A0A087XYX6_POEFO Loading...

Kinase

AlphaFold DB , UniProt , Accession A0A087XYX6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 415 aa.

Structure Viewer

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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	Q	35.9	Very low	41.6	Very low	239 Å²	239	163.4 Å²	163.4	100%	1.117	87%	0.87	S	S	*	*				0	144.3	0	-77.1	166.7	-19.3	0	0	108.1
2	T	40	Very low	41.7	Very low	139 Å²	139	159.6 Å²	159.6	85%	0.853	86%	0.861	S	S	*	*			trans	46.6	94.5	167.3	53	0	0	0	0	118.4
3	S	36.4	Very low	41.3	Very low	124 Å²	124	153.5 Å²	153.5	87%	0.867	86%	0.859	S	S	*	*			trans	-84.8	134.8	158.3	45.1	0	0	0	0	110.6
4	Q	45.1	Very low	41.3	Very low	194 Å²	194	152.4 Å²	152.4	91%	0.907	86%	0.858	S	S	*	*			trans	-91.8	143.4	176.8	-71.7	-179.1	-14.9	0	0	111.7
5	S	41.2	Very low	41.4	Very low	114 Å²	114	152.6 Å²	152.6	80%	0.797	85%	0.854	S	S	*	*			trans	-107.9	135.4	178.3	48.2	0	0	0	0	112.1
6	P	53.1	Low	41.2	Very low	122 Å²	122	150.5 Å²	150.5	79%	0.792	85%	0.849	S	S	*	*			trans	-90.1	156.6	166.8	34.8	-32.1	0	0	0	111.9
7	P	48	Very low	40.7	Very low	117 Å²	117	153.2 Å²	153.2	76%	0.76	85%	0.849	S	S	*	*			trans	-102.4	149.3	-169.3	37.2	-34.5	0	0	0	116.6
8	R	42.3	Very low	40.1	Very low	240 Å²	240	154.5 Å²	154.5	91%	0.906	85%	0.853	S	S	*	*			trans	54.7	123.7	148.3	-66.9	-175.6	176.9	-159.3	-0.8	120.9
9	Q	37.5	Very low	39.9	Very low	192 Å²	192	154 Å²	154	90%	0.897	85%	0.847	S	S	*	*			trans	-148.5	155	133.6	-108.4	169.1	28.3	0	0	110.8
10	S	37.9	Very low	39.7	Very low	109 Å²	109	154.2 Å²	154.2	76%	0.762	85%	0.845	S	S	*	*			trans	-104.6	144	-170.2	52.3	0	0	0	0	113.1
11	F	40.4	Very low	39.4	Very low	207 Å²	207	152.9 Å²	152.9	91%	0.908	84%	0.843	S	S	*	*			trans	-111.6	116.3	174	-70.8	-85.3	0	0	0	112.3
12	P	42.8	Very low	39.2	Very low	118 Å²	118	152.1 Å²	152.1	77%	0.766	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-95.5	119.3	154.6	32.3	-24.5	0	0	0	109.6
13	G	36.8	Very low	38.8	Very low	81 Å²	81	153.1 Å²	153.1	84%	0.835	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-84.4	138.4	179.3	0	0	0	0	0	113.1
14	T	40.1	Very low	38.5	Very low	137 Å²	137	153.1 Å²	153.1	84%	0.84	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-97.3	136.9	177.6	-57.1	0	0	0	0	111.5
15	I	43.2	Very low	38	Very low	156 Å²	156	149.1 Å²	149.1	80%	0.8	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-77.7	130.8	-178.1	-59	166.1	0	0	0	111.7
16	P	37.9	Very low	38	Very low	119 Å²	119	149.1 Å²	149.1	77%	0.773	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-85.1	139.4	163.6	-10.1	28.7	0	0	0	112.6
17	K	33.8	Very low	36.9	Very low	196 Å²	196	150.9 Å²	150.9	85%	0.852	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-76.7	143.1	177.4	-67.8	173.8	175.7	176.1	0	112
18	L	29.7	Very low	35.9	Very low	177 Å²	177	155 Å²	155	93%	0.927	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-83.5	136.9	164.1	-152.4	81.7	0	0	0	110.2
19	I	36.3	Very low	35.1	Very low	145 Å²	145	150 Å²	150	74%	0.744	82%	0.817	S	S	*	*			trans	-108	133.9	180	-65	173.1	0	0	0	108.8
20	I	35.7	Very low	34.7	Very low	157 Å²	157	147.4 Å²	147.4	81%	0.805	81%	0.805	S	S	*	*			trans	-86.8	129.2	173.9	-61.5	171	0	0	0	108.9
21	T	32.8	Very low	34.2	Very low	128 Å²	128	146.9 Å²	146.9	79%	0.785	80%	0.801	S	S	*	*			trans	-130.2	128.2	160.6	41.9	0	0	0	0	110.1
22	R	32.7	Very low	33.5	Very low	223 Å²	223	143.8 Å²	143.8	84%	0.842	80%	0.799	S	S	*	*			trans	-89.3	150.7	153.9	-70.2	175.5	166.1	156.2	-4.5	106.6
23	D	30.9	Very low	32.8	Very low	159 Å²	159	144.6 Å²	144.6	85%	0.85	80%	0.802	S	S	*	*				-168.5	168.1	123.6	-104	-21.2	0	0	0	115.8
24	T	31.1	Very low	32.4	Very low	125 Å²	125	145.5 Å²	145.5	77%	0.767	80%	0.802	S	S	*	*			trans	-45.6	156	-171.1	36.6	0	0	0	0	121.2
25	S	33	Very low	32	Very low	109 Å²	109	147 Å²	147	76%	0.762	80%	0.804	S	S	*	*			trans	-58.1	169.2	159.4	-37.6	0	0	0	0	112.6
26	P	41.8	Very low	31.9	Very low	115 Å²	115	145.1 Å²	145.1	75%	0.747	80%	0.802	S	S	*	*				-158.8	177.3	95.8	40	-19.1	0	0	0	118.6
27	I	30.5	Very low	31.5	Very low	158 Å²	158	145.3 Å²	145.3	81%	0.81	80%	0.801	S	S	*	*			trans	82.2	96	156.1	-40.6	-166.6	0	0	0	121.9
28	R	27.4	Very low	31.2	Very low	204 Å²	204	143.2 Å²	143.2	77%	0.77	80%	0.799	S	S	*	*			trans	-9.1	139.5	135.5	-170.3	-171.7	-149.4	178.6	7.3	120.4
29	C	24.8	Very low	31.3	Very low	134 Å²	134	143.1 Å²	143.1	91%	0.905	79%	0.794	S	S	*	*			trans	-142.6	162.6	141.3	-140.6	0	0	0	0	111.4
30	Q	29	Very low	30.9	Very low	139 Å²	139	142.6 Å²	142.6	65%	0.65	80%	0.797	S	S	*	*			trans	-109.1	149.7	-160	-66	174.8	-40.5	0	0	115.4
31	S	27.1	Very low	30.7	Very low	98 Å²	98	140.3 Å²	140.3	69%	0.685	80%	0.796	S	S	*	*			trans	45.7	124.8	142.9	62.9	0	0	0	0	121.4
32	T	26	Very low	30.5	Very low	142 Å²	142	139.4 Å²	139.4	87%	0.871	79%	0.793	S	S	*	*				-162.5	160.2	102.7	4.9	0	0	0	0	113.7
33	T	28.5	Very low	30.6	Very low	134 Å²	134	137.1 Å²	137.1	82%	0.822	80%	0.797	S	S	*	*			trans	-71.7	144.5	-179.1	40.1	0	0	0	0	115.2
34	A	28.1	Very low	30.3	Very low	101 Å²	101	136.1 Å²	136.1	84%	0.835	79%	0.791	S	S	*	*				-169.2	132.8	129.3	0	0	0	0	0	112.7
35	L	31.9	Very low	30.5	Very low	168 Å²	168	138.7 Å²	138.7	88%	0.88	80%	0.799	S	S	*	*			trans	-93.6	149.8	150.7	-93.1	159.1	0	0	0	106.7
36	P	40.1	Very low	30.1	Very low	116 Å²	116	140.5 Å²	140.5	75%	0.753	80%	0.796	S	S	*	*				-142.9	167.5	89.7	37.1	-21	0	0	0	116
37	T	30.5	Very low	29.9	Very low	123 Å²	123	140 Å²	140	76%	0.755	80%	0.801	S	S	*	*			trans	-42.4	143.6	163.1	-4.6	0	0	0	0	114
38	D	27.4	Very low	29.8	Very low	152 Å²	152	139.4 Å²	139.4	81%	0.813	80%	0.795	S	S	*	*				-161.3	168.9	99.8	-134.9	-23.1	0	0	0	113.8
39	Q	32	Very low	29.9	Very low	176 Å²	176	137.8 Å²	137.8	82%	0.822	80%	0.801	S	S	*	*			trans	-86.4	132.5	-177.5	-58.2	172.8	4.2	0	0	112.8
40	T	27.7	Very low	30.1	Very low	133 Å²	133	138 Å²	138	82%	0.816	79%	0.789	S	S	*	*			trans	-143.6	133.8	152.6	-34.7	0	0	0	0	111.4
41	S	32.2	Very low	30.1	Very low	110 Å²	110	135.1 Å²	135.1	77%	0.769	79%	0.785	S	S	*	*			trans	-73.6	128.2	173.8	53.9	0	0	0	0	112.4
42	C	27.6	Very low	30.2	Very low	108 Å²	108	136.3 Å²	136.3	73%	0.73	79%	0.79	S	S	*	*			trans	-128.5	118.4	159.7	-73.6	0	0	0	0	109.4	D44	C42-D44 PolarHBondContact O-N 3.41Å
43	L	35.7	Very low	30.3	Very low	175 Å²	175	132.8 Å²	132.8	92%	0.916	77%	0.77	S	S	*	*			trans	-80.2	85.5	168.4	-75.7	163.4	0	0	0	108.3	L45	L43-L45 PolarHBondContact O-N 3.29Å
44	D	24.8	Very low	30.5	Very low	139 Å²	139	130.7 Å²	130.7	74%	0.743	76%	0.761	S	S	*	*			trans	-87.7	106.8	168.5	-87.1	-43.5	0	0	0	110.4	C42 Q46	C42-D44 PolarHBondContact O-N 3.41Å; D44-Q46 PolarHBondContact O-N 2.71Å
45	L	34.3	Very low	30.5	Very low	178 Å²	178	130.1 Å²	130.1	93%	0.932	74%	0.744	S	S	*	*			trans	-74.8	75.2	167.8	-74.4	166.2	0	0	0	109.3	L43 A47	L43-L45 PolarHBondContact O-N 3.29Å; L45-A47 PolarHBondContact O-N 3.11Å
46	Q	25.5	Very low	30.6	Very low	148 Å²	148	122.6 Å²	122.6	69%	0.692	71%	0.705	S	S	*	*			trans	-71.9	108.7	166.5	-82.1	-163.1	-86.9	0	0	110	D44 E48	D44-Q46 PolarHBondContact O-N 2.71Å; Q46-E48 HydrophobicContact CB-CG 3.99Å; Q46-E48 PolarHBondContact NE2-OE1 3.22Å; Q46-E48 VanDerWaalsContact NE2-OE1 3.13Å; Q46-E48 PolarHBondContact O-N 2.93Å
47	A	36.7	Very low	30.2	Very low	103 Å²	103	119.3 Å²	119.3	85%	0.851	69%	0.692	S	S	*	*			trans	-81	96	161.7	0	0	0	0	0	108.1	L45	L45-A47 PolarHBondContact O-N 3.11Å
48	E	27.9	Very low	30.5	Very low	146 Å²	146	115 Å²	115	68%	0.682	67%	0.667	S	S	*	*			trans	-116.1	147.9	177.2	-66.3	-82.2	141.5	0	0	109.5	Q46 E50	Q46-E48 HydrophobicContact CB-CG 3.99Å; Q46-E48 PolarHBondContact NE2-OE1 3.22Å; Q46-E48 VanDerWaalsContact NE2-OE1 3.13Å; Q46-E48 PolarHBondContact O-N 2.93Å; E48-E50 PolarHBondContact O-N 3.02Å
49	D	29.7	Very low	30.8	Very low	170 Å²	170	109.7 Å²	109.7	91%	0.909	65%	0.648	S	S	*	*			trans	-53.1	121.6	-165.4	-96.4	-45.9	0	0	0	114.8	S51	D49-S51 PolarHBondContact O-N 3Å
50	E	29	Very low	30.5	Very low	139 Å²	139	104.4 Å²	104.4	65%	0.65	64%	0.641	S	S	*	*			trans	-80.3	100.2	169.8	-163.9	165.4	-143.9	0	0	109.1	E48 R237	E48-E50 PolarHBondContact O-N 3.02Å; E50-R237 IonicContact OE1-NH1 2.65Å; E50-R237 IonicContact OE1-NH2 2.76Å; E50-R237 PolarHBondContact OE1-NH2 2.96Å
51	S	29	Very low	30.6	Very low	79 Å²	79	103.8 Å²	103.8	55%	0.552	64%	0.642	S	S	*	*			trans	-51.8	122	172.2	173.3	0	0	0	0	110.5	D49 C53	D49-S51 PolarHBondContact O-N 3Å; S51-C53 PolarHBondContact O-N 2.82Å
52	P	29	Very low	30.5	Very low	122 Å²	122	104.7 Å²	104.7	79%	0.792	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	3	-165	29.4	-36.8	0	0	0	114.5
53	C	29	Very low	30.4	Very low	68 Å²	68	103.9 Å²	103.9	46%	0.459	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.9	2.9	-175.5	-64.4	0	0	0	0	114.5	S51	S51-C53 PolarHBondContact O-N 2.82Å
54	S	32.8	Very low	30	Very low	90 Å²	90	104 Å²	104	63%	0.629	65%	0.647	S	S	*	*			trans	-99.5	22.3	-179.1	-73.3	0	0	0	0	115.2	S56	S54-S56 PolarHBondContact O-N 3.18Å
55	D	28.3	Very low	30.2	Very low	90 Å²	90	104.6 Å²	104.6	48%	0.481	65%	0.649	S	S	.	*			trans	-87.6	113	175.5	-154.6	6.1	0	0	0	112.8	G57 H147	D55-G57 PolarHBondContact O-N 3Å; D55-H147 IonicContact OD2-CE1 2.8Å; D55-H147 PolarHBondContact OD2-CE1 3.18Å; D55-H147 IonicContact OD2-ND1 2.75Å; D55-H147 IonicContact OD2-NE2 2.72Å
56	S	33.8	Very low	29.9	Very low	9 Å²	9	107.8 Å²	107.8	6%	0.063	65%	0.649	C	S	.	*			trans	-73.1	103.7	173.2	44.9	0	0	0	0	109.6	S54 C58 M242	S54-S56 PolarHBondContact O-N 3.18Å; S56-C58 PolarHBondContact O-N 2.65Å; S56-M242 WeakPolarHBondContact OG-CE 3.4Å
57	G	30.8	Very low	30	Very low	47 Å²	47	106.6 Å²	106.6	49%	0.485	65%	0.652	S	S	.	*	S	Bend	trans	-38	84.5	-171.2	0	0	0	0	0	117.1	D55 H147	D55-G57 PolarHBondContact O-N 3Å; G57-H147 WeakPolarHBondContact CA-NE2 3.41Å
58	C	37	Very low	29.7	Very low	34 Å²	34	107.8 Å²	107.8	23%	0.23	65%	0.651	C	S	.	*			trans	-159.8	99.1	175	-88.2	0	0	0	0	108.1	S56 H147 K245	S56-C58 PolarHBondContact O-N 2.65Å; C58-H147 PolarHBondContact N-CD2 3.1Å; C58-H147 PolarHBondContact N-NE2 2.87Å; C58-K245 HydrophobicContact CB-CD 4.12Å; C58-K245 WeakPolarHBondContact O-CE 3.47Å; C58-K245 PolarHBondContact O-NZ 3.04Å
59	G	33.7	Very low	29.8	Very low	40 Å²	40	112.1 Å²	112.1	41%	0.412	66%	0.661	S	S	.	*			trans	-65.2	154.2	-175.7	0	0	0	0	0	115.6	H147 K245	G59-H147 VanDerWaalsContact CA-CE1 3.42Å; G59-H147 WeakPolarHBondContact CA-CE1 3.32Å; G59-H147 PolarHBondContact N-CE1 3.23Å; G59-H147 PolarHBondContact N-NE2 3.01Å; G59-K245 WeakPolarHBondContact O-CE 3.2Å
60	G	26.8	Very low	29.6	Very low	65 Å²	65	114.1 Å²	114.1	67%	0.67	66%	0.661	S	S	*	*			trans	-96.6	176.3	163.7	0	0	0	0	0	111.9
61	S	29	Very low	29.7	Very low	119 Å²	119	114.8 Å²	114.8	83%	0.832	67%	0.668	S	S	*	*			trans	-114.4	149	175.5	-60.6	0	0	0	0	111.3
62	P	29.4	Very low	29.7	Very low	129 Å²	129	117 Å²	117	84%	0.838	68%	0.684	S	S	*	*			trans	-76.6	133.7	-172.5	29.8	-34.8	0	0	0	112.8
63	A	27	Very low	29.7	Very low	92 Å²	92	117.5 Å²	117.5	76%	0.76	69%	0.685	S	S	*	*			trans	-77.5	132.4	167.9	0	0	0	0	0	110.7	I65	A63-I65 PolarHBondContact O-N 3.45Å; A63-I65 VanDerWaalsContact O-N 3.08Å
64	L	25.5	Very low	29.7	Very low	176 Å²	176	119.9 Å²	119.9	92%	0.921	70%	0.702	S	S	*	*			trans	-70.6	100.4	179.6	-72.5	168.6	0	0	0	111.8	R66	L64-R66 PolarHBondContact O-N 3.49Å
65	I	29.5	Very low	29.6	Very low	153 Å²	153	120.9 Å²	120.9	79%	0.785	71%	0.709	S	S	*	*			trans	-77	110	167.1	-61.4	179.7	0	0	0	108.9	A63 T67	A63-I65 PolarHBondContact O-N 3.45Å; A63-I65 VanDerWaalsContact O-N 3.08Å; I65-T67 HydrophobicContact CG2-CG2 4.45Å; I65-T67 PolarHBondContact O-N 2.97Å
66	R	27.7	Very low	29.7	Very low	245 Å²	245	121.4 Å²	121.4	93%	0.925	72%	0.72	S	S	*	*			trans	-72	121.5	168.5	-83.4	179.7	167.8	172.9	-2.4	110.5	L64	L64-R66 PolarHBondContact O-N 3.49Å
67	T	29.2	Very low	29.8	Very low	123 Å²	123	128.4 Å²	128.4	76%	0.755	76%	0.755	S	S	*	*			trans	-126.1	152.8	154.4	52.8	0	0	0	0	110	I65	I65-T67 HydrophobicContact CG2-CG2 4.45Å; I65-T67 PolarHBondContact O-N 2.97Å
68	P	29.8	Very low	29.6	Very low	128 Å²	128	129.1 Å²	129.1	83%	0.831	76%	0.762	S	S	*	*			trans	-85.4	157	-159.6	32.3	-35.9	0	0	0	115.2
69	R	28.7	Very low	29.4	Very low	237 Å²	237	136 Å²	136	89%	0.894	80%	0.796	S	S	*	*			trans	-50.1	146.1	-177.6	-60.6	169	176.4	144.9	-3.5	115
70	K	27.1	Very low	29.1	Very low	212 Å²	212	139.5 Å²	139.5	92%	0.922	81%	0.814	S	S	*	*			trans	-133.6	154	132.1	-118.6	175.2	-177.7	177.2	0	110.4
71	L	30.1	Very low	29.2	Very low	153 Å²	153	142.1 Å²	142.1	80%	0.801	82%	0.822	S	S	*	*			trans	-86.1	143.3	-154.7	-66.4	147	0	0	0	113.3
72	S	29.5	Very low	29.1	Very low	125 Å²	125	140.7 Å²	140.7	87%	0.874	82%	0.817	S	S	*	*				-158.4	145.5	126.4	-82.6	0	0	0	0	111.5
73	T	28.3	Very low	29	Very low	132 Å²	132	139.6 Å²	139.6	81%	0.81	81%	0.813	S	S	*	*			trans	-85.7	139.6	-170.6	39.3	0	0	0	0	113.2
74	S	29.5	Very low	29.1	Very low	119 Å²	119	140.6 Å²	140.6	83%	0.832	81%	0.814	S	S	*	*				-164.9	138.8	124.2	-80.3	0	0	0	0	112.2
75	S	30.9	Very low	29.1	Very low	110 Å²	110	139.8 Å²	139.8	77%	0.769	80%	0.804	S	S	*	*			trans	-49.2	165.4	162.5	44.2	0	0	0	0	113.7
76	S	30.1	Very low	29.2	Very low	101 Å²	101	139.2 Å²	139.2	71%	0.706	80%	0.798	S	S	*	*			cis	-175.8	179.7	-10.7	50.5	0	0	0	0	106.2
77	I	35.8	Very low	29.2	Very low	156 Å²	156	134.5 Å²	134.5	80%	0.8	79%	0.786	S	S	*	*			cis	-126.4	160.5	9.3	-65	86.6	0	0	0	107.8
78	G	26.4	Very low	29.2	Very low	62 Å²	62	134.2 Å²	134.2	64%	0.639	79%	0.789	S	S	*	*			trans	-115.7	146.5	167.4	0	0	0	0	0	113.1
79	L	32.5	Very low	29.4	Very low	178 Å²	178	135.7 Å²	135.7	93%	0.932	79%	0.785	S	S	*	*			trans	-144.1	140.5	151.9	-77.5	-176.3	0	0	0	108.3
80	S	28.7	Very low	29.5	Very low	115 Å²	115	132.4 Å²	132.4	80%	0.804	79%	0.785	S	S	*	*			trans	-105.7	155.5	-178.4	-63.8	0	0	0	0	112.4
81	S	29.1	Very low	29.8	Very low	119 Å²	119	128.8 Å²	128.8	83%	0.832	78%	0.776	S	S	*	*			trans	-4.1	138.8	153.1	-44.8	0	0	0	0	119.9
82	A	27	Very low	29.7	Very low	89 Å²	89	129.8 Å²	129.8	74%	0.736	77%	0.774	S	S	*	*				176.7	155.1	107.1	0	0	0	0	0	113.6
83	S	26.9	Very low	29.8	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	77%	0.769	S	S	*	*			trans	36.2	122.7	154	56.7	0	0	0	0	120.5
84	S	28.3	Very low	29.8	Very low	113 Å²	113	126.4 Å²	126.4	79%	0.79	76%	0.761	S	S	*	*				61.6	109.2	63.7	179.1	0	0	0	0	114.4
85	F	25.4	Very low	29.9	Very low	160 Å²	160	125.8 Å²	125.8	70%	0.702	76%	0.756	S	S	*	*				159.7	132.8	125.4	-170.5	-115.4	0	0	0	111.5
86	E	32.7	Very low	30.1	Very low	140 Å²	140	127.6 Å²	127.6	65%	0.654	76%	0.757	S	S	*	*			trans	42.3	162.2	160.8	-74	-177.6	-172.1	0	0	120.1
87	E	27.1	Very low	30.5	Very low	147 Å²	147	129.4 Å²	129.4	69%	0.687	76%	0.757	S	S	*	*			cis	176.5	134.7	-20.9	175.6	179.9	140.3	0	0	102.5
88	S	29.7	Very low	30.4	Very low	117 Å²	117	129.5 Å²	129.5	82%	0.818	75%	0.754	S	S	*	*			trans	-164.3	114.3	163.6	-170.7	0	0	0	0	108.6
89	E	32.6	Very low	30.6	Very low	158 Å²	158	130 Å²	130	74%	0.738	75%	0.748	S	S	*	*			trans	-70.8	150.9	164	-51.1	-176.9	114.4	0	0	109.3
90	D	32.4	Very low	30.5	Very low	168 Å²	168	126.2 Å²	126.2	90%	0.898	74%	0.737	S	S	*	*				-179.4	165.6	123.6	-104.4	-28.9	0	0	0	112.1
91	D	32.7	Very low	30.6	Very low	136 Å²	136	129.1 Å²	129.1	73%	0.727	74%	0.742	S	S	*	*			trans	-108.5	175.4	-140.3	-148.6	-2.9	0	0	0	116.5
92	F	28.6	Very low	30.8	Very low	175 Å²	175	128.5 Å²	128.5	77%	0.768	74%	0.738	S	S	*	*			trans	10.5	142.2	150.3	-105.9	-102	0	0	0	119.5
93	T	30.9	Very low	32.1	Very low	125 Å²	125	129.6 Å²	129.6	77%	0.767	74%	0.738	S	S	*	*				-166.2	151.8	55.8	57.2	0	0	0	0	114
94	G	28.4	Very low	32.2	Very low	61 Å²	61	132 Å²	132	63%	0.629	75%	0.748	S	S	*	*			trans	83.8	121.2	141.3	0	0	0	0	0	118.8
95	S	32.3	Very low	32.3	Very low	106 Å²	106	138.2 Å²	138.2	74%	0.741	75%	0.754	S	S	*	*				73.5	132.7	71	70.1	0	0	0	0	113.1
96	D	33.5	Very low	32.3	Very low	147 Å²	147	136.1 Å²	136.1	79%	0.786	76%	0.76	S	S	*	*			cis	-169.6	-174.7	7	-115.1	-27.3	0	0	0	110.9
97	I	39.7	Very low	32.1	Very low	139 Å²	139	136.4 Å²	136.4	71%	0.713	77%	0.765	S	S	*	*			trans	86	110.3	155	-121	57.3	0	0	0	116.6
98	E	32.7	Very low	32.1	Very low	158 Å²	158	135 Å²	135	74%	0.738	77%	0.77	S	S	*	*				69.1	147.4	76.6	-105.2	-152.9	109.7	0	0	114.8
99	S	31.5	Very low	32	Very low	73 Å²	73	135.7 Å²	135.7	51%	0.51	77%	0.774	S	S	.	*			cis	-161.3	156.4	-0.7	-150.9	0	0	0	0	111.3
100	S	30.8	Very low	32	Very low	99 Å²	99	133 Å²	133	69%	0.692	78%	0.779	S	S	*	*			trans	39.4	134.5	139.3	-53.3	0	0	0	0	123
101	L	29.9	Very low	31.8	Very low	175 Å²	175	128.8 Å²	128.8	92%	0.916	78%	0.776	S	S	*	*				174.1	155.2	107.7	-89.4	174.8	0	0	0	113.7
102	S	33	Very low	31.7	Very low	107 Å²	107	130.8 Å²	130.8	75%	0.748	79%	0.786	S	S	*	*			trans	-154.7	-167.8	173.6	59	0	0	0	0	108.3
103	P	56.2	Low	31.7	Very low	112 Å²	112	125.9 Å²	125.9	73%	0.727	79%	0.785	S	S	*	*				-121.7	173.4	-56.5	35.7	-21.8	0	0	0	112.9
104	T	27.2	Very low	31.6	Very low	156 Å²	156	126.1 Å²	126.1	96%	0.957	79%	0.792	S	S	*	*			trans	-155.9	160.2	159.1	-4.1	0	0	0	0	116.2
105	R	30.4	Very low	31.6	Very low	243 Å²	243	126.9 Å²	126.9	92%	0.917	80%	0.8	S	S	*	*			trans	-92.1	162.6	-175.7	-59.1	165.7	162.8	170.5	-7.1	112.9
106	S	26.1	Very low	31.6	Very low	117 Å²	117	126.2 Å²	126.2	82%	0.818	80%	0.795	S	S	*	*				177.2	169.2	119.1	-153.8	0	0	0	0	115.5
107	L	28.4	Very low	31.7	Very low	146 Å²	146	128.7 Å²	128.7	76%	0.764	80%	0.799	S	S	*	*			trans	-71.1	154.4	-159.4	-80.6	69.8	0	0	0	121.3
108	C	26.6	Very low	31.4	Very low	118 Å²	118	126.3 Å²	126.3	80%	0.797	80%	0.795	S	S	*	*			trans	37.5	132.9	131.2	-49.4	0	0	0	0	123.8
109	S	29.2	Very low	31.2	Very low	130 Å²	130	130.1 Å²	130.1	91%	0.909	80%	0.803	S	S	*	*				-171.2	171	109	-159.2	0	0	0	0	112.5
110	A	31.1	Very low	31.2	Very low	102 Å²	102	131.6 Å²	131.6	84%	0.843	81%	0.813	S	S	*	*			trans	-102.2	166.3	-167.7	0	0	0	0	0	115.4
111	G	28.5	Very low	31.8	Very low	80 Å²	80	137 Å²	137	83%	0.825	82%	0.824	S	S	*	*			trans	-160.5	138.2	170.8	0	0	0	0	0	111.5
112	D	31	Very low	32.2	Very low	177 Å²	177	136.5 Å²	136.5	95%	0.947	82%	0.821	S	S	*	*			trans	-95.1	163.4	-162.6	-149.7	-18.5	0	0	0	114
113	G	28.3	Very low	32.6	Very low	72 Å²	72	140.8 Å²	140.8	74%	0.742	83%	0.826	S	S	*	*			trans	165.1	88.7	175	0	0	0	0	0	119.6
114	S	29.8	Very low	31.5	Very low	131 Å²	131	140.3 Å²	140.3	92%	0.916	83%	0.825	S	S	*	*			trans	-42.2	139.6	170.4	174.9	0	0	0	0	118
115	G	28	Very low	31.7	Very low	77 Å²	77	140.1 Å²	140.1	79%	0.794	82%	0.815	S	S	*	*			trans	-170.3	101.7	170.1	0	0	0	0	0	116.2
116	S	31.5	Very low	31.8	Very low	92 Å²	92	132.6 Å²	132.6	64%	0.643	80%	0.797	S	S	*	*			trans	-61.4	159.6	-167.6	71.6	0	0	0	0	120.9
117	K	36.2	Very low	32.1	Very low	199 Å²	199	134.7 Å²	134.7	87%	0.865	79%	0.793	S	S	*	*			trans	80.4	153.2	157	-54.4	156.8	-169.5	175	0	117.5
118	S	34.1	Very low	32.1	Very low	88 Å²	88	136.3 Å²	136.3	62%	0.615	79%	0.794	S	S	*	*			cis	-178.2	156.7	-32.2	-176.3	0	0	0	0	107.9
119	W	27.2	Very low	32.5	Very low	239 Å²	239	135.2 Å²	135.2	91%	0.905	79%	0.788	S	S	*	*			trans	67.1	135.8	177	-48.2	82.1	0	0	0	114.2
120	S	32.6	Very low	32.7	Very low	103 Å²	103	134.2 Å²	134.2	72%	0.72	78%	0.778	S	S	*	*			cis	-145.6	125.7	8.1	-58	0	0	0	0	110.4
121	K	43.1	Very low	32.9	Very low	213 Å²	213	136 Å²	136	93%	0.926	77%	0.773	S	S	*	*			trans	-101.5	100.4	159.7	-95.9	179	178.1	167.7	0	108.5
122	L	38.3	Very low	33.3	Very low	164 Å²	164	136 Å²	136	86%	0.859	77%	0.765	S	S	*	*			trans	-121.4	109.1	162.3	-136.7	160.8	0	0	0	107.5	S124	L122-S124 PolarHBondContact O-N 3.47Å
123	K	40.3	Very low	33.3	Very low	197 Å²	197	135.5 Å²	135.5	86%	0.857	76%	0.755	S	S	*	*			trans	-70.7	92.9	-177.6	-66.5	177.9	177.3	-179.1	0	109	M125	K123-M125 PolarHBondContact O-N 3.41Å
