact O-CB 3.36Å; E118-A122 PolarHBondContact O-N 2.81Å; C119-A122 PolarHBondContact O-N 2.89Å; A122-Y185 HydrophobicContact CB-CD1 4.11Å; A122-Y185 HydrophobicContact CB-CD2 3.66Å; A122-Y185 HydrophobicContact CB-CE1 4.25Å; A122-Y185 HydrophobicContact CB-CE2 3.8Å; A122-Y185 HydrophobicContact CB-CG 3.82Å
123	L	93.5	Very high	93	Very high	14 Å²	14	71.4 Å²	71.4	7%	0.073	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	5.5	-178.5	-62.2	172	0	0	0	113.7	C119 E120 E121 L125 R126 Q186 E189	C119-L123 WeakPolarHBondContact O-CB 3.4Å; C119-L123 VanDerWaalsContact O-CG 3.26Å; C119-L123 WeakPolarHBondContact O-CG 3.49Å; C119-L123 PolarHBondContact O-N 3.18Å; E120-L123 CarbonylContact O-C 3.58Å; E120-L123 PolarHBondContact O-N 2.71Å; E121-L123 PolarHBondContact O-N 3.11Å; L123-L125 PolarHBondContact O-N 3.46Å; L123-R126 HydrophobicContact CD2-CG 4.3Å; L123-R126 WeakPolarHBondContact O-CA 3.32Å; L123-R126 WeakPolarHBondContact O-CB 3.32Å; L123-R126 PolarHBondContact O-N 3.13Å; L123-Q186 HydrophobicContact CD1-CB 4.37Å; L123-Q186 HydrophobicContact CD1-CG 3.7Å; L123-Q186 HydrophobicContact CD2-CG 3.66Å; L123-Q186 HydrophobicContact CG-CG 4.35Å; L123-E189 HydrophobicContact CD1-CB 4.49Å
124	R	93.5	Very high	93.1	Very high	167 Å²	167	70.8 Å²	70.8	63%	0.63	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-23	-172.7	74.3	-171.1	-177.1	167.7	2.7	115.7	E120 E121	E120-R124 WeakPolarHBondContact O-CA 3.36Å; E120-R124 PolarHBondContact O-N 3.02Å; E121-R124 WeakPolarHBondContact O-CB 3.39Å; E121-R124 WeakPolarHBondContact O-CD 3.34Å; E121-R124 VanDerWaalsContact O-CG 3.26Å; E121-R124 WeakPolarHBondContact O-CG 3.48Å; E121-R124 PolarHBondContact O-N 2.97Å; E121-R124 WeakPolarHBondContact OE1-CD 3.41Å; E121-R124 IonicContact OE1-CZ 3.34Å; E121-R124 IonicContact OE1-NE 3.17Å; E121-R124 IonicContact OE1-NH1 2.66Å; E121-R124 PolarHBondContact OE1-NH1 3.37Å
125	L	92.8	Very high	93.2	Very high	149 Å²	149	69.7 Å²	69.7	78%	0.78	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-1	178.3	-60.5	-177.8	0	0	0	113	L123	L123-L125 PolarHBondContact O-N 3.46Å
126	R	92.3	Very high	93.2	Very high	70 Å²	70	79 Å²	79	26%	0.264	39%	0.386	S	S	.	.	S	Bend	trans	-98.4	152.2	179.1	-59	-54.8	-176	-167.5	1.3	110.2	L123 E182 Y422	L123-R126 HydrophobicContact CD2-CG 4.3Å; L123-R126 WeakPolarHBondContact O-CA 3.32Å; L123-R126 WeakPolarHBondContact O-CB 3.32Å; L123-R126 PolarHBondContact O-N 3.13Å; R126-E182 IonicContact CZ-OE1 3.2Å; R126-E182 IonicContact CZ-OE2 2.65Å; R126-E182 IonicContact NE-OE1 2.75Å; R126-E182 PolarHBondContact NE-OE1 3.02Å; R126-E182 IonicContact NE-OE2 3.87Å; R126-E182 PolarHBondContact NE-OE2 2.98Å; R126-E182 IonicContact NH2-OE1 3.15Å; R126-E182 PolarHBondContact NH2-OE1 3.07Å; R126-E182 IonicContact NH2-OE2 2.68Å; R126-E182 PolarHBondContact NH2-OE2 2.87Å; R126-Y422 VanDerWaalsContact CZ-CE1 3.42Å
127	P	92.5	Very high	92.8	Very high	74 Å²	74	78.2 Å²	78.2	48%	0.481	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-63.1	144.4	172.9	-11.8	26.8	0	0	0	109.7	H423	P127-H423 HydrophobicContact CB-CB 4.17Å; P127-H423 WeakPolarHBondContact O-CB 3.48Å
128	A	89.4	Confident	92.2	Very high	92 Å²	92	81.1 Å²	81.1	76%	0.76	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-60.7	144.4	176.1	0	0	0	0	0	110.9	H423	A128-H423 WeakPolarHBondContact O-CB 3.4Å
129	R	90	Very high	91.4	Very high	58 Å²	58	84.4 Å²	84.4	22%	0.219	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-58.8	153.4	172.9	66.9	-172.2	-178.6	84.4	21.8	111.6	Q131 E190 T193 Y194 H423	R129-Q131 PolarHBondContact O-N 3.06Å; R129-E190 IonicContact CZ-OE2 2.91Å; R129-E190 IonicContact NE-OE2 3.94Å; R129-E190 IonicContact NH1-OE2 2.74Å; R129-E190 PolarHBondContact NH1-OE2 3.21Å; R129-T193 PolarHBondContact NH2-OG1 2.77Å; R129-Y194 PolarHBondContact NH1-OH 3.34Å; R129-H423 WeakPolarHBondContact CA-O 3.46Å; R129-H423 WeakPolarHBondContact CB-O 3.48Å
130	P	89.8	Confident	90.5	Very high	13 Å²	13	86.7 Å²	86.7	8%	0.084	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-56.5	125.9	176.5	-25.2	35.6	0	0	0	110.6	R132 P409 Q413	P130-R132 PolarHBondContact O-N 2.93Å; P130-P409 HydrophobicContact CB-CB 4.46Å; P130-P409 HydrophobicContact CB-CG 4.28Å; P130-Q413 HydrophobicContact CB-CB 4.41Å
131	Q	89.5	Confident	89.5	Confident	143 Å²	143	85.6 Å²	85.6	67%	0.668	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-66.5	130.6	172.9	-176.8	176	-12.1	0	0	109.3	R129 Q413	R129-Q131 PolarHBondContact O-N 3.06Å; Q131-Q413 PolarHBondContact O-NE2 3.11Å
132	R	96.4	Very high	88.3	Confident	12 Å²	12	87 Å²	87	5%	0.045	45%	0.454	C	S	.	.			trans	-132.5	137	-178.8	-67.1	173.9	69.1	-168.2	4.1	109.5	P130 E190 L406 D407 P409 A430	P130-R132 PolarHBondContact O-N 2.93Å; R132-E190 IonicContact NH1-OE1 2.75Å; R132-L406 HydrophobicContact CB-CD1 3.61Å; R132-L406 HydrophobicContact CB-CD2 4.46Å; R132-L406 HydrophobicContact CB-CG 3.99Å; R132-D407 WeakPolarHBondContact CA-OD1 3.46Å; R132-D407 WeakPolarHBondContact CB-OD1 3.49Å; R132-D407 PolarHBondContact NE-O 3.39Å; R132-D407 PolarHBondContact NH2-O 3.21Å; R132-P409 HydrophobicContact CG-CG 3.87Å; R132-A430 VanDerWaalsContact CZ-O 3.27Å; R132-A430 PolarHBondContact NH1-O 3.39Å; R132-A430 PolarHBondContact NH2-O 3.47Å
133	D	96	Very high	86.9	Confident	89 Å²	89	86.5 Å²	86.5	48%	0.476	45%	0.447	S	S	.	.			trans	-105.7	143.3	-174	-69.2	-38.2	0	0	0	111.6	V135 D407	D133-V135 HydrophobicContact CB-CG1 4.46Å; D133-V135 PolarHBondContact O-N 3.45Å; D133-D407 PolarHBondContact N-OD1 2.98Å; D133-D407 PolarHBondContact O-N 3.26Å
134	L	96.1	Very high	85.2	Confident	68 Å²	68	91 Å²	91	36%	0.356	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	105.4	167.7	-80.7	174.8	0	0	0	109.4	A404 L405 L406 L432	L134-A404 HydrophobicContact CD2-CB 4.42Å; L134-L405 CarbonylContact C-O 3.54Å; L134-L405 WeakPolarHBondContact CA-O 3.46Å; L134-L406 HydrophobicContact CD2-CB 4.3Å; L134-L406 HydrophobicContact CD2-CD1 4.46Å; L134-L432 HydrophobicContact CD2-CD2 3.55Å
135	V	95.2	Very high	83.8	Confident	50 Å²	50	86.4 Å²	86.4	30%	0.303	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	139.2	-179.4	-61.3	0	0	0	0	111.1	D133 L365 A404 L405 D407	D133-V135 HydrophobicContact CB-CG1 4.46Å; D133-V135 PolarHBondContact O-N 3.45Å; V135-L365 HydrophobicContact CG2-CD2 3.28Å; V135-A404 CarbonylContact O-C 3.56Å; V135-A404 VanDerWaalsContact O-CA 3.26Å; V135-A404 WeakPolarHBondContact O-CA 3.4Å; V135-L405 HydrophobicContact CG2-CB 4.34Å; V135-L405 VanDerWaalsContact CG2-O 3.31Å; V135-L405 WeakPolarHBondContact CG2-O 3.36Å; V135-L405 PolarHBondContact N-O 3.37Å; V135-L405 PolarHBondContact O-N 3.09Å; V135-D407 HydrophobicContact CG1-CB 4.21Å; V135-D407 HydrophobicContact CG2-CB 4.38Å
136	R	92.9	Very high	82.1	Confident	208 Å²	208	87.9 Å²	87.9	79%	0.785	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-87.8	130.1	171.7	-65.6	-171.6	176.4	87.2	0.5	109.4	K138	R136-K138 PolarHBondContact O-N 3.46Å
137	P	87.3	Confident	80.9	Confident	9 Å²	9	92.4 Å²	92.4	6%	0.058	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-56.8	125.8	175.5	-27.9	36.7	0	0	0	112.3	L139 L140 L364 V402 E403 L405	P137-L139 PolarHBondContact O-N 2.9Å; P137-L140 HydrophobicContact CB-CB 4.38Å; P137-L140 HydrophobicContact CB-CD1 3.91Å; P137-L140 HydrophobicContact CB-CG 4.04Å; P137-L140 HydrophobicContact CG-CD1 4.06Å; P137-L140 PolarHBondContact O-N 3.48Å; P137-L364 HydrophobicContact CB-CB 3.99Å; P137-L364 HydrophobicContact CG-CB 3.97Å; P137-L364 HydrophobicContact CG-CD1 4.37Å; P137-V402 HydrophobicContact CG-CG1 4.31Å; P137-E403 WeakPolarHBondContact CD-O 2.93Å; P137-L405 HydrophobicContact CG-CD1 4.01Å
138	K	79.9	Confident	80.4	Confident	202 Å²	202	89.9 Å²	89.9	88%	0.878	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-28.9	-175.4	-67.3	179.7	-179.5	174.5	0	113.6	R136 L140	R136-K138 PolarHBondContact O-N 3.46Å; K138-L140 VanDerWaalsContact C-N 3.28Å; K138-L140 PolarHBondContact O-N 3.39Å
139	L	77.9	Confident	80.3	Confident	105 Å²	105	87.6 Å²	87.6	55%	0.55	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-6.8	-176.6	-64.6	171.5	0	0	0	113.2	P137	P137-L139 PolarHBondContact O-N 2.9Å
140	L	75.3	Confident	80.4	Confident	48 Å²	48	87.4 Å²	87.4	25%	0.251	46%	0.46	S	S	.	.	S	Bend	trans	-105.2	121	-177.6	-62	-178.5	0	0	0	110.3	P137 K138 L364 V402	P137-L140 HydrophobicContact CB-CB 4.38Å; P137-L140 HydrophobicContact CB-CD1 3.91Å; P137-L140 HydrophobicContact CB-CG 4.04Å; P137-L140 HydrophobicContact CG-CD1 4.06Å; P137-L140 PolarHBondContact O-N 3.48Å; K138-L140 VanDerWaalsContact C-N 3.28Å; K138-L140 PolarHBondContact O-N 3.39Å; L140-L364 HydrophobicContact CD1-CD1 4.15Å; L140-V402 WeakPolarHBondContact CD1-O 3.46Å
141	A	72.5	Confident	80.8	Confident	72 Å²	72	86.8 Å²	86.8	60%	0.595	46%	0.456	S	S	*	.			trans	-60.8	135.3	176.1	0	0	0	0	0	110.2	C143 R401	A141-C143 PolarHBondContact O-N 3.03Å; A141-R401 PolarHBondContact O-NH1 3.31Å; A141-R401 PolarHBondContact O-NH2 3.37Å
142	P	67.9	Low	81.3	Confident	133 Å²	133	82.8 Å²	82.8	86%	0.864	43%	0.434	S	S	*	.			trans	-53.8	133.6	177.7	-23.4	32.1	0	0	0	111.2
143	C	64.1	Low	81.4	Confident	40 Å²	40	82.2 Å²	82.2	27%	0.27	43%	0.432	S	S	.	.			trans	-123.6	137.7	170.9	77.6	0	0	0	0	109.6	A141 H145 R401 E403	A141-C143 PolarHBondContact O-N 3.03Å; C143-H145 WeakPolarHBondContact CB-NE2 3.31Å; C143-R401 PolarHBondContact SG-NE 3.24Å; C143-R401 VanDerWaalsContact SG-NE 3.36Å; C143-E403 PolarHBondContact SG-OE1 2.82Å; C143-E403 PolarHBondContact SG-OE2 3.42Å; C143-E403 VanDerWaalsContact SG-OE2 3.41Å
144	S	58	Low	81.5	Confident	110 Å²	110	78 Å²	78	77%	0.769	41%	0.41	S	S	*	.			trans	-126.9	98.9	-179.3	153.9	0	0	0	0	106.6
145	H	64.6	Low	81.7	Confident	69 Å²	69	74.7 Å²	74.7	32%	0.319	39%	0.393	S	S	.	.			trans	-114.7	108.4	178.1	-62.3	-78.9	0	0	0	109	C143 H147 N148 E439	C143-H145 WeakPolarHBondContact CB-NE2 3.31Å; H145-H147 PolarHBondContact O-N 3.28Å; H145-H147 VanDerWaalsContact O-N 3.16Å; H145-N148 HydrophobicContact CB-CB 3.81Å; H145-N148 PolarHBondContact O-N 3.01Å; H145-E439 IonicContact CE1-OE1 3.68Å; H145-E439 PolarHBondContact CE1-OE1 3.41Å; H145-E439 IonicContact CE1-OE2 2.87Å; H145-E439 PolarHBondContact CE1-OE2 2.89Å; H145-E439 IonicContact CG-OE1 2.78Å; H145-E439 IonicContact ND1-OE1 3.81Å; H145-E439 PolarHBondContact ND1-OE1 3.41Å; H145-E439 IonicContact ND1-OE2 3.65Å
146	Q	56.1	Low	81.8	Confident	180 Å²	180	72.3 Å²	72.3	84%	0.841	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-22	179.5	-72.6	178.7	-5.2	0	0	112.9
147	H	67.9	Low	82.1	Confident	166 Å²	166	62.4 Å²	62.4	77%	0.769	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	10.4	-176.6	-63.8	-56	0	0	0	114.8	H145	H145-H147 PolarHBondContact O-N 3.28Å; H145-H147 VanDerWaalsContact O-N 3.16Å
148	N	80.9	Confident	82.7	Confident	21 Å²	21	62.1 Å²	62.1	11%	0.112	34%	0.339	C	S	.	.	S	Bend	trans	-135	75.1	-179.4	-175.4	33.7	0	0	0	109.8	H145 F437	H145-N148 HydrophobicContact CB-CB 3.81Å; H145-N148 PolarHBondContact O-N 3.01Å; N148-F437 PolarHBondContact ND2-O 2.75Å
149	P	87.3	Confident	83.6	Confident	43 Å²	43	52.6 Å²	52.6	28%	0.279	30%	0.297	S	S	.	.			trans	-63.9	141.8	-177.1	27.8	-34.4	0	0	0	110.3	A283	P149-A283 HydrophobicContact CG-CB 3.8Å
150	S	93.4	Very high	84.6	Confident	54 Å²	54	47.6 Å²	47.6	38%	0.378	27%	0.271	S	S	.	.			trans	-60.1	148.9	173.9	55.5	0	0	0	0	110.8	R252 I435	S150-R252 PolarHBondContact O-NH2 3.39Å; S150-I435 CarbonylContact C-O 3.5Å; S150-I435 VanDerWaalsContact CA-O 3.29Å; S150-I435 WeakPolarHBondContact CA-O 3.27Å
151	I	97.9	Very high	85.7	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119.3	174.1	-62.5	169	0	0	0	106.2	V153 D197 I198 F253 L288 I435 F437	I151-V153 HydrophobicContact CG2-CG2 4.18Å; I151-D197 WeakPolarHBondContact CA-OD2 3.45Å; I151-D197 HydrophobicContact CG2-CB 4.42Å; I151-I198 HydrophobicContact CG2-CD1 3.68Å; I151-F253 HydrophobicContact CB-CZ 4.41Å; I151-F253 HydrophobicContact CD1-CE1 4.08Å; I151-F253 HydrophobicContact CD1-CZ 3.91Å; I151-F253 HydrophobicContact CG1-CZ 3.93Å; I151-F253 HydrophobicContact CG2-CE2 4.29Å; I151-F253 HydrophobicContact CG2-CZ 3.67Å; I151-L288 HydrophobicContact CD1-CD2 4.23Å; I151-I435 HydrophobicContact CB-CG1 3.95Å; I151-I435 HydrophobicContact CG2-CG1 4.38Å; I151-I435 PolarHBondContact N-O 3.41Å; I151-I435 WeakPolarHBondContact O-CG1 3.4Å; I151-I435 PolarHBondContact O-N 2.93Å; I151-F437 HydrophobicContact CD1-CD2 4.42Å; I151-F437 HydrophobicContact CD1-CE2 3.76Å; I151-F437 HydrophobicContact CD1-CZ 4.21Å
152	R	98.7	Very high	86.9	Confident	58 Å²	58	42.5 Å²	42.5	22%	0.219	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	122.5	178.7	-175.6	167.1	-76	-179.7	2	110.9	Y194 P196 D197 I198 L432 D434	R152-Y194 WeakPolarHBondContact CD-O 3.41Å; R152-Y194 PolarHBondContact NH1-O 2.97Å; R152-P196 HydrophobicContact CG-CB 4.06Å; R152-D197 PolarHBondContact N-OD2 2.82Å; R152-D197 PolarHBondContact O-N 3.25Å; R152-I198 PolarHBondContact O-N 2.87Å; R152-L432 HydrophobicContact CG-CD1 3.86Å; R152-L432 HydrophobicContact CG-CD2 3.99Å; R152-L432 HydrophobicContact CG-CG 3.97Å; R152-D434 VanDerWaalsContact CB-OD1 3.23Å; R152-D434 WeakPolarHBondContact CB-OD1 3.43Å; R152-D434 VanDerWaalsContact CG-OD1 3.26Å; R152-D434 WeakPolarHBondContact CG-OD1 3.16Å; R152-D434 IonicContact CZ-OD1 3.56Å; R152-D434 IonicContact CZ-OD2 3.57Å; R152-D434 IonicContact NE-OD1 2.83Å; R152-D434 PolarHBondContact NE-OD1 3.33Å; R152-D434 IonicContact NE-OD2 3.66Å; R152-D434 IonicContact NH2-OD1 2.71Å; R152-D434 PolarHBondContact NH2-OD1 2.93Å; R152-D434 IonicContact NH2-OD2 3.87Å; R152-D434 PolarHBondContact NH2-OD2 3.43Å
153	V	98.9	Very high	88.2	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	124.6	-179.5	-174.3	0	0	0	0	109.5	I151 I198 V334 L432 C433 I435	I151-V153 HydrophobicContact CG2-CG2 4.18Å; V153-I198 WeakPolarHBondContact CA-O 3.31Å; V153-I198 HydrophobicContact CG1-CB 4.47Å; V153-I198 HydrophobicContact CG1-CG2 4.15Å; V153-I198 HydrophobicContact CG2-CB 4.36Å; V153-I198 HydrophobicContact CG2-CD1 4.28Å; V153-V334 HydrophobicContact CG1-CG1 4.07Å; V153-V334 HydrophobicContact CG2-CG1 4.46Å; V153-L432 VanDerWaalsContact O-CA 3.27Å; V153-L432 WeakPolarHBondContact O-CA 3.38Å; V153-C433 PolarHBondContact N-O 2.99Å; V153-C433 PolarHBondContact O-N 2.92Å; V153-I435 HydrophobicContact CG2-CD1 4.1Å; V153-I435 HydrophobicContact CG2-CG1 4.34Å
154	L	98.9	Very high	89.7	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.2	172.6	-176.7	73.9	0	0	0	109.7	I191 P196 I198 V199 C200 A430 L431 L432	L154-I191 HydrophobicContact CD2-CG1 3.83Å; L154-P196 HydrophobicContact CB-CB 3.77Å; L154-P196 HydrophobicContact CB-CG 3.93Å; L154-P196 HydrophobicContact CD2-CG 4.11Å; L154-I198 PolarHBondContact N-O 3.02Å; L154-V199 HydrophobicContact CB-CG2 4.38Å; L154-V199 HydrophobicContact CD2-CG1 4.03Å; L154-V199 HydrophobicContact CD2-CG2 4.35Å; L154-C200 PolarHBondContact O-N 2.82Å; L154-A430 HydrophobicContact CD1-CB 3.96Å; L154-L431 CarbonylContact C-O 3.53Å; L154-L431 WeakPolarHBondContact CA-O 3.41Å; L154-L432 HydrophobicContact CD1-CB 4.06Å; L154-L432 HydrophobicContact CD1-CD1 3.97Å
155	Q	98.9	Very high	91.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125.4	174.1	157.4	49.6	18.1	0	0	108.9	C200 Q202 C336 G337 I393 L431	Q155-C200 WeakPolarHBondContact CA-O 3.45Å; Q155-C200 PolarHBondContact OE1-O 2.97Å; Q155-Q202 VanDerWaalsContact NE2-CD 3.34Å; Q155-C336 HydrophobicContact CB-CB 3.88Å; Q155-C336 HydrophobicContact CG-CB 4.07Å; Q155-G337 VanDerWaalsContact CD-N 3.31Å; Q155-G337 PolarHBondContact NE2-O 2.89Å; Q155-I393 HydrophobicContact CB-CD1 3.94Å; Q155-I393 HydrophobicContact CB-CG1 3.66Å; Q155-I393 HydrophobicContact CG-CG1 4.14Å; Q155-L431 HydrophobicContact CB-CB 4.23Å; Q155-L431 HydrophobicContact CG-CB 4.36Å; Q155-L431 PolarHBondContact N-O 2.89Å; Q155-L431 PolarHBondContact O-N 3.46Å
156	W	98.9	Very high	92.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	124.1	-178.3	-160.1	16.5	0	0	0	114.3	I158 I187 E190 C200 L201 Q202 Y424 P425 H428 A430	W156-I158 HydrophobicContact CB-CG2 4.22Å; W156-I158 HydrophobicContact CD2-CG2 3.8Å; W156-I158 HydrophobicContact CE3-CG2 3.72Å; W156-I158 HydrophobicContact CG-CG2 4.03Å; W156-I158 HydrophobicContact CZ3-CG2 4.41Å; W156-I158 PolarHBondContact O-N 3.04Å; W156-I187 HydrophobicContact CE3-CG2 4.41Å; W156-I187 HydrophobicContact CH2-CB 4.34Å; W156-I187 HydrophobicContact CH2-CG1 4.06Å; W156-I187 HydrophobicContact CH2-CG2 4.42Å; W156-I187 HydrophobicContact CZ3-CB 4.14Å; W156-I187 HydrophobicContact CZ3-CG1 4.23Å; W156-I187 HydrophobicContact CZ3-CG2 3.76Å; W156-E190 HydrophobicContact CH2-CB 3.9Å; W156-E190 HydrophobicContact CH2-CG 4Å; W156-E190 HydrophobicContact CZ3-CB 3.79Å; W156-E190 HydrophobicContact CZ3-CG 3.92Å; W156-C200 PolarHBondContact N-O 2.86Å; W156-L201 HydrophobicContact CB-CD2 3.99Å; W156-L201 VanDerWaalsContact O-CA 3.24Å; W156-L201 WeakPolarHBondContact O-CA 3.37Å; W156-Q202 VanDerWaalsContact C-OE1 3.25Å; W156-Q202 PolarHBondContact O-N 2.73Å; W156-Q202 PolarHBondContact O-OE1 3.29Å; W156-Y424 AromaticContact CZ2-CE1 3.9Å; W156-Y424 HydrophobicContact CZ2-CE1 3.9Å; W156-Y424 AromaticContact CZ2-CZ 3.84Å; W156-P425 HydrophobicContact CH2-CG 3.63Å; W156-P425 HydrophobicContact CZ2-CG 3.82Å; W156-H428 PolarHBondContact NE1-O 3.16Å; W156-A430 HydrophobicContact CB-CB 4.26Å; W156-A430 VanDerWaalsContact CD1-CA 3.48Å; W156-A430 HydrophobicContact CD2-CB 3.72Å; W156-A430 HydrophobicContact CE3-CB 4.24Å; W156-A430 HydrophobicContact CG-CB 3.73Å
157	N	98.9	Very high	93.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	112.4	158.1	-177.5	-20.9	0	0	0	107.6	L159 Q202 E203 D338 S426 H428	N157-L159 VanDerWaalsContact C-N 3.3Å; N157-L159 PolarHBondContact O-N 2.88Å; N157-L159 PolarHBondContact OD1-N 2.93Å; N157-Q202 HydrophobicContact CB-CB 4.22Å; N157-Q202 VanDerWaalsContact N-OE1 3.11Å; N157-E203 PolarHBondContact ND2-OE1 3.13Å; N157-E203 WeakPolarHBondContact OD1-CB 3.3Å; N157-E203 VanDerWaalsContact OD1-CG 3.24Å; N157-E203 WeakPolarHBondContact OD1-CG 3.36Å; N157-E203 PolarHBondContact OD1-OE1 2.95Å; N157-D338 HydrophobicContact CB-CB 4.28Å; N157-D338 PolarHBondContact ND2-OD2 2.83Å; N157-S426 PolarHBondContact O-OG 3.08Å; N157-H428 HydrophobicContact CB-CB 3.98Å
158	I	98.9	Very high	94.8	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.01	13%	0.127	C	C	.	.			trans	-88.5	1.9	-172.9	66.3	168.6	0	0	0	113.3	W156 R183 I187 L201 Q202 V204 F211	W156-I158 HydrophobicContact CB-CG2 4.22Å; W156-I158 HydrophobicContact CD2-CG2 3.8Å; W156-I158 HydrophobicContact CE3-CG2 3.72Å; W156-I158 HydrophobicContact CG-CG2 4.03Å; W156-I158 HydrophobicContact CZ3-CG2 4.41Å; W156-I158 PolarHBondContact O-N 3.04Å; I158-R183 PolarHBondContact O-NH2 3.25Å; I158-I187 HydrophobicContact CB-CD1 4.27Å; I158-I187 HydrophobicContact CD1-CD1 4.47Å; I158-I187 HydrophobicContact CG2-CG2 4.38Å; I158-L201 HydrophobicContact CD1-CD1 4.45Å; I158-L201 HydrophobicContact CG2-CB 4.43Å; I158-L201 HydrophobicContact CG2-CD1 4.33Å; I158-L201 HydrophobicContact CG2-CD2 3.79Å; I158-L201 HydrophobicContact CG2-CG 4.39Å; I158-Q202 WeakPolarHBondContact CG1-O 3.29Å; I158-Q202 PolarHBondContact N-O 2.71Å; I158-V204 HydrophobicContact CD1-CB 4.37Å; I158-V204 HydrophobicContact CD1-CG1 4.37Å; I158-V204 HydrophobicContact CD1-CG2 3.89Å; I158-V204 HydrophobicContact CG1-CG2 4.31Å; I158-F211 HydrophobicContact CD1-CD2 4.4Å; I158-F211 HydrophobicContact CD1-CE1 4.43Å; I158-F211 HydrophobicContact CD1-CE2 3.46Å; I158-F211 VanDerWaalsContact CD1-CE2 3.46Å; I158-F211 HydrophobicContact CD1-CZ 3.48Å; I158-F211 VanDerWaalsContact CD1-CZ 3.48Å
159	L	98.8	Very high	95.4	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.01	14%	0.144	C	C	.	.			trans	59	109.4	-173.5	168.5	67.9	0	0	0	112.1	N157 Q161 D168 F170 R183 E203 P420	N157-L159 VanDerWaalsContact C-N 3.3Å; N157-L159 PolarHBondContact O-N 2.88Å; N157-L159 PolarHBondContact OD1-N 2.93Å; L159-Q161 PolarHBondContact O-N 3.33Å; L159-D168 WeakPolarHBondContact CD1-OD2 3.26Å; L159-F170 HydrophobicContact CD1-CE2 4.02Å; L159-F170 HydrophobicContact CD1-CZ 3.97Å; L159-F170 HydrophobicContact CD2-CE2 3.6Å; L159-F170 HydrophobicContact CD2-CZ 3.83Å; L159-F170 HydrophobicContact CG-CE2 4.46Å; L159-R183 VanDerWaalsContact CB-NH2 3.32Å; L159-R183 PolarHBondContact O-NH1 3.03Å; L159-R183 VanDerWaalsContact O-NH1 3.17Å; L159-R183 PolarHBondContact O-NH2 2.97Å; L159-E203 WeakPolarHBondContact CA-OE2 3.37Å; L159-P420 HydrophobicContact CD2-CG 4.1Å
160	A	98.8	Very high	95.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.133	C	C	.	.			trans	-60.1	137.9	179.5	0	0	0	0	0	110.3	A162 L163 G164 E203 D205 D242	A160-A162 VanDerWaalsContact C-N 3.32Å; A160-A162 PolarHBondContact O-N 3.15Å; A160-L163 HydrophobicContact CB-CB 4.19Å; A160-L163 HydrophobicContact CB-CD1 3.99Å; A160-L163 HydrophobicContact CB-CG 3.85Å; A160-L163 PolarHBondContact O-N 3.16Å; A160-L163 VanDerWaalsContact O-N 3.13Å; A160-G164 PolarHBondContact O-N 2.93Å; A160-E203 VanDerWaalsContact CA-O 3.24Å; A160-E203 WeakPolarHBondContact CA-O 3.4Å; A160-E203 HydrophobicContact CB-CB 3.92Å; A160-E203 WeakPolarHBondContact CB-O 3.23Å; A160-E203 PolarHBondContact N-O 2.89Å; A160-E203 PolarHBondContact N-OE2 2.83Å; A160-D205 HydrophobicContact CB-CB 4.19Å; A160-D242 HydrophobicContact CB-CB 4.05Å
161	Q	98.4	Very high	96	Very high	8 Å²	8	25.5 Å²	25.5	4%	0.037	14%	0.14	C	C	.	.	H	α-helix	trans	-58.4	-46.7	-178.1	-176.9	61.4	19.9	0	0	111.6	L159 L163 G164 E165 L178 W180 D205	L159-Q161 PolarHBondContact O-N 3.33Å; Q161-L163 VanDerWaalsContact C-N 3.26Å; Q161-L163 PolarHBondContact O-N 2.88Å; Q161-G164 PolarHBondContact O-N 2.83Å; Q161-E165 PolarHBondContact NE2-OE1 2.92Å; Q161-E165 PolarHBondContact O-N 2.94Å; Q161-E165 VanDerWaalsContact O-N 3.15Å; Q161-L178 PolarHBondContact NE2-O 2.81Å; Q161-L178 PolarHBondContact OE1-O 3.49Å; Q161-W180 HydrophobicContact CB-CE3 4.26Å; Q161-W180 HydrophobicContact CG-CB 3.87Å; Q161-W180 HydrophobicContact CG-CE3 4.39Å; Q161-W180 HydrophobicContact CG-CG 4.35Å; Q161-D205 VanDerWaalsContact N-CG 3.31Å; Q161-D205 PolarHBondContact N-OD1 3.1Å; Q161-D205 PolarHBondContact N-OD2 2.84Å
162	A	97.8	Very high	96	Very high	6 Å²	6	31.9 Å²	31.9	5%	0.05	16%	0.164	C	C	.	.	H	α-helix	trans	-59.4	-38.3	178.3	0	0	0	0	0	111.9	A160 G166 D205 C232 V235 N238	A160-A162 VanDerWaalsContact C-N 3.32Å; A160-A162 PolarHBondContact O-N 3.15Å; A162-G166 WeakPolarHBondContact O-CA 3.25Å; A162-G166 PolarHBondContact O-N 3.43Å; A162-D205 PolarHBondContact N-OD2 2.8Å; A162-C232 HydrophobicContact CB-CB 3.79Å; A162-V235 HydrophobicContact CB-CB 4.16Å; A162-V235 HydrophobicContact CB-CG1 4.36Å; A162-V235 HydrophobicContact CB-CG2 4.44Å; A162-V235 WeakPolarHBondContact O-CG1 3.26Å; A162-V235 WeakPolarHBondContact O-CG2 3.46Å; A162-N238 HydrophobicContact CB-CB 3.83Å
163	L	96.9	Very high	95.9	Very high	12 Å²	12	29.8 Å²	29.8	6%	0.063	16%	0.158	C	C	.	.	H	α-helix	trans	-72.9	-41.6	179.5	-58.8	-175.5	0	0	0	111.9	A160 Q161 E165 G166 K167 D168 P231	A160-L163 HydrophobicContact CB-CB 4.19Å; A160-L163 HydrophobicContact CB-CD1 3.99Å; A160-L163 HydrophobicContact CB-CG 3.85Å; A160-L163 PolarHBondContact O-N 3.16Å; A160-L163 VanDerWaalsContact O-N 3.13Å; Q161-L163 VanDerWaalsContact C-N 3.26Å; Q161-L163 PolarHBondContact O-N 2.88Å; L163-E165 PolarHBondContact O-N 2.81Å; L163-G166 PolarHBondContact O-N 2.87Å; L163-K167 HydrophobicContact CD2-CB 4.31Å; L163-K167 HydrophobicContact CD2-CD 3.76Å; L163-K167 HydrophobicContact CD2-CG 4.47Å; L163-K167 PolarHBondContact O-N 3.03Å; L163-D168 WeakPolarHBondContact O-CB 3.35Å; L163-D168 PolarHBondContact O-N 2.91Å; L163-P231 HydrophobicContact CD1-CG 4.12Å; L163-P231 HydrophobicContact CD2-CB 4.01Å; L163-P231 HydrophobicContact CD2-CG 4.02Å
164	G	94.9	Very high	95.7	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-58.1	-46.2	178.6	0	0	0	0	0	113	A160 Q161	A160-G164 PolarHBondContact O-N 2.93Å; Q161-G164 PolarHBondContact O-N 2.83Å
165	E	91.1	Very high	95.4	Very high	121 Å²	121	38.4 Å²	38.4	57%	0.565	21%	0.206	S	C	*	.	H	α-helix	trans	-78.8	-39.7	178.9	-67.9	-178	171.5	0	0	113.1	Q161 L163	Q161-E165 PolarHBondContact NE2-OE1 2.92Å; Q161-E165 PolarHBondContact O-N 2.94Å; Q161-E165 VanDerWaalsContact O-N 3.15Å; L163-E165 PolarHBondContact O-N 2.81Å
166	G	86.6	Confident	95.2	Very high	46 Å²	46	43.5 Å²	43.5	47%	0.474	23%	0.23	S	C	.	.	H	α-helix	trans	-103.6	-25.8	-164	0	0	0	0	0	116.7	A162 L163	A162-G166 WeakPolarHBondContact O-CA 3.25Å; A162-G166 PolarHBondContact O-N 3.43Å; L163-G166 PolarHBondContact O-N 2.87Å
167	K	88	Confident	95	Very high	74 Å²	74	43.5 Å²	43.5	32%	0.322	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.2	-32.3	-170.2	-79.8	-176.3	170.1	-178.3	0	114.3	L163 P231 D234 V235	L163-K167 HydrophobicContact CD2-CB 4.31Å; L163-K167 HydrophobicContact CD2-CD 3.76Å; L163-K167 HydrophobicContact CD2-CG 4.47Å; L163-K167 PolarHBondContact O-N 3.03Å; K167-P231 HydrophobicContact CD-CB 4.48Å; K167-P231 WeakPolarHBondContact CE-O 3.36Å; K167-P231 PolarHBondContact NZ-O 2.84Å; K167-D234 IonicContact NZ-OD2 3.53Å; K167-D234 PolarHBondContact NZ-OD2 3.09Å; K167-V235 HydrophobicContact CD-CG2 3.99Å; K167-V235 HydrophobicContact CG-CG2 3.87Å
168	D	88.3	Confident	94.8	Very high	24 Å²	24	43.8 Å²	43.8	13%	0.128	23%	0.231	C	C	.	.	S	Bend	trans	-80.8	-25.5	-164.1	-86.6	-5.3	0	0	0	114.6	L159 L163 F170 R381	L159-D168 WeakPolarHBondContact CD1-OD2 3.26Å; L163-D168 WeakPolarHBondContact O-CB 3.35Å; L163-D168 PolarHBondContact O-N 2.91Å; D168-F170 HydrophobicContact CB-CD2 4Å; D168-F170 HydrophobicContact CB-CE1 4.31Å; D168-F170 HydrophobicContact CB-CE2 3.42Å; D168-F170 VanDerWaalsContact CB-CE2 3.42Å; D168-F170 HydrophobicContact CB-CZ 3.61Å; D168-F170 WeakPolarHBondContact OD2-CZ 3.32Å; D168-R381 VanDerWaalsContact CG-CZ 3.42Å; D168-R381 WeakPolarHBondContact O-CD 3.35Å; D168-R381 WeakPolarHBondContact O-CG 3.17Å; D168-R381 PolarHBondContact O-NH1 2.9Å; D168-R381 IonicContact OD1-CZ 2.66Å; D168-R381 IonicContact OD1-NH1 3.41Å; D168-R381 PolarHBondContact OD1-NH1 2.83Å; D168-R381 IonicContact OD1-NH2 3.07Å; D168-R381 PolarHBondContact OD1-NH2 2.77Å; D168-R381 IonicContact OD2-CZ 3.33Å; D168-R381 IonicContact OD2-NH1 2.94Å; D168-R381 IonicContact OD2-NH2 3.61Å; D168-R381 PolarHBondContact OD2-NH2 3Å
169	S	92.7	Very high	94.7	Very high	66 Å²	66	45.6 Å²	45.6	46%	0.462	24%	0.244	S	C	.	.			trans	55.1	56.2	172.4	-55.1	0	0	0	0	112.8	I171 P382	S169-I171 PolarHBondContact O-N 2.94Å; S169-P382 WeakPolarHBondContact O-CD 3.31Å
170	F	96.6	Very high	94.6	Very high	13 Å²	13	47.5 Å²	47.5	6%	0.057	25%	0.251	C	S	.	.			trans	-71.2	90.3	176.6	-60.4	-69.8	0	0	0	111.4	L159 D168 R172 C173 L178 K379 R381 P420 D427	L159-F170 HydrophobicContact CD1-CE2 4.02Å; L159-F170 HydrophobicContact CD1-CZ 3.97Å; L159-F170 HydrophobicContact CD2-CE2 3.6Å; L159-F170 HydrophobicContact CD2-CZ 3.83Å; L159-F170 HydrophobicContact CG-CE2 4.46Å; D168-F170 HydrophobicContact CB-CD2 4Å; D168-F170 HydrophobicContact CB-CE1 4.31Å; D168-F170 HydrophobicContact CB-CE2 3.42Å; D168-F170 VanDerWaalsContact CB-CE2 3.42Å; D168-F170 HydrophobicContact CB-CZ 3.61Å; D168-F170 WeakPolarHBondContact OD2-CZ 3.32Å; F170-R172 PolarHBondContact O-N 2.79Å; F170-R172 VanDerWaalsContact O-N 3.08Å; F170-C173 HydrophobicContact CB-CB 3.55Å; F170-C173 HydrophobicContact CG-CB 4.5Å; F170-C173 PolarHBondContact O-N 2.84Å; F170-C173 VanDerWaalsContact O-N 3.1Å; F170-L178 HydrophobicContact CD2-CD1 4.24Å; F170-L178 HydrophobicContact CD2-CD2 3.88Å; F170-L178 HydrophobicContact CE2-CD2 4.31Å; F170-K379 HydrophobicContact CD1-CB 4.35Å; F170-K379 HydrophobicContact CE1-CB 4.16Å; F170-K379 HydrophobicContact CE1-CD 4.33Å; F170-R381 HydrophobicContact CD1-CG 4.44Å; F170-P420 VanDerWaalsContact CD1-CD 3.45Å; F170-P420 HydrophobicContact CD1-CG 4.38Å; F170-P420 HydrophobicContact CD2-CG 3.89Å; F170-P420 HydrophobicContact CE1-CG 4.49Å; F170-P420 HydrophobicContact CE2-CG 4Å; F170-P420 HydrophobicContact CG-CG 4.07Å; F170-P420 HydrophobicContact CZ-CG 4.31Å; F170-D427 HydrophobicContact CE1-CB 3.68Å; F170-D427 HydrophobicContact CZ-CB 3.89Å