124	S	33.7	Very low	33.7	Very low	102 Å²	102	137.7 Å²	137.7	71%	0.713	75%	0.754	S	S	*	*			trans	-77.2	97.6	158.4	-170.5	0	0	0	0	107.7	L122 V126	L122-S124 PolarHBondContact O-N 3.47Å; S124-V126 PolarHBondContact O-N 2.85Å; S124-V126 WeakPolarHBondContact OG-CG2 3.45Å
125	M	31.4	Very low	33.9	Very low	152 Å²	152	139.1 Å²	139.1	75%	0.749	75%	0.75	S	S	*	*			trans	-78.7	73.9	174.9	-161.8	174.7	83.3	0	0	108.3	K123 H127	K123-M125 PolarHBondContact O-N 3.41Å; M125-H127 PolarHBondContact O-N 3.28Å
126	V	33	Very low	34.7	Very low	86 Å²	86	141.2 Å²	141.2	52%	0.521	74%	0.738	S	S	.	*			trans	-67.2	105.9	174	-174.2	0	0	0	0	107.2	S124 F128	S124-V126 PolarHBondContact O-N 2.85Å; S124-V126 WeakPolarHBondContact OG-CG2 3.45Å; V126-F128 HydrophobicContact CB-CD2 3.94Å; V126-F128 HydrophobicContact CB-CE2 3.94Å; V126-F128 HydrophobicContact CG1-CD2 3.6Å; V126-F128 HydrophobicContact CG1-CE2 3.63Å; V126-F128 HydrophobicContact CG1-CG 4.23Å; V126-F128 HydrophobicContact CG1-CZ 4.29Å; V126-F128 PolarHBondContact O-N 3.37Å
127	H	32.2	Very low	35.2	Very low	161 Å²	161	140.8 Å²	140.8	75%	0.745	73%	0.733	S	S	*	*			trans	-62.3	86.8	158.1	-85.5	-91.1	0	0	0	107.6	M125 S129	M125-H127 PolarHBondContact O-N 3.28Å; H127-S129 PolarHBondContact O-N 2.68Å
128	F	29	Very low	35.5	Very low	179 Å²	179	142.7 Å²	142.7	79%	0.785	74%	0.735	S	S	*	*			trans	-65.3	83.3	156.7	-82.5	-87.1	0	0	0	106.7	V126 P130	V126-F128 HydrophobicContact CB-CD2 3.94Å; V126-F128 HydrophobicContact CB-CE2 3.94Å; V126-F128 HydrophobicContact CG1-CD2 3.6Å; V126-F128 HydrophobicContact CG1-CE2 3.63Å; V126-F128 HydrophobicContact CG1-CG 4.23Å; V126-F128 HydrophobicContact CG1-CZ 4.29Å; V126-F128 PolarHBondContact O-N 3.37Å; F128-P130 WeakPolarHBondContact O-CD 3.39Å
129	S	33.5	Very low	36.3	Very low	96 Å²	96	141.9 Å²	141.9	67%	0.671	72%	0.721	S	S	*	*			trans	-69.7	110.2	150.2	-170.4	0	0	0	0	105	H127 L131	H127-S129 PolarHBondContact O-N 2.68Å; S129-L131 VanDerWaalsContact C-N 3.28Å; S129-L131 PolarHBondContact O-N 2.88Å
130	P	33.4	Very low	37.4	Very low	108 Å²	108	135.5 Å²	135.5	70%	0.701	71%	0.713	S	S	*	*			trans	-67.6	100.7	169.8	29.6	-30.3	0	0	0	105.7	F128 A132	F128-P130 WeakPolarHBondContact O-CD 3.39Å; P130-A132 PolarHBondContact O-N 2.74Å
131	L	36.7	Very low	38.4	Very low	140 Å²	140	133.6 Å²	133.6	73%	0.733	69%	0.69	S	S	*	*			trans	-57.5	92.8	156.5	-97.6	158.5	0	0	0	105.6	S129 F133	S129-L131 VanDerWaalsContact C-N 3.28Å; S129-L131 PolarHBondContact O-N 2.88Å; L131-F133 HydrophobicContact CB-CD2 4.14Å; L131-F133 HydrophobicContact CB-CE2 4.3Å; L131-F133 HydrophobicContact CD2-CE2 4.13Å; L131-F133 PolarHBondContact O-N 2.76Å
132	A	35.3	Very low	39	Very low	80 Å²	80	125.5 Å²	125.5	66%	0.661	66%	0.658	S	S	*	*			trans	-70.9	72	176.4	0	0	0	0	0	107.9	P130 T134	P130-A132 PolarHBondContact O-N 2.74Å; A132-T134 PolarHBondContact O-N 2.78Å
133	F	31.6	Very low	40	Very low	166 Å²	166	119.6 Å²	119.6	73%	0.728	63%	0.626	S	S	*	*			trans	-64.6	77.5	151.2	-78.6	-79.2	0	0	0	106.7	L131 L135	L131-F133 HydrophobicContact CB-CD2 4.14Å; L131-F133 HydrophobicContact CB-CE2 4.3Å; L131-F133 HydrophobicContact CD2-CE2 4.13Å; L131-F133 PolarHBondContact O-N 2.76Å; F133-L135 PolarHBondContact O-N 3.34Å
134	T	36.5	Very low	40.7	Very low	118 Å²	118	111.1 Å²	111.1	72%	0.724	59%	0.59	S	S	*	*			trans	-60.1	92.1	153.7	42.7	0	0	0	0	105.6	A132 K136	A132-T134 PolarHBondContact O-N 2.78Å; T134-K136 PolarHBondContact O-N 2.77Å
135	L	34.2	Very low	41.5	Very low	161 Å²	161	107 Å²	107	84%	0.843	56%	0.563	S	S	*	*			trans	-62.5	80.6	160.9	-77.3	167.4	0	0	0	106.1	F133 P137	F133-L135 PolarHBondContact O-N 3.34Å; L135-P137 WeakPolarHBondContact O-CD 2.86Å; L135-P137 VanDerWaalsContact O-N 3.15Å
136	K	44.2	Very low	42.2	Very low	121 Å²	121	102 Å²	102	53%	0.526	55%	0.55	S	S	.	.			trans	-48.1	123.3	166.6	-85.7	-165.7	170.5	-167.2	0	105.3	T134 R138 T207 D208	T134-K136 PolarHBondContact O-N 2.77Å; K136-R138 PolarHBondContact O-N 3.35Å; K136-T207 PolarHBondContact NZ-O 2.99Å; K136-D208 IonicContact NZ-OD1 2.82Å; K136-D208 PolarHBondContact NZ-OD1 3.11Å
137	P	42.6	Very low	42.8	Very low	84 Å²	84	100 Å²	100	55%	0.545	54%	0.535	S	S	.	.			trans	-51.1	129.4	174.7	-26.2	34.8	0	0	0	108.5	L135 H139	L135-P137 WeakPolarHBondContact O-CD 2.86Å; L135-P137 VanDerWaalsContact O-N 3.15Å; P137-H139 PolarHBondContact O-CD2 3.17Å; P137-H139 PolarHBondContact O-N 2.97Å
138	R	43.7	Very low	43.2	Very low	238 Å²	238	98.5 Å²	98.5	90%	0.898	54%	0.537	S	S	*	.			trans	-68.3	91.8	168.3	-84.3	-176.4	164.2	132.8	-6.7	106.7	K136 S140	K136-R138 PolarHBondContact O-N 3.35Å; R138-S140 PolarHBondContact O-N 3.47Å; R138-S140 VanDerWaalsContact O-N 3.13Å
139	H	49.7	Very low	43.8	Very low	71 Å²	71	92 Å²	92	33%	0.329	52%	0.516	S	S	.	.			trans	-56.8	119.9	171.2	-59.3	-70.6	0	0	0	107.2	P137 W141	P137-H139 PolarHBondContact O-CD2 3.17Å; P137-H139 PolarHBondContact O-N 2.97Å; H139-W141 PolarHBondContact O-N 2.99Å
140	S	50.5	Low	44	Very low	105 Å²	105	96.6 Å²	96.6	73%	0.734	53%	0.527	S	S	*	.			trans	-62.2	114	168.8	-172	0	0	0	0	106.4	R138 V142	R138-S140 PolarHBondContact O-N 3.47Å; R138-S140 VanDerWaalsContact O-N 3.13Å; S140-V142 WeakPolarHBondContact O-CG2 3.38Å; S140-V142 PolarHBondContact O-N 3.03Å
141	W	53	Low	44.9	Very low	64 Å²	64	92.7 Å²	92.7	24%	0.242	51%	0.506	C	S	.	.			trans	-60.7	134.2	-178.5	-179.2	89.6	0	0	0	109.3	H139 Q143 F153 L161	H139-W141 PolarHBondContact O-N 2.99Å; W141-Q143 HydrophobicContact CH2-CB 3.57Å; W141-Q143 HydrophobicContact CH2-CG 3.96Å; W141-Q143 HydrophobicContact CZ3-CB 3.58Å; W141-Q143 HydrophobicContact CZ3-CG 4.34Å; W141-F153 HydrophobicContact CD2-CB 4.35Å; W141-F153 HydrophobicContact CE3-CB 3.74Å; W141-F153 HydrophobicContact CE3-CG 4.31Å; W141-F153 HydrophobicContact CH2-CB 3.54Å; W141-F153 AromaticContact CH2-CD1 3.59Å; W141-F153 HydrophobicContact CH2-CD1 3.59Å; W141-F153 AromaticContact CH2-CD2 3.2Å; W141-F153 HydrophobicContact CH2-CD2 3.2Å; W141-F153 AromaticContact CH2-CE1 3.95Å; W141-F153 HydrophobicContact CH2-CE1 3.95Å; W141-F153 AromaticContact CH2-CE2 3.64Å; W141-F153 HydrophobicContact CH2-CE2 3.64Å; W141-F153 AromaticContact CH2-CG 3.16Å; W141-F153 HydrophobicContact CH2-CG 3.16Å; W141-F153 AromaticContact CH2-CZ 3.97Å; W141-F153 HydrophobicContact CH2-CZ 3.97Å; W141-F153 HydrophobicContact CZ2-CB 4.15Å; W141-F153 AromaticContact CZ2-CD1 3.59Å; W141-F153 HydrophobicContact CZ2-CD1 3.59Å; W141-F153 HydrophobicContact CZ2-CD2 4.06Å; W141-F153 AromaticContact CZ2-CE1 3.81Å; W141-F153 HydrophobicContact CZ2-CE1 3.81Å; W141-F153 HydrophobicContact CZ2-CE2 4.29Å; W141-F153 AromaticContact CZ2-CG 3.7Å; W141-F153 HydrophobicContact CZ2-CG 3.7Å; W141-F153 HydrophobicContact CZ2-CZ 4.16Å; W141-F153 HydrophobicContact CZ3-CB 3.28Å; W141-F153 HydrophobicContact CZ3-CD1 4.25Å; W141-F153 AromaticContact CZ3-CD2 3.66Å; W141-F153 HydrophobicContact CZ3-CD2 3.66Å; W141-F153 HydrophobicContact CZ3-CE2 4.49Å; W141-F153 AromaticContact CZ3-CG 3.5Å; W141-F153 HydrophobicContact CZ3-CG 3.5Å; W141-L161 HydrophobicContact CD2-CD1 3.88Å; W141-L161 HydrophobicContact CG-CD1 3.9Å; W141-L161 HydrophobicContact CZ2-CD1 4.36Å; W141-L161 HydrophobicContact CZ2-CD2 4.05Å
142	V	56.6	Low	46.1	Very low	43 Å²	43	87.1 Å²	87.1	26%	0.261	48%	0.479	S	S	.	.			trans	-123.1	124.3	-174.9	175.5	0	0	0	0	111.5	S140 L144 K290	S140-V142 WeakPolarHBondContact O-CG2 3.38Å; S140-V142 PolarHBondContact O-N 3.03Å; V142-L144 HydrophobicContact CG1-CD2 4.11Å; V142-K290 HydrophobicContact CB-CD 4.22Å; V142-K290 HydrophobicContact CG1-CD 3.95Å; V142-K290 HydrophobicContact CG2-CD 4.25Å
143	Q	59.9	Low	47.8	Very low	40 Å²	40	85 Å²	85	19%	0.187	46%	0.455	C	S	.	.			trans	-80.4	124.8	167.7	-164.9	161.2	-2.4	0	0	110.5	W141 A145 H147 F153	W141-Q143 HydrophobicContact CH2-CB 3.57Å; W141-Q143 HydrophobicContact CH2-CG 3.96Å; W141-Q143 HydrophobicContact CZ3-CB 3.58Å; W141-Q143 HydrophobicContact CZ3-CG 4.34Å; Q143-A145 WeakPolarHBondContact CG-O 3.44Å; Q143-A145 PolarHBondContact NE2-O 3.43Å; Q143-H147 PolarHBondContact NE2-O 3.5Å; Q143-H147 PolarHBondContact OE1-O 2.98Å; Q143-F153 HydrophobicContact CG-CE2 4.44Å
144	L	54.9	Low	49.9	Very low	19 Å²	19	79.3 Å²	79.3	10%	0.099	43%	0.434	C	S	.	.	S	Bend	trans	-91.2	-33.3	171.5	-59.4	-170.5	0	0	0	113.1	V142 I214 D216 K290	V142-L144 HydrophobicContact CG1-CD2 4.11Å; L144-I214 HydrophobicContact CD1-CB 3.82Å; L144-I214 HydrophobicContact CD1-CG2 3.52Å; L144-I214 WeakPolarHBondContact CD1-O 3.37Å; L144-I214 HydrophobicContact CG-CG2 4.2Å; L144-D216 HydrophobicContact CB-CB 4.21Å; L144-D216 HydrophobicContact CD1-CB 4.35Å; L144-K290 HydrophobicContact CD2-CB 3.52Å
145	A	48.8	Very low	51.8	Low	16 Å²	16	77.3 Å²	77.3	13%	0.132	43%	0.429	C	S	.	.	S	Bend	trans	-135.1	152.5	-177.5	0	0	0	0	0	111.6	Q143 D216 E287	Q143-A145 WeakPolarHBondContact CG-O 3.44Å; Q143-A145 PolarHBondContact NE2-O 3.43Å; A145-D216 HydrophobicContact CB-CB 4.49Å; A145-D216 WeakPolarHBondContact CB-OD2 3.39Å; A145-E287 HydrophobicContact CB-CB 4.04Å
146	G	47.1	Very low	53.8	Low	46 Å²	46	70.7 Å²	70.7	47%	0.474	40%	0.4	S	S	.	.	S	Bend	trans	90.9	-174.5	-172.5	0	0	0	0	0	113.3
147	H	45.3	Very low	55.5	Low	45 Å²	45	71.9 Å²	71.9	21%	0.208	41%	0.412	C	S	.	.			trans	-84.8	126.5	-171.2	-66.2	-143.2	0	0	0	110.7	D55 G57 C58 G59 Q143 A149	D55-H147 IonicContact OD2-CE1 2.8Å; D55-H147 PolarHBondContact OD2-CE1 3.18Å; D55-H147 IonicContact OD2-ND1 2.75Å; D55-H147 IonicContact OD2-NE2 2.72Å; G57-H147 WeakPolarHBondContact CA-NE2 3.41Å; C58-H147 PolarHBondContact N-CD2 3.1Å; C58-H147 PolarHBondContact N-NE2 2.87Å; G59-H147 VanDerWaalsContact CA-CE1 3.42Å; G59-H147 WeakPolarHBondContact CA-CE1 3.32Å; G59-H147 PolarHBondContact N-CE1 3.23Å; G59-H147 PolarHBondContact N-NE2 3.01Å; Q143-H147 PolarHBondContact NE2-O 3.5Å; Q143-H147 PolarHBondContact OE1-O 2.98Å; H147-A149 HydrophobicContact CB-CB 4.16Å; H147-A149 PolarHBondContact O-N 3.42Å
148	T	40.9	Very low	57.3	Low	128 Å²	128	71.5 Å²	71.5	79%	0.785	42%	0.424	S	S	*	.			trans	-72.3	45.9	156.7	58.1	0	0	0	0	111	E150	T148-E150 PolarHBondContact O-N 3.16Å
149	A	40.6	Very low	59.3	Low	42 Å²	42	61.1 Å²	61.1	35%	0.347	39%	0.39	S	S	.	.			trans	-68.1	126.2	159.5	0	0	0	0	0	106.2	H147 G151 S152	H147-A149 HydrophobicContact CB-CB 4.16Å; H147-A149 PolarHBondContact O-N 3.42Å; A149-G151 PolarHBondContact O-N 3.19Å; A149-G151 VanDerWaalsContact O-N 3.14Å; A149-S152 PolarHBondContact O-N 3.26Å
150	E	39.2	Very low	61.3	Low	194 Å²	194	61.2 Å²	61.2	91%	0.907	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.8	124.3	174.4	-64.9	179.1	148.9	0	0	108.7	T148 R164	T148-E150 PolarHBondContact O-N 3.16Å; E150-R164 PolarHBondContact O-NH2 3.48Å
151	G	52.5	Low	63.3	Low	26 Å²	26	56.8 Å²	56.8	27%	0.268	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	23	-176.6	0	0	0	0	0	117.2	A149 F153 R164	A149-G151 PolarHBondContact O-N 3.19Å; A149-G151 VanDerWaalsContact O-N 3.14Å; G151-F153 VanDerWaalsContact C-N 3.29Å; G151-R164 VanDerWaalsContact C-NH2 3.34Å; G151-R164 PolarHBondContact O-NE 2.97Å; G151-R164 PolarHBondContact O-NH2 3.08Å
152	S	61	Low	65.1	Low	22 Å²	22	54.3 Å²	54.3	15%	0.154	35%	0.347	C	S	.	.	S	Bend	trans	-69.1	-32.9	161.1	-172.8	0	0	0	0	111.7	A149 R164	A149-S152 PolarHBondContact O-N 3.26Å; S152-R164 PolarHBondContact O-N 2.76Å
153	F	70.1	Confident	66.9	Low	36 Å²	36	53.3 Å²	53.3	16%	0.158	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	145.1	177.3	-70.2	-94.8	0	0	0	109.7	W141 Q143 G151 L161 L162 K163	W141-F153 HydrophobicContact CD2-CB 4.35Å; W141-F153 HydrophobicContact CE3-CB 3.74Å; W141-F153 HydrophobicContact CE3-CG 4.31Å; W141-F153 HydrophobicContact CH2-CB 3.54Å; W141-F153 AromaticContact CH2-CD1 3.59Å; W141-F153 HydrophobicContact CH2-CD1 3.59Å; W141-F153 AromaticContact CH2-CD2 3.2Å; W141-F153 HydrophobicContact CH2-CD2 3.2Å; W141-F153 AromaticContact CH2-CE1 3.95Å; W141-F153 HydrophobicContact CH2-CE1 3.95Å; W141-F153 AromaticContact CH2-CE2 3.64Å; W141-F153 HydrophobicContact CH2-CE2 3.64Å; W141-F153 AromaticContact CH2-CG 3.16Å; W141-F153 HydrophobicContact CH2-CG 3.16Å; W141-F153 AromaticContact CH2-CZ 3.97Å; W141-F153 HydrophobicContact CH2-CZ 3.97Å; W141-F153 HydrophobicContact CZ2-CB 4.15Å; W141-F153 AromaticContact CZ2-CD1 3.59Å; W141-F153 HydrophobicContact CZ2-CD1 3.59Å; W141-F153 HydrophobicContact CZ2-CD2 4.06Å; W141-F153 AromaticContact CZ2-CE1 3.81Å; W141-F153 HydrophobicContact CZ2-CE1 3.81Å; W141-F153 HydrophobicContact CZ2-CE2 4.29Å; W141-F153 AromaticContact CZ2-CG 3.7Å; W141-F153 HydrophobicContact CZ2-CG 3.7Å; W141-F153 HydrophobicContact CZ2-CZ 4.16Å; W141-F153 HydrophobicContact CZ3-CB 3.28Å; W141-F153 HydrophobicContact CZ3-CD1 4.25Å; W141-F153 AromaticContact CZ3-CD2 3.66Å; W141-F153 HydrophobicContact CZ3-CD2 3.66Å; W141-F153 HydrophobicContact CZ3-CE2 4.49Å; W141-F153 AromaticContact CZ3-CG 3.5Å; W141-F153 HydrophobicContact CZ3-CG 3.5Å; Q143-F153 HydrophobicContact CG-CE2 4.44Å; G151-F153 VanDerWaalsContact C-N 3.29Å; F153-L161 HydrophobicContact CB-CD1 4.28Å; F153-L161 HydrophobicContact CD1-CD1 3.96Å; F153-L161 HydrophobicContact CD1-CD2 3.76Å; F153-L161 HydrophobicContact CD1-CG 3.91Å; F153-L161 HydrophobicContact CE1-CD2 3.92Å; F153-L161 HydrophobicContact CE1-CG 4.49Å; F153-L162 CarbonylContact C-O 3.11Å; F153-L162 WeakPolarHBondContact CA-O 3.5Å; F153-K163 HydrophobicContact CD1-CB 3.84Å; F153-K163 HydrophobicContact CD1-CD 4.49Å; F153-K163 HydrophobicContact CD1-CG 3.93Å; F153-K163 HydrophobicContact CE1-CB 3.7Å; F153-K163 HydrophobicContact CE1-CD 3.55Å; F153-K163 HydrophobicContact CE1-CG 3.45Å; F153-K163 VanDerWaalsContact CE1-CG 3.45Å; F153-K163 HydrophobicContact CE2-CG 4.48Å; F153-K163 HydrophobicContact CZ-CD 3.69Å; F153-K163 HydrophobicContact CZ-CG 3.78Å
154	T	75.6	Confident	68.4	Low	46 Å²	46	56.3 Å²	56.3	28%	0.282	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	139.4	175	-56.5	0	0	0	0	109.5	G156 L162	T154-G156 PolarHBondContact O-N 2.86Å; T154-L162 PolarHBondContact N-O 2.9Å; T154-L162 WeakPolarHBondContact O-CB 3.32Å; T154-L162 PolarHBondContact O-N 3.45Å
155	A	78.1	Confident	70.3	Confident	77 Å²	77	58.7 Å²	58.7	64%	0.636	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.3	126.2	172.8	0	0	0	0	0	110.1
156	G	76.3	Confident	72.4	Confident	22 Å²	22	59 Å²	59	23%	0.227	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-93.7	170.6	171.1	0	0	0	0	0	111.7	T154 R160	T154-G156 PolarHBondContact O-N 2.86Å; G156-R160 CarbonylContact C-O 3.47Å; G156-R160 VanDerWaalsContact CA-O 3.24Å; G156-R160 WeakPolarHBondContact CA-O 3.47Å; G156-R160 PolarHBondContact N-O 3.32Å
157	D	78.8	Confident	74.7	Confident	145 Å²	145	62.1 Å²	62.1	78%	0.775	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	148	176.4	-70.4	-48.8	0	0	0	112	G159 R160	D157-G159 PolarHBondContact O-N 3.34Å; D157-R160 WeakPolarHBondContact O-CB 3.49Å; D157-R160 WeakPolarHBondContact O-CG 3.44Å
158	G	81.2	Confident	77.1	Confident	77 Å²	77	61.6 Å²	61.6	79%	0.794	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	32	168	0	0	0	0	0	116.1
159	G	85.4	Confident	79.7	Confident	19 Å²	19	55.7 Å²	55.7	20%	0.196	33%	0.325	C	S	.	.	S	Bend	trans	80	38	-177.9	0	0	0	0	0	112.8	D157 D204 T207	D157-G159 PolarHBondContact O-N 3.34Å; G159-D204 PolarHBondContact O-N 2.87Å; G159-D204 VanDerWaalsContact O-N 3.14Å; G159-T207 WeakPolarHBondContact CA-OG1 3.16Å
160	R	91.6	Very high	82.4	Confident	73 Å²	73	55.1 Å²	55.1	28%	0.275	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	151.8	178.3	-62.4	-68.9	175.6	-109.3	11.6	110.6	G156 D157 Y189 I201 M202 D203	G156-R160 CarbonylContact C-O 3.47Å; G156-R160 VanDerWaalsContact CA-O 3.24Å; G156-R160 WeakPolarHBondContact CA-O 3.47Å; G156-R160 PolarHBondContact N-O 3.32Å; D157-R160 WeakPolarHBondContact O-CB 3.49Å; D157-R160 WeakPolarHBondContact O-CG 3.44Å; R160-Y189 PolarHBondContact NH2-OH 3.49Å; R160-Y189 VanDerWaalsContact NH2-OH 3.07Å; R160-I201 HydrophobicContact CB-CG2 4.4Å; R160-I201 HydrophobicContact CG-CG2 4.5Å; R160-M202 CarbonylContact C-O 3.59Å; R160-M202 VanDerWaalsContact CA-O 3.29Å; R160-M202 WeakPolarHBondContact CA-O 3.46Å; R160-M202 WeakPolarHBondContact CD-O 3.04Å; R160-D203 IonicContact CZ-OD1 2.78Å; R160-D203 IonicContact NH1-OD1 2.65Å; R160-D203 PolarHBondContact NH1-OD1 2.9Å; R160-D203 IonicContact NH2-OD1 2.83Å
161	L	91.8	Very high	85.2	Confident	12 Å²	12	50 Å²	50	6%	0.063	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.7	173.5	-178.8	62.6	0	0	0	108.4	W141 F153 M202 D204	W141-L161 HydrophobicContact CD2-CD1 3.88Å; W141-L161 HydrophobicContact CG-CD1 3.9Å; W141-L161 HydrophobicContact CZ2-CD1 4.36Å; W141-L161 HydrophobicContact CZ2-CD2 4.05Å; F153-L161 HydrophobicContact CB-CD1 4.28Å; F153-L161 HydrophobicContact CD1-CD1 3.96Å; F153-L161 HydrophobicContact CD1-CD2 3.76Å; F153-L161 HydrophobicContact CD1-CG 3.91Å; F153-L161 HydrophobicContact CE1-CD2 3.92Å; F153-L161 HydrophobicContact CE1-CG 4.49Å; L161-M202 HydrophobicContact CB-CG 4.22Å; L161-M202 HydrophobicContact CD2-SD 4.45Å; L161-M202 PolarHBondContact N-O 3.06Å; L161-M202 PolarHBondContact O-N 2.91Å; L161-D204 HydrophobicContact CB-CB 4.22Å
162	L	92.1	Very high	87.4	Confident	12 Å²	12	48.9 Å²	48.9	6%	0.063	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	115	169.6	-58.6	179.1	0	0	0	107.5	F153 T154 L192 F199 I201	F153-L162 CarbonylContact C-O 3.11Å; F153-L162 WeakPolarHBondContact CA-O 3.5Å; T154-L162 PolarHBondContact N-O 2.9Å; T154-L162 WeakPolarHBondContact O-CB 3.32Å; T154-L162 PolarHBondContact O-N 3.45Å; L162-L192 HydrophobicContact CD1-CD2 4.05Å; L162-L192 HydrophobicContact CD2-CD2 3.97Å; L162-F199 HydrophobicContact CB-CB 4Å; L162-F199 HydrophobicContact CB-CD1 4.14Å; L162-F199 HydrophobicContact CB-CG 4.23Å; L162-F199 HydrophobicContact CD2-CB 4.44Å; L162-I201 HydrophobicContact CD2-CB 4.33Å; L162-I201 HydrophobicContact CD2-CG1 3.93Å; L162-I201 HydrophobicContact CD2-CG2 4.23Å
163	K	92.9	Very high	89.2	Confident	22 Å²	22	47.9 Å²	47.9	10%	0.096	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	138.8	172.4	-177.4	174.5	-178.3	-175.4	0	108.7	F153 Y165 E169 F199 N200 M202 D370	F153-K163 HydrophobicContact CD1-CB 3.84Å; F153-K163 HydrophobicContact CD1-CD 4.49Å; F153-K163 HydrophobicContact CD1-CG 3.93Å; F153-K163 HydrophobicContact CE1-CB 3.7Å; F153-K163 HydrophobicContact CE1-CD 3.55Å; F153-K163 HydrophobicContact CE1-CG 3.45Å; F153-K163 VanDerWaalsContact CE1-CG 3.45Å; F153-K163 HydrophobicContact CE2-CG 4.48Å; F153-K163 HydrophobicContact CZ-CD 3.69Å; F153-K163 HydrophobicContact CZ-CG 3.78Å; K163-Y165 PolarHBondContact O-N 3.12Å; K163-E169 VanDerWaalsContact CD-OE2 3.26Å; K163-E169 WeakPolarHBondContact CD-OE2 3.36Å; K163-E169 WeakPolarHBondContact CE-OE2 3.4Å; K163-E169 IonicContact NZ-OE1 2.79Å; K163-E169 PolarHBondContact NZ-OE1 3.19Å; K163-E169 IonicContact NZ-OE2 2.81Å; K163-E169 PolarHBondContact NZ-OE2 3.38Å; K163-F199 CarbonylContact O-C 3.39Å; K163-F199 WeakPolarHBondContact O-CA 3.26Å; K163-N200 PolarHBondContact N-O 2.96Å; K163-N200 PolarHBondContact O-N 3.03Å; K163-M202 HydrophobicContact CB-SD 4.29Å; K163-M202 HydrophobicContact CD-CE 4.49Å; K163-M202 HydrophobicContact CD-SD 4.42Å; K163-D370 IonicContact NZ-OD1 2.78Å; K163-D370 PolarHBondContact NZ-OD1 3.23Å
164	R	92.5	Very high	90.5	Very high	103 Å²	103	49.7 Å²	49.7	39%	0.389	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.5	134	177.2	-178.4	175.1	-64.1	173.4	1	110.7	E150 G151 S152 C166	E150-R164 PolarHBondContact O-NH2 3.48Å; G151-R164 VanDerWaalsContact C-NH2 3.34Å; G151-R164 PolarHBondContact O-NE 2.97Å; G151-R164 PolarHBondContact O-NH2 3.08Å; S152-R164 PolarHBondContact O-N 2.76Å; R164-C166 PolarHBondContact O-N 3.09Å