171	I	96.9	Very high	94.2	Very high	100 Å²	100	52.9 Å²	52.9	51%	0.513	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-10.2	-169	57.3	160.6	0	0	0	115	S169 I380 P382	S169-I171 PolarHBondContact O-N 2.94Å; I171-I380 HydrophobicContact CD1-CG2 3.82Å; I171-I380 HydrophobicContact CG1-CB 4.48Å; I171-I380 HydrophobicContact CG1-CG2 3.75Å; I171-I380 PolarHBondContact N-O 3.02Å; I171-P382 HydrophobicContact CG2-CG 3.81Å
172	R	97.1	Very high	93.7	Very high	135 Å²	135	54.3 Å²	54.3	51%	0.509	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-5.6	176.1	-61.4	-62.3	-65.1	-168.8	-1.5	113.1	F170 I380 D417	F170-R172 PolarHBondContact O-N 2.79Å; F170-R172 VanDerWaalsContact O-N 3.08Å; R172-I380 HydrophobicContact CB-CB 4.39Å; R172-I380 HydrophobicContact CB-CD1 4.38Å; R172-I380 HydrophobicContact CG-CB 3.88Å; R172-I380 HydrophobicContact CG-CD1 3.75Å; R172-I380 HydrophobicContact CG-CG1 4.38Å; R172-I380 HydrophobicContact CG-CG2 3.86Å; R172-D417 HydrophobicContact CB-CB 4.04Å; R172-D417 IonicContact CZ-OD1 2.8Å; R172-D417 IonicContact NE-OD1 3.15Å; R172-D417 PolarHBondContact NE-OD1 2.75Å; R172-D417 IonicContact NH2-OD1 2.79Å; R172-D417 PolarHBondContact NH2-OD1 2.8Å
173	C	97.2	Very high	93.7	Very high	14 Å²	14	54 Å²	54	10%	0.095	28%	0.281	C	S	.	.	S	Bend	trans	-88.7	128.1	177.3	-170.9	0	0	0	0	109.9	F170 P420	F170-C173 HydrophobicContact CB-CB 3.55Å; F170-C173 HydrophobicContact CG-CB 4.5Å; F170-C173 PolarHBondContact O-N 2.84Å; F170-C173 VanDerWaalsContact O-N 3.1Å; C173-P420 HydrophobicContact CB-CG 4.29Å; C173-P420 WeakPolarHBondContact CB-O 3.25Å; C173-P420 PolarHBondContact SG-O 3.13Å
174	P	95.1	Very high	93.7	Very high	45 Å²	45	54.9 Å²	54.9	29%	0.292	28%	0.284	S	S	.	.			trans	-59.1	136.5	169	-23.9	35.9	0	0	0	111.2	E176 A177 L178 Y422	P174-E176 PolarHBondContact O-N 2.78Å; P174-A177 HydrophobicContact CB-CB 4.36Å; P174-A177 WeakPolarHBondContact O-CB 3.49Å; P174-A177 PolarHBondContact O-N 2.8Å; P174-L178 PolarHBondContact O-N 2.95Å; P174-Y422 HydrophobicContact CB-CE1 4.37Å; P174-Y422 HydrophobicContact CB-CE2 3.76Å; P174-Y422 HydrophobicContact CG-CD2 4.05Å; P174-Y422 HydrophobicContact CG-CE2 3.5Å; P174-Y422 VanDerWaalsContact CG-CE2 3.5Å
175	L	93.4	Very high	93.8	Very high	136 Å²	136	55.2 Å²	55.2	71%	0.712	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-61	-31.9	-178.7	-67.6	177.6	0	0	0	112.1	A177 L178 S179	L175-A177 VanDerWaalsContact C-N 3.28Å; L175-A177 PolarHBondContact O-N 3.28Å; L175-L178 HydrophobicContact CD2-CD1 4.37Å; L175-L178 WeakPolarHBondContact O-CB 3.28Å; L175-L178 PolarHBondContact O-N 3.44Å; L175-L178 VanDerWaalsContact O-N 3.09Å; L175-S179 PolarHBondContact O-N 3.42Å
176	E	93.1	Very high	94.1	Very high	107 Å²	107	49.9 Å²	49.9	50%	0.5	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-64.5	-35.1	177	-58	77.7	-170.8	0	0	111.6	P174 L178 S179 Y422	P174-E176 PolarHBondContact O-N 2.78Å; E176-L178 PolarHBondContact O-N 2.69Å; E176-S179 VanDerWaalsContact O-CB 3.23Å; E176-S179 WeakPolarHBondContact O-CB 3.27Å; E176-S179 PolarHBondContact O-N 3.01Å; E176-S179 VanDerWaalsContact O-N 3.13Å; E176-Y422 HydrophobicContact CB-CE1 4.09Å; E176-Y422 PolarHBondContact OE2-OH 2.78Å
177	A	94.7	Very high	94.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-69.1	-21.6	175.7	0	0	0	0	0	112.4	P174 L175 S179 R183 Y422	P174-A177 HydrophobicContact CB-CB 4.36Å; P174-A177 WeakPolarHBondContact O-CB 3.49Å; P174-A177 PolarHBondContact O-N 2.8Å; L175-A177 VanDerWaalsContact C-N 3.28Å; L175-A177 PolarHBondContact O-N 3.28Å; A177-S179 VanDerWaalsContact C-N 3.31Å; A177-R183 VanDerWaalsContact O-CG 3.31Å; A177-R183 WeakPolarHBondContact O-CG 3.24Å; A177-Y422 HydrophobicContact CB-CD1 3.64Å; A177-Y422 HydrophobicContact CB-CE1 3.86Å; A177-Y422 HydrophobicContact CB-CG 4.12Å
178	L	95.9	Very high	95.1	Very high	6 Å²	6	44.3 Å²	44.3	3%	0.031	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-81.7	-8.9	174	-66.2	174.5	0	0	0	113	Q161 F170 P174 L175 E176 W180 R183 P420	Q161-L178 PolarHBondContact NE2-O 2.81Å; Q161-L178 PolarHBondContact OE1-O 3.49Å; F170-L178 HydrophobicContact CD2-CD1 4.24Å; F170-L178 HydrophobicContact CD2-CD2 3.88Å; F170-L178 HydrophobicContact CE2-CD2 4.31Å; P174-L178 PolarHBondContact O-N 2.95Å; L175-L178 HydrophobicContact CD2-CD1 4.37Å; L175-L178 WeakPolarHBondContact O-CB 3.28Å; L175-L178 PolarHBondContact O-N 3.44Å; L175-L178 VanDerWaalsContact O-N 3.09Å; E176-L178 PolarHBondContact O-N 2.69Å; L178-W180 PolarHBondContact O-N 3.43Å; L178-R183 WeakPolarHBondContact O-CD 3.36Å; L178-P420 HydrophobicContact CD2-CB 4.46Å; L178-P420 HydrophobicContact CD2-CG 3.55Å
179	S	95.5	Very high	95.5	Very high	41 Å²	41	44.5 Å²	44.5	29%	0.287	22%	0.222	S	C	.	.			trans	-63.8	130.7	-176.2	-175.4	0	0	0	0	112.4	L175 E176 A177 H181 E182 R183	L175-S179 PolarHBondContact O-N 3.42Å; E176-S179 VanDerWaalsContact O-CB 3.23Å; E176-S179 WeakPolarHBondContact O-CB 3.27Å; E176-S179 PolarHBondContact O-N 3.01Å; E176-S179 VanDerWaalsContact O-N 3.13Å; A177-S179 VanDerWaalsContact C-N 3.31Å; S179-H181 PolarHBondContact O-N 3.37Å; S179-H181 VanDerWaalsContact O-N 3.13Å; S179-H181 PolarHBondContact OG-N 3.16Å; S179-E182 PolarHBondContact O-N 3.22Å; S179-R183 WeakPolarHBondContact O-CG 3.33Å; S179-R183 PolarHBondContact O-N 2.99Å
180	W	97.1	Very high	95.7	Very high	42 Å²	42	41.5 Å²	41.5	16%	0.159	20%	0.201	C	C	.	.	H	α-helix	trans	-55.9	-31.6	174.2	-175.2	-127.8	0	0	0	113.2	Q161 L178 E182 R183 K184 I187 H206 T210 F211	Q161-W180 HydrophobicContact CB-CE3 4.26Å; Q161-W180 HydrophobicContact CG-CB 3.87Å; Q161-W180 HydrophobicContact CG-CE3 4.39Å; Q161-W180 HydrophobicContact CG-CG 4.35Å; L178-W180 PolarHBondContact O-N 3.43Å; W180-E182 PolarHBondContact O-N 3.33Å; W180-E182 VanDerWaalsContact O-N 3.12Å; W180-R183 HydrophobicContact CE3-CB 4.34Å; W180-K184 HydrophobicContact CD2-CB 4.12Å; W180-K184 HydrophobicContact CE3-CB 4.19Å; W180-K184 HydrophobicContact CH2-CB 3.69Å; W180-K184 HydrophobicContact CZ2-CB 3.61Å; W180-K184 HydrophobicContact CZ3-CB 3.99Å; W180-K184 VanDerWaalsContact O-CG 3.31Å; W180-K184 WeakPolarHBondContact O-CG 3.33Å; W180-K184 PolarHBondContact O-N 3.37Å; W180-I187 HydrophobicContact CZ3-CD1 4.13Å; W180-H206 AromaticContact CD1-CE1 3.65Å; W180-H206 AromaticContact CD2-CD2 3.87Å; W180-H206 AromaticContact CD2-NE2 3.89Å; W180-H206 AromaticContact CE2-CD2 3.72Å; W180-H206 AromaticContact CE2-CE1 3.77Å; W180-H206 AromaticContact CE2-CG 3.48Å; W180-H206 VanDerWaalsContact CE2-CG 3.48Å; W180-H206 AromaticContact CE2-ND1 3.52Å; W180-H206 AromaticContact CE2-NE2 3.9Å; W180-H206 HydrophobicContact CH2-CB 3.63Å; W180-H206 AromaticContact CH2-CG 3.86Å; W180-H206 HydrophobicContact CZ2-CB 3.33Å; W180-H206 AromaticContact CZ2-CD2 3.86Å; W180-H206 AromaticContact CZ2-CG 3.35Å; W180-H206 AromaticContact CZ2-ND1 3.75Å; W180-H206 HydrophobicContact CZ3-CB 4.49Å; W180-H206 AromaticContact NE1-CE1 3.42Å; W180-H206 PolarHBondContact NE1-CE1 2.93Å; W180-H206 AromaticContact NE1-CG 3.82Å; W180-H206 AromaticContact NE1-ND1 3.33Å; W180-H206 PolarHBondContact NE1-ND1 2.97Å; W180-H206 AromaticContact NE1-NE2 3.93Å; W180-T210 HydrophobicContact CZ2-CG2 3.93Å; W180-F211 AromaticContact CH2-CE2 3.86Å; W180-F211 HydrophobicContact CH2-CE2 3.86Å; W180-F211 AromaticContact CH2-CZ 3.72Å; W180-F211 HydrophobicContact CH2-CZ 3.72Å; W180-F211 HydrophobicContact CZ3-CZ 4.49Å
181	H	91.3	Very high	95.8	Very high	113 Å²	113	41 Å²	41	52%	0.523	20%	0.199	S	C	.	.	H	α-helix	trans	-56.9	-30.4	179.5	-169.3	80.2	0	0	0	112.1	S179 Y185	S179-H181 PolarHBondContact O-N 3.37Å; S179-H181 VanDerWaalsContact O-N 3.13Å; S179-H181 PolarHBondContact OG-N 3.16Å; H181-Y185 WeakPolarHBondContact O-CD2 3.4Å; H181-Y185 WeakPolarHBondContact O-CE2 3.48Å
182	E	88.6	Confident	95.8	Very high	38 Å²	38	36.6 Å²	36.6	18%	0.178	18%	0.176	C	C	.	.	H	α-helix	trans	-106.7	-42.3	-177.7	-59.1	-172.4	173.9	0	0	112.4	R126 S179 W180 K184 Y185 Q186	R126-E182 IonicContact CZ-OE1 3.2Å; R126-E182 IonicContact CZ-OE2 2.65Å; R126-E182 IonicContact NE-OE1 2.75Å; R126-E182 PolarHBondContact NE-OE1 3.02Å; R126-E182 IonicContact NE-OE2 3.87Å; R126-E182 PolarHBondContact NE-OE2 2.98Å; R126-E182 IonicContact NH2-OE1 3.15Å; R126-E182 PolarHBondContact NH2-OE1 3.07Å; R126-E182 IonicContact NH2-OE2 2.68Å; R126-E182 PolarHBondContact NH2-OE2 2.87Å; S179-E182 PolarHBondContact O-N 3.22Å; W180-E182 PolarHBondContact O-N 3.33Å; W180-E182 VanDerWaalsContact O-N 3.12Å; E182-K184 PolarHBondContact O-N 3.3Å; E182-Y185 PolarHBondContact O-N 2.92Å; E182-Q186 PolarHBondContact O-N 3.21Å
183	R	97.3	Very high	95.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-55.7	-40.1	-178.8	-73.8	-173.7	64.5	-147.3	-5.4	112.3	I158 L159 A177 L178 S179 W180 Y185 Q186 I187 P425	I158-R183 PolarHBondContact O-NH2 3.25Å; L159-R183 VanDerWaalsContact CB-NH2 3.32Å; L159-R183 PolarHBondContact O-NH1 3.03Å; L159-R183 VanDerWaalsContact O-NH1 3.17Å; L159-R183 PolarHBondContact O-NH2 2.97Å; A177-R183 VanDerWaalsContact O-CG 3.31Å; A177-R183 WeakPolarHBondContact O-CG 3.24Å; L178-R183 WeakPolarHBondContact O-CD 3.36Å; S179-R183 WeakPolarHBondContact O-CG 3.33Å; S179-R183 PolarHBondContact O-N 2.99Å; W180-R183 HydrophobicContact CE3-CB 4.34Å; R183-Y185 VanDerWaalsContact C-N 3.29Å; R183-Y185 PolarHBondContact O-N 3.47Å; R183-Q186 PolarHBondContact O-N 3.2Å; R183-I187 VanDerWaalsContact O-CG1 3.27Å; R183-I187 WeakPolarHBondContact O-CG1 3.23Å; R183-I187 PolarHBondContact O-N 2.89Å; R183-P425 HydrophobicContact CB-CB 4.2Å; R183-P425 HydrophobicContact CG-CB 4.24Å; R183-P425 PolarHBondContact NE-O 3.23Å; R183-P425 PolarHBondContact NH2-O 3.32Å
184	K	97.1	Very high	95.7	Very high	29 Å²	29	32.4 Å²	32.4	13%	0.126	16%	0.164	C	C	.	.	H	α-helix	trans	-57.6	-40.4	177.5	73.9	-175.3	-178.7	169.8	0	112.6	W180 E182 I187 L188	W180-K184 HydrophobicContact CD2-CB 4.12Å; W180-K184 HydrophobicContact CE3-CB 4.19Å; W180-K184 HydrophobicContact CH2-CB 3.69Å; W180-K184 HydrophobicContact CZ2-CB 3.61Å; W180-K184 HydrophobicContact CZ3-CB 3.99Å; W180-K184 VanDerWaalsContact O-CG 3.31Å; W180-K184 WeakPolarHBondContact O-CG 3.33Å; W180-K184 PolarHBondContact O-N 3.37Å; E182-K184 PolarHBondContact O-N 3.3Å; K184-I187 PolarHBondContact O-N 3.48Å; K184-L188 WeakPolarHBondContact O-CB 3.44Å; K184-L188 WeakPolarHBondContact O-CG 3.23Å; K184-L188 PolarHBondContact O-N 3.05Å
185	Y	96.4	Very high	95.8	Very high	9 Å²	9	34.2 Å²	34.2	4%	0.035	17%	0.165	C	C	.	.	H	α-helix	trans	-72.5	-37.2	-179.7	-66.1	-65.3	0	0	0	111.3	F82 C119 A122 H181 E182 R183 L188 E189	F82-Y185 HydrophobicContact CD2-CE1 4.31Å; F82-Y185 HydrophobicContact CE1-CE1 4.5Å; F82-Y185 AromaticContact CE2-CE1 3.6Å; F82-Y185 HydrophobicContact CE2-CE1 3.6Å; F82-Y185 AromaticContact CZ-CE1 3.7Å; F82-Y185 HydrophobicContact CZ-CE1 3.7Å; C119-Y185 HydrophobicContact CB-CD1 4.46Å; A122-Y185 HydrophobicContact CB-CD1 4.11Å; A122-Y185 HydrophobicContact CB-CD2 3.66Å; A122-Y185 HydrophobicContact CB-CE1 4.25Å; A122-Y185 HydrophobicContact CB-CE2 3.8Å; A122-Y185 HydrophobicContact CB-CG 3.82Å; H181-Y185 WeakPolarHBondContact O-CD2 3.4Å; H181-Y185 WeakPolarHBondContact O-CE2 3.48Å; E182-Y185 PolarHBondContact O-N 2.92Å; R183-Y185 VanDerWaalsContact C-N 3.29Å; R183-Y185 PolarHBondContact O-N 3.47Å; Y185-L188 PolarHBondContact O-N 3.2Å; Y185-E189 WeakPolarHBondContact O-CB 3.29Å; Y185-E189 PolarHBondContact O-N 3.5Å
186	Q	97.3	Very high	96	Very high	10 Å²	10	27.7 Å²	27.7	5%	0.047	13%	0.131	C	C	.	.	H	α-helix	trans	-65.8	-39.5	174.9	-67.3	178.7	58.2	0	0	111.6	L123 E182 R183 E190 Y424 P425	L123-Q186 HydrophobicContact CD1-CB 4.37Å; L123-Q186 HydrophobicContact CD1-CG 3.7Å; L123-Q186 HydrophobicContact CD2-CG 3.66Å; L123-Q186 HydrophobicContact CG-CG 4.35Å; E182-Q186 PolarHBondContact O-N 3.21Å; R183-Q186 PolarHBondContact O-N 3.2Å; Q186-E190 PolarHBondContact O-N 3.37Å; Q186-E190 VanDerWaalsContact O-N 3.1Å; Q186-Y424 VanDerWaalsContact OE1-N 3.09Å; Q186-P425 HydrophobicContact CB-CB 3.73Å; Q186-P425 HydrophobicContact CB-CG 3.67Å
187	I	98.5	Very high	96.3	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-64.4	-46.2	175.9	-65.3	163.5	0	0	0	110.3	W156 I158 W180 R183 K184 E190 I191 F211 P425	W156-I187 HydrophobicContact CE3-CG2 4.41Å; W156-I187 HydrophobicContact CH2-CB 4.34Å; W156-I187 HydrophobicContact CH2-CG1 4.06Å; W156-I187 HydrophobicContact CH2-CG2 4.42Å; W156-I187 HydrophobicContact CZ3-CB 4.14Å; W156-I187 HydrophobicContact CZ3-CG1 4.23Å; W156-I187 HydrophobicContact CZ3-CG2 3.76Å; I158-I187 HydrophobicContact CB-CD1 4.27Å; I158-I187 HydrophobicContact CD1-CD1 4.47Å; I158-I187 HydrophobicContact CG2-CG2 4.38Å; W180-I187 HydrophobicContact CZ3-CD1 4.13Å; R183-I187 VanDerWaalsContact O-CG1 3.27Å; R183-I187 WeakPolarHBondContact O-CG1 3.23Å; R183-I187 PolarHBondContact O-N 2.89Å; K184-I187 PolarHBondContact O-N 3.48Å; I187-E190 PolarHBondContact O-N 2.86Å; I187-I191 HydrophobicContact CG2-CD1 4.24Å; I187-I191 WeakPolarHBondContact O-CG1 3.45Å; I187-I191 PolarHBondContact O-N 3.29Å; I187-F211 HydrophobicContact CB-CE1 4.47Å; I187-F211 HydrophobicContact CD1-CZ 4.22Å; I187-F211 HydrophobicContact CG2-CE1 3.63Å; I187-F211 HydrophobicContact CG2-CZ 3.94Å; I187-P425 HydrophobicContact CD1-CB 4.44Å; I187-P425 HydrophobicContact CG1-CB 3.85Å; I187-P425 HydrophobicContact CG1-CG 3.62Å
188	L	97.6	Very high	96.5	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-65.4	-41.4	177.9	-70.3	173.8	0	0	0	112	K184 Y185 E190 I191 L192 V214	K184-L188 WeakPolarHBondContact O-CB 3.44Å; K184-L188 WeakPolarHBondContact O-CG 3.23Å; K184-L188 PolarHBondContact O-N 3.05Å; Y185-L188 PolarHBondContact O-N 3.2Å; L188-E190 VanDerWaalsContact C-N 3.33Å; L188-E190 PolarHBondContact O-N 2.76Å; L188-I191 PolarHBondContact O-N 2.78Å; L188-L192 HydrophobicContact CB-CD1 4.34Å; L188-L192 VanDerWaalsContact O-CB 3.26Å; L188-L192 WeakPolarHBondContact O-CB 3.42Å; L188-L192 WeakPolarHBondContact O-CD1 3.25Å; L188-L192 WeakPolarHBondContact O-CG 3.43Å; L188-L192 PolarHBondContact O-N 3.11Å; L188-V214 HydrophobicContact CD1-CG1 4.21Å; L188-V214 HydrophobicContact CD2-CB 4.49Å; L188-V214 HydrophobicContact CD2-CG1 3.69Å
189	E	96.3	Very high	96.6	Very high	29 Å²	29	23 Å²	23	14%	0.136	11%	0.109	C	C	.	.	H	α-helix	trans	-58.2	-43.1	176	-175.8	-176.4	-132.2	0	0	111.6	L116 C119 L123 Y185 L192 T193	L116-E189 HydrophobicContact CD1-CG 3.88Å; C119-E189 HydrophobicContact CB-CB 4.11Å; L123-E189 HydrophobicContact CD1-CB 4.49Å; Y185-E189 WeakPolarHBondContact O-CB 3.29Å; Y185-E189 PolarHBondContact O-N 3.5Å; E189-L192 PolarHBondContact O-N 3.19Å; E189-T193 VanDerWaalsContact O-CB 3.26Å; E189-T193 WeakPolarHBondContact O-CB 3.48Å; E189-T193 PolarHBondContact O-N 3.1Å; E189-T193 PolarHBondContact O-OG1 3.17Å
190	E	97.2	Very high	96.8	Very high	3 Å²	3	21 Å²	21	1%	0.014	10%	0.095	C	C	.	.	H	α-helix	trans	-61.6	-47.4	176.4	-169.3	83.5	156.3	0	0	110.9	R129 R132 W156 Q186 I187 L188 Y194 Y424 A430	R129-E190 IonicContact CZ-OE2 2.91Å; R129-E190 IonicContact NE-OE2 3.94Å; R129-E190 IonicContact NH1-OE2 2.74Å; R129-E190 PolarHBondContact NH1-OE2 3.21Å; R132-E190 IonicContact NH1-OE1 2.75Å; W156-E190 HydrophobicContact CH2-CB 3.9Å; W156-E190 HydrophobicContact CH2-CG 4Å; W156-E190 HydrophobicContact CZ3-CB 3.79Å; W156-E190 HydrophobicContact CZ3-CG 3.92Å; Q186-E190 PolarHBondContact O-N 3.37Å; Q186-E190 VanDerWaalsContact O-N 3.1Å; I187-E190 PolarHBondContact O-N 2.86Å; L188-E190 VanDerWaalsContact C-N 3.33Å; L188-E190 PolarHBondContact O-N 2.76Å; E190-Y194 HydrophobicContact CG-CD2 4.21Å; E190-Y194 HydrophobicContact CG-CE2 4.15Å; E190-Y194 WeakPolarHBondContact O-CD2 3.28Å; E190-Y194 PolarHBondContact O-N 3.35Å; E190-Y424 PolarHBondContact OE1-OH 3.27Å; E190-Y424 VanDerWaalsContact OE1-OH 3.1Å; E190-A430 HydrophobicContact CG-CB 4.17Å
191	I	98	Very high	96.9	Very high	2 Å²	2	19 Å²	19	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-64.2	-44.8	178.4	-64.9	169.6	0	0	0	111.2	L154 I187 L188 Y194 R195 P196 M215	L154-I191 HydrophobicContact CD2-CG1 3.83Å; I187-I191 HydrophobicContact CG2-CD1 4.24Å; I187-I191 WeakPolarHBondContact O-CG1 3.45Å; I187-I191 PolarHBondContact O-N 3.29Å; L188-I191 PolarHBondContact O-N 2.78Å; I191-Y194 PolarHBondContact O-N 3.22Å; I191-R195 PolarHBondContact O-N 2.85Å; I191-P196 HydrophobicContact CG2-CG 4.32Å; I191-P196 VanDerWaalsContact O-CD 3.22Å; I191-P196 WeakPolarHBondContact O-CD 3.2Å; I191-M215 HydrophobicContact CD1-SD 4.42Å; I191-M215 HydrophobicContact CG2-CE 4.24Å; I191-M215 HydrophobicContact CG2-SD 4.16Å
192	L	96.6	Very high	97.2	Very high	7 Å²	7	13.7 Å²	13.7	4%	0.037	6%	0.063	C	C	.	.	H	α-helix	trans	-70.2	-33.8	-177.6	-73.3	165.2	0	0	0	112.6	P112 L115 L116 L188 E189 R195 L218	P112-L192 HydrophobicContact CB-CD2 4Å; L115-L192 HydrophobicContact CB-CD1 4.07Å; L115-L192 HydrophobicContact CD2-CD1 3.87Å; L115-L192 HydrophobicContact CD2-CD2 4.4Å; L115-L192 HydrophobicContact CG-CD1 3.72Å; L116-L192 HydrophobicContact CB-CB 4.21Å; L116-L192 HydrophobicContact CB-CD1 4.32Å; L116-L192 HydrophobicContact CD1-CB 3.99Å; L188-L192 HydrophobicContact CB-CD1 4.34Å; L188-L192 VanDerWaalsContact O-CB 3.26Å; L188-L192 WeakPolarHBondContact O-CB 3.42Å; L188-L192 WeakPolarHBondContact O-CD1 3.25Å; L188-L192 WeakPolarHBondContact O-CG 3.43Å; L188-L192 PolarHBondContact O-N 3.11Å; E189-L192 PolarHBondContact O-N 3.19Å; L192-R195 WeakPolarHBondContact O-CG 3.38Å; L192-L218 HydrophobicContact CD2-CD1 3.76Å; L192-L218 HydrophobicContact CD2-CD2 3.83Å; L192-L218 HydrophobicContact CD2-CG 4.47Å
193	T	95.5	Very high	97.7	Very high	46 Å²	46	12.7 Å²	12.7	28%	0.282	6%	0.058	S	C	.	.	H	α-helix	trans	-60.6	-54.4	172.6	-64.4	0	0	0	0	109.8	R129 E189	R129-T193 PolarHBondContact NH2-OG1 2.77Å; E189-T193 VanDerWaalsContact O-CB 3.26Å; E189-T193 WeakPolarHBondContact O-CB 3.48Å; E189-T193 PolarHBondContact O-N 3.1Å; E189-T193 PolarHBondContact O-OG1 3.17Å
194	Y	96.6	Very high	97.8	Very high	16 Å²	16	12.7 Å²	12.7	6%	0.063	6%	0.058	C	C	.	.	H	α-helix	trans	-85.3	-16.6	-169.9	-65.9	-61.6	0	0	0	113.9	R129 R152 E190 I191 L406 L432	R129-Y194 PolarHBondContact NH1-OH 3.34Å; R152-Y194 WeakPolarHBondContact CD-O 3.41Å; R152-Y194 PolarHBondContact NH1-O 2.97Å; E190-Y194 HydrophobicContact CG-CD2 4.21Å; E190-Y194 HydrophobicContact CG-CE2 4.15Å; E190-Y194 WeakPolarHBondContact O-CD2 3.28Å; E190-Y194 PolarHBondContact O-N 3.35Å; I191-Y194 PolarHBondContact O-N 3.22Å; Y194-L406 HydrophobicContact CD1-CD1 4.35Å; Y194-L406 HydrophobicContact CD1-CD2 4.4Å; Y194-L406 HydrophobicContact CD2-CD2 4.17Å; Y194-L406 HydrophobicContact CE1-CD1 3.49Å; Y194-L406 VanDerWaalsContact CE1-CD1 3.49Å; Y194-L406 HydrophobicContact CE1-CD2 3.88Å; Y194-L406 HydrophobicContact CE1-CG 4.34Å; Y194-L406 HydrophobicContact CE2-CD2 3.61Å; Y194-L406 VanDerWaalsContact CZ-CD2 3.46Å; Y194-L432 VanDerWaalsContact CB-CD1 3.47Å; Y194-L432 HydrophobicContact CD1-CD1 4.41Å; Y194-L432 HydrophobicContact CD2-CD1 4.48Å; Y194-L432 HydrophobicContact CG-CD1 3.89Å
195	R	97.1	Very high	97.9	Very high	82 Å²	82	11.7 Å²	11.7	31%	0.309	5%	0.054	S	C	.	.			trans	49.4	51.3	175.2	-69.5	-156.6	177.9	100.8	-2.9	113.3	E113 I191 L192 R249	E113-R195 IonicContact OE1-CZ 3.37Å; E113-R195 VanDerWaalsContact OE1-CZ 3.3Å; E113-R195 IonicContact OE1-NE 3.56Å; E113-R195 IonicContact OE1-NH1 2.67Å; E113-R195 IonicContact OE1-NH2 3.37Å; E113-R195 PolarHBondContact OE1-NH2 2.72Å; E113-R195 IonicContact OE2-NH2 3.83Å; I191-R195 PolarHBondContact O-N 2.85Å; L192-R195 WeakPolarHBondContact O-CG 3.38Å; R195-R249 VanDerWaalsContact O-CZ 3.25Å; R195-R249 PolarHBondContact O-NH1 2.97Å; R195-R249 PolarHBondContact O-NH2 2.9Å
196	P	98.6	Very high	98	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.056	C	C	.	.			trans	-63.1	149.8	-177.6	29.7	-37.1	0	0	0	112.2	R152 L154 I191 V199 Y220 R249	R152-P196 HydrophobicContact CG-CB 4.06Å; L154-P196 HydrophobicContact CB-CB 3.77Å; L154-P196 HydrophobicContact CB-CG 3.93Å; L154-P196 HydrophobicContact CD2-CG 4.11Å; I191-P196 HydrophobicContact CG2-CG 4.32Å; I191-P196 VanDerWaalsContact O-CD 3.22Å; I191-P196 WeakPolarHBondContact O-CD 3.2Å; P196-V199 HydrophobicContact CB-CG2 4Å; P196-V199 HydrophobicContact CG-CG2 3.28Å; P196-Y220 VanDerWaalsContact O-CE1 3.23Å; P196-Y220 WeakPolarHBondContact O-CE1 3.15Å; P196-Y220 PolarHBondContact O-OH 3.12Å; P196-R249 PolarHBondContact O-NE 3.26Å
197	D	98.8	Very high	98.1	Very high	13 Å²	13	11.9 Å²	11.9	7%	0.07	6%	0.055	C	C	.	.	S	Bend	trans	-80.8	-27.1	172.6	-58.3	-54.7	0	0	0	111.8	I151 R152 Y248 R249 R252 F253	I151-D197 WeakPolarHBondContact CA-OD2 3.45Å; I151-D197 HydrophobicContact CG2-CB 4.42Å; R152-D197 PolarHBondContact N-OD2 2.82Å; R152-D197 PolarHBondContact O-N 3.25Å; D197-Y248 CarbonylContact O-C 3.51Å; D197-Y248 VanDerWaalsContact O-CA 3.31Å; D197-Y248 WeakPolarHBondContact O-CA 3.36Å; D197-R249 PolarHBondContact O-N 3.42Å; D197-R249 IonicContact OD1-NH1 3.49Å; D197-R252 IonicContact OD1-NE 3.66Å; D197-R252 IonicContact OD2-NE 3.86Å; D197-R252 IonicContact OD2-NH2 3.15Å; D197-F253 HydrophobicContact CB-CE2 3.86Å
198	I	98.9	Very high	98.1	Very high	0 Å²	0	19 Å²	19	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134	179.4	-68.9	157.3	0	0	0	108.9	I151 R152 V153 L154 F247 F253 L279 L288 V290	I151-I198 HydrophobicContact CG2-CD1 3.68Å; R152-I198 PolarHBondContact O-N 2.87Å; V153-I198 WeakPolarHBondContact CA-O 3.31Å; V153-I198 HydrophobicContact CG1-CB 4.47Å; V153-I198 HydrophobicContact CG1-CG2 4.15Å; V153-I198 HydrophobicContact CG2-CB 4.36Å; V153-I198 HydrophobicContact CG2-CD1 4.28Å; L154-I198 PolarHBondContact N-O 3.02Å; I198-F247 CarbonylContact C-O 3.56Å; I198-F247 WeakPolarHBondContact CA-O 3.47Å; I198-F253 HydrophobicContact CD1-CE2 3.93Å; I198-F253 HydrophobicContact CD1-CZ 3.91Å; I198-F253 HydrophobicContact CG1-CD2 4.46Å; I198-F253 HydrophobicContact CG1-CE2 3.94Å; I198-F253 HydrophobicContact CG1-CZ 4.43Å; I198-L279 HydrophobicContact CD1-CD1 4.23Å; I198-L279 HydrophobicContact CG1-CD1 4.24Å; I198-L288 HydrophobicContact CD1-CD2 4.09Å; I198-V290 HydrophobicContact CD1-CG2 3.71Å; I198-V290 HydrophobicContact CG2-CG1 3.59Å; I198-V290 HydrophobicContact CG2-CG2 4.35Å
199	V	98.9	Very high	98	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	120.4	179.4	-178.3	0	0	0	0	110.2	L154 P196 L201 M215 Y220 L246 F247	L154-V199 HydrophobicContact CB-CG2 4.38Å; L154-V199 HydrophobicContact CD2-CG1 4.03Å; L154-V199 HydrophobicContact CD2-CG2 4.35Å; P196-V199 HydrophobicContact CB-CG2 4Å; P196-V199 HydrophobicContact CG-CG2 3.28Å; V199-L201 HydrophobicContact CG1-CD1 4.15Å; V199-L201 HydrophobicContact CG1-CD2 3.47Å; V199-L201 VanDerWaalsContact CG1-CD2 3.47Å; V199-L201 HydrophobicContact CG1-CG 3.69Å; V199-M215 HydrophobicContact CB-CE 4.36Å; V199-M215 HydrophobicContact CG2-CE 4.01Å; V199-Y220 HydrophobicContact CG2-CE1 4.27Å; V199-L246 CarbonylContact O-C 3.57Å; V199-L246 WeakPolarHBondContact O-CA 3.39Å; V199-F247 HydrophobicContact CB-CB 4.16Å; V199-F247 HydrophobicContact CB-CD2 4.32Å; V199-F247 HydrophobicContact CG1-CD2 4.39Å; V199-F247 PolarHBondContact N-O 2.81Å; V199-F247 PolarHBondContact O-N 2.74Å
200	C	98.9	Very high	98.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	113.8	178	-67.6	0	0	0	0	109.1	L154 Q155 W156 V292 C336	L154-C200 PolarHBondContact O-N 2.82Å; Q155-C200 WeakPolarHBondContact CA-O 3.45Å; Q155-C200 PolarHBondContact OE1-O 2.97Å; W156-C200 PolarHBondContact N-O 2.86Å; C200-V292 HydrophobicContact CB-CB 3.86Å; C200-V292 HydrophobicContact CB-CG2 3.78Å; C200-C336 HydrophobicContact CB-CB 3.39Å; C200-C336 VanDerWaalsContact SG-SG 3.67Å
201	L	98.9	Very high	98.2	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	146.3	-176.8	-52.1	-179.1	0	0	0	112.1	W156 I158 V199 V204 C244 A245 F247	W156-L201 HydrophobicContact CB-CD2 3.99Å; W156-L201 VanDerWaalsContact O-CA 3.24Å; W156-L201 WeakPolarHBondContact O-CA 3.37Å; I158-L201 HydrophobicContact CD1-CD1 4.45Å; I158-L201 HydrophobicContact CG2-CB 4.43Å; I158-L201 HydrophobicContact CG2-CD1 4.33Å; I158-L201 HydrophobicContact CG2-CD2 3.79Å; I158-L201 HydrophobicContact CG2-CG 4.39Å; V199-L201 HydrophobicContact CG1-CD1 4.15Å; V199-L201 HydrophobicContact CG1-CD2 3.47Å; V199-L201 VanDerWaalsContact CG1-CD2 3.47Å; V199-L201 HydrophobicContact CG1-CG 3.69Å; L201-V204 HydrophobicContact CB-CG2 3.45Å; L201-V204 VanDerWaalsContact CB-CG2 3.45Å; L201-V204 HydrophobicContact CD1-CG2 4.18Å; L201-V204 HydrophobicContact CG-CG2 4.46Å; L201-C244 CarbonylContact O-C 3.56Å; L201-C244 VanDerWaalsContact O-CA 3.29Å; L201-C244 WeakPolarHBondContact O-CA 3.26Å; L201-A245 HydrophobicContact CB-CB 4.37Å; L201-A245 PolarHBondContact N-O 2.87Å; L201-A245 PolarHBondContact O-N 2.81Å; L201-F247 HydrophobicContact CD1-CE2 4.05Å
202	Q	98.9	Very high	98.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	159.3	167.1	-55.5	77.4	53.3	0	0	110.3	Q155 W156 N157 I158 V204 T293 H294 D338	Q155-Q202 VanDerWaalsContact NE2-CD 3.34Å; W156-Q202 VanDerWaalsContact C-OE1 3.25Å; W156-Q202 PolarHBondContact O-N 2.73Å; W156-Q202 PolarHBondContact O-OE1 3.29Å; N157-Q202 HydrophobicContact CB-CB 4.22Å; N157-Q202 VanDerWaalsContact N-OE1 3.11Å; I158-Q202 WeakPolarHBondContact CG1-O 3.29Å; I158-Q202 PolarHBondContact N-O 2.71Å; Q202-V204 VanDerWaalsContact C-N 3.31Å; Q202-V204 PolarHBondContact O-N 2.95Å; Q202-T293 VanDerWaalsContact CG-O 3.32Å; Q202-T293 WeakPolarHBondContact CG-O 3.46Å; Q202-H294 HydrophobicContact CB-CB 4.04Å; Q202-H294 HydrophobicContact CG-CB 3.71Å; Q202-D338 HydrophobicContact CG-CB 4.29Å
203	E	98.9	Very high	98.2	Very high	18 Å²	18	26.6 Å²	26.6	8%	0.084	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	60.7	38.4	-178.7	-57.8	-165.4	-163.5	0	0	113.5	N157 L159 A160 D205 G243 H294	N157-E203 PolarHBondContact ND2-OE1 3.13Å; N157-E203 WeakPolarHBondContact OD1-CB 3.3Å; N157-E203 VanDerWaalsContact OD1-CG 3.24Å; N157-E203 WeakPolarHBondContact OD1-CG 3.36Å; N157-E203 PolarHBondContact OD1-OE1 2.95Å; L159-E203 WeakPolarHBondContact CA-OE2 3.37Å; A160-E203 VanDerWaalsContact CA-O 3.24Å; A160-E203 WeakPolarHBondContact CA-O 3.4Å; A160-E203 HydrophobicContact CB-CB 3.92Å; A160-E203 WeakPolarHBondContact CB-O 3.23Å; A160-E203 PolarHBondContact N-O 2.89Å; A160-E203 PolarHBondContact N-OE2 2.83Å; E203-D205 PolarHBondContact O-N 3.09Å; E203-G243 PolarHBondContact N-O 2.82Å; E203-G243 VanDerWaalsContact N-O 3.1Å; E203-H294 VanDerWaalsContact CG-CE1 3.46Å; E203-H294 WeakPolarHBondContact CG-CE1 3.41Å; E203-H294 IonicContact OE1-CE1 3.67Å; E203-H294 PolarHBondContact OE1-CE1 3.49Å
204	V	98.9	Very high	98.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	105.2	176.8	-170.1	0	0	0	0	109.4	I158 L201 Q202 Y207 F211 F224 D242 G243 A245	I158-V204 HydrophobicContact CD1-CB 4.37Å; I158-V204 HydrophobicContact CD1-CG1 4.37Å; I158-V204 HydrophobicContact CD1-CG2 3.89Å; I158-V204 HydrophobicContact CG1-CG2 4.31Å; L201-V204 HydrophobicContact CB-CG2 3.45Å; L201-V204 VanDerWaalsContact CB-CG2 3.45Å; L201-V204 HydrophobicContact CD1-CG2 4.18Å; L201-V204 HydrophobicContact CG-CG2 4.46Å; Q202-V204 VanDerWaalsContact C-N 3.31Å; Q202-V204 PolarHBondContact O-N 2.95Å; V204-Y207 HydrophobicContact CG1-CD2 4.39Å; V204-F211 HydrophobicContact CG1-CD2 3.54Å; V204-F211 HydrophobicContact CG1-CE2 3.95Å; V204-F211 HydrophobicContact CG1-CG 4.49Å; V204-F224 HydrophobicContact CB-CD2 4.45Å; V204-F224 HydrophobicContact CB-CE2 4.01Å; V204-F224 HydrophobicContact CG1-CE2 4.47Å; V204-F224 WeakPolarHBondContact O-CE2 3.5Å; V204-F224 VanDerWaalsContact O-CZ 3.3Å; V204-F224 WeakPolarHBondContact O-CZ 3.38Å; V204-D242 WeakPolarHBondContact O-CA 3.35Å; V204-G243 PolarHBondContact N-O 3.44Å; V204-G243 VanDerWaalsContact N-O 3.09Å; V204-G243 PolarHBondContact O-N 3.44Å; V204-G243 VanDerWaalsContact O-N 3.13Å; V204-A245 HydrophobicContact CB-CB 4.4Å; V204-A245 HydrophobicContact CG2-CB 3.86Å
205	D	98.7	Very high	98.3	Very high	7 Å²	7	23.9 Å²	23.9	4%	0.037	11%	0.11	C	C	.	.	S	Bend	trans	-106.1	-5.9	172.5	63.2	-20.1	0	0	0	113.3	A160 Q161 A162 E203 N239 D242	A160-D205 HydrophobicContact CB-CB 4.19Å; Q161-D205 VanDerWaalsContact N-CG 3.31Å; Q161-D205 PolarHBondContact N-OD1 3.1Å; Q161-D205 PolarHBondContact N-OD2 2.84Å; A162-D205 PolarHBondContact N-OD2 2.8Å; E203-D205 PolarHBondContact O-N 3.09Å; D205-N239 PolarHBondContact O-ND2 2.92Å; D205-D242 HydrophobicContact CB-CB 4.27Å
206	H	98.7	Very high	98.3	Very high	16 Å²	16	20.8 Å²	20.8	7%	0.074	10%	0.102	C	C	.	.			trans	-112	36.1	175.6	-79.6	-86.8	0	0	0	113.5	W180 D209 T210 F211 N239	W180-H206 AromaticContact CD1-CE1 3.65Å; W180-H206 AromaticContact CD2-CD2 3.87Å; W180-H206 AromaticContact CD2-NE2 3.89Å; W180-H206 AromaticContact CE2-CD2 3.72Å; W180-H206 AromaticContact CE2-CE1 3.77Å; W180-H206 AromaticContact CE2-CG 3.48Å; W180-H206 VanDerWaalsContact CE2-CG 3.48Å; W180-H206 AromaticContact CE2-ND1 3.52Å; W180-H206 AromaticContact CE2-NE2 3.9Å; W180-H206 HydrophobicContact CH2-CB 3.63Å; W180-H206 AromaticContact CH2-CG 3.86Å; W180-H206 HydrophobicContact CZ2-CB 3.33Å; W180-H206 AromaticContact CZ2-CD2 3.86Å; W180-H206 AromaticContact CZ2-CG 3.35Å; W180-H206 AromaticContact CZ2-ND1 3.75Å; W180-H206 HydrophobicContact CZ3-CB 4.49Å; W180-H206 AromaticContact NE1-CE1 3.42Å; W180-H206 PolarHBondContact NE1-CE1 2.93Å; W180-H206 AromaticContact NE1-CG 3.82Å; W180-H206 AromaticContact NE1-ND1 3.33Å; W180-H206 PolarHBondContact NE1-ND1 2.97Å; W180-H206 AromaticContact NE1-NE2 3.93Å; H206-D209 VanDerWaalsContact C-OD1 3.31Å; H206-D209 WeakPolarHBondContact CA-OD1 3.2Å; H206-D209 IonicContact CE1-OD2 3.6Å; H206-D209 IonicContact CG-OD1 2.89Å; H206-D209 IonicContact CG-OD2 3.3Å; H206-D209 IonicContact ND1-OD1 2.79Å; H206-D209 PolarHBondContact ND1-OD1 2.83Å; H206-D209 IonicContact ND1-OD2 3.49Å; H206-D209 PolarHBondContact ND1-OD2 3.05Å; H206-T210 WeakPolarHBondContact O-CB 3.02Å; H206-T210 PolarHBondContact O-N 2.49Å; H206-F211 HydrophobicContact CB-CD2 4.3Å; H206-F211 HydrophobicContact CB-CE2 4.05Å; H206-F211 WeakPolarHBondContact O-CD2 3.26Å; H206-F211 PolarHBondContact O-N 3.24Å; H206-F211 VanDerWaalsContact O-N 3.11Å; H206-N239 PolarHBondContact ND1-ND2 2.64Å
207	Y	98.8	Very high	98.2	Very high	8 Å²	8	21.1 Å²	21.1	3%	0.031	10%	0.104	C	C	.	.	I	π-helix	trans	-64.4	-57.1	-175.6	-179.1	-97.8	0	0	0	112.1	V204 F211 Q212 G222 F224 A245 F247	V204-Y207 HydrophobicContact CG1-CD2 4.39Å; Y207-F211 PolarHBondContact O-N 2.6Å; Y207-Q212 HydrophobicContact CD1-CB 4.1Å; Y207-Q212 HydrophobicContact CE1-CB 3.74Å; Y207-Q212 HydrophobicContact CE1-CG 3.96Å; Y207-Q212 HydrophobicContact CE2-CB 4.33Å; Y207-Q212 VanDerWaalsContact O-CB 3.26Å; Y207-Q212 WeakPolarHBondContact O-CB 3.19Å; Y207-Q212 PolarHBondContact O-N 2.87Å; Y207-G222 PolarHBondContact OH-O 3.46Å; Y207-G222 VanDerWaalsContact OH-O 3.04Å; Y207-F224 HydrophobicContact CD1-CB 3.47Å; Y207-F224 VanDerWaalsContact CD1-CB 3.47Å; Y207-F224 HydrophobicContact CD1-CD1 4Å; Y207-F224 AromaticContact CD1-CG 3.8Å; Y207-F224 HydrophobicContact CD1-CG 3.8Å; Y207-F224 HydrophobicContact CD2-CB 3.6Å; Y207-F224 HydrophobicContact CD2-CD2 4.04Å; Y207-F224 AromaticContact CD2-CG 3.94Å; Y207-F224 HydrophobicContact CD2-CG 3.94Å; Y207-F224 HydrophobicContact CE1-CB 3.48Å; Y207-F224 VanDerWaalsContact CE1-CB 3.48Å; Y207-F224 HydrophobicContact CE1-CG 4.31Å; Y207-F224 HydrophobicContact CE2-CB 3.6Å; Y207-F224 HydrophobicContact CE2-CG 4.44Å; Y207-F224 HydrophobicContact CG-CB 3.53Å; Y207-F224 HydrophobicContact CG-CD1 4.06Å; Y207-F224 AromaticContact CG-CD2 3.94Å; Y207-F224 HydrophobicContact CG-CD2 3.94Å; Y207-F224 AromaticContact CG-CG 3.58Å; Y207-F224 HydrophobicContact CG-CG 3.58Å; Y207-A245 HydrophobicContact CD2-CB 4.01Å; Y207-A245 HydrophobicContact CE2-CB 4.15Å; Y207-F247 AromaticContact CD2-CZ 3.85Å; Y207-F247 HydrophobicContact CD2-CZ 3.85Å; Y207-F247 AromaticContact CE2-CE1 3.77Å; Y207-F247 HydrophobicContact CE2-CE1 3.77Å; Y207-F247 HydrophobicContact CE2-CE2 4.29Å; Y207-F247 AromaticContact CE2-CZ 3.41Å; Y207-F247 HydrophobicContact CE2-CZ 3.41Å; Y207-F247 VanDerWaalsContact CE2-CZ 3.41Å
208	Y	98.3	Very high	98.1	Very high	151 Å²	151	21.5 Å²	21.5	59%	0.592	11%	0.106	S	C	*	.	I	π-helix	trans	-75.5	-34.5	-170.5	-65.1	-72.9	0	0	0	113.5	Q212 P213 F224	Y208-Q212 VanDerWaalsContact CD1-OE1 3.31Å; Y208-P213 WeakPolarHBondContact O-CD 3.49Å; Y208-F224 AromaticContact CE2-CD1 3.91Å; Y208-F224 HydrophobicContact CE2-CD1 3.91Å; Y208-F224 HydrophobicContact CE2-CE1 4.17Å
209	D	97.2	Very high	98	Very high	71 Å²	71	22.3 Å²	22.3	38%	0.38	11%	0.114	S	C	.	.	I	π-helix	trans	-84.2	-25.3	-177.3	62.9	-74.4	0	0	0	113.3	H206 N239	H206-D209 VanDerWaalsContact C-OD1 3.31Å; H206-D209 WeakPolarHBondContact CA-OD1 3.2Å; H206-D209 IonicContact CE1-OD2 3.6Å; H206-D209 IonicContact CG-OD1 2.89Å; H206-D209 IonicContact CG-OD2 3.3Å; H206-D209 IonicContact ND1-OD1 2.79Å; H206-D209 PolarHBondContact ND1-OD1 2.83Å; H206-D209 IonicContact ND1-OD2 3.49Å; H206-D209 PolarHBondContact ND1-OD2 3.05Å; D209-N239 PolarHBondContact OD1-ND2 2.67Å
210	T	97.9	Very high	98	Very high	11 Å²	11	22.7 Å²	22.7	7%	0.067	12%	0.116	C	C	.	.	I	π-helix	trans	-127.5	-65.8	-174.4	-59.9	0	0	0	0	112.6	W180 H206 P213 V214	W180-T210 HydrophobicContact CZ2-CG2 3.93Å; H206-T210 WeakPolarHBondContact O-CB 3.02Å; H206-T210 PolarHBondContact O-N 2.49Å; T210-P213 WeakPolarHBondContact O-CD 3.41Å; T210-P213 WeakPolarHBondContact O-CG 3.48Å; T210-V214 WeakPolarHBondContact O-CB 3.42Å; T210-V214 VanDerWaalsContact O-CG2 3.23Å; T210-V214 WeakPolarHBondContact O-CG2 3.29Å; T210-V214 PolarHBondContact O-N 2.83Å
211	F	98.4	Very high	97.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.125	C	C	.	.	I	π-helix	trans	-70.4	-42.4	-166.1	-64.4	-66.3	0	0	0	113.4	I158 W180 I187 V204 H206 Y207 M215 F247	I158-F211 HydrophobicContact CD1-CD2 4.4Å; I158-F211 HydrophobicContact CD1-CE1 4.43Å; I158-F211 HydrophobicContact CD1-CE2 3.46Å; I158-F211 VanDerWaalsContact CD1-CE2 3.46Å; I158-F211 HydrophobicContact CD1-CZ 3.48Å; I158-F211 VanDerWaalsContact CD1-CZ 3.48Å; W180-F211 AromaticContact CH2-CE2 3.86Å; W180-F211 HydrophobicContact CH2-CE2 3.86Å; W180-F211 AromaticContact CH2-CZ 3.72Å; W180-F211 HydrophobicContact CH2-CZ 3.72Å; W180-F211 HydrophobicContact CZ3-CZ 4.49Å; I187-F211 HydrophobicContact CB-CE1 4.47Å; I187-F211 HydrophobicContact CD1-CZ 4.22Å; I187-F211 HydrophobicContact CG2-CE1 3.63Å; I187-F211 HydrophobicContact CG2-CZ 3.94Å; V204-F211 HydrophobicContact CG1-CD2 3.54Å; V204-F211 HydrophobicContact CG1-CE2 3.95Å; V204-F211 HydrophobicContact CG1-CG 4.49Å; H206-F211 HydrophobicContact CB-CD2 4.3Å; H206-F211 HydrophobicContact CB-CE2 4.05Å; H206-F211 WeakPolarHBondContact O-CD2 3.26Å; H206-F211 PolarHBondContact O-N 3.24Å; H206-F211 VanDerWaalsContact O-N 3.11Å; Y207-F211 PolarHBondContact O-N 2.6Å; F211-M215 WeakPolarHBondContact O-CB 3.08Å; F211-M215 WeakPolarHBondContact O-CG 3.23Å; F211-M215 PolarHBondContact O-N 3.29Å; F211-F247 HydrophobicContact CB-CZ 3.95Å
212	Q	98.1	Very high	97.9	Very high	81 Å²	81	25.6 Å²	25.6	38%	0.379	13%	0.134	S	C	.	.	H	α-helix	trans	-58.8	-56.4	179	-174.6	-171.6	24.6	0	0	112.2	Y207 Y208 V214 A216	Y207-Q212 HydrophobicContact CD1-CB 4.1Å; Y207-Q212 HydrophobicContact CE1-CB 3.74Å; Y207-Q212 HydrophobicContact CE1-CG 3.96Å; Y207-Q212 HydrophobicContact CE2-CB 4.33Å; Y207-Q212 VanDerWaalsContact O-CB 3.26Å; Y207-Q212 WeakPolarHBondContact O-CB 3.19Å; Y207-Q212 PolarHBondContact O-N 2.87Å; Y208-Q212 VanDerWaalsContact CD1-OE1 3.31Å; Q212-V214 PolarHBondContact O-N 2.83Å; Q212-A216 WeakPolarHBondContact O-CB 3.3Å; Q212-A216 PolarHBondContact O-N 3.37Å
213	P	96.9	Very high	97.9	Very high	38 Å²	38	26.9 Å²	26.9	25%	0.247	14%	0.141	C	C	.	.	H	α-helix	trans	-64.2	-42.3	-178.8	23	-33.1	0	0	0	112.7	Y208 T210 A216 S217	Y208-P213 WeakPolarHBondContact O-CD 3.49Å; T210-P213 WeakPolarHBondContact O-CD 3.41Å; T210-P213 WeakPolarHBondContact O-CG 3.48Å; P213-A216 PolarHBondContact O-N 3.06Å; P213-S217 PolarHBondContact O-N 2.79Å
214	V	96.9	Very high	97.9	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.024	14%	0.142	C	C	.	.	H	α-helix	trans	-68	-44.1	-179.2	175.5	0	0	0	0	111.7	M85 L115 L188 T210 Q212 A216 S217 L218	M85-V214 HydrophobicContact CE-CG2 4.12Å; L115-V214 HydrophobicContact CD2-CG1 3.6Å; L188-V214 HydrophobicContact CD1-CG1 4.21Å; L188-V214 HydrophobicContact CD2-CB 4.49Å; L188-V214 HydrophobicContact CD2-CG1 3.69Å; T210-V214 WeakPolarHBondContact O-CB 3.42Å; T210-V214 VanDerWaalsContact O-CG2 3.23Å; T210-V214 WeakPolarHBondContact O-CG2 3.29Å; T210-V214 PolarHBondContact O-N 2.83Å; Q212-V214 PolarHBondContact O-N 2.83Å; V214-A216 VanDerWaalsContact C-N 3.31Å; V214-A216 PolarHBondContact O-N 2.94Å; V214-S217 PolarHBondContact O-N 2.77Å; V214-S217 PolarHBondContact O-OG 3.28Å; V214-L218 HydrophobicContact CG1-CD1 4.13Å; V214-L218 VanDerWaalsContact O-CG 3.26Å; V214-L218 WeakPolarHBondContact O-CG 3.47Å; V214-L218 PolarHBondContact O-N 2.96Å
215	M	97.9	Very high	97.9	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-67.8	-35.3	177.6	-64.8	-68.6	-73.8	0	0	110.9	I191 V199 F211 L218 G219 Y220 F247	I191-M215 HydrophobicContact CD1-SD 4.42Å; I191-M215 HydrophobicContact CG2-CE 4.24Å; I191-M215 HydrophobicContact CG2-SD 4.16Å; V199-M215 HydrophobicContact CB-CE 4.36Å; V199-M215 HydrophobicContact CG2-CE 4.01Å; F211-M215 WeakPolarHBondContact O-CB 3.08Å; F211-M215 WeakPolarHBondContact O-CG 3.23Å; F211-M215 PolarHBondContact O-N 3.29Å; M215-L218 CarbonylContact O-C 3.58Å; M215-L218 PolarHBondContact O-N 2.99Å; M215-L218 HydrophobicContact SD-CD1 4.47Å; M215-G219 PolarHBondContact O-N 2.9Å; M215-Y220 HydrophobicContact CE-CD1 3.87Å; M215-Y220 HydrophobicContact CE-CD2 3.92Å; M215-Y220 HydrophobicContact CE-CE1 4.11Å; M215-Y220 HydrophobicContact CE-CE2 4.15Å; M215-Y220 HydrophobicContact CE-CG 3.77Å; M215-Y220 WeakPolarHBondContact O-CB 3.35Å; M215-Y220 WeakPolarHBondContact O-CD2 3.27Å; M215-Y220 PolarHBondContact O-N 2.99Å; M215-Y220 HydrophobicContact SD-CD2 4.48Å; M215-F247 HydrophobicContact CB-CD1 3.64Å; M215-F247 HydrophobicContact CB-CE1 3.64Å; M215-F247 HydrophobicContact CB-CG 4.44Å; M215-F247 HydrophobicContact CB-CZ 4.44Å; M215-F247 HydrophobicContact CE-CB 3.87Å; M215-F247 HydrophobicContact CE-CD1 4.2Å; M215-F247 HydrophobicContact CE-CD2 4.17Å; M215-F247 HydrophobicContact CE-CG 3.84Å; M215-F247 HydrophobicContact CG-CD1 3.94Å; M215-F247 HydrophobicContact CG-CE1 3.77Å; M215-F247 HydrophobicContact CG-CG 4.39Å; M215-F247 HydrophobicContact CG-CZ 4.08Å
216	A	97.5	Very high	97.9	Very high	17 Å²	17	30.3 Å²	30.3	14%	0.14	16%	0.161	C	C	.	.	H	α-helix	trans	-61.5	-45.7	174.6	0	0	0	0	0	112.3	I107 Q212 P213 V214 L218 G219 Y220 R250	I107-A216 HydrophobicContact CD1-CB 4.32Å; Q212-A216 WeakPolarHBondContact O-CB 3.3Å; Q212-A216 PolarHBondContact O-N 3.37Å; P213-A216 PolarHBondContact O-N 3.06Å; V214-A216 VanDerWaalsContact C-N 3.31Å; V214-A216 PolarHBondContact O-N 2.94Å; A216-L218 PolarHBondContact O-N 2.87Å; A216-G219 PolarHBondContact O-N 2.87Å; A216-Y220 WeakPolarHBondContact CA-O 3.35Å; A216-R250 PolarHBondContact O-NH1 3.48Å
217	S	96.1	Very high	97.9	Very high	7 Å²	7	30.3 Å²	30.3	5%	0.049	16%	0.161	C	C	.	.	H	α-helix	trans	-66.2	-19.6	176.4	69.2	0	0	0	0	113.4	V108 E109 V110 P213 V214 G219	V108-S217 WeakPolarHBondContact O-CB 3.49Å; E109-S217 WeakPolarHBondContact CA-O 3.15Å; V110-S217 PolarHBondContact N-O 3.23Å; P213-S217 PolarHBondContact O-N 2.79Å; V214-S217 PolarHBondContact O-N 2.77Å; V214-S217 PolarHBondContact O-OG 3.28Å; S217-G219 VanDerWaalsContact C-N 3.31Å
218	L	96.1	Very high	97.9	Very high	21 Å²	21	32.3 Å²	32.3	11%	0.11	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	9.8	173.1	-64.5	168.8	0	0	0	113	P112 L115 L192 V214 M215 A216 Y220	P112-L218 HydrophobicContact CB-CD2 3.99Å; P112-L218 HydrophobicContact CG-CD2 3.92Å; L115-L218 HydrophobicContact CD2-CD1 4.02Å; L115-L218 HydrophobicContact CD2-CD2 4.15Å; L115-L218 HydrophobicContact CD2-CG 4.33Å; L192-L218 HydrophobicContact CD2-CD1 3.76Å; L192-L218 HydrophobicContact CD2-CD2 3.83Å; L192-L218 HydrophobicContact CD2-CG 4.47Å; V214-L218 HydrophobicContact CG1-CD1 4.13Å; V214-L218 VanDerWaalsContact O-CG 3.26Å; V214-L218 WeakPolarHBondContact O-CG 3.47Å; V214-L218 PolarHBondContact O-N 2.96Å; M215-L218 CarbonylContact O-C 3.58Å; M215-L218 PolarHBondContact O-N 2.99Å; M215-L218 HydrophobicContact SD-CD1 4.47Å; A216-L218 PolarHBondContact O-N 2.87Å; L218-Y220 HydrophobicContact CB-CD2 3.82Å; L218-Y220 HydrophobicContact CB-CE2 3.91Å; L218-Y220 WeakPolarHBondContact O-CD2 3.29Å
219	G	97	Very high	97.9	Very high	17 Å²	17	34.2 Å²	34.2	18%	0.175	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	13.7	177.6	0	0	0	0	0	115.2	M215 A216 S217 R250	M215-G219 PolarHBondContact O-N 2.9Å; A216-G219 PolarHBondContact O-N 2.87Å; S217-G219 VanDerWaalsContact C-N 3.31Å; G219-R250 PolarHBondContact O-N 3.04Å
220	Y	98.4	Very high	97.9	Very high	8 Å²	8	31 Å²	31	3%	0.031	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	138.7	174.5	-61.9	-103.9	0	0	0	111.8	P196 V199 M215 A216 L218 F247 Y248 R249 R250	P196-Y220 VanDerWaalsContact O-CE1 3.23Å; P196-Y220 WeakPolarHBondContact O-CE1 3.15Å; P196-Y220 PolarHBondContact O-OH 3.12Å; V199-Y220 HydrophobicContact CG2-CE1 4.27Å; M215-Y220 HydrophobicContact CE-CD1 3.87Å; M215-Y220 HydrophobicContact CE-CD2 3.92Å; M215-Y220 HydrophobicContact CE-CE1 4.11Å; M215-Y220 HydrophobicContact CE-CE2 4.15Å; M215-Y220 HydrophobicContact CE-CG 3.77Å; M215-Y220 WeakPolarHBondContact O-CB 3.35Å; M215-Y220 WeakPolarHBondContact O-CD2 3.27Å; M215-Y220 PolarHBondContact O-N 2.99Å; M215-Y220 HydrophobicContact SD-CD2 4.48Å; A216-Y220 WeakPolarHBondContact CA-O 3.35Å; L218-Y220 HydrophobicContact CB-CD2 3.82Å; L218-Y220 HydrophobicContact CB-CE2 3.91Å; L218-Y220 WeakPolarHBondContact O-CD2 3.29Å; Y220-F247 HydrophobicContact CD1-CB 4.11Å; Y220-F247 HydrophobicContact CG-CB 4.49Å; Y220-Y248 CarbonylContact C-O 3.5Å; Y220-Y248 VanDerWaalsContact CA-O 3.25Å; Y220-Y248 WeakPolarHBondContact CA-O 3.07Å; Y220-R249 HydrophobicContact CD1-CG 3.78Å; Y220-R249 HydrophobicContact CE1-CG 3.41Å; Y220-R249 VanDerWaalsContact CE1-CG 3.41Å; Y220-R249 HydrophobicContact CE2-CG 4.32Å; Y220-R249 HydrophobicContact CG-CG 4.37Å; Y220-R249 PolarHBondContact OH-NE 3.44Å; Y220-R249 VanDerWaalsContact OH-NE 3.1Å; Y220-R249 PolarHBondContact OH-NH2 3.06Å; Y220-R250 PolarHBondContact O-NH1 3.06Å; Y220-R250 PolarHBondContact O-NH2 3.02Å; Y220-R250 VanDerWaalsContact O-NH2 3.08Å
221	H	98.3	Very high	97.9	Very high	42 Å²	42	32.5 Å²	32.5	19%	0.194	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	143.3	159	-175.7	-74.1	0	0	0	108.8	N223 F247 Y248 R250	H221-N223 PolarHBondContact CE1-OD1 3.38Å; H221-F247 CarbonylContact O-C 3.56Å; H221-F247 WeakPolarHBondContact O-CA 3.49Å; H221-Y248 HydrophobicContact CB-CD1 4.32Å; H221-Y248 HydrophobicContact CB-CD2 4.49Å; H221-Y248 HydrophobicContact CB-CE1 3.68Å; H221-Y248 HydrophobicContact CB-CE2 3.9Å; H221-Y248 VanDerWaalsContact CB-CZ 3.42Å; H221-Y248 WeakPolarHBondContact CB-OH 3.34Å; H221-Y248 AromaticContact CG-CE1 3.78Å; H221-Y248 AromaticContact CG-CZ 3.67Å; H221-Y248 VanDerWaalsContact CG-OH 3.28Å; H221-Y248 PolarHBondContact N-O 3.47Å; H221-Y248 AromaticContact ND1-CE1 3.55Å; H221-Y248 AromaticContact ND1-CZ 3.91Å; H221-Y248 PolarHBondContact O-N 2.84Å; H221-R250 HydrophobicContact CB-CG 3.98Å
222	G	98	Very high	97.9	Very high	19 Å²	19	32.5 Å²	32.5	20%	0.196	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147.4	-179.1	0	0	0	0	0	113.3	Y207 L246	Y207-G222 PolarHBondContact OH-O 3.46Å; Y207-G222 VanDerWaalsContact OH-O 3.04Å; G222-L246 CarbonylContact C-O 3.48Å; G222-L246 WeakPolarHBondContact CA-O 3.35Å
223	N	98.5	Very high	97.9	Very high	28 Å²	28	32.6 Å²	32.6	15%	0.15	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.8	167.4	-81.6	61.1	0	0	0	110.1	H221 A245 L246 H260 Q277	H221-N223 PolarHBondContact CE1-OD1 3.38Å; N223-A245 CarbonylContact O-C 3.56Å; N223-A245 VanDerWaalsContact O-CA 3.27Å; N223-A245 WeakPolarHBondContact O-CA 3.45Å; N223-L246 PolarHBondContact N-O 2.85Å; N223-L246 PolarHBondContact O-N 3.44Å; N223-H260 PolarHBondContact ND2-NE2 2.91Å; N223-Q277 PolarHBondContact OD1-NE2 3.27Å
224	F	98.9	Very high	98	Very high	22 Å²	22	36.7 Å²	36.7	10%	0.096	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	139.2	177.7	177	-116.4	0	0	0	111.2	V204 Y207 Y208 P226 G243 C244 A245	V204-F224 HydrophobicContact CB-CD2 4.45Å; V204-F224 HydrophobicContact CB-CE2 4.01Å; V204-F224 HydrophobicContact CG1-CE2 4.47Å; V204-F224 WeakPolarHBondContact O-CE2 3.5Å; V204-F224 VanDerWaalsContact O-CZ 3.3Å; V204-F224 WeakPolarHBondContact O-CZ 3.38Å; Y207-F224 HydrophobicContact CD1-CB 3.47Å; Y207-F224 VanDerWaalsContact CD1-CB 3.47Å; Y207-F224 HydrophobicContact CD1-CD1 4Å; Y207-F224 AromaticContact CD1-CG 3.8Å; Y207-F224 HydrophobicContact CD1-CG 3.8Å; Y207-F224 HydrophobicContact CD2-CB 3.6Å; Y207-F224 HydrophobicContact CD2-CD2 4.04Å; Y207-F224 AromaticContact CD2-CG 3.94Å; Y207-F224 HydrophobicContact CD2-CG 3.94Å; Y207-F224 HydrophobicContact CE1-CB 3.48Å; Y207-F224 VanDerWaalsContact CE1-CB 3.48Å; Y207-F224 HydrophobicContact CE1-CG 4.31Å; Y207-F224 HydrophobicContact CE2-CB 3.6Å; Y207-F224 HydrophobicContact CE2-CG 4.44Å; Y207-F224 HydrophobicContact CG-CB 3.53Å; Y207-F224 HydrophobicContact CG-CD1 4.06Å; Y207-F224 AromaticContact CG-CD2 3.94Å; Y207-F224 HydrophobicContact CG-CD2 3.94Å; Y207-F224 AromaticContact CG-CG 3.58Å; Y207-F224 HydrophobicContact CG-CG 3.58Å; Y208-F224 AromaticContact CE2-CD1 3.91Å; Y208-F224 HydrophobicContact CE2-CD1 3.91Å; Y208-F224 HydrophobicContact CE2-CE1 4.17Å; F224-P226 HydrophobicContact CE1-CB 3.84Å; F224-P226 HydrophobicContact CE1-CG 4.15Å; F224-P226 HydrophobicContact CZ-CB 3.97Å; F224-G243 VanDerWaalsContact CE2-CA 3.5Å; F224-C244 WeakPolarHBondContact CA-O 3.28Å; F224-C244 VanDerWaalsContact CD2-O 3.25Å; F224-C244 WeakPolarHBondContact CD2-O 3.37Å; F224-A245 HydrophobicContact CD2-CB 4.22Å
225	L	98.9	Very high	98	Very high	30 Å²	30	37.3 Å²	37.3	16%	0.157	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	105.3	176.2	-176	60	0	0	0	109	G243 C244 H260 V273 A274 I275	L225-G243 VanDerWaalsContact O-CA 3.23Å; L225-G243 WeakPolarHBondContact O-CA 3.3Å; L225-C244 PolarHBondContact N-O 2.88Å; L225-C244 PolarHBondContact O-N 3.41Å; L225-H260 HydrophobicContact CD1-CB 4.05Å; L225-H260 HydrophobicContact CD2-CB 3.78Å; L225-V273 HydrophobicContact CD2-CB 3.75Å; L225-V273 HydrophobicContact CD2-CG1 4.26Å; L225-V273 HydrophobicContact CD2-CG2 4.36Å; L225-V273 HydrophobicContact CG-CB 3.97Å; L225-V273 HydrophobicContact CG-CG1 4.2Å; L225-V273 HydrophobicContact CG-CG2 4.2Å; L225-A274 WeakPolarHBondContact CD2-O 3.11Å; L225-I275 HydrophobicContact CB-CD1 3.76Å; L225-I275 HydrophobicContact CB-CG1 3.6Å; L225-I275 HydrophobicContact CD2-CG1 4.09Å
226	P	98.8	Very high	97.9	Very high	45 Å²	45	44.9 Å²	44.9	29%	0.292	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	151.3	178.1	28.6	-34	0	0	0	111.5	F224 P241	F224-P226 HydrophobicContact CE1-CB 3.84Å; F224-P226 HydrophobicContact CE1-CG 4.15Å; F224-P226 HydrophobicContact CZ-CB 3.97Å; P226-P241 HydrophobicContact CB-CB 3.95Å; P226-P241 HydrophobicContact CB-CG 3.7Å; P226-P241 HydrophobicContact CG-CG 4.5Å
227	K	98.8	Very high	97.8	Very high	15 Å²	15	52.4 Å²	52.4	7%	0.065	27%	0.268	C	S	.	.			trans	-63.7	133.9	164.8	-69.5	172	-176.1	153.7	0	108.5	W229 S230 D242 V273 H294	K227-W229 PolarHBondContact O-N 3.17Å; K227-W229 VanDerWaalsContact O-N 3.16Å; K227-S230 PolarHBondContact O-N 3.31Å; K227-D242 WeakPolarHBondContact CE-OD2 3.42Å; K227-D242 PolarHBondContact N-O 2.87Å; K227-D242 IonicContact NZ-OD1 3.1Å; K227-D242 IonicContact NZ-OD2 3.42Å; K227-D242 PolarHBondContact NZ-OD2 3.33Å; K227-V273 HydrophobicContact CG-CG2 4.38Å; K227-H294 PolarHBondContact NZ-CE1 3.03Å; K227-H294 PolarHBondContact NZ-ND1 3.42Å
228	P	98.3	Very high	97.9	Very high	51 Å²	51	54.6 Å²	54.6	33%	0.331	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-37.7	-179.3	-27.8	34.3	0	0	0	113.8	N271	P228-N271 WeakPolarHBondContact CD-O 3.32Å; P228-N271 WeakPolarHBondContact CD-OD1 3.37Å
229	W	98.2	Very high	98	Very high	191 Å²	191	57.2 Å²	57.2	72%	0.723	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.4	65.2	179	-51.6	110.3	0	0	0	109.3	K227 N271	K227-W229 PolarHBondContact O-N 3.17Å; K227-W229 VanDerWaalsContact O-N 3.16Å; W229-N271 WeakPolarHBondContact CA-OD1 3.13Å; W229-N271 WeakPolarHBondContact CB-OD1 3.28Å; W229-N271 PolarHBondContact N-OD1 3.37Å; W229-N271 PolarHBondContact O-ND2 3.07Å
230	S	98.6	Very high	98	Very high	4 Å²	4	57.3 Å²	57.3	3%	0.028	29%	0.294	C	S	.	.			trans	-58.8	136.4	179.9	167.5	0	0	0	0	111.8	K227 C232 L233 P241 D242	K227-S230 PolarHBondContact O-N 3.31Å; S230-C232 PolarHBondContact O-N 2.62Å; S230-C232 WeakPolarHBondContact OG-CB 3.26Å; S230-C232 PolarHBondContact OG-N 3.21Å; S230-L233 PolarHBondContact O-N 3.09Å; S230-P241 VanDerWaalsContact CB-CA 3.42Å; S230-D242 VanDerWaalsContact CB-OD1 3.3Å; S230-D242 WeakPolarHBondContact CB-OD1 3.41Å; S230-D242 PolarHBondContact OG-N 3.42Å; S230-D242 PolarHBondContact OG-OD1 3.07Å
231	P	98	Very high	98.1	Very high	41 Å²	41	59.1 Å²	59.1	27%	0.266	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-65.4	-14.9	172.5	28	-35.5	0	0	0	113.9	L163 K167 L233 D234 D242	L163-P231 HydrophobicContact CD1-CG 4.12Å; L163-P231 HydrophobicContact CD2-CB 4.01Å; L163-P231 HydrophobicContact CD2-CG 4.02Å; K167-P231 HydrophobicContact CD-CB 4.48Å; K167-P231 WeakPolarHBondContact CE-O 3.36Å; K167-P231 PolarHBondContact NZ-O 2.84Å; P231-L233 PolarHBondContact O-N 2.9Å; P231-D234 PolarHBondContact O-N 3.42Å; P231-D242 WeakPolarHBondContact CD-OD1 3.34Å
232	C	98.5	Very high	98.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-61.7	-31	175.4	-63.9	0	0	0	0	111.5	A162 S230 D234 V235 N238 G240	A162-C232 HydrophobicContact CB-CB 3.79Å; S230-C232 PolarHBondContact O-N 2.62Å; S230-C232 WeakPolarHBondContact OG-CB 3.26Å; S230-C232 PolarHBondContact OG-N 3.21Å; C232-D234 PolarHBondContact O-N 3.26Å; C232-D234 VanDerWaalsContact O-N 3.15Å; C232-V235 WeakPolarHBondContact O-CB 3.31Å; C232-V235 PolarHBondContact O-N 3.38Å; C232-N238 WeakPolarHBondContact O-CB 3.39Å; C232-N238 PolarHBondContact O-ND2 3.42Å; C232-G240 VanDerWaalsContact CB-O 3.27Å; C232-G240 WeakPolarHBondContact CB-O 3.13Å
233	L	98.1	Very high	98.1	Very high	84 Å²	84	56.2 Å²	56.2	44%	0.44	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-66.1	-17.2	-178.5	-60.4	176.4	0	0	0	113.8	S230 P231 V235	S230-L233 PolarHBondContact O-N 3.09Å; P231-L233 PolarHBondContact O-N 2.9Å; L233-V235 VanDerWaalsContact C-N 3.31Å
234	D	97.6	Very high	98.1	Very high	124 Å²	124	54.9 Å²	54.9	66%	0.663	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-86.9	-2.7	174.8	-47.7	-48.1	0	0	0	112.8	K167 P231 C232	K167-D234 IonicContact NZ-OD2 3.53Å; K167-D234 PolarHBondContact NZ-OD2 3.09Å; P231-D234 PolarHBondContact O-N 3.42Å; C232-D234 PolarHBondContact O-N 3.26Å; C232-D234 VanDerWaalsContact O-N 3.15Å
235	V	97.4	Very high	98.1	Very high	17 Å²	17	53.9 Å²	53.9	10%	0.103	28%	0.277	C	S	.	.	S	Bend	trans	-97	133.5	179.9	-177.8	0	0	0	0	109.2	A162 K167 C232 L233 N238	A162-V235 HydrophobicContact CB-CB 4.16Å; A162-V235 HydrophobicContact CB-CG1 4.36Å; A162-V235 HydrophobicContact CB-CG2 4.44Å; A162-V235 WeakPolarHBondContact O-CG1 3.26Å; A162-V235 WeakPolarHBondContact O-CG2 3.46Å; K167-V235 HydrophobicContact CD-CG2 3.99Å; K167-V235 HydrophobicContact CG-CG2 3.87Å; C232-V235 WeakPolarHBondContact O-CB 3.31Å; C232-V235 PolarHBondContact O-N 3.38Å; L233-V235 VanDerWaalsContact C-N 3.31Å; V235-N238 WeakPolarHBondContact O-CB 3.41Å; V235-N238 PolarHBondContact O-N 3.4Å; V235-N238 PolarHBondContact O-ND2 2.9Å
236	E	96.1	Very high	98.2	Very high	159 Å²	159	52.4 Å²	52.4	74%	0.743	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	141.1	174.7	-164.1	174.9	-169.8	0	0	110.4	N238	E236-N238 PolarHBondContact O-N 3.31Å
237	H	95.6	Very high	98.2	Very high	176 Å²	176	50.4 Å²	50.4	82%	0.815	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	25.6	-177.2	-51.8	-62.3	0	0	0	115.7
238	N	97.8	Very high	98.2	Very high	53 Å²	53	50.3 Å²	50.3	28%	0.283	26%	0.255	S	S	.	.			trans	-62.2	159.2	173	70.7	83.7	0	0	0	113.2	A162 C232 V235 E236 G240	A162-N238 HydrophobicContact CB-CB 3.83Å; C232-N238 WeakPolarHBondContact O-CB 3.39Å; C232-N238 PolarHBondContact O-ND2 3.42Å; V235-N238 WeakPolarHBondContact O-CB 3.41Å; V235-N238 PolarHBondContact O-N 3.4Å; V235-N238 PolarHBondContact O-ND2 2.9Å; E236-N238 PolarHBondContact O-N 3.31Å; N238-G240 WeakPolarHBondContact OD1-CA 3.39Å; N238-G240 PolarHBondContact OD1-N 3.15Å
239	N	98.1	Very high	98.2	Very high	76 Å²	76	50.4 Å²	50.4	41%	0.406	25%	0.249	S	C	.	.			trans	-97.9	29	176.3	-162.3	62.9	0	0	0	112.9	D205 H206 D209	D205-N239 PolarHBondContact O-ND2 2.92Å; H206-N239 PolarHBondContact ND1-ND2 2.64Å; D209-N239 PolarHBondContact OD1-ND2 2.67Å
240	G	98.2	Very high	98.1	Very high	18 Å²	18	45.6 Å²	45.6	19%	0.186	23%	0.231	C	C	.	.	S	Bend	trans	91.7	-165.6	-175.5	0	0	0	0	0	113.7	C232 N238	C232-G240 VanDerWaalsContact CB-O 3.27Å; C232-G240 WeakPolarHBondContact CB-O 3.13Å; N238-G240 WeakPolarHBondContact OD1-CA 3.39Å; N238-G240 PolarHBondContact OD1-N 3.15Å
241	P	98.6	Very high	98.1	Very high	47 Å²	47	50 Å²	50	31%	0.305	26%	0.262	S	S	.	.			trans	-77	138.2	-175.4	31	-34.3	0	0	0	112.5	P226 S230	P226-P241 HydrophobicContact CB-CB 3.95Å; P226-P241 HydrophobicContact CB-CG 3.7Å; P226-P241 HydrophobicContact CG-CG 4.5Å; S230-P241 VanDerWaalsContact CB-CA 3.42Å
242	D	98.8	Very high	98.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.258	C	S	.	.			trans	-70.3	158.5	164.6	79.7	-63.7	0	0	0	112.3	A160 V204 D205 K227 S230 P231	A160-D242 HydrophobicContact CB-CB 4.05Å; V204-D242 WeakPolarHBondContact O-CA 3.35Å; D205-D242 HydrophobicContact CB-CB 4.27Å; K227-D242 WeakPolarHBondContact CE-OD2 3.42Å; K227-D242 PolarHBondContact N-O 2.87Å; K227-D242 IonicContact NZ-OD1 3.1Å; K227-D242 IonicContact NZ-OD2 3.42Å; K227-D242 PolarHBondContact NZ-OD2 3.33Å; S230-D242 VanDerWaalsContact CB-OD1 3.3Å; S230-D242 WeakPolarHBondContact CB-OD1 3.41Å; S230-D242 PolarHBondContact OG-N 3.42Å; S230-D242 PolarHBondContact OG-OD1 3.07Å; P231-D242 WeakPolarHBondContact CD-OD1 3.34Å