165	Y	94.1	Very high	91.6	Very high	69 Å²	69	51.3 Å²	51.3	27%	0.271	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-58.7	137.8	-177.8	176.6	-99.6	0	0	0	112	K163 E167 Q170 V191 D198 N200	K163-Y165 PolarHBondContact O-N 3.12Å; Y165-E167 HydrophobicContact CE1-CB 4.11Å; Y165-Q170 HydrophobicContact CD2-CB 4.39Å; Y165-Q170 HydrophobicContact CE2-CB 3.78Å; Y165-Q170 HydrophobicContact CE2-CG 3.98Å; Y165-V191 HydrophobicContact CD2-CG1 4.02Å; Y165-V191 HydrophobicContact CD2-CG2 3.83Å; Y165-V191 HydrophobicContact CE2-CG2 3.82Å; Y165-D198 VanDerWaalsContact CB-C 3.48Å; Y165-D198 WeakPolarHBondContact CB-O 3.44Å; Y165-D198 HydrophobicContact CD1-CB 4.43Å; Y165-D198 HydrophobicContact CG-CB 3.97Å; Y165-D198 PolarHBondContact N-O 3.17Å; Y165-N200 WeakPolarHBondContact CD2-OD1 3.31Å
166	C	93.7	Very high	92.6	Very high	22 Å²	22	47.6 Å²	47.6	15%	0.149	26%	0.255	C	S	.	.			trans	-143.4	121.6	168.9	174.4	0	0	0	0	106.2	R164 C168 E169 Q170	R164-C166 PolarHBondContact O-N 3.09Å; C166-C168 VanDerWaalsContact C-N 3.34Å; C166-C168 PolarHBondContact O-N 3.4Å; C166-E169 HydrophobicContact CB-CB 4.01Å; C166-E169 PolarHBondContact O-N 3.1Å; C166-E169 VanDerWaalsContact O-N 3.16Å; C166-Q170 PolarHBondContact O-N 2.64Å
167	E	95.3	Very high	93.7	Very high	113 Å²	113	48 Å²	48	53%	0.528	25%	0.251	S	S	.	.	H	α-helix	trans	-57.4	-45.7	-176.8	178.4	177.3	-158.8	0	0	112	Y165 E169 Q170 Q171	Y165-E167 HydrophobicContact CE1-CB 4.11Å; E167-E169 VanDerWaalsContact C-N 3.32Å; E167-E169 PolarHBondContact O-N 3.45Å; E167-Q170 PolarHBondContact O-N 3.39Å; E167-Q170 PolarHBondContact O-OE1 3.08Å; E167-Q171 HydrophobicContact CG-CG 4.49Å; E167-Q171 VanDerWaalsContact CG-NE2 3.35Å; E167-Q171 WeakPolarHBondContact O-CG 3.49Å; E167-Q171 PolarHBondContact O-N 3.1Å; E167-Q171 PolarHBondContact OE1-NE2 2.65Å
168	C	95	Very high	94.6	Very high	34 Å²	34	49.2 Å²	49.2	23%	0.23	25%	0.25	C	C	.	.	H	α-helix	trans	-57.8	-43.2	176.9	175.7	0	0	0	0	112.2	C166 C172 G372 T374	C166-C168 VanDerWaalsContact C-N 3.34Å; C166-C168 PolarHBondContact O-N 3.4Å; C168-C172 PolarHBondContact O-N 3.03Å; C168-C172 VanDerWaalsContact O-N 3.12Å; C168-C172 PolarHBondContact O-SG 2.82Å; C168-G372 PolarHBondContact SG-O 2.86Å; C168-T374 PolarHBondContact SG-O 2.85Å
169	E	96.9	Very high	95.5	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.019	22%	0.218	C	C	.	.	H	α-helix	trans	-70.6	-40	177.2	-177.7	157.4	-125.1	0	0	112.6	K163 C166 E167 C172 L173 D370 F371	K163-E169 VanDerWaalsContact CD-OE2 3.26Å; K163-E169 WeakPolarHBondContact CD-OE2 3.36Å; K163-E169 WeakPolarHBondContact CE-OE2 3.4Å; K163-E169 IonicContact NZ-OE1 2.79Å; K163-E169 PolarHBondContact NZ-OE1 3.19Å; K163-E169 IonicContact NZ-OE2 2.81Å; K163-E169 PolarHBondContact NZ-OE2 3.38Å; C166-E169 HydrophobicContact CB-CB 4.01Å; C166-E169 PolarHBondContact O-N 3.1Å; C166-E169 VanDerWaalsContact O-N 3.16Å; E167-E169 VanDerWaalsContact C-N 3.32Å; E167-E169 PolarHBondContact O-N 3.45Å; E169-C172 PolarHBondContact O-N 2.85Å; E169-L173 HydrophobicContact CG-CD1 3.75Å; E169-L173 HydrophobicContact CG-CG 4.24Å; E169-L173 WeakPolarHBondContact O-CB 3.28Å; E169-L173 VanDerWaalsContact O-CG 3.24Å; E169-L173 WeakPolarHBondContact O-CG 3.33Å; E169-L173 PolarHBondContact O-N 3.22Å; E169-D370 WeakPolarHBondContact OE1-CA 3.16Å; E169-F371 HydrophobicContact CG-CB 4.21Å; E169-F371 PolarHBondContact OE1-N 2.65Å
170	Q	97.3	Very high	96.1	Very high	29 Å²	29	49.6 Å²	49.6	14%	0.136	23%	0.232	C	C	.	.	H	α-helix	trans	-60.5	-48	176	169.3	-98.3	-15	0	0	111.1	Y165 C166 E167 C172 L173 E174 Y188 V191	Y165-Q170 HydrophobicContact CD2-CB 4.39Å; Y165-Q170 HydrophobicContact CE2-CB 3.78Å; Y165-Q170 HydrophobicContact CE2-CG 3.98Å; C166-Q170 PolarHBondContact O-N 2.64Å; E167-Q170 PolarHBondContact O-N 3.39Å; E167-Q170 PolarHBondContact O-OE1 3.08Å; Q170-C172 VanDerWaalsContact C-N 3.31Å; Q170-C172 PolarHBondContact O-N 3.24Å; Q170-L173 PolarHBondContact O-N 3.15Å; Q170-E174 PolarHBondContact NE2-OE1 3.21Å; Q170-E174 WeakPolarHBondContact O-CG 3.45Å; Q170-E174 PolarHBondContact O-N 3.02Å; Q170-Y188 WeakPolarHBondContact CG-OH 3.45Å; Q170-V191 HydrophobicContact CG-CG2 4.26Å
171	Q	97.9	Very high	96.4	Very high	87 Å²	87	46.1 Å²	46.1	41%	0.407	22%	0.218	S	C	.	.	H	α-helix	trans	-61.2	-37.8	176.4	-68.9	177.4	11.9	0	0	112.5	E167 Q175	E167-Q171 HydrophobicContact CG-CG 4.49Å; E167-Q171 VanDerWaalsContact CG-NE2 3.35Å; E167-Q171 WeakPolarHBondContact O-CG 3.49Å; E167-Q171 PolarHBondContact O-N 3.1Å; E167-Q171 PolarHBondContact OE1-NE2 2.65Å; Q171-Q175 WeakPolarHBondContact O-CG 3.33Å; Q171-Q175 PolarHBondContact O-N 2.69Å; Q171-Q175 PolarHBondContact O-NE2 2.79Å
172	C	98.4	Very high	96.8	Very high	3 Å²	3	52.7 Å²	52.7	2%	0.02	24%	0.242	C	C	.	.	H	α-helix	trans	-65.7	-49.7	174.2	-71.3	0	0	0	0	111.9	C168 E169 Q170 E174 Q175 L176 F343 F371 T374	C168-C172 PolarHBondContact O-N 3.03Å; C168-C172 VanDerWaalsContact O-N 3.12Å; C168-C172 PolarHBondContact O-SG 2.82Å; E169-C172 PolarHBondContact O-N 2.85Å; Q170-C172 VanDerWaalsContact C-N 3.31Å; Q170-C172 PolarHBondContact O-N 3.24Å; C172-E174 VanDerWaalsContact C-N 3.32Å; C172-E174 PolarHBondContact O-N 3.38Å; C172-Q175 PolarHBondContact O-N 2.99Å; C172-Q175 VanDerWaalsContact O-N 3.14Å; C172-L176 HydrophobicContact CB-CD1 4.45Å; C172-L176 WeakPolarHBondContact O-CB 3.49Å; C172-L176 WeakPolarHBondContact O-CD1 3.35Å; C172-L176 WeakPolarHBondContact O-CG 3.39Å; C172-L176 PolarHBondContact O-N 3.26Å; C172-F343 HydrophobicContact CB-CE2 4.2Å; C172-F343 HydrophobicContact CB-CZ 3.95Å; C172-F371 HydrophobicContact CB-CB 3.61Å; C172-F371 HydrophobicContact CB-CG 4.18Å; C172-T374 PolarHBondContact SG-O 3.16Å
173	L	98.3	Very high	97.1	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.1	-39.2	-179	-70.8	168	0	0	0	112	E169 Q170 Q175 L176 M177 Y188 M202 F371	E169-L173 HydrophobicContact CG-CD1 3.75Å; E169-L173 HydrophobicContact CG-CG 4.24Å; E169-L173 WeakPolarHBondContact O-CB 3.28Å; E169-L173 VanDerWaalsContact O-CG 3.24Å; E169-L173 WeakPolarHBondContact O-CG 3.33Å; E169-L173 PolarHBondContact O-N 3.22Å; Q170-L173 PolarHBondContact O-N 3.15Å; L173-Q175 VanDerWaalsContact C-N 3.31Å; L173-Q175 PolarHBondContact O-N 3.13Å; L173-L176 PolarHBondContact O-N 3.23Å; L173-M177 WeakPolarHBondContact O-CG 3.26Å; L173-M177 PolarHBondContact O-N 2.86Å; L173-Y188 HydrophobicContact CB-CD1 3.95Å; L173-Y188 HydrophobicContact CB-CD2 4.02Å; L173-Y188 HydrophobicContact CB-CG 3.67Å; L173-Y188 HydrophobicContact CD1-CD2 3.74Å; L173-Y188 HydrophobicContact CD1-CE2 4.17Å; L173-Y188 HydrophobicContact CD1-CG 4.24Å; L173-Y188 HydrophobicContact CG-CD2 4.47Å; L173-Y188 HydrophobicContact CG-CG 4.49Å; L173-M202 HydrophobicContact CD1-CE 3.45Å; L173-M202 VanDerWaalsContact CD1-CE 3.45Å; L173-M202 HydrophobicContact CD2-CE 4.22Å; L173-M202 HydrophobicContact CG-CE 4.5Å; L173-F371 HydrophobicContact CD2-CD2 3.91Å; L173-F371 HydrophobicContact CD2-CE2 4.07Å; L173-F371 HydrophobicContact CG-CD2 4.38Å
174	E	98.4	Very high	97.3	Very high	75 Å²	75	56.2 Å²	56.2	35%	0.35	27%	0.266	S	S	.	.	H	α-helix	trans	-66.7	-27.9	176.2	-75.3	-172.6	-170.9	0	0	114.7	Q170 C172 K178 Y188	Q170-E174 PolarHBondContact NE2-OE1 3.21Å; Q170-E174 WeakPolarHBondContact O-CG 3.45Å; Q170-E174 PolarHBondContact O-N 3.02Å; C172-E174 VanDerWaalsContact C-N 3.32Å; C172-E174 PolarHBondContact O-N 3.38Å; E174-K178 WeakPolarHBondContact O-CD 3.27Å; E174-K178 WeakPolarHBondContact O-CE 3.4Å; E174-K178 PolarHBondContact O-NZ 3.45Å; E174-Y188 HydrophobicContact CG-CD1 3.97Å; E174-Y188 HydrophobicContact CG-CE1 3.48Å; E174-Y188 VanDerWaalsContact CG-CE1 3.48Å
175	Q	98.4	Very high	97.6	Very high	79 Å²	79	51.6 Å²	51.6	37%	0.369	25%	0.248	S	C	.	.	H	α-helix	trans	-79.2	-45.7	171.9	-70.5	-179.1	83.7	0	0	110.6	Q171 C172 L173 M177 K178 D179 F343 H347	Q171-Q175 WeakPolarHBondContact O-CG 3.33Å; Q171-Q175 PolarHBondContact O-N 2.69Å; Q171-Q175 PolarHBondContact O-NE2 2.79Å; C172-Q175 PolarHBondContact O-N 2.99Å; C172-Q175 VanDerWaalsContact O-N 3.14Å; L173-Q175 VanDerWaalsContact C-N 3.31Å; L173-Q175 PolarHBondContact O-N 3.13Å; Q175-M177 VanDerWaalsContact C-N 3.25Å; Q175-M177 PolarHBondContact O-N 3.37Å; Q175-K178 CarbonylContact O-C 3.48Å; Q175-K178 WeakPolarHBondContact O-CA 3.3Å; Q175-K178 WeakPolarHBondContact O-CB 3.36Å; Q175-K178 PolarHBondContact O-N 3.42Å; Q175-D179 PolarHBondContact O-N 3.44Å; Q175-D179 VanDerWaalsContact O-N 3.16Å; Q175-F343 HydrophobicContact CB-CD2 3.74Å; Q175-F343 HydrophobicContact CB-CE2 4.07Å; Q175-H347 PolarHBondContact NE2-NE2 3.06Å; Q175-H347 PolarHBondContact OE1-CE1 3.44Å
176	L	98.7	Very high	97.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.8	-32.4	177.9	-75.3	161.8	0	0	0	113	C172 L173 K178 D179 L181 R182 V185 F343 F371	C172-L176 HydrophobicContact CB-CD1 4.45Å; C172-L176 WeakPolarHBondContact O-CB 3.49Å; C172-L176 WeakPolarHBondContact O-CD1 3.35Å; C172-L176 WeakPolarHBondContact O-CG 3.39Å; C172-L176 PolarHBondContact O-N 3.26Å; L173-L176 PolarHBondContact O-N 3.23Å; L176-K178 PolarHBondContact O-N 2.99Å; L176-K178 VanDerWaalsContact O-N 3.16Å; L176-D179 PolarHBondContact O-N 3.48Å; L176-L181 HydrophobicContact CD2-CB 3.81Å; L176-L181 HydrophobicContact CD2-CD1 3.92Å; L176-R182 WeakPolarHBondContact O-CB 3.41Å; L176-V185 HydrophobicContact CB-CG2 4.2Å; L176-V185 HydrophobicContact CD1-CG1 4.2Å; L176-V185 HydrophobicContact CD2-CG1 4.17Å; L176-F343 HydrophobicContact CD1-CE1 4.04Å; L176-F343 HydrophobicContact CD1-CZ 4.04Å; L176-F343 HydrophobicContact CD2-CD1 3.47Å; L176-F343 VanDerWaalsContact CD2-CD1 3.47Å; L176-F343 HydrophobicContact CD2-CE1 3.65Å; L176-F343 HydrophobicContact CD2-CG 3.99Å; L176-F343 HydrophobicContact CD2-CZ 4.29Å; L176-F343 HydrophobicContact CG-CD1 3.99Å; L176-F343 HydrophobicContact CG-CD2 4.37Å; L176-F343 HydrophobicContact CG-CE1 3.84Å; L176-F343 HydrophobicContact CG-CE2 4.23Å; L176-F343 HydrophobicContact CG-CG 4.26Å; L176-F343 HydrophobicContact CG-CZ 3.96Å; L176-F371 HydrophobicContact CD1-CD1 4.06Å; L176-F371 HydrophobicContact CD1-CD2 3.95Å; L176-F371 HydrophobicContact CD1-CE1 3.81Å; L176-F371 HydrophobicContact CD1-CE2 3.69Å; L176-F371 HydrophobicContact CD1-CG 4.12Å; L176-F371 HydrophobicContact CD1-CZ 3.62Å
177	M	98.6	Very high	98	Very high	31 Å²	31	47.9 Å²	47.9	15%	0.153	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-10.6	172.4	-72.6	-55.1	102.9	0	0	114.7	L173 Q175 R182 V185 P186 Y188	L173-M177 WeakPolarHBondContact O-CG 3.26Å; L173-M177 PolarHBondContact O-N 2.86Å; Q175-M177 VanDerWaalsContact C-N 3.25Å; Q175-M177 PolarHBondContact O-N 3.37Å; M177-R182 HydrophobicContact CE-CG 4.14Å; M177-R182 WeakPolarHBondContact O-CD 3.44Å; M177-R182 HydrophobicContact SD-CG 4.17Å; M177-V185 HydrophobicContact CE-CG2 3.54Å; M177-P186 VanDerWaalsContact CE-O 3.26Å; M177-P186 WeakPolarHBondContact CE-O 3.41Å; M177-Y188 PolarHBondContact SD-N 3.13Å; M177-Y188 VanDerWaalsContact SD-N 3.39Å
178	K	98.4	Very high	98.1	Very high	169 Å²	169	43.5 Å²	43.5	74%	0.735	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.8	-9.7	177.2	-57.4	163.3	-171.4	131.7	0	112.4	E174 Q175 L176	E174-K178 WeakPolarHBondContact O-CD 3.27Å; E174-K178 WeakPolarHBondContact O-CE 3.4Å; E174-K178 PolarHBondContact O-NZ 3.45Å; Q175-K178 CarbonylContact O-C 3.48Å; Q175-K178 WeakPolarHBondContact O-CA 3.3Å; Q175-K178 WeakPolarHBondContact O-CB 3.36Å; Q175-K178 PolarHBondContact O-N 3.42Å; L176-K178 PolarHBondContact O-N 2.99Å; L176-K178 VanDerWaalsContact O-N 3.16Å
179	D	98.8	Very high	98.2	Very high	25 Å²	25	47.1 Å²	47.1	13%	0.134	22%	0.223	C	C	.	.	S	Bend	trans	-92.9	163.5	-177.6	-172.3	-95.4	0	0	0	112.4	Q175 L176 L181 R182 S341 D342 F343	Q175-D179 PolarHBondContact O-N 3.44Å; Q175-D179 VanDerWaalsContact O-N 3.16Å; L176-D179 PolarHBondContact O-N 3.48Å; D179-L181 PolarHBondContact O-N 2.96Å; D179-L181 WeakPolarHBondContact OD1-CB 3.35Å; D179-L181 WeakPolarHBondContact OD1-CG 3.39Å; D179-L181 PolarHBondContact OD1-N 3.41Å; D179-R182 WeakPolarHBondContact O-CB 3.45Å; D179-R182 PolarHBondContact O-N 3.27Å; D179-R182 VanDerWaalsContact O-N 3.15Å; D179-S341 WeakPolarHBondContact OD1-CB 3.35Å; D179-S341 PolarHBondContact OD1-OG 2.82Å; D179-S341 PolarHBondContact OD2-OG 2.64Å; D179-S341 VanDerWaalsContact OD2-OG 3.1Å; D179-D342 PolarHBondContact OD2-N 3.05Å; D179-F343 HydrophobicContact CB-CB 4.09Å; D179-F343 PolarHBondContact OD2-N 2.96Å
180	V	98.7	Very high	98.2	Very high	79 Å²	79	47.9 Å²	47.9	48%	0.479	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.4	173.8	-65.1	0	0	0	0	113.4	R182 P183 V337	V180-R182 VanDerWaalsContact C-N 3.26Å; V180-R182 PolarHBondContact O-N 3.37Å; V180-P183 WeakPolarHBondContact O-CD 3.44Å; V180-V337 HydrophobicContact CB-CG1 4Å; V180-V337 HydrophobicContact CG2-CG1 3.76Å; V180-V337 WeakPolarHBondContact O-CG1 3.24Å
181	L	98.7	Very high	98.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-8.9	174.5	-72.9	171.9	0	0	0	114.8	L176 D179 P183 Y184 L334 V337 L338 S341 F343 F344 M368	L176-L181 HydrophobicContact CD2-CB 3.81Å; L176-L181 HydrophobicContact CD2-CD1 3.92Å; D179-L181 PolarHBondContact O-N 2.96Å; D179-L181 WeakPolarHBondContact OD1-CB 3.35Å; D179-L181 WeakPolarHBondContact OD1-CG 3.39Å; D179-L181 PolarHBondContact OD1-N 3.41Å; L181-P183 VanDerWaalsContact C-N 3.28Å; L181-Y184 WeakPolarHBondContact O-CA 3.19Å; L181-Y184 WeakPolarHBondContact O-CB 3.37Å; L181-Y184 PolarHBondContact O-N 3.01Å; L181-L334 HydrophobicContact CD2-CD1 3.86Å; L181-V337 HydrophobicContact CD2-CB 4.47Å; L181-V337 HydrophobicContact CD2-CG1 3.84Å; L181-V337 HydrophobicContact CG-CG1 4.32Å; L181-L338 HydrophobicContact CD1-CD2 3.94Å; L181-L338 HydrophobicContact CD2-CD2 3.66Å; L181-L338 HydrophobicContact CD2-CG 3.96Å; L181-L338 HydrophobicContact CG-CD2 4.45Å; L181-S341 VanDerWaalsContact CD1-OG 3.27Å; L181-S341 WeakPolarHBondContact CD1-OG 3.43Å; L181-F343 HydrophobicContact CD1-CD1 4.29Å; L181-F344 HydrophobicContact CD1-CB 4.08Å; L181-M368 HydrophobicContact CD1-SD 4.33Å; L181-M368 HydrophobicContact CD2-SD 4.08Å
182	R	98.7	Very high	97.9	Very high	150 Å²	150	48.8 Å²	48.8	57%	0.566	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-44.4	-41.8	180	-179	179.6	173.6	172.4	-5.7	115	L176 M177 D179 V180 Y184	L176-R182 WeakPolarHBondContact O-CB 3.41Å; M177-R182 HydrophobicContact CE-CG 4.14Å; M177-R182 WeakPolarHBondContact O-CD 3.44Å; M177-R182 HydrophobicContact SD-CG 4.17Å; D179-R182 WeakPolarHBondContact O-CB 3.45Å; D179-R182 PolarHBondContact O-N 3.27Å; D179-R182 VanDerWaalsContact O-N 3.15Å; V180-R182 VanDerWaalsContact C-N 3.26Å; V180-R182 PolarHBondContact O-N 3.37Å; R182-Y184 PolarHBondContact O-N 2.99Å
183	P	98.4	Very high	97.7	Very high	84 Å²	84	55.4 Å²	55.4	55%	0.545	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-74	-0.2	178.8	-16.8	33.2	0	0	0	115.2	V180 L181 R330	V180-P183 WeakPolarHBondContact O-CD 3.44Å; L181-P183 VanDerWaalsContact C-N 3.28Å; P183-R330 PolarHBondContact O-NH2 3Å
184	Y	98.6	Very high	97.1	Very high	25 Å²	25	59.4 Å²	59.4	10%	0.098	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-119.8	7.4	-174.7	-58.5	-96.1	0	0	0	113	L181 R182 E333 L334 V337 W367 M368	L181-Y184 WeakPolarHBondContact O-CA 3.19Å; L181-Y184 WeakPolarHBondContact O-CB 3.37Å; L181-Y184 PolarHBondContact O-N 3.01Å; R182-Y184 PolarHBondContact O-N 2.99Å; Y184-E333 HydrophobicContact CE1-CB 4.39Å; Y184-L334 HydrophobicContact CD1-CB 3.72Å; Y184-L334 HydrophobicContact CD1-CD1 3.63Å; Y184-L334 HydrophobicContact CD1-CD2 4.46Å; Y184-L334 HydrophobicContact CD1-CG 4.11Å; Y184-L334 HydrophobicContact CE1-CB 3.82Å; Y184-L334 HydrophobicContact CE1-CD1 4.36Å; Y184-L334 HydrophobicContact CG-CD1 3.74Å; Y184-V337 HydrophobicContact CD2-CG1 4.29Å; Y184-V337 HydrophobicContact CE2-CB 4.1Å; Y184-V337 HydrophobicContact CE2-CG1 4.04Å; Y184-V337 HydrophobicContact CE2-CG2 3.79Å; Y184-W367 CarbonylContact O-C 3.53Å; Y184-W367 WeakPolarHBondContact O-CA 3.37Å; Y184-M368 PolarHBondContact O-N 3.11Å
185	V	98.5	Very high	96.6	Very high	5 Å²	5	62.1 Å²	62.1	3%	0.03	31%	0.307	C	S	.	.	S	Bend	trans	-128.4	163.2	176.2	-58.5	0	0	0	0	109.5	L176 M177 G187 M368 F371	L176-V185 HydrophobicContact CB-CG2 4.2Å; L176-V185 HydrophobicContact CD1-CG1 4.2Å; L176-V185 HydrophobicContact CD2-CG1 4.17Å; M177-V185 HydrophobicContact CE-CG2 3.54Å; V185-G187 PolarHBondContact O-N 3.38Å; V185-M368 HydrophobicContact CG1-CB 4.21Å; V185-F371 HydrophobicContact CB-CE2 4.44Å; V185-F371 HydrophobicContact CB-CZ 4.47Å; V185-F371 HydrophobicContact CG1-CE2 4.16Å; V185-F371 HydrophobicContact CG1-CZ 3.72Å
186	P	97.7	Very high	96.1	Very high	4 Å²	4	67.4 Å²	67.4	3%	0.026	33%	0.332	C	S	.	.			trans	-56.9	135.1	166.3	-20.7	30.9	0	0	0	110.8	M177 Y188 M202 D203 L205 M368 I369	M177-P186 VanDerWaalsContact CE-O 3.26Å; M177-P186 WeakPolarHBondContact CE-O 3.41Å; P186-Y188 PolarHBondContact O-N 3.39Å; P186-M202 HydrophobicContact CB-CB 4.03Å; P186-M202 HydrophobicContact CB-SD 4.3Å; P186-M202 HydrophobicContact CG-SD 4.41Å; P186-D203 HydrophobicContact CB-CB 4.45Å; P186-L205 HydrophobicContact CB-CD2 4.32Å; P186-L205 HydrophobicContact CG-CD1 4.07Å; P186-L205 HydrophobicContact CG-CD2 4.28Å; P186-L205 HydrophobicContact CG-CG 4.27Å; P186-M368 WeakPolarHBondContact CD-O 3.24Å; P186-I369 HydrophobicContact CG-CG2 4.08Å
187	G	97.6	Very high	95.7	Very high	9 Å²	9	71.7 Å²	71.7	9%	0.093	35%	0.352	C	S	.	.			trans	-59.4	136.8	166.5	0	0	0	0	0	109.9	V185 Y189 M202 D203	V185-G187 PolarHBondContact O-N 3.38Å; G187-Y189 VanDerWaalsContact O-CE2 3.29Å; G187-Y189 WeakPolarHBondContact O-CE2 3.25Å; G187-M202 CarbonylContact O-C 3.42Å; G187-M202 WeakPolarHBondContact O-CA 3.45Å; G187-M202 WeakPolarHBondContact O-CB 3.3Å; G187-D203 WeakPolarHBondContact CA-OD2 3.45Å; G187-D203 PolarHBondContact N-OD2 3.14Å; G187-D203 PolarHBondContact O-N 2.72Å
188	Y	98	Very high	95.5	Very high	21 Å²	21	73.3 Å²	73.3	8%	0.082	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	139	-177	175.5	-110.1	0	0	0	111.2	Q170 L173 E174 M177 P186 G190 V191 N200 I201	Q170-Y188 WeakPolarHBondContact CG-OH 3.45Å; L173-Y188 HydrophobicContact CB-CD1 3.95Å; L173-Y188 HydrophobicContact CB-CD2 4.02Å; L173-Y188 HydrophobicContact CB-CG 3.67Å; L173-Y188 HydrophobicContact CD1-CD2 3.74Å; L173-Y188 HydrophobicContact CD1-CE2 4.17Å; L173-Y188 HydrophobicContact CD1-CG 4.24Å; L173-Y188 HydrophobicContact CG-CD2 4.47Å; L173-Y188 HydrophobicContact CG-CG 4.49Å; E174-Y188 HydrophobicContact CG-CD1 3.97Å; E174-Y188 HydrophobicContact CG-CE1 3.48Å; E174-Y188 VanDerWaalsContact CG-CE1 3.48Å; M177-Y188 PolarHBondContact SD-N 3.13Å; M177-Y188 VanDerWaalsContact SD-N 3.39Å; P186-Y188 PolarHBondContact O-N 3.39Å; Y188-G190 VanDerWaalsContact CE2-O 3.32Å; Y188-G190 WeakPolarHBondContact CE2-O 3.39Å; Y188-G190 VanDerWaalsContact CZ-CA 3.41Å; Y188-G190 VanDerWaalsContact OH-C 3.26Å; Y188-G190 WeakPolarHBondContact OH-CA 3.44Å; Y188-G190 PolarHBondContact OH-O 2.78Å; Y188-V191 WeakPolarHBondContact OH-CG2 3.45Å; Y188-N200 HydrophobicContact CE2-CB 3.97Å; Y188-I201 VanDerWaalsContact CD2-O 3.25Å; Y188-I201 WeakPolarHBondContact CD2-O 3.44Å
189	Y	96.9	Very high	95.3	Very high	110 Å²	110	65.8 Å²	65.8	43%	0.431	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	12.8	-168.2	-58.9	-77.6	0	0	0	113.9	R160 G187 I201 D203	R160-Y189 PolarHBondContact NH2-OH 3.49Å; R160-Y189 VanDerWaalsContact NH2-OH 3.07Å; G187-Y189 VanDerWaalsContact O-CE2 3.29Å; G187-Y189 WeakPolarHBondContact O-CE2 3.25Å; Y189-I201 HydrophobicContact CD2-CG2 4.45Å; Y189-I201 PolarHBondContact N-O 3.19Å; Y189-D203 WeakPolarHBondContact CE2-OD1 3.32Å; Y189-D203 PolarHBondContact OH-OD1 2.95Å; Y189-D203 VanDerWaalsContact OH-OD1 3.11Å