243	G	98.9	Very high	98	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	-171	178.3	0	0	0	0	0	114.5	E203 V204 F224 L225	E203-G243 PolarHBondContact N-O 2.82Å; E203-G243 VanDerWaalsContact N-O 3.1Å; V204-G243 PolarHBondContact N-O 3.44Å; V204-G243 VanDerWaalsContact N-O 3.09Å; V204-G243 PolarHBondContact O-N 3.44Å; V204-G243 VanDerWaalsContact O-N 3.13Å; F224-G243 VanDerWaalsContact CE2-CA 3.5Å; L225-G243 VanDerWaalsContact O-CA 3.23Å; L225-G243 WeakPolarHBondContact O-CA 3.3Å
244	C	98.9	Very high	98	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	142.4	166.9	-66	0	0	0	0	109.6	L201 F224 L225 I275 V292	L201-C244 CarbonylContact O-C 3.56Å; L201-C244 VanDerWaalsContact O-CA 3.29Å; L201-C244 WeakPolarHBondContact O-CA 3.26Å; F224-C244 WeakPolarHBondContact CA-O 3.28Å; F224-C244 VanDerWaalsContact CD2-O 3.25Å; F224-C244 WeakPolarHBondContact CD2-O 3.37Å; L225-C244 PolarHBondContact N-O 2.88Å; L225-C244 PolarHBondContact O-N 3.41Å; C244-I275 HydrophobicContact CB-CD1 4.29Å; C244-I275 VanDerWaalsContact O-CD1 3.28Å; C244-I275 WeakPolarHBondContact O-CD1 3.48Å; C244-V292 HydrophobicContact CB-CG1 3.91Å; C244-V292 HydrophobicContact CB-CG2 4.2Å
245	A	98.9	Very high	98	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142.7	169.9	0	0	0	0	0	110.6	L201 V204 Y207 N223 F224 F247	L201-A245 HydrophobicContact CB-CB 4.37Å; L201-A245 PolarHBondContact N-O 2.87Å; L201-A245 PolarHBondContact O-N 2.81Å; V204-A245 HydrophobicContact CB-CB 4.4Å; V204-A245 HydrophobicContact CG2-CB 3.86Å; Y207-A245 HydrophobicContact CD2-CB 4.01Å; Y207-A245 HydrophobicContact CE2-CB 4.15Å; N223-A245 CarbonylContact O-C 3.56Å; N223-A245 VanDerWaalsContact O-CA 3.27Å; N223-A245 WeakPolarHBondContact O-CA 3.45Å; F224-A245 HydrophobicContact CD2-CB 4.22Å; A245-F247 HydrophobicContact CB-CD2 4.38Å; A245-F247 HydrophobicContact CB-CE2 3.64Å; A245-F247 HydrophobicContact CB-CZ 4.22Å
246	L	98.9	Very high	97.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	120.2	176.3	-162	172.4	0	0	0	108.3	V199 G222 N223 I275 Q277 V290 V292	V199-L246 CarbonylContact O-C 3.57Å; V199-L246 WeakPolarHBondContact O-CA 3.39Å; G222-L246 CarbonylContact C-O 3.48Å; G222-L246 WeakPolarHBondContact CA-O 3.35Å; N223-L246 PolarHBondContact N-O 2.85Å; N223-L246 PolarHBondContact O-N 3.44Å; L246-I275 HydrophobicContact CB-CG2 4.25Å; L246-I275 HydrophobicContact CD1-CG2 4.16Å; L246-Q277 HydrophobicContact CD1-CB 4.13Å; L246-Q277 HydrophobicContact CD1-CG 4.11Å; L246-Q277 VanDerWaalsContact CD2-OE1 3.26Å; L246-V290 HydrophobicContact CD1-CB 4.25Å; L246-V290 HydrophobicContact CD1-CG1 3.98Å; L246-V290 HydrophobicContact CD2-CG1 4.45Å; L246-V290 HydrophobicContact CG-CG1 4.37Å; L246-V292 HydrophobicContact CB-CG1 3.9Å; L246-V292 HydrophobicContact CD1-CG1 4.28Å; L246-V292 HydrophobicContact CG-CG1 4.35Å
247	F	98.9	Very high	97.9	Very high	2 Å²	2	47 Å²	47	1%	0.009	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	147.1	174.7	-54.2	-97	0	0	0	111.3	I198 V199 L201 Y207 F211 M215 Y220 H221 A245	I198-F247 CarbonylContact C-O 3.56Å; I198-F247 WeakPolarHBondContact CA-O 3.47Å; V199-F247 HydrophobicContact CB-CB 4.16Å; V199-F247 HydrophobicContact CB-CD2 4.32Å; V199-F247 HydrophobicContact CG1-CD2 4.39Å; V199-F247 PolarHBondContact N-O 2.81Å; V199-F247 PolarHBondContact O-N 2.74Å; L201-F247 HydrophobicContact CD1-CE2 4.05Å; Y207-F247 AromaticContact CD2-CZ 3.85Å; Y207-F247 HydrophobicContact CD2-CZ 3.85Å; Y207-F247 AromaticContact CE2-CE1 3.77Å; Y207-F247 HydrophobicContact CE2-CE1 3.77Å; Y207-F247 HydrophobicContact CE2-CE2 4.29Å; Y207-F247 AromaticContact CE2-CZ 3.41Å; Y207-F247 HydrophobicContact CE2-CZ 3.41Å; Y207-F247 VanDerWaalsContact CE2-CZ 3.41Å; F211-F247 HydrophobicContact CB-CZ 3.95Å; M215-F247 HydrophobicContact CB-CD1 3.64Å; M215-F247 HydrophobicContact CB-CE1 3.64Å; M215-F247 HydrophobicContact CB-CG 4.44Å; M215-F247 HydrophobicContact CB-CZ 4.44Å; M215-F247 HydrophobicContact CE-CB 3.87Å; M215-F247 HydrophobicContact CE-CD1 4.2Å; M215-F247 HydrophobicContact CE-CD2 4.17Å; M215-F247 HydrophobicContact CE-CG 3.84Å; M215-F247 HydrophobicContact CG-CD1 3.94Å; M215-F247 HydrophobicContact CG-CE1 3.77Å; M215-F247 HydrophobicContact CG-CG 4.39Å; M215-F247 HydrophobicContact CG-CZ 4.08Å; Y220-F247 HydrophobicContact CD1-CB 4.11Å; Y220-F247 HydrophobicContact CG-CB 4.49Å; H221-F247 CarbonylContact O-C 3.56Å; H221-F247 WeakPolarHBondContact O-CA 3.49Å; A245-F247 HydrophobicContact CB-CD2 4.38Å; A245-F247 HydrophobicContact CB-CE2 3.64Å; A245-F247 HydrophobicContact CB-CZ 4.22Å
248	Y	98.9	Very high	98.1	Very high	13 Å²	13	41 Å²	41	5%	0.051	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	149.6	171.4	68.7	-93.5	0	0	0	110.9	D197 Y220 H221 R250 F253 L255 L279	D197-Y248 CarbonylContact O-C 3.51Å; D197-Y248 VanDerWaalsContact O-CA 3.31Å; D197-Y248 WeakPolarHBondContact O-CA 3.36Å; Y220-Y248 CarbonylContact C-O 3.5Å; Y220-Y248 VanDerWaalsContact CA-O 3.25Å; Y220-Y248 WeakPolarHBondContact CA-O 3.07Å; H221-Y248 HydrophobicContact CB-CD1 4.32Å; H221-Y248 HydrophobicContact CB-CD2 4.49Å; H221-Y248 HydrophobicContact CB-CE1 3.68Å; H221-Y248 HydrophobicContact CB-CE2 3.9Å; H221-Y248 VanDerWaalsContact CB-CZ 3.42Å; H221-Y248 WeakPolarHBondContact CB-OH 3.34Å; H221-Y248 AromaticContact CG-CE1 3.78Å; H221-Y248 AromaticContact CG-CZ 3.67Å; H221-Y248 VanDerWaalsContact CG-OH 3.28Å; H221-Y248 PolarHBondContact N-O 3.47Å; H221-Y248 AromaticContact ND1-CE1 3.55Å; H221-Y248 AromaticContact ND1-CZ 3.91Å; H221-Y248 PolarHBondContact O-N 2.84Å; Y248-R250 PolarHBondContact O-N 3.35Å; Y248-F253 HydrophobicContact CD2-CB 3.74Å; Y248-F253 HydrophobicContact CE2-CB 4.26Å; Y248-F253 WeakPolarHBondContact CE2-O 3.32Å; Y248-F253 HydrophobicContact CG-CB 4.48Å; Y248-L255 HydrophobicContact CE1-CB 4.08Å; Y248-L255 HydrophobicContact CE1-CD1 4.46Å; Y248-L255 VanDerWaalsContact OH-CB 3.23Å; Y248-L255 WeakPolarHBondContact OH-CB 3.38Å; Y248-L279 HydrophobicContact CD1-CD1 4.33Å; Y248-L279 HydrophobicContact CD1-CD2 3.73Å; Y248-L279 HydrophobicContact CD2-CD2 4.45Å; Y248-L279 HydrophobicContact CE1-CD2 3.93Å; Y248-L279 HydrophobicContact CG-CD1 4.08Å; Y248-L279 HydrophobicContact CG-CD2 4.03Å
249	R	98.3	Very high	98.1	Very high	54 Å²	54	39.8 Å²	39.8	20%	0.204	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	122.2	176.1	-70.7	-176.1	177.3	-171.2	-20.1	111.7	R195 P196 D197 Y220 S251 R252 F253	R195-R249 VanDerWaalsContact O-CZ 3.25Å; R195-R249 PolarHBondContact O-NH1 2.97Å; R195-R249 PolarHBondContact O-NH2 2.9Å; P196-R249 PolarHBondContact O-NE 3.26Å; D197-R249 PolarHBondContact O-N 3.42Å; D197-R249 IonicContact OD1-NH1 3.49Å; Y220-R249 HydrophobicContact CD1-CG 3.78Å; Y220-R249 HydrophobicContact CE1-CG 3.41Å; Y220-R249 VanDerWaalsContact CE1-CG 3.41Å; Y220-R249 HydrophobicContact CE2-CG 4.32Å; Y220-R249 HydrophobicContact CG-CG 4.37Å; Y220-R249 PolarHBondContact OH-NE 3.44Å; Y220-R249 VanDerWaalsContact OH-NE 3.1Å; Y220-R249 PolarHBondContact OH-NH2 3.06Å; R249-S251 PolarHBondContact O-N 2.92Å; R249-R252 HydrophobicContact CB-CB 4.08Å; R249-R252 HydrophobicContact CB-CG 4.02Å; R249-R252 PolarHBondContact O-N 3.15Å; R249-F253 PolarHBondContact O-N 2.77Å
250	R	97.9	Very high	98.1	Very high	90 Å²	90	41 Å²	41	34%	0.34	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-33.2	178	-63.2	-176.1	-172.5	94.6	1	112.5	A216 G219 Y220 H221 Y248 R252	A216-R250 PolarHBondContact O-NH1 3.48Å; G219-R250 PolarHBondContact O-N 3.04Å; Y220-R250 PolarHBondContact O-NH1 3.06Å; Y220-R250 PolarHBondContact O-NH2 3.02Å; Y220-R250 VanDerWaalsContact O-NH2 3.08Å; H221-R250 HydrophobicContact CB-CG 3.98Å; Y248-R250 PolarHBondContact O-N 3.35Å; R250-R252 PolarHBondContact O-N 3.38Å
251	S	97	Very high	98.1	Very high	97 Å²	97	41.5 Å²	41.5	68%	0.678	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-13.1	177.2	60.9	0	0	0	0	114.3	R249	R249-S251 PolarHBondContact O-N 2.92Å
252	R	97.6	Very high	98.1	Very high	51 Å²	51	44.6 Å²	44.6	19%	0.192	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-30.7	-175.8	-67.8	-76.8	-63.9	-174.7	-2.8	112.6	S150 D197 R249 R250 L282	S150-R252 PolarHBondContact O-NH2 3.39Å; D197-R252 IonicContact OD1-NE 3.66Å; D197-R252 IonicContact OD2-NE 3.86Å; D197-R252 IonicContact OD2-NH2 3.15Å; R249-R252 HydrophobicContact CB-CB 4.08Å; R249-R252 HydrophobicContact CB-CG 4.02Å; R249-R252 PolarHBondContact O-N 3.15Å; R250-R252 PolarHBondContact O-N 3.38Å; R252-L282 PolarHBondContact O-N 3.35Å
253	F	98.3	Very high	98.1	Very high	3 Å²	3	44.6 Å²	44.6	1%	0.013	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	145.9	-173.5	-59.6	-80	0	0	0	112.6	I151 D197 I198 Y248 R249 L279 R280 C281	I151-F253 HydrophobicContact CB-CZ 4.41Å; I151-F253 HydrophobicContact CD1-CE1 4.08Å; I151-F253 HydrophobicContact CD1-CZ 3.91Å; I151-F253 HydrophobicContact CG1-CZ 3.93Å; I151-F253 HydrophobicContact CG2-CE2 4.29Å; I151-F253 HydrophobicContact CG2-CZ 3.67Å; D197-F253 HydrophobicContact CB-CE2 3.86Å; I198-F253 HydrophobicContact CD1-CE2 3.93Å; I198-F253 HydrophobicContact CD1-CZ 3.91Å; I198-F253 HydrophobicContact CG1-CD2 4.46Å; I198-F253 HydrophobicContact CG1-CE2 3.94Å; I198-F253 HydrophobicContact CG1-CZ 4.43Å; Y248-F253 HydrophobicContact CD2-CB 3.74Å; Y248-F253 HydrophobicContact CE2-CB 4.26Å; Y248-F253 WeakPolarHBondContact CE2-O 3.32Å; Y248-F253 HydrophobicContact CG-CB 4.48Å; R249-F253 PolarHBondContact O-N 2.77Å; F253-L279 HydrophobicContact CB-CB 4.18Å; F253-L279 HydrophobicContact CB-CD1 4.43Å; F253-L279 HydrophobicContact CD1-CB 3.9Å; F253-L279 HydrophobicContact CD1-CD1 4.43Å; F253-L279 HydrophobicContact CG-CB 4.24Å; F253-L279 HydrophobicContact CG-CD1 4.23Å; F253-R280 VanDerWaalsContact CA-O 3.31Å; F253-R280 WeakPolarHBondContact CA-O 3.36Å; F253-C281 HydrophobicContact CD1-CB 4.14Å; F253-C281 HydrophobicContact CE1-CB 3.87Å
254	H	97.7	Very high	98.1	Very high	120 Å²	120	45.9 Å²	45.9	56%	0.556	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	131.9	163.1	-174.8	76	0	0	0	109.3	H256 R280 L282	H254-H256 PolarHBondContact O-N 3.45Å; H254-R280 PolarHBondContact N-O 3.02Å; H254-R280 PolarHBondContact O-N 2.75Å; H254-L282 HydrophobicContact CB-CD2 4.02Å
255	L	97.9	Very high	97.9	Very high	41 Å²	41	46.5 Å²	46.5	22%	0.215	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	126.6	175.8	176.6	65.6	0	0	0	110.2	Y248 S257 Q277 L279	Y248-L255 HydrophobicContact CE1-CB 4.08Å; Y248-L255 HydrophobicContact CE1-CD1 4.46Å; Y248-L255 VanDerWaalsContact OH-CB 3.23Å; Y248-L255 WeakPolarHBondContact OH-CB 3.38Å; L255-S257 WeakPolarHBondContact CD1-O 3.12Å; L255-Q277 HydrophobicContact CD1-CB 3.94Å; L255-Q277 HydrophobicContact CD1-CG 3.98Å; L255-L279 HydrophobicContact CB-CD2 4.39Å; L255-L279 HydrophobicContact CD1-CD2 3.76Å
256	H	95.1	Very high	97.4	Very high	96 Å²	96	55 Å²	55	44%	0.444	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-44.1	174.8	-178.8	-91.5	0	0	0	111.6	H254 T278	H254-H256 PolarHBondContact O-N 3.45Å; H256-T278 WeakPolarHBondContact CA-O 3.42Å; H256-T278 HydrophobicContact CB-CG2 4.22Å; H256-T278 VanDerWaalsContact CB-O 3.31Å; H256-T278 WeakPolarHBondContact CB-O 3.19Å; H256-T278 PolarHBondContact N-O 2.85Å
257	S	96.1	Very high	96.8	Very high	50 Å²	50	63.6 Å²	63.6	35%	0.35	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	151.9	178.2	60.3	0	0	0	0	111.8	L255 Q277 T278	L255-S257 WeakPolarHBondContact CD1-O 3.12Å; S257-Q277 CarbonylContact O-C 3.53Å; S257-Q277 VanDerWaalsContact O-CA 3.32Å; S257-Q277 WeakPolarHBondContact O-CA 3.24Å; S257-T278 PolarHBondContact N-O 2.96Å; S257-T278 PolarHBondContact O-N 3.03Å; S257-T278 WeakPolarHBondContact OG-CB 3.48Å
258	T	98.4	Very high	96.7	Very high	51 Å²	51	69.4 Å²	69.4	31%	0.313	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136	170.7	-59.2	0	0	0	0	109.8	H260 I275 A276 Q277	T258-H260 WeakPolarHBondContact CG2-NE2 3.47Å; T258-I275 HydrophobicContact CG2-CG2 4.2Å; T258-A276 CarbonylContact C-O 3.51Å; T258-A276 WeakPolarHBondContact CA-O 3.22Å; T258-Q277 HydrophobicContact CG2-CG 3.95Å; T258-Q277 PolarHBondContact OG1-NE2 2.98Å
259	A	98.5	Very high	96.5	Very high	27 Å²	27	72.4 Å²	72.4	22%	0.223	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	120.3	167.6	0	0	0	0	0	109.6	L261 A276 I319	A259-L261 HydrophobicContact CB-CD2 4.16Å; A259-L261 HydrophobicContact CB-CG 4.47Å; A259-A276 HydrophobicContact CB-CB 4.38Å; A259-A276 PolarHBondContact N-O 2.97Å; A259-A276 PolarHBondContact O-N 3.41Å; A259-I319 HydrophobicContact CB-CD1 3.87Å
260	H	98.7	Very high	96.6	Very high	100 Å²	100	70.6 Å²	70.6	46%	0.463	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	112.6	170.1	-65.5	155.6	0	0	0	108.7	N223 L225 T258	N223-H260 PolarHBondContact ND2-NE2 2.91Å; L225-H260 HydrophobicContact CD1-CB 4.05Å; L225-H260 HydrophobicContact CD2-CB 3.78Å; T258-H260 WeakPolarHBondContact CG2-NE2 3.47Å
261	L	98.5	Very high	96.6	Very high	29 Å²	29	68.2 Å²	68.2	15%	0.152	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	122.4	-173.1	-55.3	177.8	0	0	0	109.7	A259 V273 A274 L312 I319	A259-L261 HydrophobicContact CB-CD2 4.16Å; A259-L261 HydrophobicContact CB-CG 4.47Å; L261-V273 CarbonylContact O-C 3.44Å; L261-V273 VanDerWaalsContact O-CA 3.23Å; L261-V273 WeakPolarHBondContact O-CA 3.44Å; L261-A274 HydrophobicContact CB-CB 4.25Å; L261-A274 PolarHBondContact N-O 3.18Å; L261-A274 PolarHBondContact O-N 3.31Å; L261-L312 HydrophobicContact CD1-CD1 3.97Å; L261-I319 HydrophobicContact CD1-CD1 4.33Å
262	R	98.4	Very high	96.7	Very high	113 Å²	113	64.3 Å²	64.3	43%	0.426	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	112.2	162.8	-177	178	-179.6	-172.8	-3.9	107.8	T270	R262-T270 PolarHBondContact NE-O 3.3Å; R262-T270 PolarHBondContact NH2-O 3.32Å; R262-T270 VanDerWaalsContact NH2-O 3.13Å
263	L	98.4	Very high	96.7	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	142.2	-173.1	-58.1	-176	0	0	0	110.7	T270 Q272 A274 L295 Q308 L312	L263-T270 WeakPolarHBondContact O-CA 3.47Å; L263-T270 VanDerWaalsContact O-CB 3.28Å; L263-T270 WeakPolarHBondContact O-CB 3.13Å; L263-T270 WeakPolarHBondContact O-CG2 3.42Å; L263-T270 PolarHBondContact O-N 2.98Å; L263-T270 PolarHBondContact O-OG1 2.74Å; L263-Q272 HydrophobicContact CB-CB 4.49Å; L263-Q272 HydrophobicContact CD1-CB 4.05Å; L263-Q272 PolarHBondContact N-O 3.23Å; L263-A274 HydrophobicContact CD2-CB 4.14Å; L263-L295 HydrophobicContact CD1-CD2 3.51Å; L263-Q308 HydrophobicContact CB-CB 4.44Å; L263-Q308 HydrophobicContact CB-CG 4.29Å; L263-Q308 HydrophobicContact CD1-CB 4.11Å; L263-L312 HydrophobicContact CD2-CB 4.02Å; L263-L312 HydrophobicContact CD2-CD1 4.24Å
264	S	97.8	Very high	96.7	Very high	26 Å²	26	61.9 Å²	61.9	18%	0.182	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	155.9	178	-62.6	0	0	0	0	111.9	L268 D311	S264-L268 CarbonylContact C-O 3.57Å; S264-L268 WeakPolarHBondContact CA-O 3.23Å; S264-L268 WeakPolarHBondContact CB-O 3.22Å; S264-D311 PolarHBondContact N-OD2 3.22Å; S264-D311 VanDerWaalsContact O-CB 3.31Å; S264-D311 WeakPolarHBondContact O-CB 3.05Å
265	A	95.4	Very high	96.8	Very high	14 Å²	14	56.2 Å²	56.2	12%	0.116	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	116.5	170.8	0	0	0	0	0	108.4	M267 L268 T270 L304 A307	A265-M267 VanDerWaalsContact C-N 3.3Å; A265-M267 PolarHBondContact O-N 2.67Å; A265-L268 PolarHBondContact N-O 3.34Å; A265-L268 WeakPolarHBondContact O-CB 3.26Å; A265-L268 PolarHBondContact O-N 2.82Å; A265-T270 HydrophobicContact CB-CG2 3.76Å; A265-L304 HydrophobicContact CB-CD1 3.29Å; A265-A307 HydrophobicContact CB-CB 3.71Å
266	M	87.8	Confident	96.8	Very high	177 Å²	177	54.3 Å²	54.3	87%	0.872	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	48.1	-174.2	-54	177.6	-178.5	0	0	111.9	L268	M266-L268 PolarHBondContact O-N 3.36Å; M266-L268 VanDerWaalsContact O-N 3.11Å
267	M	87.9	Confident	97	Very high	181 Å²	181	49.8 Å²	49.8	89%	0.892	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	2.1	-176.9	-52	176.3	64.2	0	0	115.9	A265	A265-M267 VanDerWaalsContact C-N 3.3Å; A265-M267 PolarHBondContact O-N 2.67Å
268	L	95.1	Very high	97.1	Very high	125 Å²	125	47.7 Å²	47.7	65%	0.654	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.6	175.4	-64.8	173.1	0	0	0	110.3	S264 A265 M266 T270	S264-L268 CarbonylContact C-O 3.57Å; S264-L268 WeakPolarHBondContact CA-O 3.23Å; S264-L268 WeakPolarHBondContact CB-O 3.22Å; A265-L268 PolarHBondContact N-O 3.34Å; A265-L268 WeakPolarHBondContact O-CB 3.26Å; A265-L268 PolarHBondContact O-N 2.82Å; M266-L268 PolarHBondContact O-N 3.36Å; M266-L268 VanDerWaalsContact O-N 3.11Å; L268-T270 PolarHBondContact O-N 3.15Å
269	P	96.7	Very high	97.1	Very high	75 Å²	75	45.2 Å²	45.2	49%	0.487	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	124.6	179.3	28.3	-34.7	0	0	0	110.1
270	T	98.4	Very high	97	Very high	17 Å²	17	49.8 Å²	49.8	10%	0.104	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-172.9	177.7	77.1	0	0	0	0	110.8	R262 L263 A265 L268 Q272 L304 Q308	R262-T270 PolarHBondContact NE-O 3.3Å; R262-T270 PolarHBondContact NH2-O 3.32Å; R262-T270 VanDerWaalsContact NH2-O 3.13Å; L263-T270 WeakPolarHBondContact O-CA 3.47Å; L263-T270 VanDerWaalsContact O-CB 3.28Å; L263-T270 WeakPolarHBondContact O-CB 3.13Å; L263-T270 WeakPolarHBondContact O-CG2 3.42Å; L263-T270 PolarHBondContact O-N 2.98Å; L263-T270 PolarHBondContact O-OG1 2.74Å; A265-T270 HydrophobicContact CB-CG2 3.76Å; L268-T270 PolarHBondContact O-N 3.15Å; T270-Q272 PolarHBondContact OG1-N 3.45Å; T270-L304 HydrophobicContact CG2-CD1 4.02Å; T270-Q308 HydrophobicContact CG2-CG 4.05Å; T270-Q308 PolarHBondContact OG1-NE2 2.74Å
271	N	98.4	Very high	96.8	Very high	39 Å²	39	45.1 Å²	45.1	21%	0.209	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-5.1	174.6	-166.2	39.1	0	0	0	113	P228 W229	P228-N271 WeakPolarHBondContact CD-O 3.32Å; P228-N271 WeakPolarHBondContact CD-OD1 3.37Å; W229-N271 WeakPolarHBondContact CA-OD1 3.13Å; W229-N271 WeakPolarHBondContact CB-OD1 3.28Å; W229-N271 PolarHBondContact N-OD1 3.37Å; W229-N271 PolarHBondContact O-ND2 3.07Å
272	Q	98.8	Very high	96.7	Very high	16 Å²	16	47.9 Å²	47.9	8%	0.075	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	153.4	-176.9	-75.5	56.3	75.8	0	0	110.2	L263 T270 H294	L263-Q272 HydrophobicContact CB-CB 4.49Å; L263-Q272 HydrophobicContact CD1-CB 4.05Å; L263-Q272 PolarHBondContact N-O 3.23Å; T270-Q272 PolarHBondContact OG1-N 3.45Å; Q272-H294 WeakPolarHBondContact CB-O 3.37Å; Q272-H294 WeakPolarHBondContact CG-O 3.05Å
273	V	98.8	Very high	96.4	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.018	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	157.8	-171.5	-63.4	0	0	0	0	110.5	L225 K227 L261 T293	L225-V273 HydrophobicContact CD2-CB 3.75Å; L225-V273 HydrophobicContact CD2-CG1 4.26Å; L225-V273 HydrophobicContact CD2-CG2 4.36Å; L225-V273 HydrophobicContact CG-CB 3.97Å; L225-V273 HydrophobicContact CG-CG1 4.2Å; L225-V273 HydrophobicContact CG-CG2 4.2Å; K227-V273 HydrophobicContact CG-CG2 4.38Å; L261-V273 CarbonylContact O-C 3.44Å; L261-V273 VanDerWaalsContact O-CA 3.23Å; L261-V273 WeakPolarHBondContact O-CA 3.44Å; V273-T293 PolarHBondContact O-OG1 3.33Å
274	A	98.9	Very high	96	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	149.6	169.1	0	0	0	0	0	110.5	L225 L261 L263 V292 L312	L225-A274 WeakPolarHBondContact CD2-O 3.11Å; L261-A274 HydrophobicContact CB-CB 4.25Å; L261-A274 PolarHBondContact N-O 3.18Å; L261-A274 PolarHBondContact O-N 3.31Å; L263-A274 HydrophobicContact CD2-CB 4.14Å; A274-V292 CarbonylContact C-O 3.48Å; A274-V292 WeakPolarHBondContact CA-O 3.39Å; A274-V292 WeakPolarHBondContact CB-O 3.48Å; A274-L312 HydrophobicContact CB-CD1 3.92Å
275	I	98.9	Very high	95.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128.9	169.3	-57.8	168.3	0	0	0	106.7	L225 C244 L246 T258 Q277 V291 V292	L225-I275 HydrophobicContact CB-CD1 3.76Å; L225-I275 HydrophobicContact CB-CG1 3.6Å; L225-I275 HydrophobicContact CD2-CG1 4.09Å; C244-I275 HydrophobicContact CB-CD1 4.29Å; C244-I275 VanDerWaalsContact O-CD1 3.28Å; C244-I275 WeakPolarHBondContact O-CD1 3.48Å; L246-I275 HydrophobicContact CB-CG2 4.25Å; L246-I275 HydrophobicContact CD1-CG2 4.16Å; T258-I275 HydrophobicContact CG2-CG2 4.2Å; I275-Q277 HydrophobicContact CG2-CG 4.09Å; I275-V291 CarbonylContact O-C 3.55Å; I275-V291 VanDerWaalsContact O-CA 3.24Å; I275-V291 WeakPolarHBondContact O-CA 3.24Å; I275-V292 HydrophobicContact CB-CG1 3.81Å; I275-V292 HydrophobicContact CD1-CG1 4.25Å; I275-V292 HydrophobicContact CG1-CG1 4.31Å; I275-V292 PolarHBondContact N-O 2.88Å; I275-V292 PolarHBondContact O-N 2.66Å
276	A	98.9	Very high	95.6	Very high	2 Å²	2	50.5 Å²	50.5	2%	0.017	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.4	170.1	0	0	0	0	0	109.5	T258 A259 V290 V291 L316 I319	T258-A276 CarbonylContact C-O 3.51Å; T258-A276 WeakPolarHBondContact CA-O 3.22Å; A259-A276 HydrophobicContact CB-CB 4.38Å; A259-A276 PolarHBondContact N-O 2.97Å; A259-A276 PolarHBondContact O-N 3.41Å; A276-V290 CarbonylContact C-O 3.55Å; A276-V290 WeakPolarHBondContact CA-O 3.4Å; A276-V291 HydrophobicContact CB-CG1 4.42Å; A276-V291 HydrophobicContact CB-CG2 3.98Å; A276-L316 HydrophobicContact CB-CD2 4.1Å; A276-I319 HydrophobicContact CB-CD1 3.98Å
277	Q	98.7	Very high	95.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.9	176.6	-72	-169.3	-37.6	0	0	110.9	N223 L246 L255 S257 T258 I275 L279 C289 V290	N223-Q277 PolarHBondContact OD1-NE2 3.27Å; L246-Q277 HydrophobicContact CD1-CB 4.13Å; L246-Q277 HydrophobicContact CD1-CG 4.11Å; L246-Q277 VanDerWaalsContact CD2-OE1 3.26Å; L255-Q277 HydrophobicContact CD1-CB 3.94Å; L255-Q277 HydrophobicContact CD1-CG 3.98Å; S257-Q277 CarbonylContact O-C 3.53Å; S257-Q277 VanDerWaalsContact O-CA 3.32Å; S257-Q277 WeakPolarHBondContact O-CA 3.24Å; T258-Q277 HydrophobicContact CG2-CG 3.95Å; T258-Q277 PolarHBondContact OG1-NE2 2.98Å; I275-Q277 HydrophobicContact CG2-CG 4.09Å; Q277-L279 HydrophobicContact CB-CD2 4.09Å; Q277-L279 HydrophobicContact CB-CG 4.42Å; Q277-C289 CarbonylContact O-C 3.6Å; Q277-C289 WeakPolarHBondContact O-CA 3.4Å; Q277-V290 PolarHBondContact N-O 3.47Å; Q277-V290 PolarHBondContact O-N 3.18Å
278	T	98.1	Very high	96.3	Very high	6 Å²	6	34.9 Å²	34.9	4%	0.037	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	117	169	-59.8	0	0	0	0	108.2	H256 S257 Q287 V331	H256-T278 WeakPolarHBondContact CA-O 3.42Å; H256-T278 HydrophobicContact CB-CG2 4.22Å; H256-T278 VanDerWaalsContact CB-O 3.31Å; H256-T278 WeakPolarHBondContact CB-O 3.19Å; H256-T278 PolarHBondContact N-O 2.85Å; S257-T278 PolarHBondContact N-O 2.96Å; S257-T278 PolarHBondContact O-N 3.03Å; S257-T278 WeakPolarHBondContact OG-CB 3.48Å; T278-Q287 HydrophobicContact CG2-CB 4.28Å; T278-Q287 HydrophobicContact CG2-CG 4.44Å; T278-V331 HydrophobicContact CG2-CG1 4.33Å
279	L	97.6	Very high	96.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	137	-176.6	-56.6	-178.7	0	0	0	109.6	I198 Y248 F253 L255 Q277 Q287 L288 V290	I198-L279 HydrophobicContact CD1-CD1 4.23Å; I198-L279 HydrophobicContact CG1-CD1 4.24Å; Y248-L279 HydrophobicContact CD1-CD1 4.33Å; Y248-L279 HydrophobicContact CD1-CD2 3.73Å; Y248-L279 HydrophobicContact CD2-CD2 4.45Å; Y248-L279 HydrophobicContact CE1-CD2 3.93Å; Y248-L279 HydrophobicContact CG-CD1 4.08Å; Y248-L279 HydrophobicContact CG-CD2 4.03Å; F253-L279 HydrophobicContact CB-CB 4.18Å; F253-L279 HydrophobicContact CB-CD1 4.43Å; F253-L279 HydrophobicContact CD1-CB 3.9Å; F253-L279 HydrophobicContact CD1-CD1 4.43Å; F253-L279 HydrophobicContact CG-CB 4.24Å; F253-L279 HydrophobicContact CG-CD1 4.23Å; L255-L279 HydrophobicContact CB-CD2 4.39Å; L255-L279 HydrophobicContact CD1-CD2 3.76Å; Q277-L279 HydrophobicContact CB-CD2 4.09Å; Q277-L279 HydrophobicContact CB-CG 4.42Å; L279-Q287 CarbonylContact O-C 3.57Å; L279-Q287 VanDerWaalsContact O-CA 3.26Å; L279-Q287 WeakPolarHBondContact O-CA 3.44Å; L279-L288 PolarHBondContact N-O 3.41Å; L279-L288 PolarHBondContact O-N 3.26Å; L279-V290 HydrophobicContact CD1-CG2 3.87Å; L279-V290 HydrophobicContact CG-CG2 4.5Å
280	R	96.1	Very high	96.6	Very high	123 Å²	123	25.3 Å²	25.3	46%	0.464	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	116.3	169.5	-177.4	178.4	177.9	-124.5	-0.2	109.2	F253 H254 L282 G285	F253-R280 VanDerWaalsContact CA-O 3.31Å; F253-R280 WeakPolarHBondContact CA-O 3.36Å; H254-R280 PolarHBondContact N-O 3.02Å; H254-R280 PolarHBondContact O-N 2.75Å; R280-L282 PolarHBondContact O-N 3.13Å; R280-G285 PolarHBondContact NE-O 2.85Å
281	C	95.8	Very high	96.6	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.007	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	123	172.3	179.5	0	0	0	0	109.5	F253 T284 G285 R286 F437	F253-C281 HydrophobicContact CD1-CB 4.14Å; F253-C281 HydrophobicContact CE1-CB 3.87Å; C281-T284 WeakPolarHBondContact CB-OG1 3.27Å; C281-T284 PolarHBondContact SG-OG1 3.05Å; C281-G285 WeakPolarHBondContact O-CA 3.05Å; C281-G285 PolarHBondContact O-N 3.12Å; C281-R286 PolarHBondContact N-O 3.05Å; C281-F437 HydrophobicContact CB-CE2 4.16Å
282	L	95.4	Very high	96.6	Very high	88 Å²	88	22.7 Å²	22.7	46%	0.461	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-35	-177.1	-65.1	179.4	0	0	0	112.1	R252 H254 R280	R252-L282 PolarHBondContact O-N 3.35Å; H254-L282 HydrophobicContact CB-CD2 4.02Å; R280-L282 PolarHBondContact O-N 3.13Å
283	A	91.9	Very high	96.7	Very high	67 Å²	67	21.9 Å²	21.9	55%	0.554	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-38.3	-178.6	0	0	0	0	0	113	P149	P149-A283 HydrophobicContact CG-CB 3.8Å
284	T	91.4	Very high	96.7	Very high	40 Å²	40	22 Å²	22	25%	0.245	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-13.1	-174.8	66.4	0	0	0	0	113.5	C281 R286	C281-T284 WeakPolarHBondContact CB-OG1 3.27Å; C281-T284 PolarHBondContact SG-OG1 3.05Å; T284-R286 PolarHBondContact O-N 2.92Å; T284-R286 VanDerWaalsContact O-N 3.15Å; T284-R286 WeakPolarHBondContact OG1-CB 3.28Å; T284-R286 PolarHBondContact OG1-N 2.95Å
285	G	91.4	Very high	96.7	Very high	30 Å²	30	22.1 Å²	22.1	31%	0.309	12%	0.12	S	C	.	.			trans	70	-3.6	-171.4	0	0	0	0	0	114.8	R280 C281	R280-G285 PolarHBondContact NE-O 2.85Å; C281-G285 WeakPolarHBondContact O-CA 3.05Å; C281-G285 PolarHBondContact O-N 3.12Å
286	R	91.9	Very high	96.6	Very high	71 Å²	71	24 Å²	24	27%	0.268	13%	0.129	S	C	.	.			trans	-79.1	149.4	-175.9	-63.3	-179.5	65.7	160.7	-0.2	111.9	C281 T284 F437 R438	C281-R286 PolarHBondContact N-O 3.05Å; T284-R286 PolarHBondContact O-N 2.92Å; T284-R286 VanDerWaalsContact O-N 3.15Å; T284-R286 WeakPolarHBondContact OG1-CB 3.28Å; T284-R286 PolarHBondContact OG1-N 2.95Å; R286-F437 HydrophobicContact CB-CD1 4.45Å; R286-F437 HydrophobicContact CB-CD2 4.38Å; R286-F437 HydrophobicContact CB-CE1 4.01Å; R286-F437 HydrophobicContact CB-CE2 3.93Å; R286-F437 HydrophobicContact CB-CZ 3.72Å; R286-F437 VanDerWaalsContact CZ-CB 3.41Å; R286-R438 PolarHBondContact NH1-O 2.9Å
287	Q	94.7	Very high	96.5	Very high	29 Å²	29	25.5 Å²	25.5	14%	0.136	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	148.9	173.7	-67.9	-176.2	-24.4	0	0	111.9	T278 L279 V331 F437	T278-Q287 HydrophobicContact CG2-CB 4.28Å; T278-Q287 HydrophobicContact CG2-CG 4.44Å; L279-Q287 CarbonylContact O-C 3.57Å; L279-Q287 VanDerWaalsContact O-CA 3.26Å; L279-Q287 WeakPolarHBondContact O-CA 3.44Å; Q287-V331 HydrophobicContact CB-CG1 3.95Å; Q287-V331 HydrophobicContact CB-CG2 4.37Å; Q287-F437 WeakPolarHBondContact O-CE1 3.21Å
288	L	97.1	Very high	96.2	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	128.5	173.8	178.4	68.3	0	0	0	108.1	I151 I198 L279 V290 P332 V334 L400 I435 F437	I151-L288 HydrophobicContact CD1-CD2 4.23Å; I198-L288 HydrophobicContact CD1-CD2 4.09Å; L279-L288 PolarHBondContact N-O 3.41Å; L279-L288 PolarHBondContact O-N 3.26Å; L288-V290 HydrophobicContact CD2-CG2 3.94Å; L288-V290 HydrophobicContact CG-CG2 4.05Å; L288-P332 HydrophobicContact CD1-CB 4.24Å; L288-V334 HydrophobicContact CD1-CG2 4.03Å; L288-L400 HydrophobicContact CD1-CD1 3.8Å; L288-L400 HydrophobicContact CD1-CD2 4.18Å; L288-I435 HydrophobicContact CD2-CD1 4.45Å; L288-F437 HydrophobicContact CB-CE1 4.39Å; L288-F437 HydrophobicContact CB-CZ 4.14Å
289	C	98.4	Very high	95.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	116.9	172	-176.9	0	0	0	0	109.3	Q277 T320 V331 P332 L333 V334	Q277-C289 CarbonylContact O-C 3.6Å; Q277-C289 WeakPolarHBondContact O-CA 3.4Å; C289-T320 HydrophobicContact CB-CG2 3.84Å; C289-V331 HydrophobicContact CB-CG1 3.92Å; C289-P332 PolarHBondContact N-O 3Å; C289-L333 HydrophobicContact CB-CD2 3.69Å; C289-L333 HydrophobicContact CB-CG 4.46Å; C289-L333 CarbonylContact O-C 3.58Å; C289-L333 WeakPolarHBondContact O-CA 3.18Å; C289-V334 PolarHBondContact O-N 3.5Å
290	V	98.9	Very high	95.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	134.4	179.4	-176.7	0	0	0	0	108.5	I198 L246 A276 Q277 L279 L288 V334	I198-V290 HydrophobicContact CD1-CG2 3.71Å; I198-V290 HydrophobicContact CG2-CG1 3.59Å; I198-V290 HydrophobicContact CG2-CG2 4.35Å; L246-V290 HydrophobicContact CD1-CB 4.25Å; L246-V290 HydrophobicContact CD1-CG1 3.98Å; L246-V290 HydrophobicContact CD2-CG1 4.45Å; L246-V290 HydrophobicContact CG-CG1 4.37Å; A276-V290 CarbonylContact C-O 3.55Å; A276-V290 WeakPolarHBondContact CA-O 3.4Å; Q277-V290 PolarHBondContact N-O 3.47Å; Q277-V290 PolarHBondContact O-N 3.18Å; L279-V290 HydrophobicContact CD1-CG2 3.87Å; L279-V290 HydrophobicContact CG-CG2 4.5Å; L288-V290 HydrophobicContact CD2-CG2 3.94Å; L288-V290 HydrophobicContact CG-CG2 4.05Å; V290-V334 CarbonylContact C-O 3.6Å; V290-V334 WeakPolarHBondContact CA-O 3.48Å
291	V	98.9	Very high	95.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	138	-176.4	-171.7	0	0	0	0	109.6	I275 A276 L312 L316 L333 V334 V335 C336	I275-V291 CarbonylContact O-C 3.55Å; I275-V291 VanDerWaalsContact O-CA 3.24Å; I275-V291 WeakPolarHBondContact O-CA 3.24Å; A276-V291 HydrophobicContact CB-CG1 4.42Å; A276-V291 HydrophobicContact CB-CG2 3.98Å; V291-L312 HydrophobicContact CG1-CD1 4.22Å; V291-L316 HydrophobicContact CB-CD2 4.44Å; V291-L316 HydrophobicContact CG1-CD1 4.45Å; V291-L316 HydrophobicContact CG1-CD2 4.18Å; V291-L316 HydrophobicContact CG2-CD1 4.03Å; V291-L316 HydrophobicContact CG2-CD2 3.41Å; V291-L316 VanDerWaalsContact CG2-CD2 3.41Å; V291-L316 HydrophobicContact CG2-CG 4.36Å; V291-L333 HydrophobicContact CG2-CD2 4.04Å; V291-V334 PolarHBondContact N-O 3.47Å; V291-V335 HydrophobicContact CB-CB 4.24Å; V291-V335 HydrophobicContact CB-CG1 3.99Å; V291-V335 HydrophobicContact CB-CG2 4.04Å; V291-V335 HydrophobicContact CG1-CG1 4.08Å; V291-V335 HydrophobicContact CG2-CG2 4.08Å; V291-C336 PolarHBondContact O-N 2.8Å
292	V	98.9	Very high	96.1	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	137.1	168.2	61.6	0	0	0	0	109.9	C200 C244 L246 A274 I275 C336	C200-V292 HydrophobicContact CB-CB 3.86Å; C200-V292 HydrophobicContact CB-CG2 3.78Å; C244-V292 HydrophobicContact CB-CG1 3.91Å; C244-V292 HydrophobicContact CB-CG2 4.2Å; L246-V292 HydrophobicContact CB-CG1 3.9Å; L246-V292 HydrophobicContact CD1-CG1 4.28Å; L246-V292 HydrophobicContact CG-CG1 4.35Å; A274-V292 CarbonylContact C-O 3.48Å; A274-V292 WeakPolarHBondContact CA-O 3.39Å; A274-V292 WeakPolarHBondContact CB-O 3.48Å; I275-V292 HydrophobicContact CB-CG1 3.81Å; I275-V292 HydrophobicContact CD1-CG1 4.25Å; I275-V292 HydrophobicContact CG1-CG1 4.31Å; I275-V292 PolarHBondContact N-O 2.88Å; I275-V292 PolarHBondContact O-N 2.66Å; V292-C336 CarbonylContact C-O 3.56Å; V292-C336 VanDerWaalsContact CA-O 3.28Å; V292-C336 WeakPolarHBondContact CA-O 3.44Å
293	T	98.9	Very high	96.2	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	160.6	177.2	-168.7	0	0	0	0	112	Q202 V273 L295 L312 C336 G337 D338 F339	Q202-T293 VanDerWaalsContact CG-O 3.32Å; Q202-T293 WeakPolarHBondContact CG-O 3.46Å; V273-T293 PolarHBondContact O-OG1 3.33Å; T293-L295 HydrophobicContact CG2-CD2 4.34Å; T293-L312 HydrophobicContact CG2-CD2 3.85Å; T293-C336 PolarHBondContact N-O 3.3Å; T293-G337 WeakPolarHBondContact O-CA 3.24Å; T293-D338 PolarHBondContact O-N 2.91Å; T293-F339 HydrophobicContact CG2-CD2 4.46Å; T293-F339 HydrophobicContact CG2-CE2 3.91Å; T293-F339 HydrophobicContact CG2-CZ 4.33Å
294	H	98.9	Very high	96.5	Very high	6 Å²	6	50.3 Å²	50.3	3%	0.028	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	107.5	169.9	-172.2	169.6	0	0	0	108.3	Q202 E203 K227 Q272 D338 N340	Q202-H294 HydrophobicContact CB-CB 4.04Å; Q202-H294 HydrophobicContact CG-CB 3.71Å; E203-H294 VanDerWaalsContact CG-CE1 3.46Å; E203-H294 WeakPolarHBondContact CG-CE1 3.41Å; E203-H294 IonicContact OE1-CE1 3.67Å; E203-H294 PolarHBondContact OE1-CE1 3.49Å; K227-H294 PolarHBondContact NZ-CE1 3.03Å; K227-H294 PolarHBondContact NZ-ND1 3.42Å; Q272-H294 WeakPolarHBondContact CB-O 3.37Å; Q272-H294 WeakPolarHBondContact CG-O 3.05Å; H294-D338 WeakPolarHBondContact CA-O 3.42Å; H294-D338 IonicContact NE2-OD2 3.66Å; H294-N340 PolarHBondContact CD2-ND2 3.47Å; H294-N340 VanDerWaalsContact CD2-ND2 3.26Å; H294-N340 PolarHBondContact NE2-ND2 3.27Å
295	L	98.8	Very high	96.8	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	24%	0.243	C	C	.	.			trans	-82	176.2	-175.7	-57.1	-171.5	0	0	0	113	L263 T293 A297 R305 Q308 D338 F339 N340 V347	L263-L295 HydrophobicContact CD1-CD2 3.51Å; T293-L295 HydrophobicContact CG2-CD2 4.34Å; L295-A297 PolarHBondContact O-N 3.27Å; L295-R305 HydrophobicContact CB-CG 4.28Å; L295-Q308 HydrophobicContact CD2-CB 4.06Å; L295-D338 PolarHBondContact N-O 3.31Å; L295-F339 WeakPolarHBondContact CB-O 3.19Å; L295-F339 HydrophobicContact CD1-CB 4.11Å; L295-F339 HydrophobicContact CD1-CD1 3.64Å; L295-F339 HydrophobicContact CD1-CE1 4.23Å; L295-F339 HydrophobicContact CD1-CG 3.92Å; L295-F339 HydrophobicContact CG-CG 4.45Å; L295-N340 PolarHBondContact O-ND2 2.92Å; L295-V347 HydrophobicContact CD1-CG2 3.77Å
296	K	98.6	Very high	97.2	Very high	41 Å²	41	47.4 Å²	47.4	18%	0.178	23%	0.23	C	C	.	.			trans	-64.2	117.7	-176.3	-180	70.3	178.8	69.9	0	112.1	W301 L304 R305 Q308	K296-W301 HydrophobicContact CB-CB 4.47Å; K296-W301 HydrophobicContact CG-CB 3.65Å; K296-W301 HydrophobicContact CG-CD2 4.12Å; K296-W301 HydrophobicContact CG-CE3 4.49Å; K296-W301 HydrophobicContact CG-CG 3.74Å; K296-L304 HydrophobicContact CB-CD2 4.19Å; K296-L304 HydrophobicContact CB-CG 4.35Å; K296-L304 HydrophobicContact CD-CD2 4.24Å; K296-L304 HydrophobicContact CG-CD2 3.88Å; K296-L304 HydrophobicContact CG-CG 4.49Å; K296-R305 HydrophobicContact CB-CG 4.09Å; K296-R305 VanDerWaalsContact O-CD 3.25Å; K296-R305 WeakPolarHBondContact O-CD 3.49Å; K296-R305 VanDerWaalsContact O-CG 3.3Å; K296-R305 WeakPolarHBondContact O-CG 3.3Å; K296-R305 PolarHBondContact O-NH1 3.3Å; K296-Q308 VanDerWaalsContact N-OE1 3.08Å
297	A	96.7	Very high	97.5	Very high	32 Å²	32	45.1 Å²	45.1	26%	0.264	23%	0.226	S	C	.	.			trans	-69.9	166.9	174	0	0	0	0	0	115.3	L295 N340	L295-A297 PolarHBondContact O-N 3.27Å; A297-N340 VanDerWaalsContact CA-CG 3.49Å; A297-N340 VanDerWaalsContact CA-OD1 3.28Å; A297-N340 WeakPolarHBondContact CA-OD1 3.44Å; A297-N340 HydrophobicContact CB-CB 4.48Å; A297-N340 WeakPolarHBondContact CB-OD1 3.43Å
298	R	92.5	Very high	97.7	Very high	199 Å²	199	43.7 Å²	43.7	75%	0.751	22%	0.219	S	C	*	.	S	Bend	trans	73	153.7	178.5	-51.8	-178.8	179	-176.3	-2.6	114.6	R305	R298-R305 PolarHBondContact O-NH1 2.96Å
299	S	92	Very high	97.8	Very high	102 Å²	102	43.7 Å²	43.7	71%	0.713	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	157.7	172.2	54.7	0	0	0	0	112.1	W301	S299-W301 VanDerWaalsContact C-N 3.32Å
300	G	95.7	Very high	97.8	Very high	61 Å²	61	45.3 Å²	45.3	63%	0.629	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.4	2.1	-176.1	0	0	0	0	0	114.4	E302	G300-E302 WeakPolarHBondContact CA-OE2 3.33Å; G300-E302 PolarHBondContact N-OE1 3.28Å; G300-E302 PolarHBondContact N-OE2 3.08Å
301	W	97.7	Very high	97.8	Very high	119 Å²	119	47.1 Å²	47.1	45%	0.451	24%	0.242	S	C	.	.			trans	-115.6	16.3	-179.8	-62	98.1	0	0	0	113.3	K296 S299 R303 L304 R305	K296-W301 HydrophobicContact CB-CB 4.47Å; K296-W301 HydrophobicContact CG-CB 3.65Å; K296-W301 HydrophobicContact CG-CD2 4.12Å; K296-W301 HydrophobicContact CG-CE3 4.49Å; K296-W301 HydrophobicContact CG-CG 3.74Å; S299-W301 VanDerWaalsContact C-N 3.32Å; W301-R303 VanDerWaalsContact C-N 3.31Å; W301-R303 PolarHBondContact O-N 3.48Å; W301-L304 HydrophobicContact CB-CB 4.45Å; W301-L304 HydrophobicContact CD2-CD2 4.39Å; W301-L304 HydrophobicContact CE3-CB 4.08Å; W301-L304 HydrophobicContact CE3-CD2 3.48Å; W301-L304 VanDerWaalsContact CE3-CD2 3.48Å; W301-L304 HydrophobicContact CE3-CG 4.41Å; W301-L304 HydrophobicContact CZ3-CD2 3.88Å; W301-L304 WeakPolarHBondContact O-CA 3.39Å; W301-L304 WeakPolarHBondContact O-CB 3.41Å; W301-L304 PolarHBondContact O-N 3.01Å; W301-R305 PolarHBondContact O-N 3.25Å
302	E	98.3	Very high	97.7	Very high	73 Å²	73	47.1 Å²	47.1	34%	0.341	24%	0.242	S	C	.	.	H	α-helix	trans	-57.3	-43.6	-175.8	-58.4	67.9	-151.3	0	0	111	G300 L304 R305 S306 E345	G300-E302 WeakPolarHBondContact CA-OE2 3.33Å; G300-E302 PolarHBondContact N-OE1 3.28Å; G300-E302 PolarHBondContact N-OE2 3.08Å; E302-L304 VanDerWaalsContact C-N 3.34Å; E302-L304 PolarHBondContact O-N 3.29Å; E302-R305 PolarHBondContact O-N 2.97Å; E302-R305 IonicContact OE1-NH2 2.96Å; E302-R305 PolarHBondContact OE1-NH2 3.23Å; E302-S306 WeakPolarHBondContact O-CB 3.12Å; E302-S306 PolarHBondContact O-N 3.19Å; E302-E345 HydrophobicContact CG-CG 4.41Å
303	R	98.1	Very high	97.7	Very high	213 Å²	213	48 Å²	48	80%	0.804	25%	0.247	S	C	*	.	H	α-helix	trans	-65.9	-36.3	176.6	-67.7	-176.1	-175.9	-94.3	-0.3	112.4	W301 S306 A307	W301-R303 VanDerWaalsContact C-N 3.31Å; W301-R303 PolarHBondContact O-N 3.48Å; R303-S306 WeakPolarHBondContact O-CB 3.43Å; R303-S306 PolarHBondContact O-N 2.89Å; R303-A307 PolarHBondContact O-N 3.39Å
304	L	98.3	Very high	97.7	Very high	40 Å²	40	54.5 Å²	54.5	21%	0.209	28%	0.277	C	S	.	.	H	α-helix	trans	-68.8	-45.3	177	178.5	56.9	0	0	0	110.3	A265 T270 K296 W301 E302 S306 A307 Q308	A265-L304 HydrophobicContact CB-CD1 3.29Å; T270-L304 HydrophobicContact CG2-CD1 4.02Å; K296-L304 HydrophobicContact CB-CD2 4.19Å; K296-L304 HydrophobicContact CB-CG 4.35Å; K296-L304 HydrophobicContact CD-CD2 4.24Å; K296-L304 HydrophobicContact CG-CD2 3.88Å; K296-L304 HydrophobicContact CG-CG 4.49Å; W301-L304 HydrophobicContact CB-CB 4.45Å; W301-L304 HydrophobicContact CD2-CD2 4.39Å; W301-L304 HydrophobicContact CE3-CB 4.08Å; W301-L304 HydrophobicContact CE3-CD2 3.48Å; W301-L304 VanDerWaalsContact CE3-CD2 3.48Å; W301-L304 HydrophobicContact CE3-CG 4.41Å; W301-L304 HydrophobicContact CZ3-CD2 3.88Å; W301-L304 WeakPolarHBondContact O-CA 3.39Å; W301-L304 WeakPolarHBondContact O-CB 3.41Å; W301-L304 PolarHBondContact O-N 3.01Å; E302-L304 VanDerWaalsContact C-N 3.34Å; E302-L304 PolarHBondContact O-N 3.29Å; L304-S306 VanDerWaalsContact C-N 3.31Å; L304-S306 PolarHBondContact O-N 2.72Å; L304-A307 PolarHBondContact O-N 2.65Å; L304-A307 VanDerWaalsContact O-N 3.17Å; L304-Q308 HydrophobicContact CD1-CG 4.31Å; L304-Q308 WeakPolarHBondContact O-CG 3.42Å; L304-Q308 PolarHBondContact O-N 2.95Å
305	R	98.6	Very high	97.6	Very high	3 Å²	3	55.9 Å²	55.9	1%	0.011	29%	0.287	C	S	.	.	H	α-helix	trans	-57.7	-43.6	172.9	-72.4	-170	-73.9	-88.8	11.3	111.9	L295 K296 R298 W301 E302 A307 Q308 G309 F339 N340 E345 V347	L295-R305 HydrophobicContact CB-CG 4.28Å; K296-R305 HydrophobicContact CB-CG 4.09Å; K296-R305 VanDerWaalsContact O-CD 3.25Å; K296-R305 WeakPolarHBondContact O-CD 3.49Å; K296-R305 VanDerWaalsContact O-CG 3.3Å; K296-R305 WeakPolarHBondContact O-CG 3.3Å; K296-R305 PolarHBondContact O-NH1 3.3Å; R298-R305 PolarHBondContact O-NH1 2.96Å; W301-R305 PolarHBondContact O-N 3.25Å; E302-R305 PolarHBondContact O-N 2.97Å; E302-R305 IonicContact OE1-NH2 2.96Å; E302-R305 PolarHBondContact OE1-NH2 3.23Å; R305-A307 VanDerWaalsContact C-N 3.33Å; R305-A307 PolarHBondContact O-N 3.13Å; R305-Q308 PolarHBondContact O-N 3.3Å; R305-G309 PolarHBondContact O-N 3.12Å; R305-F339 WeakPolarHBondContact CD-O 3.44Å; R305-N340 VanDerWaalsContact CD-O 3.3Å; R305-N340 WeakPolarHBondContact CD-O 3.25Å; R305-N340 PolarHBondContact NE-O 3.06Å; R305-N340 VanDerWaalsContact NE-O 3.08Å; R305-N340 PolarHBondContact NH1-O 3.29Å; R305-E345 IonicContact CZ-OE1 3.36Å; R305-E345 IonicContact CZ-OE2 2.74Å; R305-E345 VanDerWaalsContact CZ-OE2 3.3Å; R305-E345 IonicContact NE-OE1 3.68Å; R305-E345 IonicContact NE-OE2 3.44Å; R305-E345 PolarHBondContact NE-OE2 3.09Å; R305-E345 IonicContact NH2-OE1 3.87Å; R305-E345 PolarHBondContact NH2-OE1 3.03Å; R305-E345 IonicContact NH2-OE2 2.97Å; R305-E345 PolarHBondContact NH2-OE2 3.2Å; R305-V347 HydrophobicContact CB-CB 4.36Å; R305-V347 HydrophobicContact CB-CG1 4.25Å; R305-V347 WeakPolarHBondContact O-CG2 3.35Å
306	S	98.6	Very high	97.6	Very high	6 Å²	6	55.8 Å²	55.8	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-58.7	-42.3	175.7	-173.2	0	0	0	0	112.3	E302 R303 L304 A310 D346 R350	E302-S306 WeakPolarHBondContact O-CB 3.12Å; E302-S306 PolarHBondContact O-N 3.19Å; R303-S306 WeakPolarHBondContact O-CB 3.43Å; R303-S306 PolarHBondContact O-N 2.89Å; L304-S306 VanDerWaalsContact C-N 3.31Å; L304-S306 PolarHBondContact O-N 2.72Å; S306-A310 PolarHBondContact O-N 3.37Å; S306-D346 WeakPolarHBondContact OG-CB 3.34Å; S306-R350 WeakPolarHBondContact O-CD 3.3Å; S306-R350 PolarHBondContact O-NE 3.2Å; S306-R350 PolarHBondContact OG-NE 3.2Å
307	A	98.6	Very high	97.4	Very high	22 Å²	22	58.9 Å²	58.9	18%	0.182	30%	0.302	C	S	.	.	H	α-helix	trans	-69.9	-42.8	176	0	0	0	0	0	112.6	A265 R303 L304 R305 G309 A310 D311	A265-A307 HydrophobicContact CB-CB 3.71Å; R303-A307 PolarHBondContact O-N 3.39Å; L304-A307 PolarHBondContact O-N 2.65Å; L304-A307 VanDerWaalsContact O-N 3.17Å; R305-A307 VanDerWaalsContact C-N 3.33Å; R305-A307 PolarHBondContact O-N 3.13Å; A307-G309 VanDerWaalsContact C-N 3.32Å; A307-G309 PolarHBondContact O-N 3.47Å; A307-A310 PolarHBondContact O-N 3.4Å; A307-D311 PolarHBondContact O-N 2.93Å
308	Q	98.8	Very high	97.4	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-59.7	-42.7	174.6	-73.6	174.6	-32.8	0	0	111.8	L263 T270 L295 K296 L304 R305 D311 L312	L263-Q308 HydrophobicContact CB-CB 4.44Å; L263-Q308 HydrophobicContact CB-CG 4.29Å; L263-Q308 HydrophobicContact CD1-CB 4.11Å; T270-Q308 HydrophobicContact CG2-CG 4.05Å; T270-Q308 PolarHBondContact OG1-NE2 2.74Å; L295-Q308 HydrophobicContact CD2-CB 4.06Å; K296-Q308 VanDerWaalsContact N-OE1 3.08Å; L304-Q308 HydrophobicContact CD1-CG 4.31Å; L304-Q308 WeakPolarHBondContact O-CG 3.42Å; L304-Q308 PolarHBondContact O-N 2.95Å; R305-Q308 PolarHBondContact O-N 3.3Å; Q308-D311 PolarHBondContact O-N 3.23Å; Q308-L312 WeakPolarHBondContact O-CB 3.33Å; Q308-L312 PolarHBondContact O-N 3.21Å
309	G	98.7	Very high	97.5	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.6	-38.7	176	0	0	0	0	0	112.8	R305 A307 L312 L313	R305-G309 PolarHBondContact O-N 3.12Å; A307-G309 VanDerWaalsContact C-N 3.32Å; A307-G309 PolarHBondContact O-N 3.47Å; G309-L312 PolarHBondContact O-N 2.8Å; G309-L313 WeakPolarHBondContact O-CB 3.49Å; G309-L313 VanDerWaalsContact O-CG 3.25Å; G309-L313 WeakPolarHBondContact O-CG 3.44Å; G309-L313 PolarHBondContact O-N 3.41Å
310	A	98.6	Very high	97.6	Very high	33 Å²	33	47.1 Å²	47.1	27%	0.273	25%	0.253	S	S	.	.	H	α-helix	trans	-63.2	-44.6	174.8	0	0	0	0	0	112.3	S306 A307 L313 Q314	S306-A310 PolarHBondContact O-N 3.37Å; A307-A310 PolarHBondContact O-N 3.4Å; A310-L313 PolarHBondContact O-N 3.32Å; A310-Q314 WeakPolarHBondContact O-CB 3.37Å; A310-Q314 PolarHBondContact O-N 3.02Å
311	D	98.7	Very high	97.3	Very high	38 Å²	38	46 Å²	46	20%	0.203	24%	0.238	C	C	.	.	H	α-helix	trans	-62.4	-41.9	176.2	-176.5	68.7	0	0	0	112.2	S264 A307 Q308 Q314 S315	S264-D311 PolarHBondContact N-OD2 3.22Å; S264-D311 VanDerWaalsContact O-CB 3.31Å; S264-D311 WeakPolarHBondContact O-CB 3.05Å; A307-D311 PolarHBondContact O-N 2.93Å; Q308-D311 PolarHBondContact O-N 3.23Å; D311-Q314 PolarHBondContact O-N 3.21Å; D311-S315 PolarHBondContact O-N 3.1Å; D311-S315 PolarHBondContact O-OG 2.72Å
312	L	98.8	Very high	96.4	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.1	-51.3	173.8	-179.2	54.2	0	0	0	111.1	L261 L263 A274 V291 T293 Q308 G309 Q314 S315 L316 F351	L261-L312 HydrophobicContact CD1-CD1 3.97Å; L263-L312 HydrophobicContact CD2-CB 4.02Å; L263-L312 HydrophobicContact CD2-CD1 4.24Å; A274-L312 HydrophobicContact CB-CD1 3.92Å; V291-L312 HydrophobicContact CG1-CD1 4.22Å; T293-L312 HydrophobicContact CG2-CD2 3.85Å; Q308-L312 WeakPolarHBondContact O-CB 3.33Å; Q308-L312 PolarHBondContact O-N 3.21Å; G309-L312 PolarHBondContact O-N 2.8Å; L312-Q314 VanDerWaalsContact C-N 3.3Å; L312-Q314 PolarHBondContact O-N 2.98Å; L312-S315 WeakPolarHBondContact O-CB 3.39Å; L312-S315 PolarHBondContact O-N 3.25Å; L312-S315 VanDerWaalsContact O-N 3.13Å; L312-L316 HydrophobicContact CD1-CD1 4.17Å; L312-L316 HydrophobicContact CD1-CD2 4.28Å; L312-L316 HydrophobicContact CD1-CG 4.02Å; L312-L316 HydrophobicContact CG-CD1 4.13Å; L312-L316 HydrophobicContact CG-CG 4.38Å; L312-L316 VanDerWaalsContact O-CG 3.29Å; L312-L316 WeakPolarHBondContact O-CG 3.35Å; L312-L316 PolarHBondContact O-N 3.27Å; L312-F351 HydrophobicContact CD2-CZ 4.03Å; L312-F351 HydrophobicContact CG-CZ 4.38Å
313	L	98.6	Very high	95	Very high	18 Å²	18	44.9 Å²	44.9	9%	0.094	27%	0.266	C	S	.	.	H	α-helix	trans	-58.7	-40.5	178.9	-70.5	170.2	0	0	0	112.2	G309 A310 L316 Q317 R350 F351 L356 L358	G309-L313 WeakPolarHBondContact O-CB 3.49Å; G309-L313 VanDerWaalsContact O-CG 3.25Å; G309-L313 WeakPolarHBondContact O-CG 3.44Å; G309-L313 PolarHBondContact O-N 3.41Å; A310-L313 PolarHBondContact O-N 3.32Å; L313-L316 PolarHBondContact O-N 2.84Å; L313-Q317 WeakPolarHBondContact O-CB 3.49Å; L313-Q317 PolarHBondContact O-N 2.7Å; L313-R350 HydrophobicContact CD1-CB 4.09Å; L313-F351 HydrophobicContact CD1-CD2 3.85Å; L313-F351 HydrophobicContact CD1-CE2 3.93Å; L313-F351 HydrophobicContact CD1-CG 4.39Å; L313-F351 HydrophobicContact CD2-CD1 3.98Å; L313-F351 HydrophobicContact CD2-CD2 4.22Å; L313-F351 HydrophobicContact CD2-CE1 3.8Å; L313-F351 HydrophobicContact CD2-CE2 4.05Å; L313-F351 HydrophobicContact CD2-CG 4.18Å; L313-F351 HydrophobicContact CD2-CZ 3.83Å; L313-F351 HydrophobicContact CG-CD2 4.11Å; L313-F351 HydrophobicContact CG-CE1 4.37Å; L313-F351 HydrophobicContact CG-CE2 3.76Å; L313-F351 HydrophobicContact CG-CZ 3.9Å; L313-L356 HydrophobicContact CD2-CD1 3.83Å; L313-L358 HydrophobicContact CD2-CD1 3.95Å
314	Q	97.8	Very high	93.2	Very high	137 Å²	137	37.4 Å²	37.4	64%	0.64	25%	0.246	S	C	*	.	H	α-helix	trans	-62.4	-44.5	175.6	-178.2	177.2	-5	0	0	111.7	A310 D311 L312 Q317 G318	A310-Q314 WeakPolarHBondContact O-CB 3.37Å; A310-Q314 PolarHBondContact O-N 3.02Å; D311-Q314 PolarHBondContact O-N 3.21Å; L312-Q314 VanDerWaalsContact C-N 3.3Å; L312-Q314 PolarHBondContact O-N 2.98Å; Q314-Q317 PolarHBondContact O-N 3.43Å; Q314-G318 PolarHBondContact O-N 3.43Å
315	S	97.8	Very high	91	Very high	35 Å²	35	36.4 Å²	36.4	25%	0.245	25%	0.245	C	C	.	.	H	α-helix	trans	-62	-43.7	176.3	-60.8	0	0	0	0	111.6	D311 L312 Q317 G318 I319	D311-S315 PolarHBondContact O-N 3.1Å; D311-S315 PolarHBondContact O-OG 2.72Å; L312-S315 WeakPolarHBondContact O-CB 3.39Å; L312-S315 PolarHBondContact O-N 3.25Å; L312-S315 VanDerWaalsContact O-N 3.13Å; S315-Q317 VanDerWaalsContact C-N 3.34Å; S315-Q317 PolarHBondContact O-N 3.22Å; S315-G318 PolarHBondContact O-N 3.23Å; S315-I319 WeakPolarHBondContact O-CG1 3.38Å; S315-I319 PolarHBondContact O-N 2.76Å
316	L	97.6	Very high	88.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.4	-34.7	178.4	-64.3	-178.1	0	0	0	112.6	A276 V291 L312 L313 G318 I319 T320 L333 V335 L356	A276-L316 HydrophobicContact CB-CD2 4.1Å; V291-L316 HydrophobicContact CB-CD2 4.44Å; V291-L316 HydrophobicContact CG1-CD1 4.45Å; V291-L316 HydrophobicContact CG1-CD2 4.18Å; V291-L316 HydrophobicContact CG2-CD1 4.03Å; V291-L316 HydrophobicContact CG2-CD2 3.41Å; V291-L316 VanDerWaalsContact CG2-CD2 3.41Å; V291-L316 HydrophobicContact CG2-CG 4.36Å; L312-L316 HydrophobicContact CD1-CD1 4.17Å; L312-L316 HydrophobicContact CD1-CD2 4.28Å; L312-L316 HydrophobicContact CD1-CG 4.02Å; L312-L316 HydrophobicContact CG-CD1 4.13Å; L312-L316 HydrophobicContact CG-CG 4.38Å; L312-L316 VanDerWaalsContact O-CG 3.29Å; L312-L316 WeakPolarHBondContact O-CG 3.35Å; L312-L316 PolarHBondContact O-N 3.27Å; L313-L316 PolarHBondContact O-N 2.84Å; L316-G318 VanDerWaalsContact C-N 3.3Å; L316-G318 PolarHBondContact O-N 2.76Å; L316-I319 HydrophobicContact CD2-CD1 4.33Å; L316-I319 PolarHBondContact O-N 2.7Å; L316-T320 WeakPolarHBondContact O-CB 3.43Å; L316-T320 WeakPolarHBondContact O-CG2 3.07Å; L316-T320 PolarHBondContact O-N 3.17Å; L316-T320 PolarHBondContact O-OG1 3.33Å; L316-L333 HydrophobicContact CB-CD1 4.3Å; L316-L333 HydrophobicContact CB-CD2 4.49Å; L316-L333 HydrophobicContact CD1-CD2 4.36Å; L316-L333 HydrophobicContact CD2-CD2 4.33Å; L316-V335 HydrophobicContact CD1-CG2 3.72Å; L316-L356 HydrophobicContact CB-CD1 4.04Å
317	Q	96.1	Very high	86.5	Confident	105 Å²	105	43 Å²	43	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-61.9	-40	172.9	-170.9	173.6	0.4	0	0	111.6	L313 Q314 S315 A321 L356	L313-Q317 WeakPolarHBondContact O-CB 3.49Å; L313-Q317 PolarHBondContact O-N 2.7Å; Q314-Q317 PolarHBondContact O-N 3.43Å; S315-Q317 VanDerWaalsContact C-N 3.34Å; S315-Q317 PolarHBondContact O-N 3.22Å; Q317-A321 WeakPolarHBondContact O-CB 3.2Å; Q317-A321 PolarHBondContact O-N 2.93Å; Q317-L356 HydrophobicContact CB-CD2 4.02Å; Q317-L356 HydrophobicContact CG-CD2 4.24Å
318	G	94.8	Very high	84.5	Confident	50 Å²	50	49 Å²	49	52%	0.515	34%	0.342	S	S	.	.	H	α-helix	trans	-66.8	-46.8	173.9	0	0	0	0	0	112.9	Q314 S315 L316 T320 A321	Q314-G318 PolarHBondContact O-N 3.43Å; S315-G318 PolarHBondContact O-N 3.23Å; L316-G318 VanDerWaalsContact C-N 3.3Å; L316-G318 PolarHBondContact O-N 2.76Å; G318-T320 VanDerWaalsContact C-N 3.33Å; G318-T320 PolarHBondContact O-N 2.71Å; G318-A321 PolarHBondContact O-N 3.31Å
319	I	95.1	Very high	83.3	Confident	36 Å²	36	50.8 Å²	50.8	19%	0.185	36%	0.36	C	S	.	.	H	α-helix	trans	-62.6	-40.2	-178.4	-69.1	163.6	0	0	0	111.4	A259 L261 A276 S315 L316 S324	A259-I319 HydrophobicContact CB-CD1 3.87Å; L261-I319 HydrophobicContact CD1-CD1 4.33Å; A276-I319 HydrophobicContact CB-CD1 3.98Å; S315-I319 WeakPolarHBondContact O-CG1 3.38Å; S315-I319 PolarHBondContact O-N 2.76Å; L316-I319 HydrophobicContact CD2-CD1 4.33Å; L316-I319 PolarHBondContact O-N 2.7Å; I319-S324 PolarHBondContact O-OG 3.39Å
320	T	94	Very high	82.7	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-92.8	-0.8	-174.4	62	0	0	0	0	114.6	C289 L316 G318 Q330 V331 L333	C289-T320 HydrophobicContact CB-CG2 3.84Å; L316-T320 WeakPolarHBondContact O-CB 3.43Å; L316-T320 WeakPolarHBondContact O-CG2 3.07Å; L316-T320 PolarHBondContact O-N 3.17Å; L316-T320 PolarHBondContact O-OG1 3.33Å; G318-T320 VanDerWaalsContact C-N 3.33Å; G318-T320 PolarHBondContact O-N 2.71Å; T320-Q330 WeakPolarHBondContact O-CA 3.31Å; T320-Q330 VanDerWaalsContact O-CG 3.32Å; T320-Q330 WeakPolarHBondContact O-CG 3.27Å; T320-Q330 PolarHBondContact OG1-NE2 3.28Å; T320-V331 WeakPolarHBondContact CB-O 3.13Å; T320-V331 HydrophobicContact CG2-CB 4.27Å; T320-V331 PolarHBondContact O-N 2.67Å; T320-V331 VanDerWaalsContact O-N 3.11Å; T320-L333 HydrophobicContact CG2-CD1 3.97Å; T320-L333 HydrophobicContact CG2-CD2 3.63Å; T320-L333 HydrophobicContact CG2-CG 3.72Å
321	A	89.7	Confident	82.5	Confident	38 Å²	38	53.7 Å²	53.7	31%	0.314	37%	0.369	S	S	.	.	S	Bend	trans	-55.4	145.3	-176.8	0	0	0	0	0	112.7	Q317 G318 G323 S324	Q317-A321 WeakPolarHBondContact O-CB 3.2Å; Q317-A321 PolarHBondContact O-N 2.93Å; G318-A321 PolarHBondContact O-N 3.31Å; A321-G323 PolarHBondContact O-N 3.13Å; A321-S324 WeakPolarHBondContact O-CB 3.26Å; A321-S324 PolarHBondContact O-N 2.97Å; A321-S324 PolarHBondContact O-OG 3.15Å
322	P	78.8	Confident	82.4	Confident	97 Å²	97	52.5 Å²	52.5	63%	0.63	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	131.3	176.2	-24	33	0	0	0	111.8
323	G	69.3	Low	82.4	Confident	72 Å²	72	52.5 Å²	52.5	74%	0.742	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.2	-2.2	-178.5	0	0	0	0	0	115.5	A321 G325	A321-G323 PolarHBondContact O-N 3.13Å; G323-G325 VanDerWaalsContact C-N 3.26Å
324	S	60.6	Low	82.4	Confident	56 Å²	56	51.7 Å²	51.7	39%	0.392	36%	0.359	S	S	.	.	S	Bend	trans	-79.8	-3.7	169.1	66.6	0	0	0	0	114	I319 A321	I319-S324 PolarHBondContact O-OG 3.39Å; A321-S324 WeakPolarHBondContact O-CB 3.26Å; A321-S324 PolarHBondContact O-N 2.97Å; A321-S324 PolarHBondContact O-OG 3.15Å
325	G	52.3	Low	82.4	Confident	18 Å²	18	45.2 Å²	45.2	19%	0.186	33%	0.328	C	S	.	.	S	Bend	trans	-167.1	165.2	179.7	0	0	0	0	0	112.5	G323 G327	G323-G325 VanDerWaalsContact C-N 3.26Å; G325-G327 PolarHBondContact O-N 3.39Å
326	A	47.2	Very low	82.5	Confident	110 Å²	110	43.5 Å²	43.5	91%	0.909	32%	0.317	S	S	*	.	S	Bend	trans	-65.5	21.8	-159.9	0	0	0	0	0	118.4
327	G	55.7	Low	82.5	Confident	39 Å²	39	43.5 Å²	43.5	40%	0.402	32%	0.317	S	S	.	.	S	Bend	trans	-129	150.9	-178.1	0	0	0	0	0	114	G325 G329	G325-G327 PolarHBondContact O-N 3.39Å; G327-G329 PolarHBondContact O-N 2.98Å
328	P	56	Low	82.7	Confident	148 Å²	148	38.6 Å²	38.6	96%	0.961	29%	0.294	S	S	*	.	S	Bend	trans	-77.1	84.3	173.6	31.8	-32.2	0	0	0	109.7
329	G	73.3	Confident	82.9	Confident	37 Å²	37	36.2 Å²	36.2	38%	0.381	27%	0.269	S	S	.	.	S	Bend	trans	158.9	172.7	175.3	0	0	0	0	0	114	G327	G327-G329 PolarHBondContact O-N 2.98Å
330	Q	86.2	Confident	83.1	Confident	83 Å²	83	35.8 Å²	35.8	39%	0.388	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-70.1	134.5	171.8	178.9	170.1	21.4	0	0	110.1	T320 P332	T320-Q330 WeakPolarHBondContact O-CA 3.31Å; T320-Q330 VanDerWaalsContact O-CG 3.32Å; T320-Q330 WeakPolarHBondContact O-CG 3.27Å; T320-Q330 PolarHBondContact OG1-NE2 3.28Å; Q330-P332 WeakPolarHBondContact O-CD 3.26Å
331	V	94.4	Very high	83.3	Confident	10 Å²	10	35.8 Å²	35.8	6%	0.061	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-67.1	125.9	176.2	179.8	0	0	0	0	109.5	T278 Q287 C289 T320	T278-V331 HydrophobicContact CG2-CG1 4.33Å; Q287-V331 HydrophobicContact CB-CG1 3.95Å; Q287-V331 HydrophobicContact CB-CG2 4.37Å; C289-V331 HydrophobicContact CB-CG1 3.92Å; T320-V331 WeakPolarHBondContact CB-O 3.13Å; T320-V331 HydrophobicContact CG2-CB 4.27Å; T320-V331 PolarHBondContact O-N 2.67Å; T320-V331 VanDerWaalsContact O-N 3.11Å
332	P	96.4	Very high	83.7	Confident	14 Å²	14	38 Å²	38	9%	0.091	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-59.3	146.7	177	-23.7	34	0	0	0	112.4	L288 C289 Q330 A399 L400 F437	L288-P332 HydrophobicContact CD1-CB 4.24Å; C289-P332 PolarHBondContact N-O 3Å; Q330-P332 WeakPolarHBondContact O-CD 3.26Å; P332-A399 HydrophobicContact CB-CB 3.89Å; P332-A399 HydrophobicContact CG-CB 3.69Å; P332-L400 HydrophobicContact CB-CD1 4.04Å; P332-L400 HydrophobicContact CB-CD2 4.16Å; P332-L400 HydrophobicContact CB-CG 3.96Å; P332-F437 HydrophobicContact CG-CE1 4.42Å