190	G	96.2	Very high	95.1	Very high	21 Å²	21	64.6 Å²	64.6	22%	0.216	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	95.5	-165.2	-178.8	0	0	0	0	0	113.3	Y188 I201	Y188-G190 VanDerWaalsContact CE2-O 3.32Å; Y188-G190 WeakPolarHBondContact CE2-O 3.39Å; Y188-G190 VanDerWaalsContact CZ-CA 3.41Å; Y188-G190 VanDerWaalsContact OH-C 3.26Å; Y188-G190 WeakPolarHBondContact OH-CA 3.44Å; Y188-G190 PolarHBondContact OH-O 2.78Å; G190-I201 WeakPolarHBondContact O-CG1 3.42Å; G190-I201 PolarHBondContact O-N 3.16Å
191	V	95.9	Very high	95	Very high	63 Å²	63	62.6 Å²	62.6	38%	0.382	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	138.9	-177.3	-173.8	0	0	0	0	110.3	Y165 Q170 Y188 D198 F199	Y165-V191 HydrophobicContact CD2-CG1 4.02Å; Y165-V191 HydrophobicContact CD2-CG2 3.83Å; Y165-V191 HydrophobicContact CE2-CG2 3.82Å; Q170-V191 HydrophobicContact CG-CG2 4.26Å; Y188-V191 WeakPolarHBondContact OH-CG2 3.45Å; V191-D198 HydrophobicContact CG1-CB 3.8Å; V191-F199 CarbonylContact C-O 3.45Å; V191-F199 WeakPolarHBondContact CA-O 3.49Å
192	L	93.9	Very high	94.9	Very high	71 Å²	71	63 Å²	63	37%	0.372	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	124.5	170.5	177.4	64.2	0	0	0	109.8	L162 F199 I201	L162-L192 HydrophobicContact CD1-CD2 4.05Å; L162-L192 HydrophobicContact CD2-CD2 3.97Å; L192-F199 PolarHBondContact N-O 2.82Å; L192-F199 PolarHBondContact O-N 3.25Å; L192-I201 HydrophobicContact CB-CD1 3.82Å; L192-I201 HydrophobicContact CB-CG1 3.77Å
193	Q	93.6	Very high	94.7	Very high	142 Å²	142	58.1 Å²	58.1	66%	0.664	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	127.6	167.3	-167.9	173.9	34	0	0	109.9	D198	Q193-D198 WeakPolarHBondContact CA-OD1 3.29Å; Q193-D198 VanDerWaalsContact CB-OD1 3.31Å; Q193-D198 WeakPolarHBondContact CB-OD1 3.4Å; Q193-D198 WeakPolarHBondContact CG-OD1 3.5Å
194	K	87.2	Confident	94.5	Very high	85 Å²	85	55.6 Å²	55.6	37%	0.37	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	132.3	178.9	-179.9	-177.2	173.6	-171	0	110	E196 Q197 F199	K194-E196 VanDerWaalsContact C-N 3.26Å; K194-E196 PolarHBondContact O-N 3.25Å; K194-Q197 PolarHBondContact N-O 2.86Å; K194-Q197 PolarHBondContact O-N 3.1Å; K194-F199 HydrophobicContact CB-CD2 4.23Å; K194-F199 HydrophobicContact CB-CE2 4.19Å
195	D	87.4	Confident	94.4	Very high	131 Å²	131	55.5 Å²	55.5	70%	0.701	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	45.2	177.3	-52.5	-38	0	0	0	112.6	Q197	D195-Q197 PolarHBondContact O-N 3.4Å; D195-Q197 VanDerWaalsContact O-N 3.12Å
196	E	88.4	Confident	94.2	Very high	190 Å²	190	55.9 Å²	55.9	89%	0.888	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	10.6	-175.4	-56.5	-175.7	159.1	0	0	115.6	K194	K194-E196 VanDerWaalsContact C-N 3.26Å; K194-E196 PolarHBondContact O-N 3.25Å
197	Q	90.4	Very high	93.9	Very high	90 Å²	90	57.6 Å²	57.6	42%	0.421	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	143.4	175.8	-69.6	172.8	47.4	0	0	111.6	K194 D195 F199	K194-Q197 PolarHBondContact N-O 2.86Å; K194-Q197 PolarHBondContact O-N 3.1Å; D195-Q197 PolarHBondContact O-N 3.4Å; D195-Q197 VanDerWaalsContact O-N 3.12Å; Q197-F199 HydrophobicContact CB-CE2 3.66Å; Q197-F199 HydrophobicContact CB-CZ 3.99Å; Q197-F199 WeakPolarHBondContact O-CD2 3.43Å
198	D	93.4	Very high	93.6	Very high	66 Å²	66	62.3 Å²	62.3	35%	0.353	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	142.7	174.4	-70.8	-30	0	0	0	111.3	Y165 V191 Q193	Y165-D198 VanDerWaalsContact CB-C 3.48Å; Y165-D198 WeakPolarHBondContact CB-O 3.44Å; Y165-D198 HydrophobicContact CD1-CB 4.43Å; Y165-D198 HydrophobicContact CG-CB 3.97Å; Y165-D198 PolarHBondContact N-O 3.17Å; V191-D198 HydrophobicContact CG1-CB 3.8Å; Q193-D198 WeakPolarHBondContact CA-OD1 3.29Å; Q193-D198 VanDerWaalsContact CB-OD1 3.31Å; Q193-D198 WeakPolarHBondContact CB-OD1 3.4Å; Q193-D198 WeakPolarHBondContact CG-OD1 3.5Å
199	F	94.6	Very high	93.4	Very high	10 Å²	10	61.6 Å²	61.6	4%	0.044	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	130.8	179.3	-63.4	-91.6	0	0	0	111.6	L162 K163 V191 L192 K194 Q197 I201	L162-F199 HydrophobicContact CB-CB 4Å; L162-F199 HydrophobicContact CB-CD1 4.14Å; L162-F199 HydrophobicContact CB-CG 4.23Å; L162-F199 HydrophobicContact CD2-CB 4.44Å; K163-F199 CarbonylContact O-C 3.39Å; K163-F199 WeakPolarHBondContact O-CA 3.26Å; V191-F199 CarbonylContact C-O 3.45Å; V191-F199 WeakPolarHBondContact CA-O 3.49Å; L192-F199 PolarHBondContact N-O 2.82Å; L192-F199 PolarHBondContact O-N 3.25Å; K194-F199 HydrophobicContact CB-CD2 4.23Å; K194-F199 HydrophobicContact CB-CE2 4.19Å; Q197-F199 HydrophobicContact CB-CE2 3.66Å; Q197-F199 HydrophobicContact CB-CZ 3.99Å; Q197-F199 WeakPolarHBondContact O-CD2 3.43Å; F199-I201 PolarHBondContact O-N 2.91Å
200	N	95.2	Very high	93.2	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	121.9	165.4	-73.8	-26.1	0	0	0	109.4	K163 Y165 Y188	K163-N200 PolarHBondContact N-O 2.96Å; K163-N200 PolarHBondContact O-N 3.03Å; Y165-N200 WeakPolarHBondContact CD2-OD1 3.31Å; Y188-N200 HydrophobicContact CE2-CB 3.97Å
201	I	95.9	Very high	93	Very high	37 Å²	37	65.9 Å²	65.9	19%	0.19	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	121.2	175.4	-44.7	169.6	0	0	0	108.6	R160 L162 Y188 Y189 G190 L192 F199	R160-I201 HydrophobicContact CB-CG2 4.4Å; R160-I201 HydrophobicContact CG-CG2 4.5Å; L162-I201 HydrophobicContact CD2-CB 4.33Å; L162-I201 HydrophobicContact CD2-CG1 3.93Å; L162-I201 HydrophobicContact CD2-CG2 4.23Å; Y188-I201 VanDerWaalsContact CD2-O 3.25Å; Y188-I201 WeakPolarHBondContact CD2-O 3.44Å; Y189-I201 HydrophobicContact CD2-CG2 4.45Å; Y189-I201 PolarHBondContact N-O 3.19Å; G190-I201 WeakPolarHBondContact O-CG1 3.42Å; G190-I201 PolarHBondContact O-N 3.16Å; L192-I201 HydrophobicContact CB-CD1 3.82Å; L192-I201 HydrophobicContact CB-CG1 3.77Å; F199-I201 PolarHBondContact O-N 2.91Å
202	M	95.9	Very high	92.9	Very high	10 Å²	10	63.3 Å²	63.3	5%	0.049	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	170.5	179	48.9	173.1	49.8	0	0	112.9	R160 L161 K163 L173 P186 G187	R160-M202 CarbonylContact C-O 3.59Å; R160-M202 VanDerWaalsContact CA-O 3.29Å; R160-M202 WeakPolarHBondContact CA-O 3.46Å; R160-M202 WeakPolarHBondContact CD-O 3.04Å; L161-M202 HydrophobicContact CB-CG 4.22Å; L161-M202 HydrophobicContact CD2-SD 4.45Å; L161-M202 PolarHBondContact N-O 3.06Å; L161-M202 PolarHBondContact O-N 2.91Å; K163-M202 HydrophobicContact CB-SD 4.29Å; K163-M202 HydrophobicContact CD-CE 4.49Å; K163-M202 HydrophobicContact CD-SD 4.42Å; L173-M202 HydrophobicContact CD1-CE 3.45Å; L173-M202 VanDerWaalsContact CD1-CE 3.45Å; L173-M202 HydrophobicContact CD2-CE 4.22Å; L173-M202 HydrophobicContact CG-CE 4.5Å; P186-M202 HydrophobicContact CB-CB 4.03Å; P186-M202 HydrophobicContact CB-SD 4.3Å; P186-M202 HydrophobicContact CG-SD 4.41Å; G187-M202 CarbonylContact O-C 3.42Å; G187-M202 WeakPolarHBondContact O-CA 3.45Å; G187-M202 WeakPolarHBondContact O-CB 3.3Å
203	D	95.7	Very high	93.1	Very high	46 Å²	46	60.5 Å²	60.5	25%	0.246	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	136.7	169.6	-76.8	-36.3	0	0	0	111	R160 P186 G187 Y189 L205	R160-D203 IonicContact CZ-OD1 2.78Å; R160-D203 IonicContact NH1-OD1 2.65Å; R160-D203 PolarHBondContact NH1-OD1 2.9Å; R160-D203 IonicContact NH2-OD1 2.83Å; P186-D203 HydrophobicContact CB-CB 4.45Å; G187-D203 WeakPolarHBondContact CA-OD2 3.45Å; G187-D203 PolarHBondContact N-OD2 3.14Å; G187-D203 PolarHBondContact O-N 2.72Å; Y189-D203 WeakPolarHBondContact CE2-OD1 3.32Å; Y189-D203 PolarHBondContact OH-OD1 2.95Å; Y189-D203 VanDerWaalsContact OH-OD1 3.11Å; D203-L205 PolarHBondContact O-N 3.5Å
204	D	94.2	Very high	93.3	Very high	31 Å²	31	54 Å²	54	17%	0.166	28%	0.275	C	S	.	.			trans	-81.2	103	160.8	170	33.9	0	0	0	109.3	G159 L161 L206 T207	G159-D204 PolarHBondContact O-N 2.87Å; G159-D204 VanDerWaalsContact O-N 3.14Å; L161-D204 HydrophobicContact CB-CB 4.22Å; D204-L206 PolarHBondContact O-N 2.83Å; D204-L206 WeakPolarHBondContact OD1-CB 3.48Å; D204-L206 PolarHBondContact OD1-N 2.95Å; D204-L206 VanDerWaalsContact OD1-N 3.16Å; D204-T207 WeakPolarHBondContact O-CB 3.5Å; D204-T207 PolarHBondContact O-N 3.02Å; D204-T207 VanDerWaalsContact O-N 3.1Å; D204-T207 PolarHBondContact O-OG1 3.42Å; D204-T207 PolarHBondContact OD2-N 3.11Å; D204-T207 PolarHBondContact OD2-OG1 2.97Å
205	L	95.4	Very high	93.8	Very high	24 Å²	24	49.9 Å²	49.9	13%	0.126	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-15.7	-179.1	-60.6	-178.1	0	0	0	113.9	P186 D203 F209 L355 W367 I369	P186-L205 HydrophobicContact CB-CD2 4.32Å; P186-L205 HydrophobicContact CG-CD1 4.07Å; P186-L205 HydrophobicContact CG-CD2 4.28Å; P186-L205 HydrophobicContact CG-CG 4.27Å; D203-L205 PolarHBondContact O-N 3.5Å; L205-F209 WeakPolarHBondContact O-CD2 3.39Å; L205-F209 WeakPolarHBondContact O-CE2 3.34Å; L205-L355 HydrophobicContact CD1-CD2 3.85Å; L205-W367 HydrophobicContact CD1-CB 3.71Å; L205-W367 HydrophobicContact CD1-CD2 3.91Å; L205-W367 HydrophobicContact CD1-CE3 4.08Å; L205-W367 HydrophobicContact CD1-CG 3.77Å; L205-W367 HydrophobicContact CD2-CD2 3.91Å; L205-W367 HydrophobicContact CD2-CG 3.93Å; L205-W367 HydrophobicContact CD2-CZ2 4.39Å; L205-W367 HydrophobicContact CG-CD2 4.38Å; L205-W367 HydrophobicContact CG-CG 4.48Å; L205-I369 HydrophobicContact CD1-CG2 4.04Å
206	L	94	Very high	94.3	Very high	13 Å²	13	43.9 Å²	43.9	7%	0.068	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-14	-179.1	-52.1	-179.2	0	0	0	113.6	D204 D208 F209 P212 I214 V357	D204-L206 PolarHBondContact O-N 2.83Å; D204-L206 WeakPolarHBondContact OD1-CB 3.48Å; D204-L206 PolarHBondContact OD1-N 2.95Å; D204-L206 VanDerWaalsContact OD1-N 3.16Å; L206-D208 PolarHBondContact O-N 2.92Å; L206-F209 PolarHBondContact O-N 3.09Å; L206-P212 HydrophobicContact CB-CG 4.4Å; L206-P212 HydrophobicContact CD2-CB 4.42Å; L206-P212 HydrophobicContact CD2-CG 4.28Å; L206-I214 HydrophobicContact CD1-CD1 3.62Å; L206-I214 HydrophobicContact CD2-CD1 3.62Å; L206-I214 HydrophobicContact CD2-CG1 3.9Å; L206-I214 HydrophobicContact CG-CD1 4.29Å; L206-V357 HydrophobicContact CD2-CG1 3.78Å; L206-V357 HydrophobicContact CD2-CG2 3.9Å
207	T	91.4	Very high	94.8	Very high	40 Å²	40	34.9 Å²	34.9	25%	0.245	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-24.5	-168.5	-83.2	0	0	0	0	115.4	K136 G159 D204	K136-T207 PolarHBondContact NZ-O 2.99Å; G159-T207 WeakPolarHBondContact CA-OG1 3.16Å; D204-T207 WeakPolarHBondContact O-CB 3.5Å; D204-T207 PolarHBondContact O-N 3.02Å; D204-T207 VanDerWaalsContact O-N 3.1Å; D204-T207 PolarHBondContact O-OG1 3.42Å; D204-T207 PolarHBondContact OD2-N 3.11Å; D204-T207 PolarHBondContact OD2-OG1 2.97Å
208	D	91.7	Very high	95.1	Very high	107 Å²	107	31.8 Å²	31.8	57%	0.572	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.2	19.5	-179	-68.1	-34.7	0	0	0	113.8	K136 L206 K363	K136-D208 IonicContact NZ-OD1 2.82Å; K136-D208 PolarHBondContact NZ-OD1 3.11Å; L206-D208 PolarHBondContact O-N 2.92Å; D208-K363 PolarHBondContact O-NZ 2.96Å
209	F	93.8	Very high	95.3	Very high	6 Å²	6	28.7 Å²	28.7	3%	0.026	15%	0.151	C	C	.	.			trans	-112.3	144.9	171.5	-67.8	-97.2	0	0	0	110.3	L205 L206 P212 V357 D359 K363 W367	L205-F209 WeakPolarHBondContact O-CD2 3.39Å; L205-F209 WeakPolarHBondContact O-CE2 3.34Å; L206-F209 PolarHBondContact O-N 3.09Å; F209-P212 HydrophobicContact CB-CB 3.77Å; F209-P212 HydrophobicContact CB-CG 4.13Å; F209-P212 HydrophobicContact CG-CB 4.4Å; F209-V357 HydrophobicContact CB-CG1 4.44Å; F209-V357 HydrophobicContact CD1-CG1 3.83Å; F209-V357 HydrophobicContact CD2-CB 4.5Å; F209-V357 HydrophobicContact CD2-CG1 3.72Å; F209-V357 HydrophobicContact CE1-CB 4.16Å; F209-V357 HydrophobicContact CE1-CG1 3.86Å; F209-V357 HydrophobicContact CE2-CB 4.05Å; F209-V357 HydrophobicContact CE2-CG1 3.76Å; F209-V357 HydrophobicContact CG-CG1 3.75Å; F209-V357 HydrophobicContact CZ-CB 3.85Å; F209-V357 HydrophobicContact CZ-CG1 3.83Å; F209-D359 VanDerWaalsContact CA-OD2 3.32Å; F209-D359 WeakPolarHBondContact CA-OD2 3.26Å; F209-D359 HydrophobicContact CB-CB 4.38Å; F209-D359 HydrophobicContact CD1-CB 4.17Å; F209-D359 WeakPolarHBondContact CD1-OD2 3.21Å; F209-K363 HydrophobicContact CD1-CB 4.39Å; F209-K363 HydrophobicContact CD1-CD 3.89Å; F209-K363 HydrophobicContact CD1-CG 4.1Å; F209-K363 HydrophobicContact CE1-CB 4.22Å; F209-K363 HydrophobicContact CE1-CD 3.78Å; F209-K363 HydrophobicContact CE1-CG 3.64Å; F209-K363 HydrophobicContact CG-CD 4.4Å; F209-K363 HydrophobicContact CZ-CD 4.19Å; F209-K363 HydrophobicContact CZ-CG 4.22Å; F209-W367 AromaticContact CE2-CH2 3.73Å; F209-W367 HydrophobicContact CE2-CH2 3.73Å; F209-W367 HydrophobicContact CE2-CZ3 4.16Å; F209-W367 AromaticContact CZ-CH2 3.83Å; F209-W367 HydrophobicContact CZ-CH2 3.83Å; F209-W367 HydrophobicContact CZ-CZ3 4.14Å
210	D	92.9	Very high	95.4	Very high	104 Å²	104	28.3 Å²	28.3	56%	0.556	15%	0.15	S	C	*	.	S	Bend	trans	-99.4	121.5	174.5	-169	15.9	0	0	0	110.9	D359	D210-D359 PolarHBondContact N-OD2 3.36Å; D210-D359 WeakPolarHBondContact O-CB 3Å
211	M	91.4	Very high	95.4	Very high	117 Å²	117	29.4 Å²	29.4	58%	0.576	16%	0.158	S	C	*	.	S	Bend	trans	44.9	57.9	-173.4	-63.6	-179.9	52.6	0	0	113.5	S213 G292	M211-S213 PolarHBondContact O-N 3.24Å; M211-G292 WeakPolarHBondContact CE-O 3.45Å; M211-G292 WeakPolarHBondContact O-CA 3.28Å
212	P	95.5	Very high	95.2	Very high	9 Å²	9	28.1 Å²	28.1	6%	0.058	15%	0.15	C	C	.	.			trans	-61.6	136.6	-170.4	20.9	-32	0	0	0	113.8	L206 F209 I214 V357 H358	L206-P212 HydrophobicContact CB-CG 4.4Å; L206-P212 HydrophobicContact CD2-CB 4.42Å; L206-P212 HydrophobicContact CD2-CG 4.28Å; F209-P212 HydrophobicContact CB-CB 3.77Å; F209-P212 HydrophobicContact CB-CG 4.13Å; F209-P212 HydrophobicContact CG-CB 4.4Å; P212-I214 HydrophobicContact CB-CG1 4.1Å; P212-I214 HydrophobicContact CG-CD1 4.46Å; P212-V357 HydrophobicContact CB-CG1 3.67Å; P212-H358 CarbonylContact C-O 3.59Å; P212-H358 VanDerWaalsContact CA-O 3.32Å; P212-H358 WeakPolarHBondContact CA-O 3.44Å
213	S	97.2	Very high	94.7	Very high	13 Å²	13	27.9 Å²	27.9	9%	0.091	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133.7	156.3	-57.8	0	0	0	0	108.8	M211 K290 G292 V357 H358	M211-S213 PolarHBondContact O-N 3.24Å; S213-K290 CarbonylContact C-O 3.54Å; S213-K290 VanDerWaalsContact CA-O 3.3Å; S213-K290 WeakPolarHBondContact CA-O 3.46Å; S213-G292 PolarHBondContact OG-N 3.35Å; S213-V357 WeakPolarHBondContact O-CA 3.46Å; S213-H358 WeakPolarHBondContact CB-CE1 3.04Å; S213-H358 WeakPolarHBondContact CB-NE2 3.43Å; S213-H358 PolarHBondContact N-O 3.32Å; S213-H358 PolarHBondContact O-N 3.35Å; S213-H358 PolarHBondContact OG-CE1 3.18Å
214	I	97.6	Very high	94.2	Very high	4 Å²	4	25.9 Å²	25.9	2%	0.021	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	137.5	-170.2	-47.9	167.6	0	0	0	108.4	L144 L206 P212 I289 K290 L355 F356 V357	L144-I214 HydrophobicContact CD1-CB 3.82Å; L144-I214 HydrophobicContact CD1-CG2 3.52Å; L144-I214 WeakPolarHBondContact CD1-O 3.37Å; L144-I214 HydrophobicContact CG-CG2 4.2Å; L206-I214 HydrophobicContact CD1-CD1 3.62Å; L206-I214 HydrophobicContact CD2-CD1 3.62Å; L206-I214 HydrophobicContact CD2-CG1 3.9Å; L206-I214 HydrophobicContact CG-CD1 4.29Å; P212-I214 HydrophobicContact CB-CG1 4.1Å; P212-I214 HydrophobicContact CG-CD1 4.46Å; I214-I289 CarbonylContact O-C 3.5Å; I214-I289 WeakPolarHBondContact O-CA 3.1Å; I214-K290 PolarHBondContact N-O 2.81Å; I214-K290 PolarHBondContact O-N 3.04Å; I214-K290 VanDerWaalsContact O-O 3.12Å; I214-L355 HydrophobicContact CG2-CD1 3.61Å; I214-L355 HydrophobicContact CG2-CG 4.15Å; I214-F356 CarbonylContact C-O 3.59Å; I214-F356 VanDerWaalsContact CA-O 3.3Å; I214-F356 WeakPolarHBondContact CA-O 3.39Å; I214-V357 HydrophobicContact CG1-CG1 4.45Å; I214-V357 HydrophobicContact CG2-CG2 4.47Å
215	M	98.1	Very high	94.1	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	134.9	172.8	168	178.8	72.3	0	0	110.6	I286 G288 I289 F313 F316 F356	M215-I286 HydrophobicContact CG-CG2 4.24Å; M215-I286 HydrophobicContact SD-CD1 4.34Å; M215-I286 HydrophobicContact SD-CG1 4.35Å; M215-I286 HydrophobicContact SD-CG2 4.43Å; M215-G288 WeakPolarHBondContact CA-O 3.42Å; M215-I289 HydrophobicContact CB-CG1 4.02Å; M215-I289 HydrophobicContact CG-CD1 4.29Å; M215-I289 HydrophobicContact CG-CG1 3.83Å; M215-I289 HydrophobicContact SD-CD1 3.96Å; M215-I289 HydrophobicContact SD-CG1 4.18Å; M215-F313 HydrophobicContact CE-CD1 3.58Å; M215-F313 HydrophobicContact CE-CE1 3.43Å; M215-F313 VanDerWaalsContact CE-CE1 3.43Å; M215-F313 HydrophobicContact SD-CD1 3.6Å; M215-F313 HydrophobicContact SD-CE1 3.55Å; M215-F313 VanDerWaalsContact SD-CE1 3.55Å; M215-F316 HydrophobicContact CB-CD1 4.11Å; M215-F316 HydrophobicContact CB-CD2 4.01Å; M215-F316 HydrophobicContact CB-CE1 3.75Å; M215-F316 HydrophobicContact CB-CE2 3.64Å; M215-F316 HydrophobicContact CB-CG 4.24Å; M215-F316 HydrophobicContact CB-CZ 3.49Å; M215-F316 VanDerWaalsContact CB-CZ 3.49Å; M215-F316 HydrophobicContact CE-CD1 3.65Å; M215-F316 HydrophobicContact CE-CE1 3.77Å; M215-F316 HydrophobicContact CE-CG 4.45Å; M215-F316 HydrophobicContact SD-CD1 3.92Å; M215-F316 HydrophobicContact SD-CE1 4.34Å; M215-F316 HydrophobicContact SD-CG 4.14Å; M215-F356 HydrophobicContact CB-CB 4.16Å; M215-F356 HydrophobicContact CE-CB 3.92Å; M215-F356 HydrophobicContact CE-CD1 3.88Å; M215-F356 HydrophobicContact CE-CD2 3.62Å; M215-F356 HydrophobicContact CE-CE1 4.29Å; M215-F356 HydrophobicContact CE-CE2 4.05Å; M215-F356 HydrophobicContact CE-CG 3.53Å; M215-F356 HydrophobicContact CE-CZ 4.37Å; M215-F356 PolarHBondContact N-O 2.87Å; M215-F356 PolarHBondContact O-N 3.3Å
216	D	97.9	Very high	93.8	Very high	5 Å²	5	25.1 Å²	25.1	3%	0.027	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	119.3	176.4	-173.5	-48.3	0	0	0	109.6	L144 A145 E287 G288 S353	L144-D216 HydrophobicContact CB-CB 4.21Å; L144-D216 HydrophobicContact CD1-CB 4.35Å; A145-D216 HydrophobicContact CB-CB 4.49Å; A145-D216 WeakPolarHBondContact CB-OD2 3.39Å; D216-E287 HydrophobicContact CB-CB 4.45Å; D216-E287 PolarHBondContact O-N 2.87Å; D216-G288 PolarHBondContact N-O 2.74Å; D216-S353 WeakPolarHBondContact OD1-CB 3.17Å; D216-S353 PolarHBondContact OD1-OG 2.87Å
217	C	97.8	Very high	93.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	108	173.1	-72.1	0	0	0	0	110.6	R285 S353 L354 F356	C217-R285 CarbonylContact C-O 3.26Å; C217-R285 VanDerWaalsContact CA-O 3.27Å; C217-R285 WeakPolarHBondContact CA-O 3.43Å; C217-S353 CarbonylContact O-C 3.57Å; C217-S353 WeakPolarHBondContact O-CA 3.49Å; C217-S353 WeakPolarHBondContact O-CB 3.45Å; C217-L354 PolarHBondContact N-O 2.89Å; C217-L354 PolarHBondContact O-N 2.84Å; C217-F356 HydrophobicContact CB-CE2 4.09Å
218	K	97.4	Very high	93.2	Very high	26 Å²	26	27.5 Å²	27.5	11%	0.113	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	129.3	172.8	-168.4	127.8	-61.8	145.8	0	110.2	F284 R285 E287 G351 S353	K218-F284 CarbonylContact O-C 3.58Å; K218-F284 WeakPolarHBondContact O-CA 3.43Å; K218-F284 WeakPolarHBondContact O-CB 3.42Å; K218-R285 HydrophobicContact CB-CG 4.21Å; K218-R285 PolarHBondContact N-O 3.37Å; K218-R285 PolarHBondContact O-N 3.1Å; K218-E287 HydrophobicContact CB-CG 3.74Å; K218-E287 WeakPolarHBondContact CD-OE2 3.43Å; K218-E287 IonicContact NZ-OE2 3.93Å; K218-E287 PolarHBondContact NZ-OE2 2.67Å; K218-G351 WeakPolarHBondContact CE-O 3.47Å; K218-S353 WeakPolarHBondContact CA-OG 3.23Å; K218-S353 VanDerWaalsContact CE-OG 3.27Å; K218-S353 WeakPolarHBondContact CE-OG 3.22Å; K218-S353 PolarHBondContact N-OG 2.81Å