333	L	98.2	Very high	84.6	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	144.2	-176.7	-78.7	160.8	0	0	0	112.6	C289 V291 L316 T320 L356 L358 Y395 S396 L400	C289-L333 HydrophobicContact CB-CD2 3.69Å; C289-L333 HydrophobicContact CB-CG 4.46Å; C289-L333 CarbonylContact O-C 3.58Å; C289-L333 WeakPolarHBondContact O-CA 3.18Å; V291-L333 HydrophobicContact CG2-CD2 4.04Å; L316-L333 HydrophobicContact CB-CD1 4.3Å; L316-L333 HydrophobicContact CB-CD2 4.49Å; L316-L333 HydrophobicContact CD1-CD2 4.36Å; L316-L333 HydrophobicContact CD2-CD2 4.33Å; T320-L333 HydrophobicContact CG2-CD1 3.97Å; T320-L333 HydrophobicContact CG2-CD2 3.63Å; T320-L333 HydrophobicContact CG2-CG 3.72Å; L333-L356 HydrophobicContact CD1-CB 4.35Å; L333-L356 HydrophobicContact CD1-CD1 3.88Å; L333-L356 HydrophobicContact CD1-CD2 4.33Å; L333-L356 HydrophobicContact CD1-CG 4.42Å; L333-L358 HydrophobicContact CB-CD2 4.03Å; L333-L358 HydrophobicContact CD1-CD2 4.46Å; L333-Y395 CarbonylContact O-C 3.54Å; L333-Y395 VanDerWaalsContact O-CA 3.31Å; L333-Y395 WeakPolarHBondContact O-CA 3.46Å; L333-S396 PolarHBondContact N-OG 3.35Å; L333-S396 PolarHBondContact O-N 3.06Å; L333-L400 WeakPolarHBondContact O-CD1 3.47Å
334	V	98.9	Very high	86	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	122	156.9	173.5	0	0	0	0	107.8	V153 L288 C289 V290 V291 I393 W394 L400 I435	V153-V334 HydrophobicContact CG1-CG1 4.07Å; V153-V334 HydrophobicContact CG2-CG1 4.46Å; L288-V334 HydrophobicContact CD1-CG2 4.03Å; C289-V334 PolarHBondContact O-N 3.5Å; V290-V334 CarbonylContact C-O 3.6Å; V290-V334 WeakPolarHBondContact CA-O 3.48Å; V291-V334 PolarHBondContact N-O 3.47Å; V334-I393 HydrophobicContact CG1-CG2 3.99Å; V334-W394 CarbonylContact C-O 3.52Å; V334-W394 VanDerWaalsContact CA-O 3.26Å; V334-W394 WeakPolarHBondContact CA-O 3.34Å; V334-L400 HydrophobicContact CG2-CD1 3.82Å; V334-I435 HydrophobicContact CG2-CD1 3.44Å; V334-I435 VanDerWaalsContact CG2-CD1 3.44Å
335	V	98.9	Very high	87.8	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	111.8	178	-172.4	0	0	0	0	109.6	V291 L316 F339 F351 W394	V291-V335 HydrophobicContact CB-CB 4.24Å; V291-V335 HydrophobicContact CB-CG1 3.99Å; V291-V335 HydrophobicContact CB-CG2 4.04Å; V291-V335 HydrophobicContact CG1-CG1 4.08Å; V291-V335 HydrophobicContact CG2-CG2 4.08Å; L316-V335 HydrophobicContact CD1-CG2 3.72Å; V335-F339 HydrophobicContact CG1-CZ 4.44Å; V335-F351 HydrophobicContact CB-CE1 4.47Å; V335-F351 HydrophobicContact CG1-CE1 4.05Å; V335-W394 HydrophobicContact CB-CB 4.11Å; V335-W394 PolarHBondContact N-O 3.24Å; V335-W394 PolarHBondContact O-N 3Å
336	C	98.9	Very high	90	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	144.1	175.5	-62.4	0	0	0	0	109.6	Q155 C200 V291 V292 T293 Y392	Q155-C336 HydrophobicContact CB-CB 3.88Å; Q155-C336 HydrophobicContact CG-CB 4.07Å; C200-C336 HydrophobicContact CB-CB 3.39Å; C200-C336 VanDerWaalsContact SG-SG 3.67Å; V291-C336 PolarHBondContact O-N 2.8Å; V292-C336 CarbonylContact C-O 3.56Å; V292-C336 VanDerWaalsContact CA-O 3.28Å; V292-C336 WeakPolarHBondContact CA-O 3.44Å; T293-C336 PolarHBondContact N-O 3.3Å; C336-Y392 WeakPolarHBondContact CA-O 3.42Å
337	G	98.8	Very high	92.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.5	161.9	167.5	0	0	0	0	0	114.8	Q155 T293 F339 D391 Y392	Q155-G337 VanDerWaalsContact CD-N 3.31Å; Q155-G337 PolarHBondContact NE2-O 2.89Å; T293-G337 WeakPolarHBondContact O-CA 3.24Å; G337-F339 WeakPolarHBondContact O-CD2 3.44Å; G337-D391 WeakPolarHBondContact O-CA 3.49Å; G337-Y392 PolarHBondContact N-O 2.69Å; G337-Y392 PolarHBondContact O-N 3.33Å
338	D	98.9	Very high	94.6	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	106.4	161.1	178.9	-5.6	0	0	0	107.8	N157 Q202 T293 H294 L295 N340 H428	N157-D338 HydrophobicContact CB-CB 4.28Å; N157-D338 PolarHBondContact ND2-OD2 2.83Å; Q202-D338 HydrophobicContact CG-CB 4.29Å; T293-D338 PolarHBondContact O-N 2.91Å; H294-D338 WeakPolarHBondContact CA-O 3.42Å; H294-D338 IonicContact NE2-OD2 3.66Å; L295-D338 PolarHBondContact N-O 3.31Å; D338-N340 VanDerWaalsContact C-N 3.29Å; D338-N340 VanDerWaalsContact CG-ND2 3.27Å; D338-N340 WeakPolarHBondContact OD1-CA 3.49Å; D338-N340 PolarHBondContact OD1-N 2.87Å; D338-N340 PolarHBondContact OD1-ND2 2.92Å; D338-N340 PolarHBondContact OD2-ND2 2.82Å; D338-H428 IonicContact OD2-CE1 3.8Å; D338-H428 PolarHBondContact OD2-CE1 3.1Å; D338-H428 VanDerWaalsContact OD2-CE1 3.27Å; D338-H428 IonicContact OD2-ND1 3.54Å; D338-H428 IonicContact OD2-NE2 2.64Å
339	F	98.9	Very high	96.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.158	C	C	.	.			trans	-84.1	-9.7	-178.2	-81.7	-126.6	0	0	0	111.7	T293 L295 R305 V335 G337 A341 V347 F351 L390 Y392 W394	T293-F339 HydrophobicContact CG2-CD2 4.46Å; T293-F339 HydrophobicContact CG2-CE2 3.91Å; T293-F339 HydrophobicContact CG2-CZ 4.33Å; L295-F339 WeakPolarHBondContact CB-O 3.19Å; L295-F339 HydrophobicContact CD1-CB 4.11Å; L295-F339 HydrophobicContact CD1-CD1 3.64Å; L295-F339 HydrophobicContact CD1-CE1 4.23Å; L295-F339 HydrophobicContact CD1-CG 3.92Å; L295-F339 HydrophobicContact CG-CG 4.45Å; R305-F339 WeakPolarHBondContact CD-O 3.44Å; V335-F339 HydrophobicContact CG1-CZ 4.44Å; G337-F339 WeakPolarHBondContact O-CD2 3.44Å; F339-A341 HydrophobicContact CB-CB 4.35Å; F339-A341 PolarHBondContact O-N 2.77Å; F339-V347 HydrophobicContact CD1-CG2 4.15Å; F339-V347 HydrophobicContact CE1-CG2 4.5Å; F339-F351 AromaticContact CE1-CD1 3.99Å; F339-F351 HydrophobicContact CE1-CD1 3.99Å; F339-F351 AromaticContact CE1-CD2 3.74Å; F339-F351 HydrophobicContact CE1-CD2 3.74Å; F339-F351 AromaticContact CE1-CE1 3.86Å; F339-F351 HydrophobicContact CE1-CE1 3.86Å; F339-F351 AromaticContact CE1-CE2 3.6Å; F339-F351 HydrophobicContact CE1-CE2 3.6Å; F339-F351 AromaticContact CE1-CG 3.94Å; F339-F351 HydrophobicContact CE1-CG 3.94Å; F339-F351 AromaticContact CE1-CZ 3.67Å; F339-F351 HydrophobicContact CE1-CZ 3.67Å; F339-F351 AromaticContact CZ-CD1 3.98Å; F339-F351 HydrophobicContact CZ-CD1 3.98Å; F339-F351 HydrophobicContact CZ-CD2 4.48Å; F339-F351 AromaticContact CZ-CE1 3.63Å; F339-F351 HydrophobicContact CZ-CE1 3.63Å; F339-F351 HydrophobicContact CZ-CE2 4.16Å; F339-F351 HydrophobicContact CZ-CG 4.4Å; F339-F351 AromaticContact CZ-CZ 3.73Å; F339-F351 HydrophobicContact CZ-CZ 3.73Å; F339-L390 PolarHBondContact N-O 2.83Å; F339-Y392 HydrophobicContact CB-CD2 3.84Å; F339-Y392 HydrophobicContact CB-CE2 3.84Å; F339-Y392 HydrophobicContact CD1-CD2 4.43Å; F339-Y392 AromaticContact CD2-CD2 3.84Å; F339-Y392 HydrophobicContact CD2-CD2 3.84Å; F339-Y392 AromaticContact CG-CD2 3.78Å; F339-Y392 HydrophobicContact CG-CD2 3.78Å; F339-Y392 HydrophobicContact CG-CE2 4.23Å; F339-W394 AromaticContact CE1-NE1 3.85Å; F339-W394 AromaticContact CE2-NE1 3.98Å; F339-W394 AromaticContact CZ-CD1 3.8Å; F339-W394 AromaticContact CZ-NE1 3.54Å
340	N	98.8	Very high	97.8	Very high	28 Å²	28	32.9 Å²	32.9	15%	0.15	16%	0.16	C	C	.	.	S	Bend	trans	48.4	31.5	-173.8	-83.1	-93.7	0	0	0	112.7	H294 L295 A297 R305 D338	H294-N340 PolarHBondContact CD2-ND2 3.47Å; H294-N340 VanDerWaalsContact CD2-ND2 3.26Å; H294-N340 PolarHBondContact NE2-ND2 3.27Å; L295-N340 PolarHBondContact O-ND2 2.92Å; A297-N340 VanDerWaalsContact CA-CG 3.49Å; A297-N340 VanDerWaalsContact CA-OD1 3.28Å; A297-N340 WeakPolarHBondContact CA-OD1 3.44Å; A297-N340 HydrophobicContact CB-CB 4.48Å; A297-N340 WeakPolarHBondContact CB-OD1 3.43Å; R305-N340 VanDerWaalsContact CD-O 3.3Å; R305-N340 WeakPolarHBondContact CD-O 3.25Å; R305-N340 PolarHBondContact NE-O 3.06Å; R305-N340 VanDerWaalsContact NE-O 3.08Å; R305-N340 PolarHBondContact NH1-O 3.29Å; D338-N340 VanDerWaalsContact C-N 3.29Å; D338-N340 VanDerWaalsContact CG-ND2 3.27Å; D338-N340 WeakPolarHBondContact OD1-CA 3.49Å; D338-N340 PolarHBondContact OD1-N 2.87Å; D338-N340 PolarHBondContact OD1-ND2 2.92Å; D338-N340 PolarHBondContact OD2-ND2 2.82Å
341	A	98.7	Very high	98.4	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.142	C	C	.	.			trans	-142.4	134.4	-174.2	0	0	0	0	0	109.4	F339 E345 V347 Y392	F339-A341 HydrophobicContact CB-CB 4.35Å; F339-A341 PolarHBondContact O-N 2.77Å; A341-E345 WeakPolarHBondContact CA-OE1 3.26Å; A341-E345 HydrophobicContact CB-CB 4.04Å; A341-E345 HydrophobicContact CB-CG 4.18Å; A341-V347 HydrophobicContact CB-CG1 3.31Å; A341-Y392 WeakPolarHBondContact O-CE2 3.18Å; A341-Y392 PolarHBondContact O-OH 2.93Å
342	E	98.6	Very high	98.6	Very high	83 Å²	83	31.1 Å²	31.1	39%	0.388	16%	0.157	S	C	.	.			trans	-75.6	162.9	172.5	-73.2	-171.7	-169.3	0	0	111.8	S344 E345 S388 T389 L390	E342-S344 PolarHBondContact O-N 2.79Å; E342-E345 WeakPolarHBondContact O-CB 3.49Å; E342-E345 PolarHBondContact O-N 2.85Å; E342-S388 WeakPolarHBondContact OE1-CB 3.46Å; E342-S388 PolarHBondContact OE1-OG 2.96Å; E342-T389 WeakPolarHBondContact CA-O 3.18Å; E342-L390 HydrophobicContact CG-CD2 4.33Å
343	P	98.6	Very high	98.6	Very high	40 Å²	40	34.9 Å²	34.9	26%	0.26	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-17.9	-180	-25.2	35	0	0	0	114.8	E345 Y348 E372 T389 Y392	P343-E345 VanDerWaalsContact C-N 3.35Å; P343-Y348 HydrophobicContact CB-CD1 4.21Å; P343-Y348 HydrophobicContact CB-CD2 4.24Å; P343-Y348 HydrophobicContact CB-CE1 4.15Å; P343-Y348 HydrophobicContact CB-CE2 4.2Å; P343-Y348 HydrophobicContact CB-CG 4.26Å; P343-Y348 WeakPolarHBondContact O-CD1 3.26Å; P343-E372 HydrophobicContact CB-CG 4.2Å; P343-E372 HydrophobicContact CG-CB 3.83Å; P343-E372 HydrophobicContact CG-CG 3.78Å; P343-T389 HydrophobicContact CG-CG2 4.34Å; P343-Y392 WeakPolarHBondContact CD-OH 3.45Å; P343-Y392 HydrophobicContact CG-CE1 4.49Å
344	S	98.1	Very high	98.6	Very high	81 Å²	81	35.5 Å²	35.5	57%	0.566	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-20.9	177.1	62	0	0	0	0	113.6	E342 R349	E342-S344 PolarHBondContact O-N 2.79Å; S344-R349 PolarHBondContact O-NE 2.85Å; S344-R349 PolarHBondContact O-NH2 2.96Å
345	E	98.8	Very high	98.4	Very high	28 Å²	28	40.7 Å²	40.7	13%	0.131	22%	0.222	C	C	.	.	S	Bend	trans	-75	156.6	-174.5	-69.9	-165.4	-145.6	0	0	113.9	E302 R305 A341 E342 P343 V347 Y348 R349	E302-E345 HydrophobicContact CG-CG 4.41Å; R305-E345 IonicContact CZ-OE1 3.36Å; R305-E345 IonicContact CZ-OE2 2.74Å; R305-E345 VanDerWaalsContact CZ-OE2 3.3Å; R305-E345 IonicContact NE-OE1 3.68Å; R305-E345 IonicContact NE-OE2 3.44Å; R305-E345 PolarHBondContact NE-OE2 3.09Å; R305-E345 IonicContact NH2-OE1 3.87Å; R305-E345 PolarHBondContact NH2-OE1 3.03Å; R305-E345 IonicContact NH2-OE2 2.97Å; R305-E345 PolarHBondContact NH2-OE2 3.2Å; A341-E345 WeakPolarHBondContact CA-OE1 3.26Å; A341-E345 HydrophobicContact CB-CB 4.04Å; A341-E345 HydrophobicContact CB-CG 4.18Å; E342-E345 WeakPolarHBondContact O-CB 3.49Å; E342-E345 PolarHBondContact O-N 2.85Å; P343-E345 VanDerWaalsContact C-N 3.35Å; E345-V347 VanDerWaalsContact C-N 3.26Å; E345-V347 HydrophobicContact CB-CG1 4.32Å; E345-V347 PolarHBondContact O-N 2.9Å; E345-Y348 PolarHBondContact O-N 2.82Å; E345-R349 PolarHBondContact O-N 2.62Å
346	D	98.6	Very high	98.2	Very high	67 Å²	67	41.2 Å²	41.2	36%	0.358	23%	0.225	S	C	.	.	H	α-helix	trans	-59.9	-34.8	-179.4	-73.1	-5.6	0	0	0	112.7	S306 Y348 R349 R350	S306-D346 WeakPolarHBondContact OG-CB 3.34Å; D346-Y348 VanDerWaalsContact C-N 3.35Å; D346-Y348 PolarHBondContact O-N 3.29Å; D346-R349 PolarHBondContact O-N 3.13Å; D346-R349 IonicContact OD1-CZ 2.73Å; D346-R349 IonicContact OD1-NH1 3.39Å; D346-R349 PolarHBondContact OD1-NH1 3.5Å; D346-R349 IonicContact OD1-NH2 2.69Å; D346-R349 PolarHBondContact OD1-NH2 2.91Å; D346-R350 WeakPolarHBondContact O-CG 3.4Å; D346-R350 PolarHBondContact O-N 3.46Å
347	V	98.8	Very high	98.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-41.1	-179.1	67.4	0	0	0	0	111.7	L295 R305 F339 A341 E345 R350 F351	L295-V347 HydrophobicContact CD1-CG2 3.77Å; R305-V347 HydrophobicContact CB-CB 4.36Å; R305-V347 HydrophobicContact CB-CG1 4.25Å; R305-V347 WeakPolarHBondContact O-CG2 3.35Å; F339-V347 HydrophobicContact CD1-CG2 4.15Å; F339-V347 HydrophobicContact CE1-CG2 4.5Å; A341-V347 HydrophobicContact CB-CG1 3.31Å; E345-V347 VanDerWaalsContact C-N 3.26Å; E345-V347 HydrophobicContact CB-CG1 4.32Å; E345-V347 PolarHBondContact O-N 2.9Å; V347-R350 WeakPolarHBondContact O-CB 3.34Å; V347-R350 PolarHBondContact O-N 3.27Å; V347-F351 HydrophobicContact CG2-CD2 4.48Å; V347-F351 HydrophobicContact CG2-CE2 4.47Å; V347-F351 WeakPolarHBondContact O-CD2 3.4Å; V347-F351 PolarHBondContact O-N 3.26Å
348	Y	98.8	Very high	98.1	Very high	22 Å²	22	42.9 Å²	42.9	9%	0.086	24%	0.24	C	C	.	.	H	α-helix	trans	-62.2	-48	174.8	178.7	-87.7	0	0	0	110.5	P343 E345 D346 R350 F351 S352 E372 Y392 W394	P343-Y348 HydrophobicContact CB-CD1 4.21Å; P343-Y348 HydrophobicContact CB-CD2 4.24Å; P343-Y348 HydrophobicContact CB-CE1 4.15Å; P343-Y348 HydrophobicContact CB-CE2 4.2Å; P343-Y348 HydrophobicContact CB-CG 4.26Å; P343-Y348 WeakPolarHBondContact O-CD1 3.26Å; E345-Y348 PolarHBondContact O-N 2.82Å; D346-Y348 VanDerWaalsContact C-N 3.35Å; D346-Y348 PolarHBondContact O-N 3.29Å; Y348-R350 VanDerWaalsContact C-N 3.27Å; Y348-R350 PolarHBondContact O-N 3.32Å; Y348-F351 PolarHBondContact O-N 3.03Å; Y348-F351 VanDerWaalsContact O-N 3.09Å; Y348-S352 PolarHBondContact O-N 3.43Å; Y348-S352 PolarHBondContact O-OG 2.59Å; Y348-E372 HydrophobicContact CE2-CG 4.1Å; Y348-E372 VanDerWaalsContact CE2-OE1 3.25Å; Y348-E372 WeakPolarHBondContact CE2-OE1 3.34Å; Y348-E372 PolarHBondContact OH-OE1 2.94Å; Y348-Y392 HydrophobicContact CD2-CD1 4.24Å; Y348-Y392 AromaticContact CD2-CE1 3.62Å; Y348-Y392 HydrophobicContact CD2-CE1 3.62Å; Y348-Y392 HydrophobicContact CD2-CE2 4.42Å; Y348-Y392 AromaticContact CD2-CZ 3.72Å; Y348-Y392 HydrophobicContact CE2-CD1 4.01Å; Y348-Y392 AromaticContact CE2-CE1 3.53Å; Y348-Y392 HydrophobicContact CE2-CE1 3.53Å; Y348-W394 HydrophobicContact CD1-CH2 4.49Å; Y348-W394 AromaticContact CD2-CH2 3.65Å; Y348-W394 HydrophobicContact CD2-CH2 3.65Å; Y348-W394 AromaticContact CD2-CZ2 3.48Å; Y348-W394 HydrophobicContact CD2-CZ2 3.48Å; Y348-W394 VanDerWaalsContact CD2-CZ2 3.48Å; Y348-W394 HydrophobicContact CE1-CH2 4.33Å; Y348-W394 AromaticContact CE2-CH2 3.42Å; Y348-W394 HydrophobicContact CE2-CH2 3.42Å; Y348-W394 VanDerWaalsContact CE2-CH2 3.42Å; Y348-W394 AromaticContact CE2-CZ2 3.57Å; Y348-W394 HydrophobicContact CE2-CZ2 3.57Å; Y348-W394 HydrophobicContact CG-CH2 4.17Å; Y348-W394 HydrophobicContact CG-CZ2 4.23Å; Y348-W394 AromaticContact CZ-CH2 3.8Å
349	R	98.6	Very high	98.1	Very high	121 Å²	121	43.2 Å²	43.2	46%	0.457	24%	0.242	S	C	.	.	H	α-helix	trans	-58.9	-35.6	177.1	-79	-176.1	-93.2	110.1	1.1	113.1	S344 E345 D346 S352 S353	S344-R349 PolarHBondContact O-NE 2.85Å; S344-R349 PolarHBondContact O-NH2 2.96Å; E345-R349 PolarHBondContact O-N 2.62Å; D346-R349 PolarHBondContact O-N 3.13Å; D346-R349 IonicContact OD1-CZ 2.73Å; D346-R349 IonicContact OD1-NH1 3.39Å; D346-R349 PolarHBondContact OD1-NH1 3.5Å; D346-R349 IonicContact OD1-NH2 2.69Å; D346-R349 PolarHBondContact OD1-NH2 2.91Å; R349-S352 WeakPolarHBondContact CA-OG 3.27Å; R349-S352 PolarHBondContact O-OG 3Å; R349-S352 VanDerWaalsContact O-OG 3.08Å; R349-S353 WeakPolarHBondContact O-CB 3.2Å; R349-S353 PolarHBondContact O-N 3.08Å; R349-S353 PolarHBondContact O-OG 2.82Å
350	R	98.6	Very high	98	Very high	112 Å²	112	43.2 Å²	43.2	42%	0.423	24%	0.242	S	C	.	.	H	α-helix	trans	-64.4	-42.7	174.7	-74.9	179.1	-175.8	-72.5	-3.4	112.3	S306 L313 D346 V347 Y348 S354	S306-R350 WeakPolarHBondContact O-CD 3.3Å; S306-R350 PolarHBondContact O-NE 3.2Å; S306-R350 PolarHBondContact OG-NE 3.2Å; L313-R350 HydrophobicContact CD1-CB 4.09Å; D346-R350 WeakPolarHBondContact O-CG 3.4Å; D346-R350 PolarHBondContact O-N 3.46Å; V347-R350 WeakPolarHBondContact O-CB 3.34Å; V347-R350 PolarHBondContact O-N 3.27Å; Y348-R350 VanDerWaalsContact C-N 3.27Å; Y348-R350 PolarHBondContact O-N 3.32Å; R350-S354 WeakPolarHBondContact O-CA 3.28Å; R350-S354 WeakPolarHBondContact O-CB 3.35Å; R350-S354 PolarHBondContact O-N 3.49Å
351	F	98.7	Very high	98	Very high	1 Å²	1	41.9 Å²	41.9	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-67.1	-46	177.4	-88.8	-109	0	0	0	111.2	L312 L313 V335 F339 V347 Y348 S353 S354 L358 W394	L312-F351 HydrophobicContact CD2-CZ 4.03Å; L312-F351 HydrophobicContact CG-CZ 4.38Å; L313-F351 HydrophobicContact CD1-CD2 3.85Å; L313-F351 HydrophobicContact CD1-CE2 3.93Å; L313-F351 HydrophobicContact CD1-CG 4.39Å; L313-F351 HydrophobicContact CD2-CD1 3.98Å; L313-F351 HydrophobicContact CD2-CD2 4.22Å; L313-F351 HydrophobicContact CD2-CE1 3.8Å; L313-F351 HydrophobicContact CD2-CE2 4.05Å; L313-F351 HydrophobicContact CD2-CG 4.18Å; L313-F351 HydrophobicContact CD2-CZ 3.83Å; L313-F351 HydrophobicContact CG-CD2 4.11Å; L313-F351 HydrophobicContact CG-CE1 4.37Å; L313-F351 HydrophobicContact CG-CE2 3.76Å; L313-F351 HydrophobicContact CG-CZ 3.9Å; V335-F351 HydrophobicContact CB-CE1 4.47Å; V335-F351 HydrophobicContact CG1-CE1 4.05Å; F339-F351 AromaticContact CE1-CD1 3.99Å; F339-F351 HydrophobicContact CE1-CD1 3.99Å; F339-F351 AromaticContact CE1-CD2 3.74Å; F339-F351 HydrophobicContact CE1-CD2 3.74Å; F339-F351 AromaticContact CE1-CE1 3.86Å; F339-F351 HydrophobicContact CE1-CE1 3.86Å; F339-F351 AromaticContact CE1-CE2 3.6Å; F339-F351 HydrophobicContact CE1-CE2 3.6Å; F339-F351 AromaticContact CE1-CG 3.94Å; F339-F351 HydrophobicContact CE1-CG 3.94Å; F339-F351 AromaticContact CE1-CZ 3.67Å; F339-F351 HydrophobicContact CE1-CZ 3.67Å; F339-F351 AromaticContact CZ-CD1 3.98Å; F339-F351 HydrophobicContact CZ-CD1 3.98Å; F339-F351 HydrophobicContact CZ-CD2 4.48Å; F339-F351 AromaticContact CZ-CE1 3.63Å; F339-F351 HydrophobicContact CZ-CE1 3.63Å; F339-F351 HydrophobicContact CZ-CE2 4.16Å; F339-F351 HydrophobicContact CZ-CG 4.4Å; F339-F351 AromaticContact CZ-CZ 3.73Å; F339-F351 HydrophobicContact CZ-CZ 3.73Å; V347-F351 HydrophobicContact CG2-CD2 4.48Å; V347-F351 HydrophobicContact CG2-CE2 4.47Å; V347-F351 WeakPolarHBondContact O-CD2 3.4Å; V347-F351 PolarHBondContact O-N 3.26Å; Y348-F351 PolarHBondContact O-N 3.03Å; Y348-F351 VanDerWaalsContact O-N 3.09Å; F351-S353 VanDerWaalsContact C-N 3.33Å; F351-S353 PolarHBondContact O-N 2.8Å; F351-S354 VanDerWaalsContact O-CB 3.28Å; F351-S354 WeakPolarHBondContact O-CB 3.44Å; F351-S354 PolarHBondContact O-N 3.29Å; F351-L358 HydrophobicContact CD1-CD1 3.89Å; F351-L358 HydrophobicContact CE1-CD1 4.34Å; F351-W394 HydrophobicContact CB-CD2 3.92Å; F351-W394 HydrophobicContact CB-CE3 4.03Å; F351-W394 HydrophobicContact CB-CH2 3.67Å; F351-W394 HydrophobicContact CB-CZ2 3.54Å; F351-W394 HydrophobicContact CB-CZ3 3.91Å; F351-W394 AromaticContact CD1-CD1 3.85Å; F351-W394 AromaticContact CD1-CD2 3.99Å; F351-W394 HydrophobicContact CD1-CD2 3.99Å; F351-W394 AromaticContact CD1-CE2 3.98Å; F351-W394 AromaticContact CD1-CG 3.92Å; F351-W394 HydrophobicContact CD1-CG 3.92Å; F351-W394 AromaticContact CD1-NE1 3.86Å; F351-W394 HydrophobicContact CG-CD2 4.38Å; F351-W394 HydrophobicContact CG-CZ2 4.33Å
352	S	98.1	Very high	98	Very high	54 Å²	54	41.9 Å²	41.9	38%	0.378	24%	0.235	S	C	.	.	H	α-helix	trans	-66.9	-30.1	-179.1	71.1	0	0	0	0	114	Y348 R349	Y348-S352 PolarHBondContact O-N 3.43Å; Y348-S352 PolarHBondContact O-OG 2.59Å; R349-S352 WeakPolarHBondContact CA-OG 3.27Å; R349-S352 PolarHBondContact O-OG 3Å; R349-S352 VanDerWaalsContact O-OG 3.08Å
353	S	97.8	Very high	98	Very high	93 Å²	93	39 Å²	39	65%	0.65	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.9	6.6	178.3	62.8	0	0	0	0	113.7	R349 F351	R349-S353 WeakPolarHBondContact O-CB 3.2Å; R349-S353 PolarHBondContact O-N 3.08Å; R349-S353 PolarHBondContact O-OG 2.82Å; F351-S353 VanDerWaalsContact C-N 3.33Å; F351-S353 PolarHBondContact O-N 2.8Å
354	S	97.3	Very high	97.9	Very high	14 Å²	14	38.1 Å²	38.1	10%	0.098	22%	0.215	C	C	.	.			trans	-61.9	141.2	-177.2	176.4	0	0	0	0	111.6	R350 F351 L356 G357	R350-S354 WeakPolarHBondContact O-CA 3.28Å; R350-S354 WeakPolarHBondContact O-CB 3.35Å; R350-S354 PolarHBondContact O-N 3.49Å; F351-S354 VanDerWaalsContact O-CB 3.28Å; F351-S354 WeakPolarHBondContact O-CB 3.44Å; F351-S354 PolarHBondContact O-N 3.29Å; S354-L356 PolarHBondContact O-N 3.08Å; S354-L356 VanDerWaalsContact O-N 3.07Å; S354-L356 WeakPolarHBondContact OG-CB 3.44Å; S354-L356 WeakPolarHBondContact OG-CG 3.47Å; S354-L356 PolarHBondContact OG-N 3.46Å; S354-L356 VanDerWaalsContact OG-N 3.16Å; S354-G357 PolarHBondContact O-N 2.87Å
355	P	94.9	Very high	97.9	Very high	110 Å²	110	37 Å²	37	71%	0.714	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-12.9	171.7	28.4	-36.2	0	0	0	113.2	G357	P355-G357 PolarHBondContact O-N 2.92Å
356	L	95.3	Very high	97.7	Very high	10 Å²	10	37 Å²	37	5%	0.052	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-6.6	171.4	-59.4	177.6	0	0	0	113.2	L313 L316 Q317 L333 S354 L358	L313-L356 HydrophobicContact CD2-CD1 3.83Å; L316-L356 HydrophobicContact CB-CD1 4.04Å; Q317-L356 HydrophobicContact CB-CD2 4.02Å; Q317-L356 HydrophobicContact CG-CD2 4.24Å; L333-L356 HydrophobicContact CD1-CB 4.35Å; L333-L356 HydrophobicContact CD1-CD1 3.88Å; L333-L356 HydrophobicContact CD1-CD2 4.33Å; L333-L356 HydrophobicContact CD1-CG 4.42Å; S354-L356 PolarHBondContact O-N 3.08Å; S354-L356 VanDerWaalsContact O-N 3.07Å; S354-L356 WeakPolarHBondContact OG-CB 3.44Å; S354-L356 WeakPolarHBondContact OG-CG 3.47Å; S354-L356 PolarHBondContact OG-N 3.46Å; S354-L356 VanDerWaalsContact OG-N 3.16Å; L356-L358 HydrophobicContact CB-CD1 4.35Å; L356-L358 HydrophobicContact CB-CD2 4.39Å; L356-L358 HydrophobicContact CB-CG 3.99Å
357	G	96.8	Very high	97.5	Very high	27 Å²	27	39.2 Å²	39.2	28%	0.278	23%	0.226	S	C	.	.			trans	64.9	44.8	174.4	0	0	0	0	0	112.8	S354 P355 E397	S354-G357 PolarHBondContact O-N 2.87Å; P355-G357 PolarHBondContact O-N 2.92Å; G357-E397 PolarHBondContact O-N 2.92Å
358	L	98.3	Very high	97.3	Very high	9 Å²	9	42.8 Å²	42.8	5%	0.047	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	137.8	-177.1	-59.1	177.5	0	0	0	111.3	L313 L333 F351 L356 W394 Y395	L313-L358 HydrophobicContact CD2-CD1 3.95Å; L333-L358 HydrophobicContact CB-CD2 4.03Å; L333-L358 HydrophobicContact CD1-CD2 4.46Å; F351-L358 HydrophobicContact CD1-CD1 3.89Å; F351-L358 HydrophobicContact CE1-CD1 4.34Å; L356-L358 HydrophobicContact CB-CD1 4.35Å; L356-L358 HydrophobicContact CB-CD2 4.39Å; L356-L358 HydrophobicContact CB-CG 3.99Å; L358-W394 HydrophobicContact CB-CB 4.4Å; L358-W394 HydrophobicContact CB-CE3 4.09Å; L358-W394 HydrophobicContact CD1-CB 4.46Å; L358-Y395 WeakPolarHBondContact CA-O 3.32Å
359	S	98.3	Very high	97.1	Very high	7 Å²	7	41.9 Å²	41.9	5%	0.049	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	147.8	168.9	-162	0	0	0	0	109	K363 W394 Y395 E397	S359-K363 PolarHBondContact OG-NZ 2.95Å; S359-K363 VanDerWaalsContact OG-NZ 3.12Å; S359-W394 CarbonylContact O-C 3.56Å; S359-W394 WeakPolarHBondContact O-CA 3.45Å; S359-Y395 PolarHBondContact N-O 3.05Å; S359-Y395 WeakPolarHBondContact O-CD1 3.31Å; S359-Y395 WeakPolarHBondContact O-CE1 3.39Å; S359-Y395 PolarHBondContact O-N 3.01Å; S359-E397 WeakPolarHBondContact CB-OE1 2.93Å; S359-E397 PolarHBondContact OG-OE1 2.96Å; S359-E397 VanDerWaalsContact OG-OE1 3.13Å
360	S	98.6	Very high	96.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	126.9	174.3	172.6	0	0	0	0	109.9	K363 E372	S360-K363 VanDerWaalsContact O-CE 3.22Å; S360-K363 WeakPolarHBondContact O-CE 3.47Å; S360-E372 WeakPolarHBondContact CB-OE1 3.26Å; S360-E372 PolarHBondContact OG-OE1 3.03Å; S360-E372 PolarHBondContact OG-OE2 2.83Å
361	A	98.6	Very high	96.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	25%	0.252	C	S	.	.	S	Bend	trans	-66.5	-38.2	-175.4	0	0	0	0	0	112.5	K363 L364 I393 Y395 V402 L405	A361-K363 VanDerWaalsContact C-N 3.29Å; A361-K363 PolarHBondContact O-N 3.49Å; A361-L364 VanDerWaalsContact O-CB 3.27Å; A361-L364 WeakPolarHBondContact O-CB 3.25Å; A361-L364 WeakPolarHBondContact O-CG 3.22Å; A361-L364 PolarHBondContact O-N 2.89Å; A361-L364 VanDerWaalsContact O-N 3.08Å; A361-I393 HydrophobicContact CB-CB 4.3Å; A361-I393 HydrophobicContact CB-CG2 4.49Å; A361-I393 WeakPolarHBondContact CB-O 3.38Å; A361-I393 PolarHBondContact N-O 2.69Å; A361-Y395 HydrophobicContact CB-CD1 3.95Å; A361-Y395 HydrophobicContact CB-CE1 4.09Å; A361-V402 HydrophobicContact CB-CG2 3.93Å; A361-L405 HydrophobicContact CB-CD2 4.14Å; A361-L405 WeakPolarHBondContact O-CD1 3.24Å
362	Y	98.5	Very high	96.8	Very high	1 Å²	1	41.7 Å²	41.7	0%	0.004	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-74.2	-16.7	-171.2	-95.9	-102.3	0	0	0	114.2	L364 L365 P373 I393 L405 L406 I408 L431 L432	Y362-L364 PolarHBondContact O-N 2.79Å; Y362-L364 VanDerWaalsContact O-N 3.15Å; Y362-L365 HydrophobicContact CD1-CD1 3.57Å; Y362-L365 HydrophobicContact CD1-CG 4.38Å; Y362-L365 HydrophobicContact CE1-CD1 3.74Å; Y362-L365 WeakPolarHBondContact O-CB 3.11Å; Y362-L365 PolarHBondContact O-N 3.27Å; Y362-L365 VanDerWaalsContact O-N 3.14Å; Y362-P373 HydrophobicContact CD1-CG 4.4Å; Y362-I393 HydrophobicContact CE2-CD1 4.07Å; Y362-L405 HydrophobicContact CD2-CD2 3.75Å; Y362-L405 HydrophobicContact CE2-CD2 3.62Å; Y362-L405 HydrophobicContact CG-CD2 4.37Å; Y362-L406 VanDerWaalsContact CE1-O 3.32Å; Y362-L406 WeakPolarHBondContact CE1-O 3.44Å; Y362-L406 PolarHBondContact OH-O 2.79Å; Y362-I408 HydrophobicContact CD1-CD1 4.14Å; Y362-I408 HydrophobicContact CD1-CG1 4.45Å; Y362-I408 HydrophobicContact CE1-CD1 3.78Å; Y362-I408 HydrophobicContact CE1-CG1 4.31Å; Y362-L431 HydrophobicContact CD1-CD2 4.08Å; Y362-L431 HydrophobicContact CD2-CB 4.3Å; Y362-L431 HydrophobicContact CD2-CD1 4.14Å; Y362-L431 HydrophobicContact CE1-CD2 3.68Å; Y362-L431 HydrophobicContact CE2-CB 3.62Å; Y362-L431 HydrophobicContact CE2-CD1 4.27Å; Y362-L431 HydrophobicContact CE2-CD2 4.19Å; Y362-L431 HydrophobicContact CE2-CG 4.24Å; Y362-L431 HydrophobicContact CG-CD1 4.39Å; Y362-L431 WeakPolarHBondContact OH-CA 3.17Å; Y362-L432 PolarHBondContact OH-N 3.46Å; Y362-L432 PolarHBondContact OH-O 2.86Å; Y362-L432 VanDerWaalsContact OH-O 3.06Å
363	K	98.1	Very high	96.8	Very high	21 Å²	21	40.1 Å²	40.1	9%	0.091	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-54.7	-29	165.3	-61.7	-177.6	-57.8	175.5	0	112.9	S359 S360 A361 L365 S366 G369 Q370 T371 E372	S359-K363 PolarHBondContact OG-NZ 2.95Å; S359-K363 VanDerWaalsContact OG-NZ 3.12Å; S360-K363 VanDerWaalsContact O-CE 3.22Å; S360-K363 WeakPolarHBondContact O-CE 3.47Å; A361-K363 VanDerWaalsContact C-N 3.29Å; A361-K363 PolarHBondContact O-N 3.49Å; K363-L365 PolarHBondContact O-N 2.84Å; K363-S366 PolarHBondContact O-N 3.43Å; K363-S366 VanDerWaalsContact O-N 3.09Å; K363-S366 PolarHBondContact O-OG 3.02Å; K363-G369 CarbonylContact O-C 3.55Å; K363-G369 WeakPolarHBondContact O-CA 3.35Å; K363-Q370 WeakPolarHBondContact CD-O 3.32Å; K363-T371 WeakPolarHBondContact CA-O 3.38Å; K363-E372 VanDerWaalsContact CG-CD 3.42Å; K363-E372 HydrophobicContact CG-CG 3.92Å; K363-E372 PolarHBondContact N-OE2 3.07Å
364	L	97.6	Very high	96.8	Very high	23 Å²	23	40 Å²	40	12%	0.12	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-71.9	-6.4	-177.2	-61.4	172.6	0	0	0	113.5	P137 L140 A361 Y362 V402 L405	P137-L364 HydrophobicContact CB-CB 3.99Å; P137-L364 HydrophobicContact CG-CB 3.97Å; P137-L364 HydrophobicContact CG-CD1 4.37Å; L140-L364 HydrophobicContact CD1-CD1 4.15Å; A361-L364 VanDerWaalsContact O-CB 3.27Å; A361-L364 WeakPolarHBondContact O-CB 3.25Å; A361-L364 WeakPolarHBondContact O-CG 3.22Å; A361-L364 PolarHBondContact O-N 2.89Å; A361-L364 VanDerWaalsContact O-N 3.08Å; Y362-L364 PolarHBondContact O-N 2.79Å; Y362-L364 VanDerWaalsContact O-N 3.15Å; L364-V402 HydrophobicContact CD1-CB 3.65Å; L364-V402 HydrophobicContact CD1-CG1 4.06Å; L364-V402 HydrophobicContact CD1-CG2 3.83Å; L364-L405 HydrophobicContact CB-CD1 3.82Å