219	M	98.3	Very high	92.9	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	162.4	-174.4	-60.9	-56.5	-67.4	0	0	113	F284 S352 L354 Y398 L405	M219-F284 HydrophobicContact CE-CB 4.18Å; M219-F284 HydrophobicContact SD-CB 3.67Å; M219-S352 PolarHBondContact N-O 2.85Å; M219-L354 HydrophobicContact CE-CD1 3.9Å; M219-L354 HydrophobicContact CG-CB 4.48Å; M219-L354 HydrophobicContact CG-CD1 4.15Å; M219-L354 HydrophobicContact CG-CG 3.78Å; M219-L354 HydrophobicContact SD-CB 4.43Å; M219-L354 HydrophobicContact SD-CD1 3.63Å; M219-L354 HydrophobicContact SD-CG 3.88Å; M219-Y398 HydrophobicContact CB-CD2 3.52Å; M219-Y398 HydrophobicContact CB-CE1 4.48Å; M219-Y398 HydrophobicContact CB-CE2 3.29Å; M219-Y398 HydrophobicContact CB-CG 4.2Å; M219-Y398 HydrophobicContact CE-CE1 4.4Å; M219-Y398 HydrophobicContact CG-CD2 4.37Å; M219-Y398 HydrophobicContact CG-CE1 4.42Å; M219-Y398 HydrophobicContact CG-CE2 3.73Å; M219-L405 HydrophobicContact CE-CD2 4.39Å; M219-L405 HydrophobicContact SD-CD2 4.44Å
220	G	97.2	Very high	92.5	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.01	14%	0.136	C	C	.	.	S	Bend	trans	96.1	156.2	179.2	0	0	0	0	0	113.4	R222 T279 G283 D396	G220-R222 PolarHBondContact O-N 3.15Å; G220-T279 VanDerWaalsContact O-CG2 3.28Å; G220-T279 WeakPolarHBondContact O-CG2 3.33Å; G220-G283 CarbonylContact C-O 3.54Å; G220-G283 VanDerWaalsContact C-O 3.23Å; G220-G283 WeakPolarHBondContact CA-O 3.48Å; G220-G283 PolarHBondContact N-O 3.19Å; G220-G283 CarbonylContact O-C 3.52Å; G220-G283 VanDerWaalsContact O-C 3.26Å; G220-G283 VanDerWaalsContact O-O 3.08Å; G220-D396 CarbonylContact C-O 3.12Å; G220-D396 WeakPolarHBondContact CA-O 3.44Å
221	S	94.1	Very high	92.1	Very high	24 Å²	24	27.7 Å²	27.7	17%	0.168	14%	0.137	C	C	.	.	S	Bend	trans	-75.9	-10	170.9	56.6	0	0	0	0	113.2	D396	S221-D396 PolarHBondContact N-O 2.79Å; S221-D396 PolarHBondContact OG-O 3.03Å
222	R	91.3	Very high	91.6	Very high	9 Å²	9	23 Å²	23	3%	0.034	12%	0.117	C	C	.	.			trans	-141.8	158.5	178.9	65.7	-178.8	177.2	99.9	-2.6	112.5	G220 C224 E274 E348 W389 R394 E395	G220-R222 PolarHBondContact O-N 3.15Å; R222-C224 PolarHBondContact NH1-O 3.3Å; R222-E274 WeakPolarHBondContact CA-OE1 3.21Å; R222-E348 IonicContact CZ-OE1 2.7Å; R222-E348 IonicContact NH1-OE1 3.41Å; R222-E348 PolarHBondContact NH1-OE1 2.93Å; R222-E348 IonicContact NH2-OE1 3.62Å; R222-E348 PolarHBondContact NH2-OE1 2.74Å; R222-E348 IonicContact NH2-OE2 3.77Å; R222-W389 VanDerWaalsContact NE-CD1 3.34Å; R222-R394 VanDerWaalsContact NH2-C 3.26Å; R222-R394 PolarHBondContact NH2-O 3Å; R222-E395 PolarHBondContact NE-O 2.63Å; R222-E395 PolarHBondContact NH2-O 3.42Å
223	T	85.3	Confident	90.9	Very high	6 Å²	6	27.8 Å²	27.8	4%	0.037	14%	0.137	C	C	.	.	S	Bend	trans	-125.1	-2	-171.4	59.9	0	0	0	0	114.4	M270 E274 T279	T223-M270 WeakPolarHBondContact OG1-CE 3.39Å; T223-E274 WeakPolarHBondContact CB-OE1 3.38Å; T223-E274 HydrophobicContact CG2-CG 4.13Å; T223-E274 PolarHBondContact N-OE1 3.32Å; T223-E274 PolarHBondContact OG1-OE1 3.49Å; T223-T279 HydrophobicContact CG2-CG2 4.21Å
224	C	86.7	Confident	90.3	Very high	4 Å²	4	33.9 Å²	33.9	3%	0.027	16%	0.163	C	C	.	.	S	Bend	trans	-115.1	140.6	172.9	-97.4	0	0	0	0	110.6	R222 E228 L229	R222-C224 PolarHBondContact NH1-O 3.3Å; C224-E228 WeakPolarHBondContact CA-OE2 3.36Å; C224-E228 PolarHBondContact SG-OE2 3.45Å; C224-L229 HydrophobicContact CB-CD2 3.97Å; C224-L229 HydrophobicContact CB-CG 4.33Å
225	L	90.6	Very high	89.5	Confident	21 Å²	21	38.2 Å²	38.2	11%	0.11	19%	0.193	C	C	.	.			trans	-65	151.4	169.1	-74.6	171.8	0	0	0	110	E227 E228 L229 E348 V350 K373 V375	L225-E227 VanDerWaalsContact C-N 3.28Å; L225-E227 PolarHBondContact O-N 3.23Å; L225-E228 HydrophobicContact CB-CB 4.32Å; L225-E228 HydrophobicContact CB-CG 4.06Å; L225-E228 PolarHBondContact N-OE2 3.15Å; L225-E228 VanDerWaalsContact N-OE2 3.15Å; L225-E228 WeakPolarHBondContact O-CB 3.23Å; L225-E228 PolarHBondContact O-N 2.97Å; L225-E228 VanDerWaalsContact O-N 3.07Å; L225-L229 PolarHBondContact O-N 3.2Å; L225-E348 WeakPolarHBondContact CA-OE1 3.38Å; L225-E348 HydrophobicContact CD2-CG 3.87Å; L225-E348 WeakPolarHBondContact CD2-OE1 3.39Å; L225-V350 HydrophobicContact CD2-CB 4.03Å; L225-V350 HydrophobicContact CD2-CG2 4.24Å; L225-K373 HydrophobicContact CD1-CB 4.36Å; L225-K373 WeakPolarHBondContact CD2-O 3.32Å; L225-K373 HydrophobicContact CG-CB 4.5Å; L225-V375 HydrophobicContact CD1-CG1 3.95Å; L225-V375 HydrophobicContact CD2-CG1 4.2Å; L225-V375 HydrophobicContact CD2-CG2 3.63Å
226	E	89.1	Confident	88.7	Confident	17 Å²	17	44.7 Å²	44.7	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-65	-35.8	179.4	-160.4	166.7	122.4	0	0	111.6	E228 L229 I230 E348 W389 G392 R394	E226-E228 VanDerWaalsContact C-N 3.3Å; E226-E228 PolarHBondContact O-N 2.95Å; E226-L229 WeakPolarHBondContact O-CB 3.15Å; E226-L229 PolarHBondContact O-N 2.53Å; E226-I230 HydrophobicContact CG-CD1 4.47Å; E226-I230 WeakPolarHBondContact O-CG1 3.34Å; E226-I230 PolarHBondContact O-N 3.02Å; E226-E348 PolarHBondContact N-OE1 3.34Å; E226-W389 PolarHBondContact OE2-NE1 3.35Å; E226-G392 VanDerWaalsContact OE1-CA 3.23Å; E226-G392 WeakPolarHBondContact OE1-CA 3.22Å; E226-G392 PolarHBondContact OE1-N 2.72Å; E226-G392 PolarHBondContact OE2-N 3.13Å; E226-R394 PolarHBondContact OE2-N 3.33Å
227	E	87.6	Confident	88.1	Confident	66 Å²	66	51.8 Å²	51.8	31%	0.308	25%	0.25	S	C	.	.	H	α-helix	trans	-64.7	-30.1	172.7	-60.8	85.4	170.7	0	0	113.1	L225 L229 K231 R394	L225-E227 VanDerWaalsContact C-N 3.28Å; L225-E227 PolarHBondContact O-N 3.23Å; E227-L229 VanDerWaalsContact C-N 3.31Å; E227-K231 WeakPolarHBondContact O-CB 3.15Å; E227-K231 VanDerWaalsContact O-CG 3.24Å; E227-K231 WeakPolarHBondContact O-CG 3.32Å; E227-K231 PolarHBondContact O-N 2.84Å; E227-R394 IonicContact OE1-CZ 3.91Å; E227-R394 IonicContact OE1-NH1 2.92Å; E227-R394 PolarHBondContact OE1-NH1 3.14Å; E227-R394 IonicContact OE1-NH2 3.54Å; E227-R394 PolarHBondContact OE1-NH2 3.01Å; E227-R394 IonicContact OE2-NH2 2.69Å; E227-R394 PolarHBondContact OE2-NH2 3.21Å
228	E	86.6	Confident	87.8	Confident	37 Å²	37	55.5 Å²	55.5	17%	0.173	27%	0.269	C	S	.	.	H	α-helix	trans	-68.1	-33.4	171.9	-74.4	-176.6	129	0	0	111.3	C224 L225 E226 A232 K266 K373	C224-E228 WeakPolarHBondContact CA-OE2 3.36Å; C224-E228 PolarHBondContact SG-OE2 3.45Å; L225-E228 HydrophobicContact CB-CB 4.32Å; L225-E228 HydrophobicContact CB-CG 4.06Å; L225-E228 PolarHBondContact N-OE2 3.15Å; L225-E228 VanDerWaalsContact N-OE2 3.15Å; L225-E228 WeakPolarHBondContact O-CB 3.23Å; L225-E228 PolarHBondContact O-N 2.97Å; L225-E228 VanDerWaalsContact O-N 3.07Å; E226-E228 VanDerWaalsContact C-N 3.3Å; E226-E228 PolarHBondContact O-N 2.95Å; E228-A232 WeakPolarHBondContact O-CB 3.22Å; E228-A232 PolarHBondContact O-N 3.19Å; E228-K266 VanDerWaalsContact OE1-CE 3.25Å; E228-K266 WeakPolarHBondContact OE1-CE 3.37Å; E228-K266 IonicContact OE1-NZ 3.19Å; E228-K266 PolarHBondContact OE1-NZ 3.5Å; E228-K373 WeakPolarHBondContact OE1-CE 3.47Å; E228-K373 IonicContact OE1-NZ 2.82Å; E228-K373 PolarHBondContact OE1-NZ 3.17Å; E228-K373 IonicContact OE2-NZ 3.85Å; E228-K373 PolarHBondContact OE2-NZ 3.45Å
229	L	84.4	Confident	87.5	Confident	19 Å²	19	56.4 Å²	56.4	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-71.5	-45.8	176	-58.6	176.9	0	0	0	110.9	C224 L225 E226 E227 A232 K233 P267 W389	C224-L229 HydrophobicContact CB-CD2 3.97Å; C224-L229 HydrophobicContact CB-CG 4.33Å; L225-L229 PolarHBondContact O-N 3.2Å; E226-L229 WeakPolarHBondContact O-CB 3.15Å; E226-L229 PolarHBondContact O-N 2.53Å; E227-L229 VanDerWaalsContact C-N 3.31Å; L229-A232 PolarHBondContact O-N 2.82Å; L229-K233 WeakPolarHBondContact O-CG 3.44Å; L229-K233 PolarHBondContact O-N 3.46Å; L229-P267 HydrophobicContact CD2-CB 3.7Å; L229-P267 HydrophobicContact CD2-CG 3.96Å; L229-W389 HydrophobicContact CD1-CH2 3.76Å; L229-W389 HydrophobicContact CD1-CZ2 3.67Å
230	I	85.8	Confident	87.3	Confident	69 Å²	69	62.8 Å²	62.8	35%	0.354	30%	0.296	S	S	.	.	H	α-helix	trans	-60.5	-55.9	178.1	-65.1	164.9	0	0	0	110.4	E226 A232 K233 E234	E226-I230 HydrophobicContact CG-CD1 4.47Å; E226-I230 WeakPolarHBondContact O-CG1 3.34Å; E226-I230 PolarHBondContact O-N 3.02Å; I230-A232 PolarHBondContact O-N 2.91Å; I230-A232 VanDerWaalsContact O-N 3.16Å; I230-K233 WeakPolarHBondContact O-CB 3.43Å; I230-K233 PolarHBondContact O-N 3.22Å; I230-E234 PolarHBondContact O-N 2.7Å; I230-E234 VanDerWaalsContact O-N 3.11Å
231	K	85.3	Confident	87	Confident	133 Å²	133	64.6 Å²	64.6	58%	0.578	31%	0.305	S	S	*	.	H	α-helix	trans	-57.3	-34.2	178.9	-71.3	173.2	-179.5	178.9	0	112.6	E227 E234 C235	E227-K231 WeakPolarHBondContact O-CB 3.15Å; E227-K231 VanDerWaalsContact O-CG 3.24Å; E227-K231 WeakPolarHBondContact O-CG 3.32Å; E227-K231 PolarHBondContact O-N 2.84Å; K231-E234 PolarHBondContact O-N 2.7Å; K231-C235 WeakPolarHBondContact O-CB 3.38Å; K231-C235 PolarHBondContact O-N 2.86Å; K231-C235 PolarHBondContact O-SG 2.79Å; K231-C235 VanDerWaalsContact O-SG 3.4Å
232	A	80.8	Confident	86.9	Confident	19 Å²	19	63.5 Å²	63.5	16%	0.157	30%	0.297	C	S	.	.	H	α-helix	trans	-75.7	-27.4	177.8	0	0	0	0	0	113.8	E228 L229 I230 Q236 P267	E228-A232 WeakPolarHBondContact O-CB 3.22Å; E228-A232 PolarHBondContact O-N 3.19Å; L229-A232 PolarHBondContact O-N 2.82Å; I230-A232 PolarHBondContact O-N 2.91Å; I230-A232 VanDerWaalsContact O-N 3.16Å; A232-Q236 WeakPolarHBondContact O-CA 3.42Å; A232-Q236 PolarHBondContact O-N 2.87Å; A232-Q236 VanDerWaalsContact O-N 3.13Å; A232-P267 VanDerWaalsContact CB-CD 3.4Å; A232-P267 HydrophobicContact CB-CG 3.29Å
233	K	79.8	Confident	87	Confident	110 Å²	110	64.1 Å²	64.1	48%	0.478	30%	0.3	S	S	.	.	H	α-helix	trans	-67.9	-38.6	169	-70.2	174.6	-177.8	-172.2	0	111.5	L229 I230 Q236 E391	L229-K233 WeakPolarHBondContact O-CG 3.44Å; L229-K233 PolarHBondContact O-N 3.46Å; I230-K233 WeakPolarHBondContact O-CB 3.43Å; I230-K233 PolarHBondContact O-N 3.22Å; K233-Q236 WeakPolarHBondContact O-CG 3.44Å; K233-Q236 PolarHBondContact O-NE2 3.24Å; K233-E391 IonicContact NZ-OE1 3Å; K233-E391 PolarHBondContact NZ-OE1 3.47Å; K233-E391 IonicContact NZ-OE2 3.65Å; K233-E391 PolarHBondContact NZ-OE2 2.97Å
234	E	83.9	Confident	87.4	Confident	140 Å²	140	68.5 Å²	68.5	65%	0.654	32%	0.32	S	S	*	.	H	α-helix	trans	-71.9	-53.7	179	-66.6	171.4	164.5	0	0	112.2	I230 K231	I230-E234 PolarHBondContact O-N 2.7Å; I230-E234 VanDerWaalsContact O-N 3.11Å; K231-E234 PolarHBondContact O-N 2.7Å
235	C	80.8	Confident	87.5	Confident	95 Å²	95	69.7 Å²	69.7	64%	0.642	33%	0.325	S	S	*	.	H	α-helix	trans	-83.7	-20.5	-172.8	-60.2	0	0	0	0	114.6	K231 R237	K231-C235 WeakPolarHBondContact O-CB 3.38Å; K231-C235 PolarHBondContact O-N 2.86Å; K231-C235 PolarHBondContact O-SG 2.79Å; K231-C235 VanDerWaalsContact O-SG 3.4Å; C235-R237 PolarHBondContact O-N 3.35Å
236	Q	82.4	Confident	87.6	Confident	137 Å²	137	68.7 Å²	68.7	64%	0.64	32%	0.32	S	S	*	.			trans	46.2	30.2	-178.9	-55.5	-169.9	0.6	0	0	115.3	A232 K233 L238 L265	A232-Q236 WeakPolarHBondContact O-CA 3.42Å; A232-Q236 PolarHBondContact O-N 2.87Å; A232-Q236 VanDerWaalsContact O-N 3.13Å; K233-Q236 WeakPolarHBondContact O-CG 3.44Å; K233-Q236 PolarHBondContact O-NE2 3.24Å; Q236-L238 PolarHBondContact O-N 3.16Å; Q236-L265 HydrophobicContact CB-CD2 4.39Å; Q236-L265 VanDerWaalsContact O-CD2 3.29Å; Q236-L265 WeakPolarHBondContact O-CD2 3.3Å
237	R	85.5	Confident	87.8	Confident	154 Å²	154	70.5 Å²	70.5	58%	0.581	33%	0.329	S	S	*	.			trans	-71	110.9	-175.8	-173.2	165.5	78.9	146.6	-3.2	111.2	E50 C235	E50-R237 IonicContact OE1-NH1 2.65Å; E50-R237 IonicContact OE1-NH2 2.76Å; E50-R237 PolarHBondContact OE1-NH2 2.96Å; C235-R237 PolarHBondContact O-N 3.35Å
238	L	90.6	Very high	87.9	Confident	77 Å²	77	71.6 Å²	71.6	40%	0.403	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	144.5	173.7	-64.4	169.8	0	0	0	111.6	Q236 Q261 L265	Q236-L238 PolarHBondContact O-N 3.16Å; L238-Q261 HydrophobicContact CD1-CB 4.11Å; L238-Q261 HydrophobicContact CD1-CG 4.41Å; L238-Q261 VanDerWaalsContact CD1-OE1 3.24Å; L238-L265 HydrophobicContact CD2-CD2 3.97Å; L238-L265 HydrophobicContact CD2-CG 4.21Å
239	R	91.6	Very high	88	Confident	45 Å²	45	70.7 Å²	70.7	17%	0.17	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	106.7	-177.2	-70.8	-69.9	-60.6	-115.2	-8.9	110.4	D241 M242 Y243 V264	R239-D241 IonicContact CZ-OD1 3.32Å; R239-D241 IonicContact CZ-OD2 2.77Å; R239-D241 IonicContact NE-OD1 3.15Å; R239-D241 PolarHBondContact NE-OD1 3.39Å; R239-D241 IonicContact NE-OD2 2.9Å; R239-D241 VanDerWaalsContact NH2-CG 3.31Å; R239-D241 IonicContact NH2-OD1 3.62Å; R239-D241 PolarHBondContact NH2-OD1 3.11Å; R239-D241 VanDerWaalsContact NH2-OD1 3.15Å; R239-D241 IonicContact NH2-OD2 3.38Å; R239-D241 PolarHBondContact NH2-OD2 3.07Å; R239-M242 HydrophobicContact CB-CB 3.87Å; R239-M242 HydrophobicContact CB-CG 3.88Å; R239-M242 HydrophobicContact CB-SD 3.84Å; R239-M242 HydrophobicContact CG-SD 4.01Å; R239-M242 PolarHBondContact O-N 2.85Å; R239-Y243 PolarHBondContact O-N 2.89Å; R239-V264 WeakPolarHBondContact CB-O 3.38Å; R239-V264 PolarHBondContact N-O 3.46Å; R239-V264 PolarHBondContact O-N 2.73Å
240	R	93.3	Very high	88.2	Confident	136 Å²	136	72.2 Å²	72.2	51%	0.513	35%	0.35	S	S	.	.	H	α-helix	trans	-64.3	-42.8	177.9	-177	-177.9	-176.5	104.1	16.2	112.3	M242 Y243 E244 Q262	R240-M242 VanDerWaalsContact C-N 3.25Å; R240-M242 PolarHBondContact O-N 2.85Å; R240-Y243 WeakPolarHBondContact O-CB 3.41Å; R240-Y243 PolarHBondContact O-N 2.83Å; R240-Y243 VanDerWaalsContact O-N 3.11Å; R240-E244 HydrophobicContact CG-CG 4.46Å; R240-E244 WeakPolarHBondContact CG-OE1 3.42Å; R240-E244 IonicContact CZ-OE1 3.64Å; R240-E244 IonicContact NE-OE1 2.84Å; R240-E244 PolarHBondContact NE-OE1 2.81Å; R240-E244 IonicContact NH2-OE1 3.58Å; R240-E244 WeakPolarHBondContact O-CG 3.32Å; R240-E244 PolarHBondContact O-N 2.88Å; R240-Q262 WeakPolarHBondContact CA-O 3.4Å; R240-Q262 VanDerWaalsContact CZ-OE1 3.3Å
241	D	90.9	Very high	88.6	Confident	38 Å²	38	73.3 Å²	73.3	20%	0.203	36%	0.361	C	S	.	.	H	α-helix	trans	-60.9	-34.9	178.5	69.7	-62.7	0	0	0	112.3	R239 K245	R239-D241 IonicContact CZ-OD1 3.32Å; R239-D241 IonicContact CZ-OD2 2.77Å; R239-D241 IonicContact NE-OD1 3.15Å; R239-D241 PolarHBondContact NE-OD1 3.39Å; R239-D241 IonicContact NE-OD2 2.9Å; R239-D241 VanDerWaalsContact NH2-CG 3.31Å; R239-D241 IonicContact NH2-OD1 3.62Å; R239-D241 PolarHBondContact NH2-OD1 3.11Å; R239-D241 VanDerWaalsContact NH2-OD1 3.15Å; R239-D241 IonicContact NH2-OD2 3.38Å; R239-D241 PolarHBondContact NH2-OD2 3.07Å; D241-K245 WeakPolarHBondContact O-CB 3.26Å; D241-K245 WeakPolarHBondContact O-CD 3.35Å; D241-K245 WeakPolarHBondContact O-CE 3.48Å; D241-K245 WeakPolarHBondContact O-CG 3.15Å; D241-K245 PolarHBondContact O-N 2.95Å; D241-K245 VanDerWaalsContact O-N 3.14Å; D241-K245 IonicContact OD2-NZ 3.31Å; D241-K245 PolarHBondContact OD2-NZ 3.44Å
242	M	91.9	Very high	89	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-73.8	-35.2	175.7	-70	-177.4	175	0	0	112.1	S56 R239 R240 M246 V264 K266 Y269	S56-M242 WeakPolarHBondContact OG-CE 3.4Å; R239-M242 HydrophobicContact CB-CB 3.87Å; R239-M242 HydrophobicContact CB-CG 3.88Å; R239-M242 HydrophobicContact CB-SD 3.84Å; R239-M242 HydrophobicContact CG-SD 4.01Å; R239-M242 PolarHBondContact O-N 2.85Å; R240-M242 VanDerWaalsContact C-N 3.25Å; R240-M242 PolarHBondContact O-N 2.85Å; M242-M246 WeakPolarHBondContact O-CB 3.47Å; M242-M246 PolarHBondContact O-N 2.76Å; M242-V264 HydrophobicContact CB-CG2 3.52Å; M242-K266 HydrophobicContact CE-CB 4.25Å; M242-K266 HydrophobicContact CE-CD 4.11Å; M242-K266 HydrophobicContact CE-CG 3.92Å; M242-K266 HydrophobicContact SD-CB 3.87Å; M242-K266 HydrophobicContact SD-CG 4.12Å; M242-Y269 HydrophobicContact CB-CD1 4.31Å; M242-Y269 HydrophobicContact CB-CD2 3.78Å; M242-Y269 HydrophobicContact CB-CE2 4.37Å; M242-Y269 HydrophobicContact CB-CG 3.76Å; M242-Y269 HydrophobicContact CG-CD1 4.08Å; M242-Y269 HydrophobicContact CG-CD2 4.41Å; M242-Y269 HydrophobicContact CG-CG 4.02Å; M242-Y269 WeakPolarHBondContact O-CD2 3.43Å; M242-Y269 WeakPolarHBondContact O-CE2 3.33Å; M242-Y269 HydrophobicContact SD-CD1 4.09Å; M242-Y269 HydrophobicContact SD-CG 4.15Å
243	Y	93.9	Very high	89.6	Confident	22 Å²	22	70.8 Å²	70.8	9%	0.086	37%	0.365	C	S	.	.	H	α-helix	trans	-65.7	-46.8	174.3	168.4	-98.1	0	0	0	111.7	R239 R240 K245 M246 I247 P254 E258 R259 Q262 V264	R239-Y243 PolarHBondContact O-N 2.89Å; R240-Y243 WeakPolarHBondContact O-CB 3.41Å; R240-Y243 PolarHBondContact O-N 2.83Å; R240-Y243 VanDerWaalsContact O-N 3.11Å; Y243-K245 VanDerWaalsContact C-N 3.33Å; Y243-K245 PolarHBondContact O-N 2.98Å; Y243-M246 WeakPolarHBondContact O-CB 3.41Å; Y243-M246 PolarHBondContact O-N 2.86Å; Y243-I247 HydrophobicContact CD1-CD1 4.37Å; Y243-I247 HydrophobicContact CD2-CD1 4.36Å; Y243-I247 HydrophobicContact CE1-CD1 3.66Å; Y243-I247 HydrophobicContact CE2-CD1 3.65Å; Y243-I247 HydrophobicContact CE2-CG1 4.37Å; Y243-I247 PolarHBondContact O-N 3.38Å; Y243-I247 VanDerWaalsContact OH-CD1 3.29Å; Y243-I247 WeakPolarHBondContact OH-CD1 3.42Å; Y243-P254 HydrophobicContact CD2-CB 4.29Å; Y243-P254 HydrophobicContact CD2-CG 4.21Å; Y243-P254 HydrophobicContact CE2-CB 3.98Å; Y243-P254 HydrophobicContact CE2-CG 3.97Å; Y243-E258 VanDerWaalsContact CE2-O 3.27Å; Y243-E258 WeakPolarHBondContact CE2-O 3.37Å; Y243-R259 HydrophobicContact CE2-CG 4.44Å; Y243-R259 WeakPolarHBondContact OH-CA 3.29Å; Y243-Q262 VanDerWaalsContact CD1-C 3.47Å; Y243-Q262 HydrophobicContact CD1-CB 4.15Å; Y243-Q262 WeakPolarHBondContact CD1-O 3.47Å; Y243-Q262 HydrophobicContact CE1-CB 3.88Å; Y243-Q262 HydrophobicContact CE1-CG 4.23Å; Y243-V264 HydrophobicContact CD2-CG1 4.11Å
244	E	93.4	Very high	90.3	Very high	98 Å²	98	65.7 Å²	65.7	46%	0.458	34%	0.343	S	S	.	.	H	α-helix	trans	-60.5	-42.4	176.4	-70.4	170.3	-178.9	0	0	111.2	R240 M246 S248	R240-E244 HydrophobicContact CG-CG 4.46Å; R240-E244 WeakPolarHBondContact CG-OE1 3.42Å; R240-E244 IonicContact CZ-OE1 3.64Å; R240-E244 IonicContact NE-OE1 2.84Å; R240-E244 PolarHBondContact NE-OE1 2.81Å; R240-E244 IonicContact NH2-OE1 3.58Å; R240-E244 WeakPolarHBondContact O-CG 3.32Å; R240-E244 PolarHBondContact O-N 2.88Å; E244-M246 PolarHBondContact O-N 3.27Å; E244-S248 WeakPolarHBondContact O-CB 3.3Å; E244-S248 PolarHBondContact O-N 2.77Å
245	K	88.9	Confident	90.8	Very high	30 Å²	30	61.8 Å²	61.8	13%	0.13	33%	0.329	C	S	.	.	H	α-helix	trans	-62.1	-40.2	171.7	-70.6	159.1	-163.7	160	0	112.3	C58 G59 D241 Y243 S248 Y269	C58-K245 HydrophobicContact CB-CD 4.12Å; C58-K245 WeakPolarHBondContact O-CE 3.47Å; C58-K245 PolarHBondContact O-NZ 3.04Å; G59-K245 WeakPolarHBondContact O-CE 3.2Å; D241-K245 WeakPolarHBondContact O-CB 3.26Å; D241-K245 WeakPolarHBondContact O-CD 3.35Å; D241-K245 WeakPolarHBondContact O-CE 3.48Å; D241-K245 WeakPolarHBondContact O-CG 3.15Å; D241-K245 PolarHBondContact O-N 2.95Å; D241-K245 VanDerWaalsContact O-N 3.14Å; D241-K245 IonicContact OD2-NZ 3.31Å; D241-K245 PolarHBondContact OD2-NZ 3.44Å; Y243-K245 VanDerWaalsContact C-N 3.33Å; Y243-K245 PolarHBondContact O-N 2.98Å; K245-S248 PolarHBondContact O-N 3.13Å; K245-S248 PolarHBondContact O-OG 3.17Å; K245-Y269 HydrophobicContact CB-CE2 3.85Å