365	L	96.3	Very high	96.9	Very high	58 Å²	58	40 Å²	40	30%	0.304	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-74.4	-27.7	168.3	-68.2	-176.8	0	0	0	112.5	V135 Y362 K363 L405 I408	V135-L365 HydrophobicContact CG2-CD2 3.28Å; Y362-L365 HydrophobicContact CD1-CD1 3.57Å; Y362-L365 HydrophobicContact CD1-CG 4.38Å; Y362-L365 HydrophobicContact CE1-CD1 3.74Å; Y362-L365 WeakPolarHBondContact O-CB 3.11Å; Y362-L365 PolarHBondContact O-N 3.27Å; Y362-L365 VanDerWaalsContact O-N 3.14Å; K363-L365 PolarHBondContact O-N 2.84Å; L365-L405 HydrophobicContact CD2-CB 3.7Å; L365-L405 HydrophobicContact CD2-CD1 3.9Å; L365-L405 HydrophobicContact CD2-CG 4.43Å; L365-L405 HydrophobicContact CG-CB 4.32Å; L365-L405 HydrophobicContact CG-CD1 3.99Å; L365-I408 HydrophobicContact CD1-CG1 4.08Å
366	S	96.3	Very high	97.1	Very high	28 Å²	28	34.7 Å²	34.7	20%	0.196	21%	0.213	C	C	.	.	S	Bend	trans	-72.6	156.4	177.9	74.1	0	0	0	0	111	K363 D368 G369 Q370 T371	K363-S366 PolarHBondContact O-N 3.43Å; K363-S366 VanDerWaalsContact O-N 3.09Å; K363-S366 PolarHBondContact O-OG 3.02Å; S366-D368 WeakPolarHBondContact CB-OD1 3.44Å; S366-D368 PolarHBondContact O-N 3.26Å; S366-D368 PolarHBondContact OG-OD1 2.96Å; S366-G369 PolarHBondContact O-N 3.34Å; S366-G369 PolarHBondContact OG-N 2.67Å; S366-Q370 PolarHBondContact OG-N 3.2Å; S366-T371 WeakPolarHBondContact CB-O 3.22Å; S366-T371 PolarHBondContact OG-N 3.33Å; S366-T371 PolarHBondContact OG-O 3.29Å
367	S	93.3	Very high	97.2	Very high	113 Å²	113	34.3 Å²	34.3	79%	0.79	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-27.4	177.9	51.2	0	0	0	0	113.7
368	D	94.6	Very high	97.3	Very high	75 Å²	75	34.1 Å²	34.1	40%	0.401	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-11.8	178.5	61.7	11.2	0	0	0	113.2	S366 Q370 T371	S366-D368 WeakPolarHBondContact CB-OD1 3.44Å; S366-D368 PolarHBondContact O-N 3.26Å; S366-D368 PolarHBondContact OG-OD1 2.96Å; D368-Q370 WeakPolarHBondContact O-CG 3.16Å; D368-Q370 PolarHBondContact O-N 2.91Å; D368-Q370 PolarHBondContact OD1-N 3.39Å; D368-T371 PolarHBondContact OD1-N 2.94Å; D368-T371 PolarHBondContact OD1-OG1 3.5Å; D368-T371 PolarHBondContact OD2-OG1 2.93Å
369	G	94.6	Very high	97.3	Very high	3 Å²	3	34.7 Å²	34.7	3%	0.031	21%	0.205	C	C	.	.	S	Bend	trans	65.6	11	-174	0	0	0	0	0	114.5	K363 S366	K363-G369 CarbonylContact O-C 3.55Å; K363-G369 WeakPolarHBondContact O-CA 3.35Å; S366-G369 PolarHBondContact O-N 3.34Å; S366-G369 PolarHBondContact OG-N 2.67Å
370	Q	94.8	Very high	97.3	Very high	132 Å²	132	35.6 Å²	35.6	62%	0.617	21%	0.209	S	C	*	.			trans	-119.7	-19.5	-175	-59.3	-49.4	-48.2	0	0	113.4	K363 S366 D368	K363-Q370 WeakPolarHBondContact CD-O 3.32Å; S366-Q370 PolarHBondContact OG-N 3.2Å; D368-Q370 WeakPolarHBondContact O-CG 3.16Å; D368-Q370 PolarHBondContact O-N 2.91Å; D368-Q370 PolarHBondContact OD1-N 3.39Å
371	T	97.3	Very high	97.2	Very high	76 Å²	76	37.9 Å²	37.9	47%	0.466	22%	0.217	S	C	.	.	S	Bend	trans	-96.6	125	-175.3	-61.5	0	0	0	0	110.8	K363 S366 D368	K363-T371 WeakPolarHBondContact CA-O 3.38Å; S366-T371 WeakPolarHBondContact CB-O 3.22Å; S366-T371 PolarHBondContact OG-N 3.33Å; S366-T371 PolarHBondContact OG-O 3.29Å; D368-T371 PolarHBondContact OD1-N 2.94Å; D368-T371 PolarHBondContact OD1-OG1 3.5Å; D368-T371 PolarHBondContact OD2-OG1 2.93Å
372	E	98.6	Very high	97.1	Very high	22 Å²	22	42.5 Å²	42.5	10%	0.103	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-63.5	158.1	174.8	-72.8	-68	-169.5	0	0	112.1	P343 Y348 S360 K363 T389 Y392	P343-E372 HydrophobicContact CB-CG 4.2Å; P343-E372 HydrophobicContact CG-CB 3.83Å; P343-E372 HydrophobicContact CG-CG 3.78Å; Y348-E372 HydrophobicContact CE2-CG 4.1Å; Y348-E372 VanDerWaalsContact CE2-OE1 3.25Å; Y348-E372 WeakPolarHBondContact CE2-OE1 3.34Å; Y348-E372 PolarHBondContact OH-OE1 2.94Å; S360-E372 WeakPolarHBondContact CB-OE1 3.26Å; S360-E372 PolarHBondContact OG-OE1 3.03Å; S360-E372 PolarHBondContact OG-OE2 2.83Å; K363-E372 VanDerWaalsContact CG-CD 3.42Å; K363-E372 HydrophobicContact CG-CG 3.92Å; K363-E372 PolarHBondContact N-OE2 3.07Å; E372-T389 HydrophobicContact CB-CG2 4.37Å; E372-Y392 HydrophobicContact CG-CE1 4.43Å
373	P	98.1	Very high	96.9	Very high	20 Å²	20	48.1 Å²	48.1	13%	0.13	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-59.7	156.1	176.5	27	-34.6	0	0	0	110.5	Y362 Y375 T376 T389 I408	Y362-P373 HydrophobicContact CD1-CG 4.4Å; P373-Y375 PolarHBondContact O-N 3.49Å; P373-T376 HydrophobicContact CG-CG2 4.05Å; P373-T389 HydrophobicContact CG-CG2 4.16Å; P373-T389 PolarHBondContact O-OG1 3.42Å; P373-I408 HydrophobicContact CB-CG1 4Å
374	A	97.9	Very high	96.9	Very high	91 Å²	91	48.7 Å²	48.7	75%	0.752	30%	0.299	S	S	*	.	S	Bend	trans	-62.3	-32.5	179.2	0	0	0	0	0	112.2
375	Y	98.6	Very high	96.9	Very high	13 Å²	13	52.5 Å²	52.5	5%	0.051	32%	0.316	C	S	.	.			trans	-157.2	156.1	177.9	68.6	-80.4	0	0	0	111.9	P373 W378 C387 T389 I408 P409 I414 L429	P373-Y375 PolarHBondContact O-N 3.49Å; Y375-W378 HydrophobicContact CD1-CE3 4.1Å; Y375-W378 HydrophobicContact CD1-CZ3 4.28Å; Y375-W378 HydrophobicContact CD2-CB 3.99Å; Y375-W378 HydrophobicContact CD2-CE3 4.01Å; Y375-W378 AromaticContact CE1-CE3 3.89Å; Y375-W378 HydrophobicContact CE1-CE3 3.89Å; Y375-W378 AromaticContact CE1-CZ3 3.9Å; Y375-W378 HydrophobicContact CE1-CZ3 3.9Å; Y375-W378 HydrophobicContact CE2-CB 4.29Å; Y375-W378 AromaticContact CE2-CE3 3.74Å; Y375-W378 HydrophobicContact CE2-CE3 3.74Å; Y375-W378 HydrophobicContact CG-CE3 4.17Å; Y375-W378 AromaticContact CZ-CE3 3.69Å; Y375-C387 WeakPolarHBondContact CB-SG 3.23Å; Y375-T389 WeakPolarHBondContact CA-OG1 3.43Å; Y375-T389 PolarHBondContact N-OG1 3.1Å; Y375-I408 HydrophobicContact CD1-CG2 4.33Å; Y375-I408 HydrophobicContact CE1-CG2 3.75Å; Y375-I408 HydrophobicContact CE2-CG2 4.1Å; Y375-P409 PolarHBondContact OH-O 3.29Å; Y375-I414 HydrophobicContact CE2-CD1 4.37Å; Y375-I414 HydrophobicContact CE2-CG1 4.27Å; Y375-I414 WeakPolarHBondContact OH-CG1 3.48Å; Y375-L429 HydrophobicContact CD2-CD1 4.03Å; Y375-L429 HydrophobicContact CE2-CD1 3.45Å; Y375-L429 VanDerWaalsContact CE2-CD1 3.45Å; Y375-L429 HydrophobicContact CE2-CG 4.44Å
376	T	98.8	Very high	96.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	32%	0.318	C	S	.	.	S	Bend	trans	-126.7	-14.9	164.6	64.1	0	0	0	0	111.2	P373 S388 T389 L390 D391 H428 L429 L431	P373-T376 HydrophobicContact CG-CG2 4.05Å; T376-S388 PolarHBondContact N-O 2.77Å; T376-T389 HydrophobicContact CG2-CG2 3.97Å; T376-L390 PolarHBondContact OG1-N 3.09Å; T376-D391 VanDerWaalsContact CB-OD2 3.26Å; T376-D391 WeakPolarHBondContact CB-OD2 3.37Å; T376-D391 HydrophobicContact CG2-CB 4.21Å; T376-D391 PolarHBondContact OG1-N 3.46Å; T376-D391 PolarHBondContact OG1-OD2 2.73Å; T376-H428 CarbonylContact O-C 3.41Å; T376-H428 WeakPolarHBondContact O-CA 3.49Å; T376-L429 PolarHBondContact O-N 3.02Å; T376-L431 HydrophobicContact CG2-CD1 4.17Å; T376-L431 HydrophobicContact CG2-CD2 4.05Å
377	S	98.6	Very high	97	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.007	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	137.1	170.3	-178.3	0	0	0	0	110.4	K379 C387 S388 D427 H428	S377-K379 WeakPolarHBondContact OG-CE 3.42Å; S377-K379 PolarHBondContact OG-NZ 2.91Å; S377-C387 WeakPolarHBondContact O-CA 3.38Å; S377-S388 PolarHBondContact N-O 2.95Å; S377-S388 PolarHBondContact O-N 3.27Å; S377-D427 VanDerWaalsContact CA-O 3.24Å; S377-D427 WeakPolarHBondContact CA-O 3.48Å; S377-D427 WeakPolarHBondContact CB-O 3.37Å; S377-D427 PolarHBondContact OG-O 3.46Å; S377-H428 PolarHBondContact OG-NE2 3.04Å
378	W	98.4	Very high	97.2	Very high	23 Å²	23	48.7 Å²	48.7	9%	0.087	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	112.3	179	-163.4	-10.4	0	0	0	111.2	Y375 E385 S386 C387 E411 I414 R418 L419 D427	Y375-W378 HydrophobicContact CD1-CE3 4.1Å; Y375-W378 HydrophobicContact CD1-CZ3 4.28Å; Y375-W378 HydrophobicContact CD2-CB 3.99Å; Y375-W378 HydrophobicContact CD2-CE3 4.01Å; Y375-W378 AromaticContact CE1-CE3 3.89Å; Y375-W378 HydrophobicContact CE1-CE3 3.89Å; Y375-W378 AromaticContact CE1-CZ3 3.9Å; Y375-W378 HydrophobicContact CE1-CZ3 3.9Å; Y375-W378 HydrophobicContact CE2-CB 4.29Å; Y375-W378 AromaticContact CE2-CE3 3.74Å; Y375-W378 HydrophobicContact CE2-CE3 3.74Å; Y375-W378 HydrophobicContact CG-CE3 4.17Å; Y375-W378 AromaticContact CZ-CE3 3.69Å; W378-E385 PolarHBondContact NE1-OE1 2.93Å; W378-S386 CarbonylContact C-O 3.57Å; W378-S386 WeakPolarHBondContact CA-O 3.35Å; W378-C387 HydrophobicContact CD2-CB 4.09Å; W378-C387 HydrophobicContact CG-CB 3.88Å; W378-E411 HydrophobicContact CH2-CB 3.71Å; W378-E411 HydrophobicContact CH2-CG 3.46Å; W378-E411 VanDerWaalsContact CH2-CG 3.46Å; W378-E411 HydrophobicContact CZ2-CG 4.25Å; W378-E411 HydrophobicContact CZ3-CB 3.85Å; W378-E411 HydrophobicContact CZ3-CG 4Å; W378-I414 HydrophobicContact CE3-CG2 4.43Å; W378-R418 HydrophobicContact CG-CB 4.26Å; W378-R418 HydrophobicContact CG-CG 4.22Å; W378-R418 VanDerWaalsContact CZ2-CZ 3.46Å; W378-R418 WeakPolarHBondContact O-CB 3.49Å; W378-L419 WeakPolarHBondContact O-CA 3.33Å; W378-L419 VanDerWaalsContact O-CB 3.24Å; W378-L419 WeakPolarHBondContact O-CB 3.49Å; W378-L419 PolarHBondContact O-N 3.22Å; W378-D427 PolarHBondContact N-O 2.52Å
379	K	97.9	Very high	97.4	Very high	22 Å²	22	45.4 Å²	45.4	10%	0.096	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	159.7	-169.5	57.5	-148.2	175.7	-162.2	0	113.4	F170 S377 E385 S386 L419 D427 H428	F170-K379 HydrophobicContact CD1-CB 4.35Å; F170-K379 HydrophobicContact CE1-CB 4.16Å; F170-K379 HydrophobicContact CE1-CD 4.33Å; S377-K379 WeakPolarHBondContact OG-CE 3.42Å; S377-K379 PolarHBondContact OG-NZ 2.91Å; K379-E385 WeakPolarHBondContact O-CA 3.26Å; K379-S386 PolarHBondContact N-O 3.1Å; K379-S386 PolarHBondContact O-N 2.74Å; K379-L419 WeakPolarHBondContact CA-O 3.34Å; K379-L419 WeakPolarHBondContact CB-O 3.47Å; K379-D427 HydrophobicContact CB-CB 4.07Å; K379-D427 HydrophobicContact CD-CB 3.66Å; K379-D427 WeakPolarHBondContact CD-OD2 3.46Å; K379-D427 VanDerWaalsContact CE-OD2 3.27Å; K379-D427 WeakPolarHBondContact CE-OD2 3.24Å; K379-D427 IonicContact NZ-OD2 3.38Å; K379-D427 PolarHBondContact NZ-OD2 2.95Å; K379-H428 PolarHBondContact NZ-NE2 2.83Å; K379-H428 VanDerWaalsContact NZ-NE2 3.13Å
380	I	98.2	Very high	97.6	Very high	26 Å²	26	46.2 Å²	46.2	13%	0.133	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	120.2	176.4	-55.1	174.1	0	0	0	109.6	I171 R172 E385 R418	I171-I380 HydrophobicContact CD1-CG2 3.82Å; I171-I380 HydrophobicContact CG1-CB 4.48Å; I171-I380 HydrophobicContact CG1-CG2 3.75Å; I171-I380 PolarHBondContact N-O 3.02Å; R172-I380 HydrophobicContact CB-CB 4.39Å; R172-I380 HydrophobicContact CB-CD1 4.38Å; R172-I380 HydrophobicContact CG-CB 3.88Å; R172-I380 HydrophobicContact CG-CD1 3.75Å; R172-I380 HydrophobicContact CG-CG1 4.38Å; R172-I380 HydrophobicContact CG-CG2 3.86Å; I380-E385 HydrophobicContact CD1-CG 4.49Å; I380-E385 HydrophobicContact CG1-CB 4.04Å; I380-E385 HydrophobicContact CG1-CG 3.91Å; I380-R418 HydrophobicContact CD1-CG 3.69Å; I380-R418 HydrophobicContact CG1-CB 4.37Å; I380-R418 HydrophobicContact CG1-CG 3.8Å
381	R	96.4	Very high	97.8	Very high	47 Å²	47	40 Å²	40	18%	0.177	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	173.6	-179.2	-65.3	179.9	-177.1	-129.1	6.2	109.6	D168 F170 S383 G384 D427	D168-R381 VanDerWaalsContact CG-CZ 3.42Å; D168-R381 WeakPolarHBondContact O-CD 3.35Å; D168-R381 WeakPolarHBondContact O-CG 3.17Å; D168-R381 PolarHBondContact O-NH1 2.9Å; D168-R381 IonicContact OD1-CZ 2.66Å; D168-R381 IonicContact OD1-NH1 3.41Å; D168-R381 PolarHBondContact OD1-NH1 2.83Å; D168-R381 IonicContact OD1-NH2 3.07Å; D168-R381 PolarHBondContact OD1-NH2 2.77Å; D168-R381 IonicContact OD2-CZ 3.33Å; D168-R381 IonicContact OD2-NH1 2.94Å; D168-R381 IonicContact OD2-NH2 3.61Å; D168-R381 PolarHBondContact OD2-NH2 3Å; F170-R381 HydrophobicContact CD1-CG 4.44Å; R381-S383 PolarHBondContact O-N 2.77Å; R381-S383 VanDerWaalsContact O-N 3.1Å; R381-G384 PolarHBondContact N-O 3.25Å; R381-G384 PolarHBondContact O-N 2.81Å; R381-D427 IonicContact NH2-OD2 2.72Å; R381-D427 PolarHBondContact NH2-OD2 3.49Å; R381-D427 VanDerWaalsContact NH2-OD2 3.1Å
382	P	96.6	Very high	97.9	Very high	98 Å²	98	36.4 Å²	36.4	64%	0.636	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.7	178.1	-25.9	36.1	0	0	0	113.6	S169 I171 G384	S169-P382 WeakPolarHBondContact O-CD 3.31Å; I171-P382 HydrophobicContact CG2-CG 3.81Å; P382-G384 PolarHBondContact O-N 3.46Å
383	S	94.3	Very high	97.9	Very high	118 Å²	118	35.4 Å²	35.4	83%	0.825	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-10.6	174.7	54.1	0	0	0	0	114.2	R381	R381-S383 PolarHBondContact O-N 2.77Å; R381-S383 VanDerWaalsContact O-N 3.1Å
384	G	96.8	Very high	98	Very high	34 Å²	34	34.5 Å²	34.5	35%	0.351	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	122.4	-178.5	-176.5	0	0	0	0	0	113.4	R381 P382	R381-G384 PolarHBondContact N-O 3.25Å; R381-G384 PolarHBondContact O-N 2.81Å; P382-G384 PolarHBondContact O-N 3.46Å
385	E	97.8	Very high	98	Very high	103 Å²	103	30.5 Å²	30.5	48%	0.481	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	134.2	170.9	-176.2	169.8	-172.3	0	0	110.1	W378 K379 I380 R418	W378-E385 PolarHBondContact NE1-OE1 2.93Å; K379-E385 WeakPolarHBondContact O-CA 3.26Å; I380-E385 HydrophobicContact CD1-CG 4.49Å; I380-E385 HydrophobicContact CG1-CB 4.04Å; I380-E385 HydrophobicContact CG1-CG 3.91Å; E385-R418 IonicContact OE1-CZ 3.27Å; E385-R418 IonicContact OE1-NE 3.29Å; E385-R418 PolarHBondContact OE1-NE 3.36Å; E385-R418 IonicContact OE1-NH2 3.79Å; E385-R418 PolarHBondContact OE1-NH2 3.19Å; E385-R418 VanDerWaalsContact OE1-NH2 3.15Å
386	S	97.3	Very high	98	Very high	49 Å²	49	30.3 Å²	30.3	34%	0.343	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	126.3	178.8	174.4	0	0	0	0	108.7	W378 K379	W378-S386 CarbonylContact C-O 3.57Å; W378-S386 WeakPolarHBondContact CA-O 3.35Å; K379-S386 PolarHBondContact N-O 3.1Å; K379-S386 PolarHBondContact O-N 2.74Å
387	C	98.1	Very high	97.8	Very high	52 Å²	52	34.6 Å²	34.6	35%	0.351	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	107.5	-179.3	-174.1	0	0	0	0	107.2	Y375 S377 W378	Y375-C387 WeakPolarHBondContact CB-SG 3.23Å; S377-C387 WeakPolarHBondContact O-CA 3.38Å; W378-C387 HydrophobicContact CD2-CB 4.09Å; W378-C387 HydrophobicContact CG-CB 3.88Å
388	S	98.2	Very high	97.5	Very high	18 Å²	18	45.5 Å²	45.5	13%	0.126	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	155.3	-170	-65.1	0	0	0	0	111.2	E342 T376 S377	E342-S388 WeakPolarHBondContact OE1-CB 3.46Å; E342-S388 PolarHBondContact OE1-OG 2.96Å; T376-S388 PolarHBondContact N-O 2.77Å; S377-S388 PolarHBondContact N-O 2.95Å; S377-S388 PolarHBondContact O-N 3.27Å
389	T	98.8	Very high	97.3	Very high	6 Å²	6	45.6 Å²	45.6	4%	0.037	25%	0.251	C	S	.	.			trans	-96.6	111	169.1	-70.8	0	0	0	0	108.9	E342 P343 E372 P373 Y375 T376 Y392	E342-T389 WeakPolarHBondContact CA-O 3.18Å; P343-T389 HydrophobicContact CG-CG2 4.34Å; E372-T389 HydrophobicContact CB-CG2 4.37Å; P373-T389 HydrophobicContact CG-CG2 4.16Å; P373-T389 PolarHBondContact O-OG1 3.42Å; Y375-T389 WeakPolarHBondContact CA-OG1 3.43Å; Y375-T389 PolarHBondContact N-OG1 3.1Å; T376-T389 HydrophobicContact CG2-CG2 3.97Å; T389-Y392 HydrophobicContact CG2-CE1 3.9Å; T389-Y392 PolarHBondContact O-OH 2.78Å
390	L	98.9	Very high	97.2	Very high	20 Å²	20	44.6 Å²	44.6	11%	0.105	25%	0.247	C	C	.	.			trans	-125.2	-19.6	-173.8	-53.6	178.5	0	0	0	112.4	F339 E342 T376 Y392	F339-L390 PolarHBondContact N-O 2.83Å; E342-L390 HydrophobicContact CG-CD2 4.33Å; T376-L390 PolarHBondContact OG1-N 3.09Å; L390-Y392 WeakPolarHBondContact O-CD2 3.31Å; L390-Y392 WeakPolarHBondContact O-CE2 3.49Å
391	D	98.9	Very high	97	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	136.1	-173.5	-54.8	-90.1	0	0	0	110.3	G337 T376 H428 L431	G337-D391 WeakPolarHBondContact O-CA 3.49Å; T376-D391 VanDerWaalsContact CB-OD2 3.26Å; T376-D391 WeakPolarHBondContact CB-OD2 3.37Å; T376-D391 HydrophobicContact CG2-CB 4.21Å; T376-D391 PolarHBondContact OG1-N 3.46Å; T376-D391 PolarHBondContact OG1-OD2 2.73Å; D391-H428 IonicContact OD1-ND1 3.73Å; D391-H428 PolarHBondContact OD1-ND1 3.2Å; D391-H428 IonicContact OD2-CE1 3.3Å; D391-H428 IonicContact OD2-CG 2.87Å; D391-H428 IonicContact OD2-ND1 4Å; D391-H428 PolarHBondContact OD2-ND1 2.87Å; D391-L431 HydrophobicContact CB-CD1 3.68Å; D391-L431 HydrophobicContact CB-CG 4.22Å; D391-L431 WeakPolarHBondContact O-CD1 3.34Å
392	Y	98.9	Very high	97	Very high	1 Å²	1	43 Å²	43	0%	0.004	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	147	-176.4	-56.4	-81.7	0	0	0	112.1	C336 G337 F339 A341 P343 Y348 E372 T389 L390 W394	C336-Y392 WeakPolarHBondContact CA-O 3.42Å; G337-Y392 PolarHBondContact N-O 2.69Å; G337-Y392 PolarHBondContact O-N 3.33Å; F339-Y392 HydrophobicContact CB-CD2 3.84Å; F339-Y392 HydrophobicContact CB-CE2 3.84Å; F339-Y392 HydrophobicContact CD1-CD2 4.43Å; F339-Y392 AromaticContact CD2-CD2 3.84Å; F339-Y392 HydrophobicContact CD2-CD2 3.84Å; F339-Y392 AromaticContact CG-CD2 3.78Å; F339-Y392 HydrophobicContact CG-CD2 3.78Å; F339-Y392 HydrophobicContact CG-CE2 4.23Å; A341-Y392 WeakPolarHBondContact O-CE2 3.18Å; A341-Y392 PolarHBondContact O-OH 2.93Å; P343-Y392 WeakPolarHBondContact CD-OH 3.45Å; P343-Y392 HydrophobicContact CG-CE1 4.49Å; Y348-Y392 HydrophobicContact CD2-CD1 4.24Å; Y348-Y392 AromaticContact CD2-CE1 3.62Å; Y348-Y392 HydrophobicContact CD2-CE1 3.62Å; Y348-Y392 HydrophobicContact CD2-CE2 4.42Å; Y348-Y392 AromaticContact CD2-CZ 3.72Å; Y348-Y392 HydrophobicContact CE2-CD1 4.01Å; Y348-Y392 AromaticContact CE2-CE1 3.53Å; Y348-Y392 HydrophobicContact CE2-CE1 3.53Å; E372-Y392 HydrophobicContact CG-CE1 4.43Å; T389-Y392 HydrophobicContact CG2-CE1 3.9Å; T389-Y392 PolarHBondContact O-OH 2.78Å; L390-Y392 WeakPolarHBondContact O-CD2 3.31Å; L390-Y392 WeakPolarHBondContact O-CE2 3.49Å; Y392-W394 VanDerWaalsContact CB-NE1 3.31Å; Y392-W394 HydrophobicContact CD1-CZ2 4.44Å; Y392-W394 HydrophobicContact CG-CZ2 4.44Å; Y392-W394 AromaticContact CG-NE1 3.81Å
393	I	98.9	Very high	96.9	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	99.3	161.6	-55.6	175.7	0	0	0	107.2	Q155 V334 A361 Y362 L431 C433	Q155-I393 HydrophobicContact CB-CD1 3.94Å; Q155-I393 HydrophobicContact CB-CG1 3.66Å; Q155-I393 HydrophobicContact CG-CG1 4.14Å; V334-I393 HydrophobicContact CG1-CG2 3.99Å; A361-I393 HydrophobicContact CB-CB 4.3Å; A361-I393 HydrophobicContact CB-CG2 4.49Å; A361-I393 WeakPolarHBondContact CB-O 3.38Å; A361-I393 PolarHBondContact N-O 2.69Å; Y362-I393 HydrophobicContact CE2-CD1 4.07Å; I393-L431 HydrophobicContact CD1-CB 3.92Å; I393-L431 HydrophobicContact CG1-CB 4.26Å; I393-C433 HydrophobicContact CD1-CB 4.44Å
394	W	98.9	Very high	97	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	144.5	172.4	-59.4	89	0	0	0	110.1	V334 V335 F339 Y348 F351 L358 S359 Y392	V334-W394 CarbonylContact C-O 3.52Å; V334-W394 VanDerWaalsContact CA-O 3.26Å; V334-W394 WeakPolarHBondContact CA-O 3.34Å; V335-W394 HydrophobicContact CB-CB 4.11Å; V335-W394 PolarHBondContact N-O 3.24Å; V335-W394 PolarHBondContact O-N 3Å; F339-W394 AromaticContact CE1-NE1 3.85Å; F339-W394 AromaticContact CE2-NE1 3.98Å; F339-W394 AromaticContact CZ-CD1 3.8Å; F339-W394 AromaticContact CZ-NE1 3.54Å; Y348-W394 HydrophobicContact CD1-CH2 4.49Å; Y348-W394 AromaticContact CD2-CH2 3.65Å; Y348-W394 HydrophobicContact CD2-CH2 3.65Å; Y348-W394 AromaticContact CD2-CZ2 3.48Å; Y348-W394 HydrophobicContact CD2-CZ2 3.48Å; Y348-W394 VanDerWaalsContact CD2-CZ2 3.48Å; Y348-W394 HydrophobicContact CE1-CH2 4.33Å; Y348-W394 AromaticContact CE2-CH2 3.42Å; Y348-W394 HydrophobicContact CE2-CH2 3.42Å; Y348-W394 VanDerWaalsContact CE2-CH2 3.42Å; Y348-W394 AromaticContact CE2-CZ2 3.57Å; Y348-W394 HydrophobicContact CE2-CZ2 3.57Å; Y348-W394 HydrophobicContact CG-CH2 4.17Å; Y348-W394 HydrophobicContact CG-CZ2 4.23Å; Y348-W394 AromaticContact CZ-CH2 3.8Å; F351-W394 HydrophobicContact CB-CD2 3.92Å; F351-W394 HydrophobicContact CB-CE3 4.03Å; F351-W394 HydrophobicContact CB-CH2 3.67Å; F351-W394 HydrophobicContact CB-CZ2 3.54Å; F351-W394 HydrophobicContact CB-CZ3 3.91Å; F351-W394 AromaticContact CD1-CD1 3.85Å; F351-W394 AromaticContact CD1-CD2 3.99Å; F351-W394 HydrophobicContact CD1-CD2 3.99Å; F351-W394 AromaticContact CD1-CE2 3.98Å; F351-W394 AromaticContact CD1-CG 3.92Å; F351-W394 HydrophobicContact CD1-CG 3.92Å; F351-W394 AromaticContact CD1-NE1 3.86Å; F351-W394 HydrophobicContact CG-CD2 4.38Å; F351-W394 HydrophobicContact CG-CZ2 4.33Å; L358-W394 HydrophobicContact CB-CB 4.4Å; L358-W394 HydrophobicContact CB-CE3 4.09Å; L358-W394 HydrophobicContact CD1-CB 4.46Å; S359-W394 CarbonylContact O-C 3.56Å; S359-W394 WeakPolarHBondContact O-CA 3.45Å; Y392-W394 VanDerWaalsContact CB-NE1 3.31Å; Y392-W394 HydrophobicContact CD1-CZ2 4.44Å; Y392-W394 HydrophobicContact CG-CZ2 4.44Å; Y392-W394 AromaticContact CG-NE1 3.81Å
395	Y	98.7	Very high	97.1	Very high	7 Å²	7	33.1 Å²	33.1	3%	0.027	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	151.1	177.3	70.6	-76.8	0	0	0	111.9	L333 L358 S359 A361 E397 L400 V402	L333-Y395 CarbonylContact O-C 3.54Å; L333-Y395 VanDerWaalsContact O-CA 3.31Å; L333-Y395 WeakPolarHBondContact O-CA 3.46Å; L358-Y395 WeakPolarHBondContact CA-O 3.32Å; S359-Y395 PolarHBondContact N-O 3.05Å; S359-Y395 WeakPolarHBondContact O-CD1 3.31Å; S359-Y395 WeakPolarHBondContact O-CE1 3.39Å; S359-Y395 PolarHBondContact O-N 3.01Å; A361-Y395 HydrophobicContact CB-CD1 3.95Å; A361-Y395 HydrophobicContact CB-CE1 4.09Å; Y395-E397 HydrophobicContact CE2-CB 4.18Å; Y395-E397 HydrophobicContact CE2-CG 4.37Å; Y395-E397 PolarHBondContact O-N 2.92Å; Y395-L400 HydrophobicContact CD2-CB 4Å; Y395-V402 HydrophobicContact CD1-CG2 4.05Å; Y395-V402 HydrophobicContact CD2-CG2 4.37Å; Y395-V402 HydrophobicContact CE1-CG2 3.72Å; Y395-V402 HydrophobicContact CE2-CG2 4.02Å; Y395-V402 HydrophobicContact CG-CG2 4.38Å
396	S	97.8	Very high	97.1	Very high	10 Å²	10	28.2 Å²	28.2	7%	0.07	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	95.3	172.4	-69.2	0	0	0	0	111.3	L333 R398 A399 L400	L333-S396 PolarHBondContact N-OG 3.35Å; L333-S396 PolarHBondContact O-N 3.06Å; S396-R398 PolarHBondContact O-N 3.18Å; S396-R398 VanDerWaalsContact O-N 3.12Å; S396-A399 PolarHBondContact O-N 3.15Å; S396-L400 PolarHBondContact O-N 3.22Å
397	E	94.9	Very high	97.1	Very high	90 Å²	90	27.6 Å²	27.6	42%	0.421	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-31.1	-169.1	-175.6	175.5	-118.8	0	0	114.1	G357 S359 Y395 L400 R438	G357-E397 PolarHBondContact O-N 2.92Å; S359-E397 WeakPolarHBondContact CB-OE1 2.93Å; S359-E397 PolarHBondContact OG-OE1 2.96Å; S359-E397 VanDerWaalsContact OG-OE1 3.13Å; Y395-E397 HydrophobicContact CE2-CB 4.18Å; Y395-E397 HydrophobicContact CE2-CG 4.37Å; Y395-E397 PolarHBondContact O-N 2.92Å; E397-L400 VanDerWaalsContact O-O 3.06Å; E397-R438 PolarHBondContact O-NE 2.74Å; E397-R438 PolarHBondContact O-NH2 3.14Å
398	R	93.4	Very high	97.1	Very high	229 Å²	229	26.7 Å²	26.7	86%	0.864	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-23.3	179.3	-66.4	-177.2	178.9	166.9	0	114	S396 R438	S396-R398 PolarHBondContact O-N 3.18Å; S396-R398 VanDerWaalsContact O-N 3.12Å; R398-R438 VanDerWaalsContact O-CD 3.26Å; R398-R438 WeakPolarHBondContact O-CD 3.41Å
399	A	93.6	Very high	97	Very high	26 Å²	26	26 Å²	26	22%	0.215	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113	-19.5	-173.7	0	0	0	0	0	113.2	P332 S396 R438	P332-A399 HydrophobicContact CB-CB 3.89Å; P332-A399 HydrophobicContact CG-CB 3.69Å; S396-A399 PolarHBondContact O-N 3.15Å; A399-R438 PolarHBondContact O-N 3.22Å
400	L	95.1	Very high	96.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	153.9	-178	-58.7	170.6	0	0	0	109.7	L288 P332 L333 V334 Y395 S396 E397 I435 S436 F437 R438	L288-L400 HydrophobicContact CD1-CD1 3.8Å; L288-L400 HydrophobicContact CD1-CD2 4.18Å; P332-L400 HydrophobicContact CB-CD1 4.04Å; P332-L400 HydrophobicContact CB-CD2 4.16Å; P332-L400 HydrophobicContact CB-CG 3.96Å; L333-L400 WeakPolarHBondContact O-CD1 3.47Å; V334-L400 HydrophobicContact CG2-CD1 3.82Å; Y395-L400 HydrophobicContact CD2-CB 4Å; S396-L400 PolarHBondContact O-N 3.22Å; E397-L400 VanDerWaalsContact O-O 3.06Å; L400-I435 HydrophobicContact CD1-CD1 4.25Å; L400-S436 CarbonylContact C-O 3.56Å; L400-S436 WeakPolarHBondContact CA-O 3.41Å; L400-F437 HydrophobicContact CD2-CD1 3.52Å; L400-F437 HydrophobicContact CD2-CE1 3.91Å; L400-F437 HydrophobicContact CD2-CG 4.19Å; L400-R438 PolarHBondContact O-NE 2.63Å
401	R	94.4	Very high	96.8	Very high	39 Å²	39	33.2 Å²	33.2	15%	0.147	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	139.4	177.7	172.9	-178.2	152.8	137.1	10	108.5	A141 C143 E403 I435 S436 R438	A141-R401 PolarHBondContact O-NH1 3.31Å; A141-R401 PolarHBondContact O-NH2 3.37Å; C143-R401 PolarHBondContact SG-NE 3.24Å; C143-R401 VanDerWaalsContact SG-NE 3.36Å; R401-E403 WeakPolarHBondContact CD-OE1 3.46Å; R401-E403 WeakPolarHBondContact CG-OE1 3.27Å; R401-E403 IonicContact CZ-OE1 3.52Å; R401-E403 IonicContact CZ-OE2 3.82Å; R401-E403 VanDerWaalsContact NE-CD 3.29Å; R401-E403 IonicContact NE-OE1 2.78Å; R401-E403 PolarHBondContact NE-OE1 3.3Å; R401-E403 IonicContact NE-OE2 3.55Å; R401-E403 PolarHBondContact NE-OE2 2.5Å; R401-E403 IonicContact NH2-OE2 3.64Å; R401-E403 PolarHBondContact NH2-OE2 3.05Å; R401-I435 CarbonylContact O-C 3.56Å; R401-I435 WeakPolarHBondContact O-CA 3.47Å; R401-I435 WeakPolarHBondContact O-CB 3.44Å; R401-S436 PolarHBondContact N-O 2.92Å; R401-S436 PolarHBondContact O-N 3.16Å; R401-R438 HydrophobicContact CB-CG 4.03Å
402	V	96.1	Very high	96.6	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	125.5	173.1	179.3	0	0	0	0	108.8	P137 L140 A361 L364 Y395 L405 C433 I435	P137-V402 HydrophobicContact CG-CG1 4.31Å; L140-V402 WeakPolarHBondContact CD1-O 3.46Å; A361-V402 HydrophobicContact CB-CG2 3.93Å; L364-V402 HydrophobicContact CD1-CB 3.65Å; L364-V402 HydrophobicContact CD1-CG1 4.06Å; L364-V402 HydrophobicContact CD1-CG2 3.83Å; Y395-V402 HydrophobicContact CD1-CG2 4.05Å; Y395-V402 HydrophobicContact CD2-CG2 4.37Å; Y395-V402 HydrophobicContact CE1-CG2 3.72Å; Y395-V402 HydrophobicContact CE2-CG2 4.02Å; Y395-V402 HydrophobicContact CG-CG2 4.38Å; V402-L405 HydrophobicContact CG1-CD1 4.11Å; V402-L405 HydrophobicContact CG1-CD2 4.07Å; V402-L405 HydrophobicContact CG1-CG 3.82Å; V402-C433 HydrophobicContact CG1-CB 4.42Å; V402-I435 HydrophobicContact CG2-CG2 4.22Å
403	E	95	Very high	96.4	Very high	33 Å²	33	45.6 Å²	45.6	15%	0.154	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	-39.2	-179.3	-58.2	-56.1	160.5	0	0	112.7	P137 C143 R401 D434 S436	P137-E403 WeakPolarHBondContact CD-O 2.93Å; C143-E403 PolarHBondContact SG-OE1 2.82Å; C143-E403 PolarHBondContact SG-OE2 3.42Å; C143-E403 VanDerWaalsContact SG-OE2 3.41Å; R401-E403 WeakPolarHBondContact CD-OE1 3.46Å; R401-E403 WeakPolarHBondContact CG-OE1 3.27Å; R401-E403 IonicContact CZ-OE1 3.52Å; R401-E403 IonicContact CZ-OE2 3.82Å; R401-E403 VanDerWaalsContact NE-CD 3.29Å; R401-E403 IonicContact NE-OE1 2.78Å; R401-E403 PolarHBondContact NE-OE1 3.3Å; R401-E403 IonicContact NE-OE2 3.55Å; R401-E403 PolarHBondContact NE-OE2 2.5Å; R401-E403 IonicContact NH2-OE2 3.64Å; R401-E403 PolarHBondContact NH2-OE2 3.05Å; E403-D434 HydrophobicContact CB-CB 4.29Å; E403-D434 PolarHBondContact N-O 2.99Å; E403-S436 WeakPolarHBondContact OE1-CB 3.44Å; E403-S436 PolarHBondContact OE1-OG 3.2Å