246	M	92.7	Very high	91.5	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-60.9	-52.3	179.2	-172	176.5	-69.8	0	0	110.6	M242 Y243 E244 S248 V249 D250 A253 P254 V264 Y269 W272	M242-M246 WeakPolarHBondContact O-CB 3.47Å; M242-M246 PolarHBondContact O-N 2.76Å; Y243-M246 WeakPolarHBondContact O-CB 3.41Å; Y243-M246 PolarHBondContact O-N 2.86Å; E244-M246 PolarHBondContact O-N 3.27Å; M246-S248 VanDerWaalsContact C-N 3.3Å; M246-S248 PolarHBondContact O-N 3.5Å; M246-V249 PolarHBondContact O-N 3.13Å; M246-V249 VanDerWaalsContact O-N 3.11Å; M246-D250 PolarHBondContact O-N 3.11Å; M246-A253 HydrophobicContact CG-CB 3.88Å; M246-A253 HydrophobicContact SD-CB 4.03Å; M246-P254 HydrophobicContact CG-CG 4.23Å; M246-P254 HydrophobicContact SD-CB 4.35Å; M246-P254 HydrophobicContact SD-CG 3.9Å; M246-V264 HydrophobicContact CE-CB 4.49Å; M246-V264 HydrophobicContact CE-CG1 4.07Å; M246-V264 HydrophobicContact CE-CG2 4.4Å; M246-V264 HydrophobicContact SD-CG1 4.24Å; M246-Y269 HydrophobicContact CB-CD2 4.27Å; M246-Y269 HydrophobicContact CB-CE2 4.3Å; M246-Y269 HydrophobicContact CE-CD2 4.02Å; M246-W272 HydrophobicContact CB-CH2 4.12Å; M246-W272 HydrophobicContact CB-CZ2 4.44Å; M246-W272 HydrophobicContact CB-CZ3 4.18Å; M246-W272 HydrophobicContact CE-CB 4.14Å; M246-W272 HydrophobicContact CE-CD2 3.86Å; M246-W272 HydrophobicContact CE-CE3 3.88Å; M246-W272 HydrophobicContact CE-CG 3.99Å; M246-W272 HydrophobicContact CG-CD2 3.97Å; M246-W272 HydrophobicContact CG-CE3 4.06Å; M246-W272 HydrophobicContact CG-CH2 3.82Å; M246-W272 HydrophobicContact CG-CZ2 3.66Å; M246-W272 HydrophobicContact CG-CZ3 4.01Å; M246-W272 HydrophobicContact SD-CD2 4.35Å
247	I	94	Very high	92.1	Very high	54 Å²	54	62 Å²	62	28%	0.277	32%	0.32	S	S	.	.	H	α-helix	trans	-61.3	-36.8	178	-70.9	-177.1	0	0	0	112.3	Y243 V249 D250 P251 P254	Y243-I247 HydrophobicContact CD1-CD1 4.37Å; Y243-I247 HydrophobicContact CD2-CD1 4.36Å; Y243-I247 HydrophobicContact CE1-CD1 3.66Å; Y243-I247 HydrophobicContact CE2-CD1 3.65Å; Y243-I247 HydrophobicContact CE2-CG1 4.37Å; Y243-I247 PolarHBondContact O-N 3.38Å; Y243-I247 VanDerWaalsContact OH-CD1 3.29Å; Y243-I247 WeakPolarHBondContact OH-CD1 3.42Å; I247-V249 PolarHBondContact O-N 3Å; I247-V249 VanDerWaalsContact O-N 3.1Å; I247-D250 CarbonylContact O-C 3.52Å; I247-D250 PolarHBondContact O-N 2.84Å; I247-P251 HydrophobicContact CG2-CB 4.33Å; I247-P251 HydrophobicContact CG2-CG 4.47Å; I247-P251 WeakPolarHBondContact O-CD 3.38Å; I247-P254 HydrophobicContact CD1-CG 4.21Å; I247-P254 HydrophobicContact CG1-CG 3.7Å
248	S	89.8	Confident	92.5	Very high	89 Å²	89	55.6 Å²	55.6	62%	0.622	30%	0.297	S	S	*	.	H	α-helix	trans	-62.1	-19.2	178.4	79.2	0	0	0	0	114.1	E244 K245 M246	E244-S248 WeakPolarHBondContact O-CB 3.3Å; E244-S248 PolarHBondContact O-N 2.77Å; K245-S248 PolarHBondContact O-N 3.13Å; K245-S248 PolarHBondContact O-OG 3.17Å; M246-S248 VanDerWaalsContact C-N 3.3Å; M246-S248 PolarHBondContact O-N 3.5Å
249	V	88	Confident	92.8	Very high	19 Å²	19	56 Å²	56	12%	0.115	29%	0.293	C	S	.	.	H	α-helix	trans	-104.8	-39.5	179.3	176.3	0	0	0	0	111	M246 I247 W272 L276 K301 K302	M246-V249 PolarHBondContact O-N 3.13Å; M246-V249 VanDerWaalsContact O-N 3.11Å; I247-V249 PolarHBondContact O-N 3Å; I247-V249 VanDerWaalsContact O-N 3.1Å; V249-W272 HydrophobicContact CB-CH2 3.76Å; V249-W272 HydrophobicContact CB-CZ2 4.08Å; V249-W272 HydrophobicContact CG1-CH2 3.99Å; V249-W272 HydrophobicContact CG1-CZ2 4.06Å; V249-W272 HydrophobicContact CG2-CH2 4.19Å; V249-L276 HydrophobicContact CG1-CD1 3.85Å; V249-K301 HydrophobicContact CG2-CD 3.92Å; V249-K302 VanDerWaalsContact CG1-CE 3.47Å; V249-K302 HydrophobicContact CG1-CG 4.41Å; V249-K302 WeakPolarHBondContact O-CE 3.23Å; V249-K302 PolarHBondContact O-NZ 3.06Å
250	D	89.7	Confident	92.9	Very high	51 Å²	51	57.8 Å²	57.8	27%	0.273	32%	0.318	S	S	.	.			trans	-153.2	102.9	178.7	-176	-3.9	0	0	0	110.5	M246 I247 A252 A253 W272	M246-D250 PolarHBondContact O-N 3.11Å; I247-D250 CarbonylContact O-C 3.52Å; I247-D250 PolarHBondContact O-N 2.84Å; D250-A252 PolarHBondContact O-N 2.97Å; D250-A252 PolarHBondContact OD1-N 3.23Å; D250-A253 HydrophobicContact CB-CB 3.84Å; D250-A253 WeakPolarHBondContact O-CB 3.41Å; D250-A253 PolarHBondContact O-N 3.02Å; D250-W272 HydrophobicContact CB-CZ2 4.32Å
251	P	93.1	Very high	93	Very high	92 Å²	92	56.8 Å²	56.8	60%	0.597	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-20.9	178.1	-25.1	35.2	0	0	0	114.8	I247	I247-P251 HydrophobicContact CG2-CB 4.33Å; I247-P251 HydrophobicContact CG2-CG 4.47Å; I247-P251 WeakPolarHBondContact O-CD 3.38Å
252	A	93.1	Very high	93.2	Very high	79 Å²	79	59.1 Å²	59.1	65%	0.653	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-10.2	179.7	0	0	0	0	0	113.2	D250	D250-A252 PolarHBondContact O-N 2.97Å; D250-A252 PolarHBondContact OD1-N 3.23Å
253	A	93.5	Very high	93.3	Very high	19 Å²	19	59.1 Å²	59.1	16%	0.157	33%	0.329	C	S	.	.	S	Bend	trans	-70.1	-31.2	-174.2	0	0	0	0	0	116.8	M246 D250 R268 W272	M246-A253 HydrophobicContact CG-CB 3.88Å; M246-A253 HydrophobicContact SD-CB 4.03Å; D250-A253 HydrophobicContact CB-CB 3.84Å; D250-A253 WeakPolarHBondContact O-CB 3.41Å; D250-A253 PolarHBondContact O-N 3.02Å; A253-R268 PolarHBondContact O-NH2 3.21Å; A253-W272 HydrophobicContact CB-CZ2 4.21Å; A253-W272 VanDerWaalsContact CB-NE1 3.28Å
254	P	95.3	Very high	93.3	Very high	4 Å²	4	58.1 Å²	58.1	3%	0.026	33%	0.325	C	S	.	.	S	Bend	trans	-70.6	154	174	-18.3	31.6	0	0	0	112.5	Y243 M246 I247 E258 R259	Y243-P254 HydrophobicContact CD2-CB 4.29Å; Y243-P254 HydrophobicContact CD2-CG 4.21Å; Y243-P254 HydrophobicContact CE2-CB 3.98Å; Y243-P254 HydrophobicContact CE2-CG 3.97Å; M246-P254 HydrophobicContact CG-CG 4.23Å; M246-P254 HydrophobicContact SD-CB 4.35Å; M246-P254 HydrophobicContact SD-CG 3.9Å; I247-P254 HydrophobicContact CD1-CG 4.21Å; I247-P254 HydrophobicContact CG1-CG 3.7Å; P254-E258 VanDerWaalsContact CA-OE2 3.26Å; P254-E258 WeakPolarHBondContact CA-OE2 3.33Å; P254-E258 HydrophobicContact CB-CB 3.96Å; P254-R259 HydrophobicContact CB-CG 4.24Å; P254-R259 PolarHBondContact O-NH1 2.79Å
255	T	95.3	Very high	93.1	Very high	57 Å²	57	56.1 Å²	56.1	35%	0.35	32%	0.318	S	S	.	.			trans	-75.9	175	167.6	79.1	0	0	0	0	111.4	E257 E258 R259	T255-E257 VanDerWaalsContact C-N 3.32Å; T255-E257 WeakPolarHBondContact CB-OE2 3.29Å; T255-E257 PolarHBondContact OG1-N 3.08Å; T255-E257 PolarHBondContact OG1-OE2 3.33Å; T255-E258 PolarHBondContact N-OE2 3.24Å; T255-E258 PolarHBondContact O-N 3.09Å; T255-E258 WeakPolarHBondContact OG1-CG 3.35Å; T255-E258 PolarHBondContact OG1-N 3Å; T255-R259 WeakPolarHBondContact O-CG 3.49Å; T255-R259 PolarHBondContact O-N 3.45Å
256	E	95	Very high	93	Very high	118 Å²	118	56.3 Å²	56.3	55%	0.551	32%	0.318	S	S	*	.	H	α-helix	trans	-68.6	-35	177.6	-164.6	58.2	-153.2	0	0	111.8	R259 A260	E256-R259 PolarHBondContact O-N 2.87Å; E256-R259 IonicContact OE2-CZ 3.19Å; E256-R259 IonicContact OE2-NE 2.83Å; E256-R259 PolarHBondContact OE2-NE 3.02Å; E256-R259 IonicContact OE2-NH2 2.7Å; E256-R259 PolarHBondContact OE2-NH2 3.38Å; E256-A260 WeakPolarHBondContact O-CB 3.15Å; E256-A260 PolarHBondContact O-N 3.02Å
257	E	94.2	Very high	92.7	Very high	118 Å²	118	57.4 Å²	57.4	55%	0.551	33%	0.326	S	S	*	.	H	α-helix	trans	-67	-44.7	174.9	-53.4	73.4	-160.1	0	0	110.9	T255 R259 A260 Q261	T255-E257 VanDerWaalsContact C-N 3.32Å; T255-E257 WeakPolarHBondContact CB-OE2 3.29Å; T255-E257 PolarHBondContact OG1-N 3.08Å; T255-E257 PolarHBondContact OG1-OE2 3.33Å; E257-R259 VanDerWaalsContact C-N 3.31Å; E257-R259 PolarHBondContact O-N 3.45Å; E257-A260 PolarHBondContact O-N 2.86Å; E257-Q261 WeakPolarHBondContact O-CB 3.39Å; E257-Q261 VanDerWaalsContact O-CG 3.26Å; E257-Q261 WeakPolarHBondContact O-CG 3.19Å; E257-Q261 PolarHBondContact O-N 2.79Å
258	E	95.3	Very high	92.5	Very high	20 Å²	20	58.3 Å²	58.3	9%	0.093	33%	0.326	C	S	.	.	H	α-helix	trans	-63.1	-36.8	175.3	-68.3	175.2	148.2	0	0	111.7	Y243 P254 T255 Q262 G263 V264 R268	Y243-E258 VanDerWaalsContact CE2-O 3.27Å; Y243-E258 WeakPolarHBondContact CE2-O 3.37Å; P254-E258 VanDerWaalsContact CA-OE2 3.26Å; P254-E258 WeakPolarHBondContact CA-OE2 3.33Å; P254-E258 HydrophobicContact CB-CB 3.96Å; T255-E258 PolarHBondContact N-OE2 3.24Å; T255-E258 PolarHBondContact O-N 3.09Å; T255-E258 WeakPolarHBondContact OG1-CG 3.35Å; T255-E258 PolarHBondContact OG1-N 3Å; E258-Q262 WeakPolarHBondContact O-CA 3.02Å; E258-Q262 PolarHBondContact O-N 2.75Å; E258-G263 PolarHBondContact O-N 3.22Å; E258-V264 HydrophobicContact CB-CG1 4.11Å; E258-V264 HydrophobicContact CG-CG1 4.03Å; E258-R268 WeakPolarHBondContact OE1-CD 3.36Å; E258-R268 WeakPolarHBondContact OE1-CG 3.39Å; E258-R268 IonicContact OE1-CZ 2.68Å; E258-R268 IonicContact OE1-NE 2.68Å; E258-R268 PolarHBondContact OE1-NE 2.89Å; E258-R268 IonicContact OE1-NH2 3.12Å; E258-R268 IonicContact OE2-CZ 2.79Å; E258-R268 IonicContact OE2-NE 3.1Å; E258-R268 PolarHBondContact OE2-NE 3.27Å; E258-R268 IonicContact OE2-NH2 3.69Å; E258-R268 PolarHBondContact OE2-NH2 3.05Å
259	R	95.4	Very high	92.5	Very high	85 Å²	85	54.3 Å²	54.3	32%	0.321	30%	0.297	S	S	.	.	H	α-helix	trans	-63.6	-49.5	171.7	-82.5	-170.7	-75.3	-79.6	-5.5	112.3	Y243 P254 T255 E256 E257 Q261 Q262	Y243-R259 HydrophobicContact CE2-CG 4.44Å; Y243-R259 WeakPolarHBondContact OH-CA 3.29Å; P254-R259 HydrophobicContact CB-CG 4.24Å; P254-R259 PolarHBondContact O-NH1 2.79Å; T255-R259 WeakPolarHBondContact O-CG 3.49Å; T255-R259 PolarHBondContact O-N 3.45Å; E256-R259 PolarHBondContact O-N 2.87Å; E256-R259 IonicContact OE2-CZ 3.19Å; E256-R259 IonicContact OE2-NE 2.83Å; E256-R259 PolarHBondContact OE2-NE 3.02Å; E256-R259 IonicContact OE2-NH2 2.7Å; E256-R259 PolarHBondContact OE2-NH2 3.38Å; E257-R259 VanDerWaalsContact C-N 3.31Å; E257-R259 PolarHBondContact O-N 3.45Å; R259-Q261 VanDerWaalsContact C-N 3.28Å; R259-Q261 PolarHBondContact O-N 3.46Å; R259-Q262 PolarHBondContact O-N 2.88Å
260	A	95.3	Very high	92.4	Very high	84 Å²	84	54.4 Å²	54.4	69%	0.694	30%	0.296	S	S	*	.	H	α-helix	trans	-62	-36.1	179.8	0	0	0	0	0	112.4	E256 E257	E256-A260 WeakPolarHBondContact O-CB 3.15Å; E256-A260 PolarHBondContact O-N 3.02Å; E257-A260 PolarHBondContact O-N 2.86Å
261	Q	94.4	Very high	92.3	Very high	115 Å²	115	58.6 Å²	58.6	54%	0.537	31%	0.308	S	S	.	.	H	α-helix	trans	-85.7	-11.6	179.6	-66.3	172.2	0.9	0	0	113.8	L238 E257 R259 G263	L238-Q261 HydrophobicContact CD1-CB 4.11Å; L238-Q261 HydrophobicContact CD1-CG 4.41Å; L238-Q261 VanDerWaalsContact CD1-OE1 3.24Å; E257-Q261 WeakPolarHBondContact O-CB 3.39Å; E257-Q261 VanDerWaalsContact O-CG 3.26Å; E257-Q261 WeakPolarHBondContact O-CG 3.19Å; E257-Q261 PolarHBondContact O-N 2.79Å; R259-Q261 VanDerWaalsContact C-N 3.28Å; R259-Q261 PolarHBondContact O-N 3.46Å; Q261-G263 PolarHBondContact O-N 2.94Å
262	Q	94.9	Very high	92.1	Very high	86 Å²	86	55.1 Å²	55.1	40%	0.402	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	38.2	-171.6	-56.9	-164.2	-33	0	0	113.6	R240 Y243 E258 R259	R240-Q262 WeakPolarHBondContact CA-O 3.4Å; R240-Q262 VanDerWaalsContact CZ-OE1 3.3Å; Y243-Q262 VanDerWaalsContact CD1-C 3.47Å; Y243-Q262 HydrophobicContact CD1-CB 4.15Å; Y243-Q262 WeakPolarHBondContact CD1-O 3.47Å; Y243-Q262 HydrophobicContact CE1-CB 3.88Å; Y243-Q262 HydrophobicContact CE1-CG 4.23Å; E258-Q262 WeakPolarHBondContact O-CA 3.02Å; E258-Q262 PolarHBondContact O-N 2.75Å; R259-Q262 PolarHBondContact O-N 2.88Å
263	G	93.8	Very high	91.8	Very high	2 Å²	2	52.8 Å²	52.8	2%	0.021	26%	0.258	C	S	.	.			trans	-159.5	148.8	-172.2	0	0	0	0	0	112.3	E258 Q261	E258-G263 PolarHBondContact O-N 3.22Å; Q261-G263 PolarHBondContact O-N 2.94Å
264	V	93.6	Very high	91.5	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	153	175	-62.4	0	0	0	0	110.2	R239 M242 Y243 M246 E258 Y269	R239-V264 WeakPolarHBondContact CB-O 3.38Å; R239-V264 PolarHBondContact N-O 3.46Å; R239-V264 PolarHBondContact O-N 2.73Å; M242-V264 HydrophobicContact CB-CG2 3.52Å; Y243-V264 HydrophobicContact CD2-CG1 4.11Å; M246-V264 HydrophobicContact CE-CB 4.49Å; M246-V264 HydrophobicContact CE-CG1 4.07Å; M246-V264 HydrophobicContact CE-CG2 4.4Å; M246-V264 HydrophobicContact SD-CG1 4.24Å; E258-V264 HydrophobicContact CB-CG1 4.11Å; E258-V264 HydrophobicContact CG-CG1 4.03Å; V264-Y269 HydrophobicContact CG2-CD2 4.42Å
265	L	90.1	Very high	91.2	Very high	57 Å²	57	56 Å²	56	30%	0.298	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	143.8	171	-63.1	175.8	0	0	0	110.5	Q236 L238 R268 Y269	Q236-L265 HydrophobicContact CB-CD2 4.39Å; Q236-L265 VanDerWaalsContact O-CD2 3.29Å; Q236-L265 WeakPolarHBondContact O-CD2 3.3Å; L238-L265 HydrophobicContact CD2-CD2 3.97Å; L238-L265 HydrophobicContact CD2-CG 4.21Å; L265-R268 HydrophobicContact CB-CB 4.15Å; L265-R268 WeakPolarHBondContact O-CB 3.48Å; L265-R268 PolarHBondContact O-N 2.96Å; L265-Y269 PolarHBondContact O-N 3.25Å
266	K	86.6	Confident	90.9	Very high	33 Å²	33	55 Å²	55	14%	0.143	27%	0.266	C	S	.	.	H	α-helix	trans	-53.8	-50.7	178.6	173	171	174.8	179.9	0	113.2	E228 M242 R268 Y269 M270	E228-K266 VanDerWaalsContact OE1-CE 3.25Å; E228-K266 WeakPolarHBondContact OE1-CE 3.37Å; E228-K266 IonicContact OE1-NZ 3.19Å; E228-K266 PolarHBondContact OE1-NZ 3.5Å; M242-K266 HydrophobicContact CE-CB 4.25Å; M242-K266 HydrophobicContact CE-CD 4.11Å; M242-K266 HydrophobicContact CE-CG 3.92Å; M242-K266 HydrophobicContact SD-CB 3.87Å; M242-K266 HydrophobicContact SD-CG 4.12Å; K266-R268 PolarHBondContact O-N 2.81Å; K266-Y269 PolarHBondContact O-N 3.35Å; K266-M270 HydrophobicContact CG-CG 4.22Å; K266-M270 VanDerWaalsContact O-CG 3.24Å; K266-M270 WeakPolarHBondContact O-CG 3.48Å; K266-M270 PolarHBondContact O-N 2.86Å
267	P	85.6	Confident	90.7	Very high	24 Å²	24	49.5 Å²	49.5	16%	0.156	24%	0.24	C	C	.	.	H	α-helix	trans	-54.4	-37.5	175.1	-29.2	36	0	0	0	114.3	L229 A232 R271	L229-P267 HydrophobicContact CD2-CB 3.7Å; L229-P267 HydrophobicContact CD2-CG 3.96Å; A232-P267 VanDerWaalsContact CB-CD 3.4Å; A232-P267 HydrophobicContact CB-CG 3.29Å; P267-R271 VanDerWaalsContact O-CB 3.26Å; P267-R271 WeakPolarHBondContact O-CB 3.26Å; P267-R271 PolarHBondContact O-N 3.27Å
268	R	90.1	Very high	90.8	Very high	73 Å²	73	43.9 Å²	43.9	28%	0.275	21%	0.214	S	C	.	.	H	α-helix	trans	-72.6	-39.7	-178.2	158	61.5	-179.7	124.2	1	111.8	A253 E258 L265 K266 W272	A253-R268 PolarHBondContact O-NH2 3.21Å; E258-R268 WeakPolarHBondContact OE1-CD 3.36Å; E258-R268 WeakPolarHBondContact OE1-CG 3.39Å; E258-R268 IonicContact OE1-CZ 2.68Å; E258-R268 IonicContact OE1-NE 2.68Å; E258-R268 PolarHBondContact OE1-NE 2.89Å; E258-R268 IonicContact OE1-NH2 3.12Å; E258-R268 IonicContact OE2-CZ 2.79Å; E258-R268 IonicContact OE2-NE 3.1Å; E258-R268 PolarHBondContact OE2-NE 3.27Å; E258-R268 IonicContact OE2-NH2 3.69Å; E258-R268 PolarHBondContact OE2-NH2 3.05Å; L265-R268 HydrophobicContact CB-CB 4.15Å; L265-R268 WeakPolarHBondContact O-CB 3.48Å; L265-R268 PolarHBondContact O-N 2.96Å; K266-R268 PolarHBondContact O-N 2.81Å; R268-W272 WeakPolarHBondContact O-CB 3.37Å; R268-W272 PolarHBondContact O-N 2.86Å
269	Y	89.4	Confident	90.8	Very high	4 Å²	4	43 Å²	43	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-63.3	-48.2	169.8	178.5	-96.5	0	0	0	111.9	M242 K245 M246 V264 L265 K266 W272 R273	M242-Y269 HydrophobicContact CB-CD1 4.31Å; M242-Y269 HydrophobicContact CB-CD2 3.78Å; M242-Y269 HydrophobicContact CB-CE2 4.37Å; M242-Y269 HydrophobicContact CB-CG 3.76Å; M242-Y269 HydrophobicContact CG-CD1 4.08Å; M242-Y269 HydrophobicContact CG-CD2 4.41Å; M242-Y269 HydrophobicContact CG-CG 4.02Å; M242-Y269 WeakPolarHBondContact O-CD2 3.43Å; M242-Y269 WeakPolarHBondContact O-CE2 3.33Å; M242-Y269 HydrophobicContact SD-CD1 4.09Å; M242-Y269 HydrophobicContact SD-CG 4.15Å; K245-Y269 HydrophobicContact CB-CE2 3.85Å; M246-Y269 HydrophobicContact CB-CD2 4.27Å; M246-Y269 HydrophobicContact CB-CE2 4.3Å; M246-Y269 HydrophobicContact CE-CD2 4.02Å; V264-Y269 HydrophobicContact CG2-CD2 4.42Å; L265-Y269 PolarHBondContact O-N 3.25Å; K266-Y269 PolarHBondContact O-N 3.35Å; Y269-W272 HydrophobicContact CD2-CE3 4.01Å; Y269-W272 AromaticContact CD2-CZ3 3.99Å; Y269-W272 HydrophobicContact CD2-CZ3 3.99Å; Y269-W272 AromaticContact CE2-CE3 3.99Å; Y269-W272 HydrophobicContact CE2-CE3 3.99Å; Y269-W272 AromaticContact CE2-CZ3 3.5Å; Y269-W272 HydrophobicContact CE2-CZ3 3.5Å; Y269-W272 PolarHBondContact O-N 2.92Å; Y269-R273 HydrophobicContact CD1-CG 4.16Å; Y269-R273 HydrophobicContact CE1-CG 3.6Å; Y269-R273 HydrophobicContact CE2-CG 4.35Å; Y269-R273 PolarHBondContact O-N 3.04Å; Y269-R273 PolarHBondContact OH-NH1 2.81Å
270	M	86.4	Confident	90.7	Very high	22 Å²	22	41.2 Å²	41.2	11%	0.108	21%	0.213	C	C	.	.	H	α-helix	trans	-66.4	-44.2	-175.5	-60.9	-61.8	-57.4	0	0	111.4	T223 K266 W272 R273 E274	T223-M270 WeakPolarHBondContact OG1-CE 3.39Å; K266-M270 HydrophobicContact CG-CG 4.22Å; K266-M270 VanDerWaalsContact O-CG 3.24Å; K266-M270 WeakPolarHBondContact O-CG 3.48Å; K266-M270 PolarHBondContact O-N 2.86Å; M270-W272 VanDerWaalsContact C-N 3.31Å; M270-W272 PolarHBondContact O-N 3.43Å; M270-R273 WeakPolarHBondContact O-CB 3.38Å; M270-R273 PolarHBondContact O-N 3.32Å; M270-R273 VanDerWaalsContact O-N 3.14Å; M270-E274 VanDerWaalsContact O-CG 3.29Å; M270-E274 WeakPolarHBondContact O-CG 3.48Å; M270-E274 PolarHBondContact O-N 2.88Å
271	R	87	Confident	90.6	Very high	139 Å²	139	40.1 Å²	40.1	53%	0.525	20%	0.199	S	C	.	.	H	α-helix	trans	-59	-40	172.6	-174.7	173.5	-67.8	155.3	-0.7	112.8	P267 E274 T275	P267-R271 VanDerWaalsContact O-CB 3.26Å; P267-R271 WeakPolarHBondContact O-CB 3.26Å; P267-R271 PolarHBondContact O-N 3.27Å; R271-E274 WeakPolarHBondContact CA-OE2 3.31Å; R271-E274 PolarHBondContact O-N 2.8Å; R271-T275 WeakPolarHBondContact O-CG2 3.15Å; R271-T275 PolarHBondContact O-N 3.19Å; R271-T275 PolarHBondContact O-OG1 3.36Å
272	W	90.6	Very high	90.8	Very high	18 Å²	18	35.5 Å²	35.5	7%	0.068	18%	0.177	C	C	.	.	H	α-helix	trans	-65.7	-41.8	175.3	164.5	85.2	0	0	0	112	M246 V249 D250 A253 R268 Y269 M270 E274 T275 L276	M246-W272 HydrophobicContact CB-CH2 4.12Å; M246-W272 HydrophobicContact CB-CZ2 4.44Å; M246-W272 HydrophobicContact CB-CZ3 4.18Å; M246-W272 HydrophobicContact CE-CB 4.14Å; M246-W272 HydrophobicContact CE-CD2 3.86Å; M246-W272 HydrophobicContact CE-CE3 3.88Å; M246-W272 HydrophobicContact CE-CG 3.99Å; M246-W272 HydrophobicContact CG-CD2 3.97Å; M246-W272 HydrophobicContact CG-CE3 4.06Å; M246-W272 HydrophobicContact CG-CH2 3.82Å; M246-W272 HydrophobicContact CG-CZ2 3.66Å; M246-W272 HydrophobicContact CG-CZ3 4.01Å; M246-W272 HydrophobicContact SD-CD2 4.35Å; V249-W272 HydrophobicContact CB-CH2 3.76Å; V249-W272 HydrophobicContact CB-CZ2 4.08Å; V249-W272 HydrophobicContact CG1-CH2 3.99Å; V249-W272 HydrophobicContact CG1-CZ2 4.06Å; V249-W272 HydrophobicContact CG2-CH2 4.19Å; D250-W272 HydrophobicContact CB-CZ2 4.32Å; A253-W272 HydrophobicContact CB-CZ2 4.21Å; A253-W272 VanDerWaalsContact CB-NE1 3.28Å; R268-W272 WeakPolarHBondContact O-CB 3.37Å; R268-W272 PolarHBondContact O-N 2.86Å; Y269-W272 HydrophobicContact CD2-CE3 4.01Å; Y269-W272 AromaticContact CD2-CZ3 3.99Å; Y269-W272 HydrophobicContact CD2-CZ3 3.99Å; Y269-W272 AromaticContact CE2-CE3 3.99Å; Y269-W272 HydrophobicContact CE2-CE3 3.99Å; Y269-W272 AromaticContact CE2-CZ3 3.5Å; Y269-W272 HydrophobicContact CE2-CZ3 3.5Å; Y269-W272 PolarHBondContact O-N 2.92Å; M270-W272 VanDerWaalsContact C-N 3.31Å; M270-W272 PolarHBondContact O-N 3.43Å; W272-E274 VanDerWaalsContact C-N 3.33Å; W272-E274 PolarHBondContact O-N 2.82Å; W272-T275 WeakPolarHBondContact CA-OG1 3.32Å; W272-T275 PolarHBondContact O-N 3.2Å; W272-T275 PolarHBondContact O-OG1 3.16Å; W272-L276 HydrophobicContact CD2-CD1 4.1Å; W272-L276 HydrophobicContact CH2-CD1 3.86Å; W272-L276 HydrophobicContact CZ2-CD1 3.27Å; W272-L276 HydrophobicContact CZ2-CG 4.43Å; W272-L276 HydrophobicContact CZ3-CD1 4.49Å; W272-L276 PolarHBondContact O-N 3Å
273	R	86.8	Confident	90.9	Very high	31 Å²	31	31.4 Å²	31.4	12%	0.117	16%	0.158	C	C	.	.	H	α-helix	trans	-59.4	-40.8	171.8	-77.6	-66.9	-61.5	-98.7	-2	112.5	Y269 M270 L276 S277 E287	Y269-R273 HydrophobicContact CD1-CG 4.16Å; Y269-R273 HydrophobicContact CE1-CG 3.6Å; Y269-R273 HydrophobicContact CE2-CG 4.35Å; Y269-R273 PolarHBondContact O-N 3.04Å; Y269-R273 PolarHBondContact OH-NH1 2.81Å; M270-R273 WeakPolarHBondContact O-CB 3.38Å; M270-R273 PolarHBondContact O-N 3.32Å; M270-R273 VanDerWaalsContact O-N 3.14Å; R273-L276 PolarHBondContact O-N 3.06Å; R273-S277 PolarHBondContact O-N 3.02Å; R273-S277 PolarHBondContact O-OG 3.3Å; R273-E287 IonicContact NH2-OE1 3.86Å
274	E	86.4	Confident	91.1	Very high	24 Å²	24	31.3 Å²	31.3	11%	0.112	16%	0.157	C	C	.	.	H	α-helix	trans	-63.6	-41.5	176.4	-70.4	160.3	176	0	0	111.4	R222 T223 M270 R271 W272 S277 T279 A280	R222-E274 WeakPolarHBondContact CA-OE1 3.21Å; T223-E274 WeakPolarHBondContact CB-OE1 3.38Å; T223-E274 HydrophobicContact CG2-CG 4.13Å; T223-E274 PolarHBondContact N-OE1 3.32Å; T223-E274 PolarHBondContact OG1-OE1 3.49Å; M270-E274 VanDerWaalsContact O-CG 3.29Å; M270-E274 WeakPolarHBondContact O-CG 3.48Å; M270-E274 PolarHBondContact O-N 2.88Å; R271-E274 WeakPolarHBondContact CA-OE2 3.31Å; R271-E274 PolarHBondContact O-N 2.8Å; W272-E274 VanDerWaalsContact C-N 3.33Å; W272-E274 PolarHBondContact O-N 2.82Å; E274-S277 PolarHBondContact O-OG 2.82Å; E274-T279 HydrophobicContact CB-CG2 4.46Å; E274-T279 HydrophobicContact CG-CG2 4.04Å; E274-A280 WeakPolarHBondContact O-CB 3.11Å; E274-A280 PolarHBondContact O-N 3.29Å
275	T	88.4	Confident	91.3	Very high	67 Å²	67	32 Å²	32	41%	0.411	16%	0.16	S	C	.	.	H	α-helix	trans	-74.8	-22.1	178.8	59.3	0	0	0	0	115.2	R271 W272 K304	R271-T275 WeakPolarHBondContact O-CG2 3.15Å; R271-T275 PolarHBondContact O-N 3.19Å; R271-T275 PolarHBondContact O-OG1 3.36Å; W272-T275 WeakPolarHBondContact CA-OG1 3.32Å; W272-T275 PolarHBondContact O-N 3.2Å; W272-T275 PolarHBondContact O-OG1 3.16Å; T275-K304 WeakPolarHBondContact O-CD 3.19Å; T275-K304 WeakPolarHBondContact O-CE 3.38Å; T275-K304 PolarHBondContact O-NZ 2.76Å
276	L	89.4	Confident	91.6	Very high	36 Å²	36	29.4 Å²	29.4	19%	0.188	15%	0.146	C	C	.	.	H	α-helix	trans	-81.5	-18.2	175.7	-77.8	-172.1	0	0	0	113.9	V249 W272 R273 K302	V249-L276 HydrophobicContact CG1-CD1 3.85Å; W272-L276 HydrophobicContact CD2-CD1 4.1Å; W272-L276 HydrophobicContact CH2-CD1 3.86Å; W272-L276 HydrophobicContact CZ2-CD1 3.27Å; W272-L276 HydrophobicContact CZ2-CG 4.43Å; W272-L276 HydrophobicContact CZ3-CD1 4.49Å; W272-L276 PolarHBondContact O-N 3Å; R273-L276 PolarHBondContact O-N 3.06Å; L276-K302 WeakPolarHBondContact O-CA 3.39Å
277	S	91.5	Very high	92	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.007	15%	0.147	C	C	.	.	S	Bend	trans	-115.4	178.4	-176	59	0	0	0	0	111.3	R273 E274 T279 R285 T303	R273-S277 PolarHBondContact O-N 3.02Å; R273-S277 PolarHBondContact O-OG 3.3Å; E274-S277 PolarHBondContact O-OG 2.82Å; S277-T279 PolarHBondContact O-N 3.41Å; S277-T279 PolarHBondContact OG-OG1 3.14Å; S277-R285 WeakPolarHBondContact OG-CD 3.37Å; S277-T303 CarbonylContact C-O 3.53Å; S277-T303 WeakPolarHBondContact CA-O 3.49Å
278	S	96.3	Very high	92.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-7.9	175.6	52.3	0	0	0	0	113.9	A280 T281 L282 F284 R285 T303	S278-A280 PolarHBondContact O-N 3.37Å; S278-T281 PolarHBondContact O-N 3.3Å; S278-T281 VanDerWaalsContact O-N 3.09Å; S278-T281 PolarHBondContact O-OG1 3.39Å; S278-L282 PolarHBondContact O-N 2.86Å; S278-F284 CarbonylContact C-O 3.23Å; S278-F284 WeakPolarHBondContact CB-O 3.43Å; S278-F284 PolarHBondContact OG-O 3.49Å; S278-R285 WeakPolarHBondContact OG-CA 3.34Å; S278-R285 WeakPolarHBondContact OG-CB 3.44Å; S278-T303 PolarHBondContact N-O 3.35Å
279	T	95.6	Very high	92.7	Very high	1 Å²	1	25 Å²	25	1%	0.006	13%	0.127	C	C	.	.	H	α-helix	trans	-55.7	-48.1	-175.7	-56.2	0	0	0	0	112.1	G220 T223 E274 S277 T281 G283 F284 R285	G220-T279 VanDerWaalsContact O-CG2 3.28Å; G220-T279 WeakPolarHBondContact O-CG2 3.33Å; T223-T279 HydrophobicContact CG2-CG2 4.21Å; E274-T279 HydrophobicContact CB-CG2 4.46Å; E274-T279 HydrophobicContact CG-CG2 4.04Å; S277-T279 PolarHBondContact O-N 3.41Å; S277-T279 PolarHBondContact OG-OG1 3.14Å; T279-T281 VanDerWaalsContact C-N 3.29Å; T279-T281 PolarHBondContact O-N 3.12Å; T279-G283 WeakPolarHBondContact O-CA 3.24Å; T279-G283 PolarHBondContact O-N 3.14Å; T279-G283 VanDerWaalsContact O-N 3.13Å; T279-F284 WeakPolarHBondContact CA-O 3.42Å; T279-F284 PolarHBondContact N-O 2.75Å; T279-F284 VanDerWaalsContact N-O 3.15Å; T279-R285 WeakPolarHBondContact OG1-CD 3.4Å; T279-R285 WeakPolarHBondContact OG1-CG 3.44Å; T279-R285 PolarHBondContact OG1-NH1 2.89Å
280	A	91.6	Very high	93	Very high	48 Å²	48	27 Å²	27	40%	0.397	14%	0.136	S	C	.	.	H	α-helix	trans	-75.1	-11.4	-179	0	0	0	0	0	114.7	E274 S278	E274-A280 WeakPolarHBondContact O-CB 3.11Å; E274-A280 PolarHBondContact O-N 3.29Å; S278-A280 PolarHBondContact O-N 3.37Å
281	T	94.9	Very high	93.3	Very high	62 Å²	62	28 Å²	28	38%	0.38	14%	0.14	S	C	.	.	H	α-helix	trans	-120	-21.8	-172.7	51.4	0	0	0	0	114.4	S278 T279 W400	S278-T281 PolarHBondContact O-N 3.3Å; S278-T281 VanDerWaalsContact O-N 3.09Å; S278-T281 PolarHBondContact O-OG1 3.39Å; T279-T281 VanDerWaalsContact C-N 3.29Å; T279-T281 PolarHBondContact O-N 3.12Å; T281-W400 WeakPolarHBondContact O-CZ2 3.29Å
282	L	97.7	Very high	93.4	Very high	18 Å²	18	22.4 Å²	22.4	9%	0.094	13%	0.125	C	C	.	.	H	α-helix	trans	-132.4	-3.5	-177.9	-60.3	177.5	0	0	0	113.2	S278 F284 R306 V309 G401 N404 I408	S278-L282 PolarHBondContact O-N 2.86Å; L282-F284 VanDerWaalsContact C-N 3.3Å; L282-F284 HydrophobicContact CB-CD1 4.24Å; L282-F284 HydrophobicContact CB-CE1 3.97Å; L282-F284 WeakPolarHBondContact O-CD1 3.32Å; L282-F284 PolarHBondContact O-N 3.48Å; L282-R306 HydrophobicContact CD1-CB 4.47Å; L282-V309 HydrophobicContact CD1-CG2 4.23Å; L282-G401 WeakPolarHBondContact O-CA 3.37Å; L282-N404 VanDerWaalsContact C-ND2 3.33Å; L282-N404 HydrophobicContact CB-CB 4.42Å; L282-N404 WeakPolarHBondContact O-CB 3.46Å; L282-N404 PolarHBondContact O-ND2 3.32Å; L282-I408 HydrophobicContact CD1-CD1 4.1Å
283	G	97.5	Very high	93.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.152	C	C	.	.	S	Bend	trans	75.2	13.5	176.3	0	0	0	0	0	115.4	G220 T279 W400 G401	G220-G283 CarbonylContact C-O 3.54Å; G220-G283 VanDerWaalsContact C-O 3.23Å; G220-G283 WeakPolarHBondContact CA-O 3.48Å; G220-G283 PolarHBondContact N-O 3.19Å; G220-G283 CarbonylContact O-C 3.52Å; G220-G283 VanDerWaalsContact O-C 3.26Å; G220-G283 VanDerWaalsContact O-O 3.08Å; T279-G283 WeakPolarHBondContact O-CA 3.24Å; T279-G283 PolarHBondContact O-N 3.14Å; T279-G283 VanDerWaalsContact O-N 3.13Å; G283-W400 VanDerWaalsContact CA-CE3 3.45Å; G283-W400 VanDerWaalsContact CA-CZ3 3.42Å; G283-G401 VanDerWaalsContact O-CA 3.29Å; G283-G401 WeakPolarHBondContact O-CA 3.26Å
284	F	98.1	Very high	93.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	170.3	171.2	69.8	-88.5	0	0	0	110.7	K218 M219 S278 T279 L282 V309 F313 N404 L405 I408	K218-F284 CarbonylContact O-C 3.58Å; K218-F284 WeakPolarHBondContact O-CA 3.43Å; K218-F284 WeakPolarHBondContact O-CB 3.42Å; M219-F284 HydrophobicContact CE-CB 4.18Å; M219-F284 HydrophobicContact SD-CB 3.67Å; S278-F284 CarbonylContact C-O 3.23Å; S278-F284 WeakPolarHBondContact CB-O 3.43Å; S278-F284 PolarHBondContact OG-O 3.49Å; T279-F284 WeakPolarHBondContact CA-O 3.42Å; T279-F284 PolarHBondContact N-O 2.75Å; T279-F284 VanDerWaalsContact N-O 3.15Å; L282-F284 VanDerWaalsContact C-N 3.3Å; L282-F284 HydrophobicContact CB-CD1 4.24Å; L282-F284 HydrophobicContact CB-CE1 3.97Å; L282-F284 WeakPolarHBondContact O-CD1 3.32Å; L282-F284 PolarHBondContact O-N 3.48Å; F284-V309 HydrophobicContact CE2-CG1 3.81Å; F284-V309 HydrophobicContact CZ-CG1 3.82Å; F284-F313 HydrophobicContact CE2-CE2 4.27Å; F284-F313 AromaticContact CE2-CZ 3.77Å; F284-F313 HydrophobicContact CE2-CZ 3.77Å; F284-F313 HydrophobicContact CZ-CE2 4.25Å; F284-F313 HydrophobicContact CZ-CZ 4.18Å; F284-N404 HydrophobicContact CE1-CB 4.23Å; F284-L405 HydrophobicContact CD1-CB 4.28Å; F284-L405 HydrophobicContact CD1-CD1 4.49Å; F284-L405 HydrophobicContact CD2-CD1 4.28Å; F284-L405 HydrophobicContact CE1-CB 3.99Å; F284-L405 HydrophobicContact CE1-CD1 4.03Å; F284-L405 HydrophobicContact CE2-CD1 3.81Å; F284-L405 HydrophobicContact CZ-CB 4.45Å; F284-L405 HydrophobicContact CZ-CD1 3.66Å; F284-I408 HydrophobicContact CE1-CD1 4.19Å; F284-I408 HydrophobicContact CZ-CD1 3.84Å
285	R	97.3	Very high	93.5	Very high	13 Å²	13	29.4 Å²	29.4	5%	0.049	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	153.4	162.6	67.3	176.7	179.3	-75.9	-8.1	112.1	C217 K218 S277 S278 T279 E287	C217-R285 CarbonylContact C-O 3.26Å; C217-R285 VanDerWaalsContact CA-O 3.27Å; C217-R285 WeakPolarHBondContact CA-O 3.43Å; K218-R285 HydrophobicContact CB-CG 4.21Å; K218-R285 PolarHBondContact N-O 3.37Å; K218-R285 PolarHBondContact O-N 3.1Å; S277-R285 WeakPolarHBondContact OG-CD 3.37Å; S278-R285 WeakPolarHBondContact OG-CA 3.34Å; S278-R285 WeakPolarHBondContact OG-CB 3.44Å; T279-R285 WeakPolarHBondContact OG1-CD 3.4Å; T279-R285 WeakPolarHBondContact OG1-CG 3.44Å; T279-R285 PolarHBondContact OG1-NH1 2.89Å; R285-E287 IonicContact CZ-OE1 2.85Å; R285-E287 IonicContact CZ-OE2 3.61Å; R285-E287 IonicContact NE-OE1 2.67Å; R285-E287 PolarHBondContact NE-OE1 2.81Å; R285-E287 IonicContact NE-OE2 3.89Å; R285-E287 IonicContact NH2-OE1 3.45Å; R285-E287 PolarHBondContact NH2-OE1 2.75Å; R285-E287 IonicContact NH2-OE2 3.5Å; R285-E287 PolarHBondContact NH2-OE2 2.97Å; R285-E287 VanDerWaalsContact NH2-OE2 3.17Å
286	I	97	Very high	93.7	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.015	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	127.8	167.7	-55	170.2	0	0	0	108	M215 I289 F300 A312 F313	M215-I286 HydrophobicContact CG-CG2 4.24Å; M215-I286 HydrophobicContact SD-CD1 4.34Å; M215-I286 HydrophobicContact SD-CG1 4.35Å; M215-I286 HydrophobicContact SD-CG2 4.43Å; I286-I289 HydrophobicContact CG2-CD1 4.19Å; I286-I289 HydrophobicContact CG2-CG1 3.92Å; I286-F300 HydrophobicContact CB-CB 4.24Å; I286-F300 HydrophobicContact CB-CD1 4.13Å; I286-F300 HydrophobicContact CB-CD2 4.36Å; I286-F300 HydrophobicContact CB-CG 3.97Å; I286-F300 HydrophobicContact CD1-CD1 4.46Å; I286-F300 HydrophobicContact CG2-CB 4.38Å; I286-F300 HydrophobicContact CG2-CD1 3.98Å; I286-F300 HydrophobicContact CG2-CD2 3.6Å; I286-F300 HydrophobicContact CG2-CE1 4.2Å; I286-F300 HydrophobicContact CG2-CE2 3.81Å; I286-F300 HydrophobicContact CG2-CG 3.7Å; I286-F300 HydrophobicContact CG2-CZ 4.12Å; I286-F300 WeakPolarHBondContact O-CB 3.45Å; I286-A312 HydrophobicContact CD1-CB 3.46Å; I286-A312 VanDerWaalsContact CD1-CB 3.46Å; I286-F313 HydrophobicContact CD1-CD1 4.12Å; I286-F313 HydrophobicContact CD1-CE1 3.8Å; I286-F313 HydrophobicContact CD1-CZ 4.41Å; I286-F313 HydrophobicContact CG1-CE1 4.02Å; I286-F313 HydrophobicContact CG1-CZ 4.5Å
287	E	94.1	Very high	93.7	Very high	34 Å²	34	31.8 Å²	31.8	16%	0.159	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-37.1	173.1	-64.9	-89.5	74.9	0	0	111	A145 D216 K218 R273 R285	A145-E287 HydrophobicContact CB-CB 4.04Å; D216-E287 HydrophobicContact CB-CB 4.45Å; D216-E287 PolarHBondContact O-N 2.87Å; K218-E287 HydrophobicContact CB-CG 3.74Å; K218-E287 WeakPolarHBondContact CD-OE2 3.43Å; K218-E287 IonicContact NZ-OE2 3.93Å; K218-E287 PolarHBondContact NZ-OE2 2.67Å; R273-E287 IonicContact NH2-OE1 3.86Å; R285-E287 IonicContact CZ-OE1 2.85Å; R285-E287 IonicContact CZ-OE2 3.61Å; R285-E287 IonicContact NE-OE1 2.67Å; R285-E287 PolarHBondContact NE-OE1 2.81Å; R285-E287 IonicContact NE-OE2 3.89Å; R285-E287 IonicContact NH2-OE1 3.45Å; R285-E287 PolarHBondContact NH2-OE1 2.75Å; R285-E287 IonicContact NH2-OE2 3.5Å; R285-E287 PolarHBondContact NH2-OE2 2.97Å; R285-E287 VanDerWaalsContact NH2-OE2 3.17Å
288	G	95.1	Very high	93.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	158	179.4	0	0	0	0	0	113.8	M215 D216 N297	M215-G288 WeakPolarHBondContact CA-O 3.42Å; D216-G288 PolarHBondContact N-O 2.74Å; G288-N297 CarbonylContact C-O 3.55Å; G288-N297 WeakPolarHBondContact CA-O 3.39Å
289	I	95.9	Very high	93.1	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.021	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	135.8	177	-60.9	-174.9	0	0	0	108.6	I214 M215 I286 K291 C296 N297 F300 F316	I214-I289 CarbonylContact O-C 3.5Å; I214-I289 WeakPolarHBondContact O-CA 3.1Å; M215-I289 HydrophobicContact CB-CG1 4.02Å; M215-I289 HydrophobicContact CG-CD1 4.29Å; M215-I289 HydrophobicContact CG-CG1 3.83Å; M215-I289 HydrophobicContact SD-CD1 3.96Å; M215-I289 HydrophobicContact SD-CG1 4.18Å; I286-I289 HydrophobicContact CG2-CD1 4.19Å; I286-I289 HydrophobicContact CG2-CG1 3.92Å; I289-K291 HydrophobicContact CG2-CG 4.06Å; I289-C296 CarbonylContact O-C 3.58Å; I289-C296 WeakPolarHBondContact O-CA 3.35Å; I289-N297 PolarHBondContact N-O 3.34Å; I289-N297 PolarHBondContact O-N 3.43Å; I289-F300 HydrophobicContact CB-CE2 4.17Å; I289-F300 HydrophobicContact CB-CZ 4.31Å; I289-F300 HydrophobicContact CD1-CE1 4.27Å; I289-F300 HydrophobicContact CD1-CE2 4.09Å; I289-F300 HydrophobicContact CD1-CZ 3.55Å; I289-F300 HydrophobicContact CG1-CE2 3.76Å; I289-F300 HydrophobicContact CG1-CZ 3.77Å; I289-F316 HydrophobicContact CD1-CB 4.16Å; I289-F316 HydrophobicContact CD1-CD2 4.49Å; I289-F316 HydrophobicContact CG2-CD2 3.58Å; I289-F316 HydrophobicContact CG2-CE2 4.13Å
290	K	94.8	Very high	92.8	Very high	46 Å²	46	40.5 Å²	40.5	20%	0.2	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.6	161.6	173.5	-177.9	168.1	-163.8	0	108.5	V142 L144 S213 I214 S295	V142-K290 HydrophobicContact CB-CD 4.22Å; V142-K290 HydrophobicContact CG1-CD 3.95Å; V142-K290 HydrophobicContact CG2-CD 4.25Å; L144-K290 HydrophobicContact CD2-CB 3.52Å; S213-K290 CarbonylContact C-O 3.54Å; S213-K290 VanDerWaalsContact CA-O 3.3Å; S213-K290 WeakPolarHBondContact CA-O 3.46Å; I214-K290 PolarHBondContact N-O 2.81Å; I214-K290 PolarHBondContact O-N 3.04Å; I214-K290 VanDerWaalsContact O-O 3.12Å; K290-S295 CarbonylContact C-O 3.39Å; K290-S295 VanDerWaalsContact CA-O 3.25Å; K290-S295 WeakPolarHBondContact CA-O 3.37Å
291	K	93.7	Very high	92.7	Very high	43 Å²	43	42.6 Å²	42.6	19%	0.187	26%	0.255	C	S	.	.			trans	-97.3	161.4	175.6	-59.6	-167.6	-68.4	-164.2	0	110.9	I289 D293 G294 S295 D315	I289-K291 HydrophobicContact CG2-CG 4.06Å; K291-D293 WeakPolarHBondContact CB-OD1 3.35Å; K291-D293 PolarHBondContact O-N 2.98Å; K291-G294 PolarHBondContact O-N 2.75Å; K291-S295 WeakPolarHBondContact CE-OG 3.33Å; K291-S295 PolarHBondContact N-O 2.85Å; K291-D315 IonicContact NZ-OD1 3.6Å; K291-D315 PolarHBondContact NZ-OD1 3.25Å; K291-D315 IonicContact NZ-OD2 3.46Å; K291-D315 PolarHBondContact NZ-OD2 2.68Å
292	G	89.4	Confident	92.4	Very high	21 Å²	21	45 Å²	45	22%	0.216	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-22.7	-178.7	0	0	0	0	0	114.2	M211 S213 G294	M211-G292 WeakPolarHBondContact CE-O 3.45Å; M211-G292 WeakPolarHBondContact O-CA 3.28Å; S213-G292 PolarHBondContact OG-N 3.35Å; G292-G294 PolarHBondContact O-N 3.13Å
293	D	88.9	Confident	92.2	Very high	120 Å²	120	45.2 Å²	45.2	64%	0.642	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-7.5	171	68.1	-2.1	0	0	0	114	K291 S295	K291-D293 WeakPolarHBondContact CB-OD1 3.35Å; K291-D293 PolarHBondContact O-N 2.98Å; D293-S295 WeakPolarHBondContact OD1-CB 3.15Å; D293-S295 PolarHBondContact OD1-N 3.19Å; D293-S295 PolarHBondContact OD1-OG 3.35Å; D293-S295 PolarHBondContact OD2-OG 3.09Å
294	G	87.4	Confident	92.1	Very high	51 Å²	51	48.4 Å²	48.4	53%	0.526	28%	0.276	S	S	.	.	S	Bend	trans	90.7	-5.8	-177.9	0	0	0	0	0	114.6	K291 G292	K291-G294 PolarHBondContact O-N 2.75Å; G292-G294 PolarHBondContact O-N 3.13Å
295	S	89.3	Confident	92	Very high	50 Å²	50	53.5 Å²	53.5	35%	0.35	30%	0.3	S	S	.	.			trans	-63.5	141.8	173.9	67.6	0	0	0	0	110.8	K290 K291 D293	K290-S295 CarbonylContact C-O 3.39Å; K290-S295 VanDerWaalsContact CA-O 3.25Å; K290-S295 WeakPolarHBondContact CA-O 3.37Å; K291-S295 WeakPolarHBondContact CE-OG 3.33Å; K291-S295 PolarHBondContact N-O 2.85Å; D293-S295 WeakPolarHBondContact OD1-CB 3.15Å; D293-S295 PolarHBondContact OD1-N 3.19Å; D293-S295 PolarHBondContact OD1-OG 3.35Å; D293-S295 PolarHBondContact OD2-OG 3.09Å
296	C	91.1	Very high	92	Very high	81 Å²	81	56.4 Å²	56.4	55%	0.547	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	133.1	-178.4	-174.5	0	0	0	0	110.1	I289	I289-C296 CarbonylContact O-C 3.58Å; I289-C296 WeakPolarHBondContact O-CA 3.35Å
297	N	90.1	Very high	92	Very high	71 Å²	71	62.4 Å²	62.4	38%	0.38	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.1	-179.3	-173.8	-1.9	0	0	0	109.5	G288 I289 S299 F300	G288-N297 CarbonylContact C-O 3.55Å; G288-N297 WeakPolarHBondContact CA-O 3.39Å; I289-N297 PolarHBondContact N-O 3.34Å; I289-N297 PolarHBondContact O-N 3.43Å; N297-S299 WeakPolarHBondContact OD1-CB 3.27Å; N297-S299 PolarHBondContact OD1-N 3.15Å; N297-F300 HydrophobicContact CB-CE2 4.13Å; N297-F300 HydrophobicContact CB-CZ 4.3Å; N297-F300 WeakPolarHBondContact O-CE2 3.49Å
298	T	87	Confident	92.2	Very high	75 Å²	75	65 Å²	65	46%	0.46	35%	0.351	S	S	.	.			trans	-127.4	16.1	174.9	56.2	0	0	0	0	111.6	F300	T298-F300 PolarHBondContact O-N 2.66Å; T298-F300 VanDerWaalsContact O-N 3.09Å
299	S	88.1	Confident	92.3	Very high	94 Å²	94	65 Å²	65	66%	0.657	35%	0.351	S	S	*	.			trans	-85.2	32.6	-174.7	-151.5	0	0	0	0	113.5	N297 K301	N297-S299 WeakPolarHBondContact OD1-CB 3.27Å; N297-S299 PolarHBondContact OD1-N 3.15Å; S299-K301 VanDerWaalsContact C-N 3.3Å; S299-K301 PolarHBondContact O-N 3.02Å
300	F	90.7	Very high	92.4	Very high	16 Å²	16	65.9 Å²	65.9	7%	0.07	36%	0.356	C	S	.	.			trans	-87.9	5.8	-177.1	-61.6	-73.5	0	0	0	114	I286 I289 N297 T298 K302 T303 A312	I286-F300 HydrophobicContact CB-CB 4.24Å; I286-F300 HydrophobicContact CB-CD1 4.13Å; I286-F300 HydrophobicContact CB-CD2 4.36Å; I286-F300 HydrophobicContact CB-CG 3.97Å; I286-F300 HydrophobicContact CD1-CD1 4.46Å; I286-F300 HydrophobicContact CG2-CB 4.38Å; I286-F300 HydrophobicContact CG2-CD1 3.98Å; I286-F300 HydrophobicContact CG2-CD2 3.6Å; I286-F300 HydrophobicContact CG2-CE1 4.2Å; I286-F300 HydrophobicContact CG2-CE2 3.81Å; I286-F300 HydrophobicContact CG2-CG 3.7Å; I286-F300 HydrophobicContact CG2-CZ 4.12Å; I286-F300 WeakPolarHBondContact O-CB 3.45Å; I289-F300 HydrophobicContact CB-CE2 4.17Å; I289-F300 HydrophobicContact CB-CZ 4.31Å; I289-F300 HydrophobicContact CD1-CE1 4.27Å; I289-F300 HydrophobicContact CD1-CE2 4.09Å; I289-F300 HydrophobicContact CD1-CZ 3.55Å; I289-F300 HydrophobicContact CG1-CE2 3.76Å; I289-F300 HydrophobicContact CG1-CZ 3.77Å; N297-F300 HydrophobicContact CB-CE2 4.13Å; N297-F300 HydrophobicContact CB-CZ 4.3Å; N297-F300 WeakPolarHBondContact O-CE2 3.49Å; T298-F300 PolarHBondContact O-N 2.66Å; T298-F300 VanDerWaalsContact O-N 3.09Å; F300-K302 PolarHBondContact O-N 3.24Å; F300-T303 HydrophobicContact CD1-CG2 4.43Å; F300-T303 WeakPolarHBondContact O-CB 3.43Å; F300-T303 PolarHBondContact O-N 2.82Å; F300-A312 HydrophobicContact CE1-CB 3.86Å
301	K	87.5	Confident	92.5	Very high	92 Å²	92	70.8 Å²	70.8	40%	0.4	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.1	-175.5	-57.5	172.8	-170.8	170.4	0	114.7	V249 S299	V249-K301 HydrophobicContact CG2-CD 3.92Å; S299-K301 VanDerWaalsContact C-N 3.3Å; S299-K301 PolarHBondContact O-N 3.02Å
302	K	90.3	Very high	92.6	Very high	114 Å²	114	69.3 Å²	69.3	50%	0.496	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	12.3	178	-60.8	-172.5	-178.2	-176.3	0	113	V249 L276 F300 K304	V249-K302 VanDerWaalsContact CG1-CE 3.47Å; V249-K302 HydrophobicContact CG1-CG 4.41Å; V249-K302 WeakPolarHBondContact O-CE 3.23Å; V249-K302 PolarHBondContact O-NZ 3.06Å; L276-K302 WeakPolarHBondContact O-CA 3.39Å; F300-K302 PolarHBondContact O-N 3.24Å; K302-K304 PolarHBondContact O-N 2.81Å