404	A	96.6	Very high	96.3	Very high	9 Å²	9	45.7 Å²	45.7	7%	0.074	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	156.2	178.2	0	0	0	0	0	110.7	L134 V135 C433 D434	L134-A404 HydrophobicContact CD2-CB 4.42Å; V135-A404 CarbonylContact O-C 3.56Å; V135-A404 VanDerWaalsContact O-CA 3.26Å; V135-A404 WeakPolarHBondContact O-CA 3.4Å; A404-C433 CarbonylContact O-C 3.43Å; A404-C433 VanDerWaalsContact O-CA 3.28Å; A404-C433 WeakPolarHBondContact O-CA 3.34Å; A404-D434 HydrophobicContact CB-CB 4.15Å; A404-D434 PolarHBondContact N-O 3.01Å; A404-D434 PolarHBondContact O-N 3.37Å
405	L	98.3	Very high	96.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	142.4	178	-72.1	159	0	0	0	108.4	L134 V135 P137 A361 Y362 L364 L365 V402 L432 C433	L134-L405 CarbonylContact C-O 3.54Å; L134-L405 WeakPolarHBondContact CA-O 3.46Å; V135-L405 HydrophobicContact CG2-CB 4.34Å; V135-L405 VanDerWaalsContact CG2-O 3.31Å; V135-L405 WeakPolarHBondContact CG2-O 3.36Å; V135-L405 PolarHBondContact N-O 3.37Å; V135-L405 PolarHBondContact O-N 3.09Å; P137-L405 HydrophobicContact CG-CD1 4.01Å; A361-L405 HydrophobicContact CB-CD2 4.14Å; A361-L405 WeakPolarHBondContact O-CD1 3.24Å; Y362-L405 HydrophobicContact CD2-CD2 3.75Å; Y362-L405 HydrophobicContact CE2-CD2 3.62Å; Y362-L405 HydrophobicContact CG-CD2 4.37Å; L364-L405 HydrophobicContact CB-CD1 3.82Å; L365-L405 HydrophobicContact CD2-CB 3.7Å; L365-L405 HydrophobicContact CD2-CD1 3.9Å; L365-L405 HydrophobicContact CD2-CG 4.43Å; L365-L405 HydrophobicContact CG-CB 4.32Å; L365-L405 HydrophobicContact CG-CD1 3.99Å; V402-L405 HydrophobicContact CG1-CD1 4.11Å; V402-L405 HydrophobicContact CG1-CD2 4.07Å; V402-L405 HydrophobicContact CG1-CG 3.82Å; L405-L432 WeakPolarHBondContact CA-O 3.39Å; L405-C433 HydrophobicContact CD2-CB 3.55Å; L405-C433 HydrophobicContact CG-CB 4.49Å
406	L	98.3	Very high	96	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	123.1	167.9	-171.9	65	0	0	0	108.7	R132 L134 Y194 Y362 L432	R132-L406 HydrophobicContact CB-CD1 3.61Å; R132-L406 HydrophobicContact CB-CD2 4.46Å; R132-L406 HydrophobicContact CB-CG 3.99Å; L134-L406 HydrophobicContact CD2-CB 4.3Å; L134-L406 HydrophobicContact CD2-CD1 4.46Å; Y194-L406 HydrophobicContact CD1-CD1 4.35Å; Y194-L406 HydrophobicContact CD1-CD2 4.4Å; Y194-L406 HydrophobicContact CD2-CD2 4.17Å; Y194-L406 HydrophobicContact CE1-CD1 3.49Å; Y194-L406 VanDerWaalsContact CE1-CD1 3.49Å; Y194-L406 HydrophobicContact CE1-CD2 3.88Å; Y194-L406 HydrophobicContact CE1-CG 4.34Å; Y194-L406 HydrophobicContact CE2-CD2 3.61Å; Y194-L406 VanDerWaalsContact CZ-CD2 3.46Å; Y362-L406 VanDerWaalsContact CE1-O 3.32Å; Y362-L406 WeakPolarHBondContact CE1-O 3.44Å; Y362-L406 PolarHBondContact OH-O 2.79Å; L406-L432 HydrophobicContact CB-CB 3.87Å; L406-L432 HydrophobicContact CB-CD2 4.29Å; L406-L432 HydrophobicContact CD2-CB 4.22Å; L406-L432 PolarHBondContact N-O 3.48Å
407	D	97.5	Very high	95.9	Very high	36 Å²	36	53.4 Å²	53.4	19%	0.193	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-61.8	165.9	-177.3	71.6	-11.8	0	0	0	113.3	R132 D133 V135	R132-D407 WeakPolarHBondContact CA-OD1 3.46Å; R132-D407 WeakPolarHBondContact CB-OD1 3.49Å; R132-D407 PolarHBondContact NE-O 3.39Å; R132-D407 PolarHBondContact NH2-O 3.21Å; D133-D407 PolarHBondContact N-OD1 2.98Å; D133-D407 PolarHBondContact O-N 3.26Å; V135-D407 HydrophobicContact CG1-CB 4.21Å; V135-D407 HydrophobicContact CG2-CB 4.38Å
408	I	97.7	Very high	96.1	Very high	33 Å²	33	50.2 Å²	50.2	17%	0.169	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-97.3	127.4	176.5	-59.6	-62.1	0	0	0	107.6	Y362 L365 P373 Y375 L429 L431	Y362-I408 HydrophobicContact CD1-CD1 4.14Å; Y362-I408 HydrophobicContact CD1-CG1 4.45Å; Y362-I408 HydrophobicContact CE1-CD1 3.78Å; Y362-I408 HydrophobicContact CE1-CG1 4.31Å; L365-I408 HydrophobicContact CD1-CG1 4.08Å; P373-I408 HydrophobicContact CB-CG1 4Å; Y375-I408 HydrophobicContact CD1-CG2 4.33Å; Y375-I408 HydrophobicContact CE1-CG2 3.75Å; Y375-I408 HydrophobicContact CE2-CG2 4.1Å; I408-L429 HydrophobicContact CD1-CD1 4.36Å; I408-L429 HydrophobicContact CG2-CD1 3.9Å; I408-L431 HydrophobicContact CD1-CD2 3.95Å
409	P	97.1	Very high	96.3	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.026	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-51.3	152.2	174.7	-27	34.9	0	0	0	112.3	P130 R132 Y375 Q413 I414 L429	P130-P409 HydrophobicContact CB-CB 4.46Å; P130-P409 HydrophobicContact CB-CG 4.28Å; R132-P409 HydrophobicContact CG-CG 3.87Å; Y375-P409 PolarHBondContact OH-O 3.29Å; P409-Q413 HydrophobicContact CB-CB 4.05Å; P409-I414 HydrophobicContact CB-CD1 3.86Å; P409-I414 HydrophobicContact CB-CG1 4.05Å; P409-I414 HydrophobicContact CG-CD1 4.22Å; P409-L429 HydrophobicContact CG-CD1 4.36Å; P409-L429 HydrophobicContact CG-CD2 4.12Å
410	T	96.4	Very high	96.5	Very high	73 Å²	73	38.3 Å²	38.3	45%	0.448	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-76.8	161.1	169.4	61.1	0	0	0	0	110.6	Q412 Q413 I414	T410-Q412 PolarHBondContact O-N 2.8Å; T410-Q412 VanDerWaalsContact O-N 3.16Å; T410-Q413 PolarHBondContact O-N 2.83Å; T410-Q413 WeakPolarHBondContact OG1-CG 3.18Å; T410-Q413 PolarHBondContact OG1-N 3.36Å; T410-Q413 PolarHBondContact OG1-OE1 3Å; T410-I414 WeakPolarHBondContact O-CG1 3.34Å; T410-I414 PolarHBondContact O-N 2.87Å
411	E	95.3	Very high	96.6	Very high	105 Å²	105	38.9 Å²	38.9	49%	0.491	20%	0.204	S	C	.	.	H	α-helix	trans	-52.2	-37.2	171.9	179.7	174.9	-175	0	0	112.4	W378 I414 G415 R418	W378-E411 HydrophobicContact CH2-CB 3.71Å; W378-E411 HydrophobicContact CH2-CG 3.46Å; W378-E411 VanDerWaalsContact CH2-CG 3.46Å; W378-E411 HydrophobicContact CZ2-CG 4.25Å; W378-E411 HydrophobicContact CZ3-CB 3.85Å; W378-E411 HydrophobicContact CZ3-CG 4Å; E411-I414 PolarHBondContact O-N 3.23Å; E411-G415 PolarHBondContact O-N 3.27Å; E411-R418 IonicContact OE1-CZ 3.75Å; E411-R418 IonicContact OE1-NH1 2.82Å; E411-R418 PolarHBondContact OE1-NH1 2.94Å; E411-R418 IonicContact OE1-NH2 3.98Å; E411-R418 PolarHBondContact OE1-NH2 3.14Å
412	Q	95	Very high	96.6	Very high	183 Å²	183	40.1 Å²	40.1	86%	0.855	21%	0.21	S	C	*	.	H	α-helix	trans	-66	-38.4	178.5	-66.2	177.8	-0.6	0	0	112.2	T410 G415	T410-Q412 PolarHBondContact O-N 2.8Å; T410-Q412 VanDerWaalsContact O-N 3.16Å; Q412-G415 PolarHBondContact O-N 2.94Å
413	Q	95.3	Very high	96.5	Very high	79 Å²	79	42 Å²	42	37%	0.369	22%	0.219	S	C	.	.	H	α-helix	trans	-72.7	-33.3	176.5	-72.5	166.6	-59.8	0	0	112.4	P130 Q131 P409 T410	P130-Q413 HydrophobicContact CB-CB 4.41Å; Q131-Q413 PolarHBondContact O-NE2 3.11Å; P409-Q413 HydrophobicContact CB-CB 4.05Å; T410-Q413 PolarHBondContact O-N 2.83Å; T410-Q413 WeakPolarHBondContact OG1-CG 3.18Å; T410-Q413 PolarHBondContact OG1-N 3.36Å; T410-Q413 PolarHBondContact OG1-OE1 3Å
414	I	96.4	Very high	96.6	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-68.9	-36.7	172.8	-66.6	-62.9	0	0	0	111.4	Y375 W378 P409 T410 E411 R418 L419 L429	Y375-I414 HydrophobicContact CE2-CD1 4.37Å; Y375-I414 HydrophobicContact CE2-CG1 4.27Å; Y375-I414 WeakPolarHBondContact OH-CG1 3.48Å; W378-I414 HydrophobicContact CE3-CG2 4.43Å; P409-I414 HydrophobicContact CB-CD1 3.86Å; P409-I414 HydrophobicContact CB-CG1 4.05Å; P409-I414 HydrophobicContact CG-CD1 4.22Å; T410-I414 WeakPolarHBondContact O-CG1 3.34Å; T410-I414 PolarHBondContact O-N 2.87Å; E411-I414 PolarHBondContact O-N 3.23Å; I414-R418 HydrophobicContact CG2-CB 4.41Å; I414-L419 HydrophobicContact CD1-CD1 4.2Å; I414-L419 HydrophobicContact CD1-CD2 4.01Å; I414-L419 HydrophobicContact CD1-CG 4.26Å; I414-L419 HydrophobicContact CG2-CD2 4.4Å; I414-L419 HydrophobicContact CG2-CG 4.37Å; I414-L429 HydrophobicContact CD1-CD2 4.1Å
415	G	95.5	Very high	96.7	Very high	16 Å²	16	40.3 Å²	40.3	17%	0.165	21%	0.209	C	C	.	.			trans	82.4	172.6	-177.5	0	0	0	0	0	113.6	E411 Q412 D417 R418	E411-G415 PolarHBondContact O-N 3.27Å; Q412-G415 PolarHBondContact O-N 2.94Å; G415-D417 PolarHBondContact O-N 2.66Å; G415-R418 WeakPolarHBondContact O-CD 3.38Å; G415-R418 PolarHBondContact O-N 3.13Å; G415-R418 PolarHBondContact O-NH1 3.34Å
416	P	96.3	Very high	96.7	Very high	101 Å²	101	40.3 Å²	40.3	66%	0.656	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-24.9	-170.1	29.4	-36.1	0	0	0	113.9	R418	P416-R418 VanDerWaalsContact C-N 3.31Å
417	D	96.8	Very high	96.7	Very high	63 Å²	63	40.4 Å²	40.4	34%	0.337	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-4.6	-177.8	-67	-39.9	0	0	0	113.3	R172 G415	R172-D417 HydrophobicContact CB-CB 4.04Å; R172-D417 IonicContact CZ-OD1 2.8Å; R172-D417 IonicContact NE-OD1 3.15Å; R172-D417 PolarHBondContact NE-OD1 2.75Å; R172-D417 IonicContact NH2-OD1 2.79Å; R172-D417 PolarHBondContact NH2-OD1 2.8Å; G415-D417 PolarHBondContact O-N 2.66Å
418	R	97.8	Very high	96.8	Very high	23 Å²	23	38.9 Å²	38.9	9%	0.087	20%	0.201	C	C	.	.			trans	59.6	-152.4	178.7	-41.9	-53	-177	-162.4	11.3	111.5	W378 I380 E385 E411 I414 G415 P416	W378-R418 HydrophobicContact CG-CB 4.26Å; W378-R418 HydrophobicContact CG-CG 4.22Å; W378-R418 VanDerWaalsContact CZ2-CZ 3.46Å; W378-R418 WeakPolarHBondContact O-CB 3.49Å; I380-R418 HydrophobicContact CD1-CG 3.69Å; I380-R418 HydrophobicContact CG1-CB 4.37Å; I380-R418 HydrophobicContact CG1-CG 3.8Å; E385-R418 IonicContact OE1-CZ 3.27Å; E385-R418 IonicContact OE1-NE 3.29Å; E385-R418 PolarHBondContact OE1-NE 3.36Å; E385-R418 IonicContact OE1-NH2 3.79Å; E385-R418 PolarHBondContact OE1-NH2 3.19Å; E385-R418 VanDerWaalsContact OE1-NH2 3.15Å; E411-R418 IonicContact OE1-CZ 3.75Å; E411-R418 IonicContact OE1-NH1 2.82Å; E411-R418 PolarHBondContact OE1-NH1 2.94Å; E411-R418 IonicContact OE1-NH2 3.98Å; E411-R418 PolarHBondContact OE1-NH2 3.14Å; I414-R418 HydrophobicContact CG2-CB 4.41Å; G415-R418 WeakPolarHBondContact O-CD 3.38Å; G415-R418 PolarHBondContact O-N 3.13Å; G415-R418 PolarHBondContact O-NH1 3.34Å; P416-R418 VanDerWaalsContact C-N 3.31Å
419	L	98.1	Very high	96.8	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.01	19%	0.193	C	C	.	.	S	Bend	trans	-109.6	152.3	-176.6	-52	176.6	0	0	0	111.4	W378 K379 I414 Y424 S426 L429	W378-L419 WeakPolarHBondContact O-CA 3.33Å; W378-L419 VanDerWaalsContact O-CB 3.24Å; W378-L419 WeakPolarHBondContact O-CB 3.49Å; W378-L419 PolarHBondContact O-N 3.22Å; K379-L419 WeakPolarHBondContact CA-O 3.34Å; K379-L419 WeakPolarHBondContact CB-O 3.47Å; I414-L419 HydrophobicContact CD1-CD1 4.2Å; I414-L419 HydrophobicContact CD1-CD2 4.01Å; I414-L419 HydrophobicContact CD1-CG 4.26Å; I414-L419 HydrophobicContact CG2-CD2 4.4Å; I414-L419 HydrophobicContact CG2-CG 4.37Å; L419-Y424 HydrophobicContact CD1-CD1 4.21Å; L419-Y424 HydrophobicContact CD2-CD1 3.98Å; L419-Y424 HydrophobicContact CD2-CG 4.11Å; L419-S426 WeakPolarHBondContact CB-O 3.15Å; L419-L429 HydrophobicContact CD1-CD2 3.86Å; L419-L429 HydrophobicContact CD1-CG 4.06Å
420	P	97.9	Very high	96.9	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.013	19%	0.192	C	C	.	.	S	Bend	cis	-74.5	168.7	-9.7	32.1	-30.3	0	0	0	111.6	L159 F170 C173 L178	L159-P420 HydrophobicContact CD2-CG 4.1Å; F170-P420 VanDerWaalsContact CD1-CD 3.45Å; F170-P420 HydrophobicContact CD1-CG 4.38Å; F170-P420 HydrophobicContact CD2-CG 3.89Å; F170-P420 HydrophobicContact CE1-CG 4.49Å; F170-P420 HydrophobicContact CE2-CG 4Å; F170-P420 HydrophobicContact CG-CG 4.07Å; F170-P420 HydrophobicContact CZ-CG 4.31Å; C173-P420 HydrophobicContact CB-CG 4.29Å; C173-P420 WeakPolarHBondContact CB-O 3.25Å; C173-P420 PolarHBondContact SG-O 3.13Å; L178-P420 HydrophobicContact CD2-CB 4.46Å; L178-P420 HydrophobicContact CD2-CG 3.55Å
421	S	96.7	Very high	97	Very high	12 Å²	12	33.7 Å²	33.7	8%	0.084	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-151.4	-179.3	-175.7	78.5	0	0	0	0	111.5	H423 Y424	S421-H423 PolarHBondContact O-N 3.33Å; S421-H423 VanDerWaalsContact O-N 3.14Å; S421-H423 PolarHBondContact OG-CD2 3.22Å; S421-H423 PolarHBondContact OG-CE1 3.01Å; S421-H423 VanDerWaalsContact OG-CG 3.26Å; S421-H423 PolarHBondContact OG-N 3.01Å; S421-H423 PolarHBondContact OG-ND1 3.42Å; S421-H423 PolarHBondContact OG-NE2 3.33Å; S421-Y424 PolarHBondContact N-O 3.12Å; S421-Y424 PolarHBondContact O-N 3.1Å; S421-Y424 PolarHBondContact OG-N 3.23Å
422	Y	95.6	Very high	97.2	Very high	66 Å²	66	28.7 Å²	28.7	26%	0.259	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.8	173.8	-78.8	-58.2	0	0	0	114.8	R126 P174 E176 A177	R126-Y422 VanDerWaalsContact CZ-CE1 3.42Å; P174-Y422 HydrophobicContact CB-CE1 4.37Å; P174-Y422 HydrophobicContact CB-CE2 3.76Å; P174-Y422 HydrophobicContact CG-CD2 4.05Å; P174-Y422 HydrophobicContact CG-CE2 3.5Å; P174-Y422 VanDerWaalsContact CG-CE2 3.5Å; E176-Y422 HydrophobicContact CB-CE1 4.09Å; E176-Y422 PolarHBondContact OE2-OH 2.78Å; A177-Y422 HydrophobicContact CB-CD1 3.64Å; A177-Y422 HydrophobicContact CB-CE1 3.86Å; A177-Y422 HydrophobicContact CB-CG 4.12Å
423	H	92.5	Very high	97.3	Very high	41 Å²	41	20 Å²	20	19%	0.19	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	2.9	-177.2	59.4	-105.3	0	0	0	112.8	P127 A128 R129 S421	P127-H423 HydrophobicContact CB-CB 4.17Å; P127-H423 WeakPolarHBondContact O-CB 3.48Å; A128-H423 WeakPolarHBondContact O-CB 3.4Å; R129-H423 WeakPolarHBondContact CA-O 3.46Å; R129-H423 WeakPolarHBondContact CB-O 3.48Å; S421-H423 PolarHBondContact O-N 3.33Å; S421-H423 VanDerWaalsContact O-N 3.14Å; S421-H423 PolarHBondContact OG-CD2 3.22Å; S421-H423 PolarHBondContact OG-CE1 3.01Å; S421-H423 VanDerWaalsContact OG-CG 3.26Å; S421-H423 PolarHBondContact OG-N 3.01Å; S421-H423 PolarHBondContact OG-ND1 3.42Å; S421-H423 PolarHBondContact OG-NE2 3.33Å
424	Y	97.7	Very high	97.4	Very high	3 Å²	3	16.9 Å²	16.9	1%	0.012	9%	0.093	C	C	.	.	B	Isolated β-bridge	trans	-151.5	127.3	175.7	-148.6	-102.4	0	0	0	112.2	W156 Q186 E190 L419 S421 S426 H428 L429 A430	W156-Y424 AromaticContact CZ2-CE1 3.9Å; W156-Y424 HydrophobicContact CZ2-CE1 3.9Å; W156-Y424 AromaticContact CZ2-CZ 3.84Å; Q186-Y424 VanDerWaalsContact OE1-N 3.09Å; E190-Y424 PolarHBondContact OE1-OH 3.27Å; E190-Y424 VanDerWaalsContact OE1-OH 3.1Å; L419-Y424 HydrophobicContact CD1-CD1 4.21Å; L419-Y424 HydrophobicContact CD2-CD1 3.98Å; L419-Y424 HydrophobicContact CD2-CG 4.11Å; S421-Y424 PolarHBondContact N-O 3.12Å; S421-Y424 PolarHBondContact O-N 3.1Å; S421-Y424 PolarHBondContact OG-N 3.23Å; Y424-S426 WeakPolarHBondContact CD1-O 3.41Å; Y424-S426 PolarHBondContact O-N 3.39Å; Y424-H428 WeakPolarHBondContact CE1-O 3.48Å; Y424-L429 HydrophobicContact CD1-CD2 4.48Å; Y424-L429 HydrophobicContact CE1-CD2 3.94Å; Y424-A430 WeakPolarHBondContact OH-CB 3.39Å; Y424-A430 PolarHBondContact OH-N 3.1Å
425	P	98	Very high	97.5	Very high	3 Å²	3	16.9 Å²	16.9	2%	0.019	9%	0.093	C	C	.	.	S	Bend	trans	-89.3	-2.6	-165	34.7	-36.5	0	0	0	114.6	W156 R183 Q186 I187	W156-P425 HydrophobicContact CH2-CG 3.63Å; W156-P425 HydrophobicContact CZ2-CG 3.82Å; R183-P425 HydrophobicContact CB-CB 4.2Å; R183-P425 HydrophobicContact CG-CB 4.24Å; R183-P425 PolarHBondContact NE-O 3.23Å; R183-P425 PolarHBondContact NH2-O 3.32Å; Q186-P425 HydrophobicContact CB-CB 3.73Å; Q186-P425 HydrophobicContact CB-CG 3.67Å; I187-P425 HydrophobicContact CD1-CB 4.44Å; I187-P425 HydrophobicContact CG1-CB 3.85Å; I187-P425 HydrophobicContact CG1-CG 3.62Å
426	S	98.6	Very high	97.4	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.087	C	C	.	.	S	Bend	trans	-134	154.8	-176.7	177.3	0	0	0	0	110.1	N157 L419 Y424 H428	N157-S426 PolarHBondContact O-OG 3.08Å; L419-S426 WeakPolarHBondContact CB-O 3.15Å; Y424-S426 WeakPolarHBondContact CD1-O 3.41Å; Y424-S426 PolarHBondContact O-N 3.39Å; S426-H428 WeakPolarHBondContact CB-O 3.34Å; S426-H428 PolarHBondContact OG-N 3.15Å; S426-H428 PolarHBondContact OG-O 2.93Å
427	D	98.5	Very high	97.3	Very high	2 Å²	2	11.7 Å²	11.7	1%	0.011	6%	0.056	C	C	.	.	S	Bend	trans	-78.3	-4.7	169.1	60.2	-34.5	0	0	0	113.6	F170 S377 W378 K379 R381	F170-D427 HydrophobicContact CE1-CB 3.68Å; F170-D427 HydrophobicContact CZ-CB 3.89Å; S377-D427 VanDerWaalsContact CA-O 3.24Å; S377-D427 WeakPolarHBondContact CA-O 3.48Å; S377-D427 WeakPolarHBondContact CB-O 3.37Å; S377-D427 PolarHBondContact OG-O 3.46Å; W378-D427 PolarHBondContact N-O 2.52Å; K379-D427 HydrophobicContact CB-CB 4.07Å; K379-D427 HydrophobicContact CD-CB 3.66Å; K379-D427 WeakPolarHBondContact CD-OD2 3.46Å; K379-D427 VanDerWaalsContact CE-OD2 3.27Å; K379-D427 WeakPolarHBondContact CE-OD2 3.24Å; K379-D427 IonicContact NZ-OD2 3.38Å; K379-D427 PolarHBondContact NZ-OD2 2.95Å; R381-D427 IonicContact NH2-OD2 2.72Å; R381-D427 PolarHBondContact NH2-OD2 3.49Å; R381-D427 VanDerWaalsContact NH2-OD2 3.1Å
428	H	98.8	Very high	97	Very high	3 Å²	3	13.4 Å²	13.4	1%	0.014	6%	0.058	C	C	.	.	B	Isolated β-bridge	trans	-113.4	140.2	173	-69.2	-117.4	0	0	0	110.3	W156 N157 D338 T376 S377 K379 D391 Y424 S426	W156-H428 PolarHBondContact NE1-O 3.16Å; N157-H428 HydrophobicContact CB-CB 3.98Å; D338-H428 IonicContact OD2-CE1 3.8Å; D338-H428 PolarHBondContact OD2-CE1 3.1Å; D338-H428 VanDerWaalsContact OD2-CE1 3.27Å; D338-H428 IonicContact OD2-ND1 3.54Å; D338-H428 IonicContact OD2-NE2 2.64Å; T376-H428 CarbonylContact O-C 3.41Å; T376-H428 WeakPolarHBondContact O-CA 3.49Å; S377-H428 PolarHBondContact OG-NE2 3.04Å; K379-H428 PolarHBondContact NZ-NE2 2.83Å; K379-H428 VanDerWaalsContact NZ-NE2 3.13Å; D391-H428 IonicContact OD1-ND1 3.73Å; D391-H428 PolarHBondContact OD1-ND1 3.2Å; D391-H428 IonicContact OD2-CE1 3.3Å; D391-H428 IonicContact OD2-CG 2.87Å; D391-H428 IonicContact OD2-ND1 4Å; D391-H428 PolarHBondContact OD2-ND1 2.87Å; Y424-H428 WeakPolarHBondContact CE1-O 3.48Å; S426-H428 WeakPolarHBondContact CB-O 3.34Å; S426-H428 PolarHBondContact OG-N 3.15Å; S426-H428 PolarHBondContact OG-O 2.93Å
429	L	98.7	Very high	96.1	Very high	1 Å²	1	18 Å²	18	1%	0.005	8%	0.08	C	C	.	.	P	Polyproline II helix	trans	-78.5	138.6	173.1	-67.9	172.7	0	0	0	110.9	Y375 T376 I408 P409 I414 L419 Y424 L431	Y375-L429 HydrophobicContact CD2-CD1 4.03Å; Y375-L429 HydrophobicContact CE2-CD1 3.45Å; Y375-L429 VanDerWaalsContact CE2-CD1 3.45Å; Y375-L429 HydrophobicContact CE2-CG 4.44Å; T376-L429 PolarHBondContact O-N 3.02Å; I408-L429 HydrophobicContact CD1-CD1 4.36Å; I408-L429 HydrophobicContact CG2-CD1 3.9Å; P409-L429 HydrophobicContact CG-CD1 4.36Å; P409-L429 HydrophobicContact CG-CD2 4.12Å; I414-L429 HydrophobicContact CD1-CD2 4.1Å; L419-L429 HydrophobicContact CD1-CD2 3.86Å; L419-L429 HydrophobicContact CD1-CG 4.06Å; Y424-L429 HydrophobicContact CD1-CD2 4.48Å; Y424-L429 HydrophobicContact CE1-CD2 3.94Å; L429-L431 PolarHBondContact O-N 3.48Å
430	A	98.6	Very high	94.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	11%	0.112	C	C	.	.	P	Polyproline II helix	trans	-64	126.2	170.4	0	0	0	0	0	110.2	R132 L154 W156 E190 Y424	R132-A430 VanDerWaalsContact CZ-O 3.27Å; R132-A430 PolarHBondContact NH1-O 3.39Å; R132-A430 PolarHBondContact NH2-O 3.47Å; L154-A430 HydrophobicContact CD1-CB 3.96Å; W156-A430 HydrophobicContact CB-CB 4.26Å; W156-A430 VanDerWaalsContact CD1-CA 3.48Å; W156-A430 HydrophobicContact CD2-CB 3.72Å; W156-A430 HydrophobicContact CE3-CB 4.24Å; W156-A430 HydrophobicContact CG-CB 3.73Å; E190-A430 HydrophobicContact CG-CB 4.17Å; Y424-A430 WeakPolarHBondContact OH-CB 3.39Å; Y424-A430 PolarHBondContact OH-N 3.1Å
431	L	98.9	Very high	92.1	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	136.5	172	-58.7	-168.3	0	0	0	109.1	L154 Q155 Y362 T376 D391 I393 I408 L429	L154-L431 CarbonylContact C-O 3.53Å; L154-L431 WeakPolarHBondContact CA-O 3.41Å; Q155-L431 HydrophobicContact CB-CB 4.23Å; Q155-L431 HydrophobicContact CG-CB 4.36Å; Q155-L431 PolarHBondContact N-O 2.89Å; Q155-L431 PolarHBondContact O-N 3.46Å; Y362-L431 HydrophobicContact CD1-CD2 4.08Å; Y362-L431 HydrophobicContact CD2-CB 4.3Å; Y362-L431 HydrophobicContact CD2-CD1 4.14Å; Y362-L431 HydrophobicContact CE1-CD2 3.68Å; Y362-L431 HydrophobicContact CE2-CB 3.62Å; Y362-L431 HydrophobicContact CE2-CD1 4.27Å; Y362-L431 HydrophobicContact CE2-CD2 4.19Å; Y362-L431 HydrophobicContact CE2-CG 4.24Å; Y362-L431 HydrophobicContact CG-CD1 4.39Å; Y362-L431 WeakPolarHBondContact OH-CA 3.17Å; T376-L431 HydrophobicContact CG2-CD1 4.17Å; T376-L431 HydrophobicContact CG2-CD2 4.05Å; D391-L431 HydrophobicContact CB-CD1 3.68Å; D391-L431 HydrophobicContact CB-CG 4.22Å; D391-L431 WeakPolarHBondContact O-CD1 3.34Å; I393-L431 HydrophobicContact CD1-CB 3.92Å; I393-L431 HydrophobicContact CG1-CB 4.26Å; I408-L431 HydrophobicContact CD1-CD2 3.95Å; L429-L431 PolarHBondContact O-N 3.48Å
432	L	98.7	Very high	89.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	135	179.5	-178.6	148.9	0	0	0	111.2	L134 R152 V153 L154 Y194 Y362 L405 L406	L134-L432 HydrophobicContact CD2-CD2 3.55Å; R152-L432 HydrophobicContact CG-CD1 3.86Å; R152-L432 HydrophobicContact CG-CD2 3.99Å; R152-L432 HydrophobicContact CG-CG 3.97Å; V153-L432 VanDerWaalsContact O-CA 3.27Å; V153-L432 WeakPolarHBondContact O-CA 3.38Å; L154-L432 HydrophobicContact CD1-CB 4.06Å; L154-L432 HydrophobicContact CD1-CD1 3.97Å; Y194-L432 VanDerWaalsContact CB-CD1 3.47Å; Y194-L432 HydrophobicContact CD1-CD1 4.41Å; Y194-L432 HydrophobicContact CD2-CD1 4.48Å; Y194-L432 HydrophobicContact CG-CD1 3.89Å; Y362-L432 PolarHBondContact OH-N 3.46Å; Y362-L432 PolarHBondContact OH-O 2.86Å; Y362-L432 VanDerWaalsContact OH-O 3.06Å; L405-L432 WeakPolarHBondContact CA-O 3.39Å; L406-L432 HydrophobicContact CB-CB 3.87Å; L406-L432 HydrophobicContact CB-CD2 4.29Å; L406-L432 HydrophobicContact CD2-CB 4.22Å; L406-L432 PolarHBondContact N-O 3.48Å
433	C	98.1	Very high	86.9	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.007	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	145.6	171.5	69.4	0	0	0	0	111.5	V153 I393 V402 A404 L405	V153-C433 PolarHBondContact N-O 2.99Å; V153-C433 PolarHBondContact O-N 2.92Å; I393-C433 HydrophobicContact CD1-CB 4.44Å; V402-C433 HydrophobicContact CG1-CB 4.42Å; A404-C433 CarbonylContact O-C 3.43Å; A404-C433 VanDerWaalsContact O-CA 3.28Å; A404-C433 WeakPolarHBondContact O-CA 3.34Å; L405-C433 HydrophobicContact CD2-CB 3.55Å; L405-C433 HydrophobicContact CG-CB 4.49Å
434	D	98.3	Very high	84.2	Confident	13 Å²	13	51.6 Å²	51.6	7%	0.07	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	125.2	162.9	-70.7	-22.3	0	0	0	107.3	R152 E403 A404	R152-D434 VanDerWaalsContact CB-OD1 3.23Å; R152-D434 WeakPolarHBondContact CB-OD1 3.43Å; R152-D434 VanDerWaalsContact CG-OD1 3.26Å; R152-D434 WeakPolarHBondContact CG-OD1 3.16Å; R152-D434 IonicContact CZ-OD1 3.56Å; R152-D434 IonicContact CZ-OD2 3.57Å; R152-D434 IonicContact NE-OD1 2.83Å; R152-D434 PolarHBondContact NE-OD1 3.33Å; R152-D434 IonicContact NE-OD2 3.66Å; R152-D434 IonicContact NH2-OD1 2.71Å; R152-D434 PolarHBondContact NH2-OD1 2.93Å; R152-D434 IonicContact NH2-OD2 3.87Å; R152-D434 PolarHBondContact NH2-OD2 3.43Å; E403-D434 HydrophobicContact CB-CB 4.29Å; E403-D434 PolarHBondContact N-O 2.99Å; A404-D434 HydrophobicContact CB-CB 4.15Å; A404-D434 PolarHBondContact N-O 3.01Å; A404-D434 PolarHBondContact O-N 3.37Å
435	I	96.9	Very high	81.2	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	155.1	175.8	62.5	173.5	0	0	0	111.1	S150 I151 V153 L288 V334 L400 R401 V402	S150-I435 CarbonylContact C-O 3.5Å; S150-I435 VanDerWaalsContact CA-O 3.29Å; S150-I435 WeakPolarHBondContact CA-O 3.27Å; I151-I435 HydrophobicContact CB-CG1 3.95Å; I151-I435 HydrophobicContact CG2-CG1 4.38Å; I151-I435 PolarHBondContact N-O 3.41Å; I151-I435 WeakPolarHBondContact O-CG1 3.4Å; I151-I435 PolarHBondContact O-N 2.93Å; V153-I435 HydrophobicContact CG2-CD1 4.1Å; V153-I435 HydrophobicContact CG2-CG1 4.34Å; L288-I435 HydrophobicContact CD2-CD1 4.45Å; V334-I435 HydrophobicContact CG2-CD1 3.44Å; V334-I435 VanDerWaalsContact CG2-CD1 3.44Å; L400-I435 HydrophobicContact CD1-CD1 4.25Å; R401-I435 CarbonylContact O-C 3.56Å; R401-I435 WeakPolarHBondContact O-CA 3.47Å; R401-I435 WeakPolarHBondContact O-CB 3.44Å; V402-I435 HydrophobicContact CG2-CG2 4.22Å
436	S	95.1	Very high	80.3	Confident	6 Å²	6	65.6 Å²	65.6	4%	0.042	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	156.5	171.2	74.6	0	0	0	0	109.4	L400 R401 E403	L400-S436 CarbonylContact C-O 3.56Å; L400-S436 WeakPolarHBondContact CA-O 3.41Å; R401-S436 PolarHBondContact N-O 2.92Å; R401-S436 PolarHBondContact O-N 3.16Å; E403-S436 WeakPolarHBondContact OE1-CB 3.44Å; E403-S436 PolarHBondContact OE1-OG 3.2Å
437	F	93.5	Very high	79.4	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.009	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	140.5	170.1	-64.3	-82	0	0	0	110.2	N148 I151 C281 R286 Q287 L288 P332 L400	N148-F437 PolarHBondContact ND2-O 2.75Å; I151-F437 HydrophobicContact CD1-CD2 4.42Å; I151-F437 HydrophobicContact CD1-CE2 3.76Å; I151-F437 HydrophobicContact CD1-CZ 4.21Å; C281-F437 HydrophobicContact CB-CE2 4.16Å; R286-F437 HydrophobicContact CB-CD1 4.45Å; R286-F437 HydrophobicContact CB-CD2 4.38Å; R286-F437 HydrophobicContact CB-CE1 4.01Å; R286-F437 HydrophobicContact CB-CE2 3.93Å; R286-F437 HydrophobicContact CB-CZ 3.72Å; R286-F437 VanDerWaalsContact CZ-CB 3.41Å; Q287-F437 WeakPolarHBondContact O-CE1 3.21Å; L288-F437 HydrophobicContact CB-CE1 4.39Å; L288-F437 HydrophobicContact CB-CZ 4.14Å; P332-F437 HydrophobicContact CG-CE1 4.42Å; L400-F437 HydrophobicContact CD2-CD1 3.52Å; L400-F437 HydrophobicContact CD2-CE1 3.91Å; L400-F437 HydrophobicContact CD2-CG 4.19Å
438	R	90.2	Very high	78.3	Confident	100 Å²	100	72.8 Å²	72.8	38%	0.377	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-70	141.5	168.3	-69.8	175.5	178.4	-96.6	6.7	109.6	R286 E397 R398 A399 L400 R401	R286-R438 PolarHBondContact NH1-O 2.9Å; E397-R438 PolarHBondContact O-NE 2.74Å; E397-R438 PolarHBondContact O-NH2 3.14Å; R398-R438 VanDerWaalsContact O-CD 3.26Å; R398-R438 WeakPolarHBondContact O-CD 3.41Å; A399-R438 PolarHBondContact O-N 3.22Å; L400-R438 PolarHBondContact O-NE 2.63Å; R401-R438 HydrophobicContact CB-CG 4.03Å
439	E	77.8	Confident	77.1	Confident	118 Å²	118	76.9 Å²	76.9	55%	0.551	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-64.3	134.3	170.9	-66.2	-174.1	158.4	0	0	109	H145	H145-E439 IonicContact CE1-OE1 3.68Å; H145-E439 PolarHBondContact CE1-OE1 3.41Å; H145-E439 IonicContact CE1-OE2 2.87Å; H145-E439 PolarHBondContact CE1-OE2 2.89Å; H145-E439 IonicContact CG-OE1 2.78Å; H145-E439 IonicContact ND1-OE1 3.81Å; H145-E439 PolarHBondContact ND1-OE1 3.41Å; H145-E439 IonicContact ND1-OE2 3.65Å
440	E	63.1	Low	75.8	Confident	144 Å²	144	81.6 Å²	81.6	67%	0.673	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-62.2	129.7	167	-71.4	-74.3	149.5	0	0	106.8	H442	E440-H442 PolarHBondContact O-N 2.8Å
441	P	49.1	Very low	74.2	Confident	112 Å²	112	87.1 Å²	87.1	73%	0.727	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-55.5	120	172.5	19.5	-25.7	0	0	0	106.8	R443	P441-R443 PolarHBondContact O-N 2.68Å
442	H	42.3	Very low	72.5	Confident	169 Å²	169	93.3 Å²	93.3	78%	0.782	45%	0.447	S	S	*	.			trans	-45.4	114.2	177.3	-70.4	-47.3	0	0	0	107.6	E440 L444	E440-H442 PolarHBondContact O-N 2.8Å; H442-L444 PolarHBondContact O-N 3.15Å
443	R	41.4	Very low	70.5	Confident	230 Å²	230	100.5 Å²	100.5	87%	0.868	48%	0.481	S	S	*	.			trans	-59.2	102.9	162.1	-78	-173.8	-178.7	175	1.2	103.9	P441 L445	P441-R443 PolarHBondContact O-N 2.68Å; R443-L445 PolarHBondContact O-N 2.79Å
444	L	35.6	Very low	68.1	Low	174 Å²	174	108.8 Å²	108.8	91%	0.911	52%	0.521	S	S	*	.			trans	-55.5	98.7	163.9	-72.5	163.3	0	0	0	104.6	H442	H442-L444 PolarHBondContact O-N 3.15Å
445	L	34.6	Very low	65.4	Low	235 Å²	235	117.5 Å²	117.5	100%	1.23	56%	0.562	S	S	*	*			trans	-72.5	0	171.5	-87.7	166.4	0	0	0	109	R443	R443-L445 PolarHBondContact O-N 2.79Å

Retrieved 445 of 445 residues in 165.8 ms (Link to these results)

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