303	T	93.9	Very high	93	Very high	21 Å²	21	68.3 Å²	68.3	13%	0.129	36%	0.363	C	S	.	.			trans	-79	108.6	175.4	-61.2	0	0	0	0	108.2	S277 S278 F300 Q308 V309	S277-T303 CarbonylContact C-O 3.53Å; S277-T303 WeakPolarHBondContact CA-O 3.49Å; S278-T303 PolarHBondContact N-O 3.35Å; F300-T303 HydrophobicContact CD1-CG2 4.43Å; F300-T303 WeakPolarHBondContact O-CB 3.43Å; F300-T303 PolarHBondContact O-N 2.82Å; T303-Q308 HydrophobicContact CG2-CB 3.98Å; T303-V309 HydrophobicContact CG2-CG2 3.91Å
304	K	94.1	Very high	93.4	Very high	67 Å²	67	67.4 Å²	67.4	29%	0.291	36%	0.355	S	S	.	.			trans	-131.5	-48.4	-167.8	177.3	169.2	-178.3	173.8	0	114.1	T275 K302	T275-K304 WeakPolarHBondContact O-CD 3.19Å; T275-K304 WeakPolarHBondContact O-CE 3.38Å; T275-K304 PolarHBondContact O-NZ 2.76Å; K302-K304 PolarHBondContact O-N 2.81Å
305	Q	96.3	Very high	93.8	Very high	107 Å²	107	68.8 Å²	68.8	50%	0.5	35%	0.35	S	S	.	.	S	Bend	trans	-75.3	149.5	-176	-54.2	-64	11.2	0	0	110.7	E307 Q308 V309	Q305-E307 WeakPolarHBondContact CB-OE2 3.19Å; Q305-E307 PolarHBondContact O-N 2.89Å; Q305-Q308 HydrophobicContact CB-CG 4.17Å; Q305-Q308 WeakPolarHBondContact O-CB 3.27Å; Q305-Q308 PolarHBondContact O-N 3.41Å; Q305-V309 PolarHBondContact O-N 3.2Å; Q305-V309 VanDerWaalsContact O-N 3.13Å
306	R	97.2	Very high	94.2	Very high	75 Å²	75	66.5 Å²	66.5	28%	0.283	33%	0.334	S	S	.	.	H	α-helix	trans	-55.3	-37.6	-177.3	-170	177.4	-177.5	-77	0.1	111.3	L282 Q308 V309 V310 D407 I408 S411	L282-R306 HydrophobicContact CD1-CB 4.47Å; R306-Q308 PolarHBondContact O-N 2.91Å; R306-V309 PolarHBondContact O-N 2.98Å; R306-V310 VanDerWaalsContact O-CG2 3.3Å; R306-V310 WeakPolarHBondContact O-CG2 3.44Å; R306-V310 PolarHBondContact O-N 2.68Å; R306-D407 IonicContact CZ-OD2 3.98Å; R306-D407 IonicContact NE-OD2 3.81Å; R306-D407 IonicContact NH2-OD2 2.74Å; R306-D407 PolarHBondContact NH2-OD2 3.28Å; R306-I408 HydrophobicContact CG-CD1 4.09Å; R306-I408 HydrophobicContact CG-CG1 4.01Å; R306-S411 PolarHBondContact NH2-OG 3.48Å
307	E	97.3	Very high	94.4	Very high	128 Å²	128	62.9 Å²	62.9	60%	0.598	31%	0.309	S	S	*	.	H	α-helix	trans	-67.8	-34.9	179.4	-57.6	66.6	-141.6	0	0	112.2	Q305 K311	Q305-E307 WeakPolarHBondContact CB-OE2 3.19Å; Q305-E307 PolarHBondContact O-N 2.89Å; E307-K311 WeakPolarHBondContact O-CB 3.42Å; E307-K311 PolarHBondContact O-N 2.78Å
308	Q	97.5	Very high	94.6	Very high	89 Å²	89	66.2 Å²	66.2	42%	0.416	33%	0.327	S	S	.	.	H	α-helix	trans	-71.4	-35.3	175.4	-60.3	174.5	-44.8	0	0	111.3	T303 Q305 R306 A312	T303-Q308 HydrophobicContact CG2-CB 3.98Å; Q305-Q308 HydrophobicContact CB-CG 4.17Å; Q305-Q308 WeakPolarHBondContact O-CB 3.27Å; Q305-Q308 PolarHBondContact O-N 3.41Å; R306-Q308 PolarHBondContact O-N 2.91Å; Q308-A312 PolarHBondContact O-N 2.89Å
309	V	97.8	Very high	94.8	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-70.4	-46	175.7	174.3	0	0	0	0	110.7	L282 F284 T303 Q305 R306 K311 A312 F313 I408	L282-V309 HydrophobicContact CD1-CG2 4.23Å; F284-V309 HydrophobicContact CE2-CG1 3.81Å; F284-V309 HydrophobicContact CZ-CG1 3.82Å; T303-V309 HydrophobicContact CG2-CG2 3.91Å; Q305-V309 PolarHBondContact O-N 3.2Å; Q305-V309 VanDerWaalsContact O-N 3.13Å; R306-V309 PolarHBondContact O-N 2.98Å; V309-K311 PolarHBondContact O-N 3.04Å; V309-A312 WeakPolarHBondContact O-CB 3.17Å; V309-A312 PolarHBondContact O-N 2.82Å; V309-A312 VanDerWaalsContact O-N 3.13Å; V309-F313 HydrophobicContact CG1-CD2 3.92Å; V309-F313 HydrophobicContact CG1-CE2 3.37Å; V309-F313 HydrophobicContact CG1-CZ 3.76Å; V309-F313 PolarHBondContact O-N 2.79Å; V309-I408 HydrophobicContact CG1-CD1 4.2Å
310	V	97.6	Very high	95.1	Very high	22 Å²	22	63.7 Å²	63.7	13%	0.133	32%	0.318	C	S	.	.	H	α-helix	trans	-52.7	-52.8	172.2	167.3	0	0	0	0	110.3	R306 A312 F313 E314 I408 M412	R306-V310 VanDerWaalsContact O-CG2 3.3Å; R306-V310 WeakPolarHBondContact O-CG2 3.44Å; R306-V310 PolarHBondContact O-N 2.68Å; V310-A312 PolarHBondContact O-N 3.28Å; V310-F313 CarbonylContact O-C 3.59Å; V310-F313 PolarHBondContact O-N 2.59Å; V310-E314 HydrophobicContact CG1-CG 4.15Å; V310-E314 WeakPolarHBondContact O-CG 3.41Å; V310-E314 PolarHBondContact O-N 2.85Å; V310-I408 HydrophobicContact CG2-CG2 3.85Å; V310-M412 HydrophobicContact CG1-CG 4.13Å
311	K	96.8	Very high	95.3	Very high	150 Å²	150	65.2 Å²	65.2	65%	0.652	33%	0.328	S	S	*	.	H	α-helix	trans	-58.2	-35	179.3	-174.7	174.2	-178.5	176.7	0	113.5	E307 V309 D315	E307-K311 WeakPolarHBondContact O-CB 3.42Å; E307-K311 PolarHBondContact O-N 2.78Å; V309-K311 PolarHBondContact O-N 3.04Å; K311-D315 PolarHBondContact O-N 3.2Å; K311-D315 VanDerWaalsContact O-N 3.11Å
312	A	97.3	Very high	95.7	Very high	11 Å²	11	66.6 Å²	66.6	9%	0.091	34%	0.336	C	S	.	.	H	α-helix	trans	-71.1	-37.2	176.2	0	0	0	0	0	112.3	I286 F300 Q308 V309 V310 F316	I286-A312 HydrophobicContact CD1-CB 3.46Å; I286-A312 VanDerWaalsContact CD1-CB 3.46Å; F300-A312 HydrophobicContact CE1-CB 3.86Å; Q308-A312 PolarHBondContact O-N 2.89Å; V309-A312 WeakPolarHBondContact O-CB 3.17Å; V309-A312 PolarHBondContact O-N 2.82Å; V309-A312 VanDerWaalsContact O-N 3.13Å; V310-A312 PolarHBondContact O-N 3.28Å; A312-F316 WeakPolarHBondContact O-CB 3.3Å; A312-F316 PolarHBondContact O-N 3.5Å
313	F	97.8	Very high	96.1	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-71	-36.1	172.7	-63.3	-35.5	0	0	0	112.5	M215 F284 I286 V309 V310 F316 V317 L405 I408 F409 M412	M215-F313 HydrophobicContact CE-CD1 3.58Å; M215-F313 HydrophobicContact CE-CE1 3.43Å; M215-F313 VanDerWaalsContact CE-CE1 3.43Å; M215-F313 HydrophobicContact SD-CD1 3.6Å; M215-F313 HydrophobicContact SD-CE1 3.55Å; M215-F313 VanDerWaalsContact SD-CE1 3.55Å; F284-F313 HydrophobicContact CE2-CE2 4.27Å; F284-F313 AromaticContact CE2-CZ 3.77Å; F284-F313 HydrophobicContact CE2-CZ 3.77Å; F284-F313 HydrophobicContact CZ-CE2 4.25Å; F284-F313 HydrophobicContact CZ-CZ 4.18Å; I286-F313 HydrophobicContact CD1-CD1 4.12Å; I286-F313 HydrophobicContact CD1-CE1 3.8Å; I286-F313 HydrophobicContact CD1-CZ 4.41Å; I286-F313 HydrophobicContact CG1-CE1 4.02Å; I286-F313 HydrophobicContact CG1-CZ 4.5Å; V309-F313 HydrophobicContact CG1-CD2 3.92Å; V309-F313 HydrophobicContact CG1-CE2 3.37Å; V309-F313 HydrophobicContact CG1-CZ 3.76Å; V309-F313 PolarHBondContact O-N 2.79Å; V310-F313 CarbonylContact O-C 3.59Å; V310-F313 PolarHBondContact O-N 2.59Å; F313-F316 PolarHBondContact O-N 2.95Å; F313-V317 WeakPolarHBondContact O-CG2 3.35Å; F313-V317 PolarHBondContact O-N 2.76Å; F313-L405 HydrophobicContact CE1-CD1 4.47Å; F313-L405 HydrophobicContact CE2-CD1 3.77Å; F313-L405 HydrophobicContact CZ-CD1 3.44Å; F313-L405 VanDerWaalsContact CZ-CD1 3.44Å; F313-I408 HydrophobicContact CD2-CG2 3.6Å; F313-I408 HydrophobicContact CE2-CG2 3.73Å; F313-F409 HydrophobicContact CD1-CE2 4.14Å; F313-F409 HydrophobicContact CD1-CZ 4.26Å; F313-F409 HydrophobicContact CD2-CD2 4.18Å; F313-F409 AromaticContact CD2-CE2 3.68Å; F313-F409 HydrophobicContact CD2-CE2 3.68Å; F313-F409 HydrophobicContact CD2-CZ 4.4Å; F313-F409 HydrophobicContact CE1-CE2 4.09Å; F313-F409 HydrophobicContact CE1-CZ 4.48Å; F313-F409 HydrophobicContact CE2-CD2 4.13Å; F313-F409 AromaticContact CE2-CE2 3.61Å; F313-F409 HydrophobicContact CE2-CE2 3.61Å; F313-F409 AromaticContact CG-CE2 3.95Å; F313-F409 HydrophobicContact CG-CE2 3.95Å; F313-F409 HydrophobicContact CG-CZ 4.23Å; F313-F409 AromaticContact CZ-CE2 3.83Å; F313-F409 HydrophobicContact CZ-CE2 3.83Å; F313-M412 HydrophobicContact CB-CE 3.66Å; F313-M412 HydrophobicContact CB-SD 3.8Å; F313-M412 HydrophobicContact CD2-SD 4.22Å
314	E	96.2	Very high	96.2	Very high	102 Å²	102	60.7 Å²	60.7	48%	0.477	31%	0.309	S	S	.	.	H	α-helix	trans	-59.9	-47.9	173.6	-71.2	174.5	153.7	0	0	111.7	V310 F316 D318 M412	V310-E314 HydrophobicContact CG1-CG 4.15Å; V310-E314 WeakPolarHBondContact O-CG 3.41Å; V310-E314 PolarHBondContact O-N 2.85Å; E314-F316 VanDerWaalsContact C-N 3.3Å; E314-F316 PolarHBondContact O-N 2.96Å; E314-D318 PolarHBondContact O-N 2.91Å; E314-D318 VanDerWaalsContact O-N 3.09Å; E314-M412 HydrophobicContact CG-CE 3.85Å
315	D	95.8	Very high	96.4	Very high	79 Å²	79	62.3 Å²	62.3	42%	0.422	32%	0.316	S	S	.	.	H	α-helix	trans	-64.3	-32.4	174	179.3	78.7	0	0	0	112.8	K291 K311	K291-D315 IonicContact NZ-OD1 3.6Å; K291-D315 PolarHBondContact NZ-OD1 3.25Å; K291-D315 IonicContact NZ-OD2 3.46Å; K291-D315 PolarHBondContact NZ-OD2 2.68Å; K311-D315 PolarHBondContact O-N 3.2Å; K311-D315 VanDerWaalsContact O-N 3.11Å
316	F	97.3	Very high	96.5	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.009	31%	0.308	C	S	.	.	H	α-helix	trans	-72.3	-40.5	179.2	-179.4	-122	0	0	0	113.4	M215 I289 A312 F313 E314 Y327 F356 H358	M215-F316 HydrophobicContact CB-CD1 4.11Å; M215-F316 HydrophobicContact CB-CD2 4.01Å; M215-F316 HydrophobicContact CB-CE1 3.75Å; M215-F316 HydrophobicContact CB-CE2 3.64Å; M215-F316 HydrophobicContact CB-CG 4.24Å; M215-F316 HydrophobicContact CB-CZ 3.49Å; M215-F316 VanDerWaalsContact CB-CZ 3.49Å; M215-F316 HydrophobicContact CE-CD1 3.65Å; M215-F316 HydrophobicContact CE-CE1 3.77Å; M215-F316 HydrophobicContact CE-CG 4.45Å; M215-F316 HydrophobicContact SD-CD1 3.92Å; M215-F316 HydrophobicContact SD-CE1 4.34Å; M215-F316 HydrophobicContact SD-CG 4.14Å; I289-F316 HydrophobicContact CD1-CB 4.16Å; I289-F316 HydrophobicContact CD1-CD2 4.49Å; I289-F316 HydrophobicContact CG2-CD2 3.58Å; I289-F316 HydrophobicContact CG2-CE2 4.13Å; A312-F316 WeakPolarHBondContact O-CB 3.3Å; A312-F316 PolarHBondContact O-N 3.5Å; F313-F316 PolarHBondContact O-N 2.95Å; E314-F316 VanDerWaalsContact C-N 3.3Å; E314-F316 PolarHBondContact O-N 2.96Å; F316-Y327 HydrophobicContact CD1-CE2 4.42Å; F316-Y327 AromaticContact CE1-CE2 3.8Å; F316-Y327 HydrophobicContact CE1-CE2 3.8Å; F316-Y327 AromaticContact CE1-CZ 3.97Å; F316-Y327 WeakPolarHBondContact CE1-OH 3.33Å; F316-F356 HydrophobicContact CE1-CB 3.89Å; F316-F356 HydrophobicContact CZ-CB 4.17Å; F316-H358 AromaticContact CE1-CD2 3.64Å; F316-H358 AromaticContact CE2-CD2 4Å; F316-H358 AromaticContact CE2-NE2 3.87Å; F316-H358 AromaticContact CZ-CD2 3.48Å; F316-H358 VanDerWaalsContact CZ-CD2 3.48Å; F316-H358 WeakPolarHBondContact CZ-CD2 3.35Å; F316-H358 AromaticContact CZ-NE2 3.82Å; F316-H358 PolarHBondContact O-CE1 3.31Å; F316-H358 PolarHBondContact O-NE2 2.72Å
317	V	96.2	Very high	96.6	Very high	5 Å²	5	55.9 Å²	55.9	3%	0.03	30%	0.295	C	S	.	.	H	α-helix	trans	-88.3	-6.2	179.2	-53.9	0	0	0	0	113.2	F313 G319 N320 I323 L324 Y327	F313-V317 WeakPolarHBondContact O-CG2 3.35Å; F313-V317 PolarHBondContact O-N 2.76Å; V317-G319 VanDerWaalsContact C-N 3.27Å; V317-G319 PolarHBondContact O-N 2.75Å; V317-N320 WeakPolarHBondContact O-CB 3.15Å; V317-N320 PolarHBondContact O-N 3.44Å; V317-I323 HydrophobicContact CB-CG2 4.38Å; V317-I323 HydrophobicContact CG1-CG2 4.12Å; V317-L324 HydrophobicContact CG1-CD1 4.5Å; V317-Y327 HydrophobicContact CG1-CD2 4.34Å; V317-Y327 HydrophobicContact CG1-CE2 4.32Å
318	D	94.1	Very high	96.6	Very high	141 Å²	141	50.7 Å²	50.7	75%	0.754	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	46.2	179.1	-163.1	31.7	0	0	0	112.9	E314 N320	E314-D318 PolarHBondContact O-N 2.91Å; E314-D318 VanDerWaalsContact O-N 3.09Å; D318-N320 PolarHBondContact O-N 2.8Å; D318-N320 VanDerWaalsContact O-N 3.08Å
319	G	90.4	Very high	96.7	Very high	61 Å²	61	52.4 Å²	52.4	63%	0.629	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	3	-176.6	0	0	0	0	0	116	V317 V321	V317-G319 VanDerWaalsContact C-N 3.27Å; V317-G319 PolarHBondContact O-N 2.75Å; G319-V321 PolarHBondContact O-N 3.22Å
320	N	95.3	Very high	96.7	Very high	55 Å²	55	54.1 Å²	54.1	29%	0.294	28%	0.283	S	S	.	.			trans	-75.1	95.2	-177.2	-169.1	-33.6	0	0	0	112.3	V317 D318 Q322 I323 L324	V317-N320 WeakPolarHBondContact O-CB 3.15Å; V317-N320 PolarHBondContact O-N 3.44Å; D318-N320 PolarHBondContact O-N 2.8Å; D318-N320 VanDerWaalsContact O-N 3.08Å; N320-Q322 PolarHBondContact O-N 3Å; N320-Q322 WeakPolarHBondContact OD1-CB 3.35Å; N320-Q322 PolarHBondContact OD1-N 3.47Å; N320-I323 HydrophobicContact CB-CB 4.2Å; N320-I323 HydrophobicContact CB-CD1 3.94Å; N320-I323 HydrophobicContact CB-CG1 4.28Å; N320-I323 WeakPolarHBondContact ND2-CD1 3.18Å; N320-I323 PolarHBondContact O-N 3.14Å; N320-I323 PolarHBondContact OD1-N 2.89Å; N320-L324 PolarHBondContact O-N 2.97Å
321	V	95.5	Very high	96.8	Very high	48 Å²	48	53 Å²	53	29%	0.291	28%	0.277	S	S	.	.	H	α-helix	trans	-59.1	-27.3	179.3	-179.9	0	0	0	0	113.3	G319 K325 L413 P414	G319-V321 PolarHBondContact O-N 3.22Å; V321-K325 HydrophobicContact CG1-CD 4.21Å; V321-K325 HydrophobicContact CG1-CG 4.43Å; V321-K325 WeakPolarHBondContact O-CB 3.29Å; V321-K325 VanDerWaalsContact O-CG 3.26Å; V321-K325 WeakPolarHBondContact O-CG 3.34Å; V321-K325 PolarHBondContact O-N 2.65Å; V321-L413 HydrophobicContact CG1-CD2 4.13Å; V321-P414 HydrophobicContact CG1-CG 4.44Å; V321-P414 HydrophobicContact CG2-CG 4.11Å
322	Q	96.1	Very high	96.9	Very high	121 Å²	121	49.7 Å²	49.7	57%	0.565	26%	0.264	S	S	*	.	H	α-helix	trans	-76	-38.8	179.5	-58	-61.4	-10.8	0	0	111.9	N320 K325 S326	N320-Q322 PolarHBondContact O-N 3Å; N320-Q322 WeakPolarHBondContact OD1-CB 3.35Å; N320-Q322 PolarHBondContact OD1-N 3.47Å; Q322-K325 PolarHBondContact O-N 3.35Å; Q322-S326 WeakPolarHBondContact O-CB 3.49Å; Q322-S326 PolarHBondContact O-N 2.9Å; Q322-S326 PolarHBondContact O-OG 3.36Å
323	I	97.8	Very high	96.9	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-46.1	171.6	-70.9	171.3	0	0	0	109.6	V317 N320 K325 S326 Y327 H358 A364	V317-I323 HydrophobicContact CB-CG2 4.38Å; V317-I323 HydrophobicContact CG1-CG2 4.12Å; N320-I323 HydrophobicContact CB-CB 4.2Å; N320-I323 HydrophobicContact CB-CD1 3.94Å; N320-I323 HydrophobicContact CB-CG1 4.28Å; N320-I323 WeakPolarHBondContact ND2-CD1 3.18Å; N320-I323 PolarHBondContact O-N 3.14Å; N320-I323 PolarHBondContact OD1-N 2.89Å; I323-K325 PolarHBondContact O-N 2.91Å; I323-S326 WeakPolarHBondContact O-CB 3.25Å; I323-S326 PolarHBondContact O-N 2.92Å; I323-S326 VanDerWaalsContact O-N 3.14Å; I323-Y327 HydrophobicContact CG2-CD2 3.71Å; I323-Y327 HydrophobicContact CG2-CE2 3.43Å; I323-Y327 VanDerWaalsContact CG2-CE2 3.43Å; I323-Y327 WeakPolarHBondContact O-CD2 3.49Å; I323-Y327 PolarHBondContact O-N 3.49Å; I323-H358 HydrophobicContact CD1-CB 4.12Å; I323-H358 HydrophobicContact CG1-CB 4.39Å; I323-H358 HydrophobicContact CG2-CB 3.85Å; I323-A364 HydrophobicContact CG1-CB 4.48Å; I323-A364 HydrophobicContact CG2-CB 4.08Å
324	L	97.3	Very high	97	Very high	7 Å²	7	52.8 Å²	52.8	4%	0.037	28%	0.276	C	S	.	.	H	α-helix	trans	-57.6	-46.6	176.9	-173	67.4	0	0	0	112.6	V317 N320 Y327 L328 F409 M412 L413	V317-L324 HydrophobicContact CG1-CD1 4.5Å; N320-L324 PolarHBondContact O-N 2.97Å; L324-Y327 PolarHBondContact O-N 2.76Å; L324-L328 PolarHBondContact O-N 3.32Å; L324-F409 HydrophobicContact CD1-CD1 3.49Å; L324-F409 VanDerWaalsContact CD1-CD1 3.49Å; L324-F409 HydrophobicContact CD1-CE1 3.87Å; L324-F409 HydrophobicContact CD1-CG 4.25Å; L324-M412 HydrophobicContact CD1-CB 4.28Å; L324-M412 HydrophobicContact CD1-CE 3.7Å; L324-M412 HydrophobicContact CD1-SD 4.26Å; L324-M412 HydrophobicContact CD2-CB 3.73Å; L324-M412 HydrophobicContact CD2-CE 4.41Å; L324-L413 HydrophobicContact CB-CD2 4.47Å; L324-L413 HydrophobicContact CD2-CD2 3.75Å; L324-L413 HydrophobicContact CD2-CG 4.2Å; L324-L413 HydrophobicContact CG-CD2 4.02Å
325	K	97.6	Very high	97.1	Very high	101 Å²	101	50.8 Å²	50.8	44%	0.439	27%	0.265	S	S	.	.	H	α-helix	trans	-62.1	-40.6	174.3	-76.4	175.9	178.9	178.1	0	112.8	V321 Q322 I323 L328 K329 L413	V321-K325 HydrophobicContact CG1-CD 4.21Å; V321-K325 HydrophobicContact CG1-CG 4.43Å; V321-K325 WeakPolarHBondContact O-CB 3.29Å; V321-K325 VanDerWaalsContact O-CG 3.26Å; V321-K325 WeakPolarHBondContact O-CG 3.34Å; V321-K325 PolarHBondContact O-N 2.65Å; Q322-K325 PolarHBondContact O-N 3.35Å; I323-K325 PolarHBondContact O-N 2.91Å; K325-L328 PolarHBondContact O-N 3.48Å; K325-K329 WeakPolarHBondContact O-CB 3.2Å; K325-K329 PolarHBondContact O-N 3.23Å; K325-L413 HydrophobicContact CD-CD2 4.41Å; K325-L413 HydrophobicContact CG-CD1 4.36Å; K325-L413 HydrophobicContact CG-CD2 3.51Å
326	S	98.2	Very high	97.3	Very high	47 Å²	47	49.2 Å²	49.2	33%	0.329	26%	0.259	S	S	.	.	H	α-helix	trans	-66.2	-40.4	179.8	-60.6	0	0	0	0	111.4	Q322 I323 R330	Q322-S326 WeakPolarHBondContact O-CB 3.49Å; Q322-S326 PolarHBondContact O-N 2.9Å; Q322-S326 PolarHBondContact O-OG 3.36Å; I323-S326 WeakPolarHBondContact O-CB 3.25Å; I323-S326 PolarHBondContact O-N 2.92Å; I323-S326 VanDerWaalsContact O-N 3.14Å; S326-R330 VanDerWaalsContact O-CB 3.26Å; S326-R330 WeakPolarHBondContact O-CB 3.36Å; S326-R330 PolarHBondContact O-N 2.84Å
327	Y	98.6	Very high	97.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.7	-49.6	172.5	-74.7	-41.3	0	0	0	112.8	F316 V317 I323 L324 K329 R330 L331 F356 V357 H358 A364 S365 V366 F409	F316-Y327 HydrophobicContact CD1-CE2 4.42Å; F316-Y327 AromaticContact CE1-CE2 3.8Å; F316-Y327 HydrophobicContact CE1-CE2 3.8Å; F316-Y327 AromaticContact CE1-CZ 3.97Å; F316-Y327 WeakPolarHBondContact CE1-OH 3.33Å; V317-Y327 HydrophobicContact CG1-CD2 4.34Å; V317-Y327 HydrophobicContact CG1-CE2 4.32Å; I323-Y327 HydrophobicContact CG2-CD2 3.71Å; I323-Y327 HydrophobicContact CG2-CE2 3.43Å; I323-Y327 VanDerWaalsContact CG2-CE2 3.43Å; I323-Y327 WeakPolarHBondContact O-CD2 3.49Å; I323-Y327 PolarHBondContact O-N 3.49Å; L324-Y327 PolarHBondContact O-N 2.76Å; Y327-K329 VanDerWaalsContact C-N 3.35Å; Y327-K329 PolarHBondContact O-N 2.81Å; Y327-R330 PolarHBondContact O-N 3.48Å; Y327-R330 VanDerWaalsContact O-N 3.12Å; Y327-L331 VanDerWaalsContact O-CG 3.3Å; Y327-L331 WeakPolarHBondContact O-CG 3.38Å; Y327-L331 PolarHBondContact O-N 2.98Å; Y327-F356 AromaticContact CD1-CD1 3.66Å; Y327-F356 HydrophobicContact CD1-CD1 3.66Å; Y327-F356 HydrophobicContact CD1-CE1 4.23Å; Y327-F356 HydrophobicContact CD2-CD1 4.18Å; Y327-F356 HydrophobicContact CE1-CB 4.05Å; Y327-F356 AromaticContact CE1-CD1 3.67Å; Y327-F356 HydrophobicContact CE1-CD1 3.67Å; Y327-F356 HydrophobicContact CE1-CG 4.33Å; Y327-F356 HydrophobicContact CE2-CD1 4.16Å; Y327-F356 AromaticContact CG-CD1 3.91Å; Y327-F356 HydrophobicContact CG-CD1 3.91Å; Y327-F356 HydrophobicContact CG-CE1 4.25Å; Y327-F356 AromaticContact CZ-CD1 3.9Å; Y327-V357 PolarHBondContact OH-N 3.16Å; Y327-V357 PolarHBondContact OH-O 3.47Å; Y327-V357 VanDerWaalsContact OH-O 3.05Å; Y327-H358 HydrophobicContact CE2-CB 4.4Å; Y327-H358 AromaticContact CE2-CD2 3.9Å; Y327-H358 AromaticContact CZ-CD2 3.99Å; Y327-H358 WeakPolarHBondContact OH-CB 3.46Å; Y327-H358 PolarHBondContact OH-CD2 3.19Å; Y327-H358 VanDerWaalsContact OH-CD2 3.27Å; Y327-H358 PolarHBondContact OH-N 2.83Å; Y327-A364 HydrophobicContact CD1-CB 4.12Å; Y327-A364 HydrophobicContact CE1-CB 3.85Å; Y327-A364 HydrophobicContact CE2-CB 4.48Å; Y327-S365 WeakPolarHBondContact CE1-O 3.45Å; Y327-V366 HydrophobicContact CD1-CG2 3.55Å; Y327-V366 HydrophobicContact CE1-CG2 3.98Å; Y327-F409 AromaticContact CD2-CE1 3.86Å; Y327-F409 HydrophobicContact CD2-CE1 3.86Å; Y327-F409 HydrophobicContact CG-CE1 4.04Å
328	L	98.4	Very high	97.5	Very high	20 Å²	20	50.1 Å²	50.1	11%	0.105	27%	0.265	C	S	.	.	H	α-helix	trans	-54.3	-52	178.4	178.7	61.5	0	0	0	111.3	L324 K325 R330 L331 E332 I406 F409 L413	L324-L328 PolarHBondContact O-N 3.32Å; K325-L328 PolarHBondContact O-N 3.48Å; L328-R330 VanDerWaalsContact C-N 3.32Å; L328-R330 PolarHBondContact O-N 2.9Å; L328-L331 PolarHBondContact O-N 2.86Å; L328-L331 VanDerWaalsContact O-N 3.17Å; L328-E332 HydrophobicContact CD1-CG 4.4Å; L328-E332 WeakPolarHBondContact O-CG 3.25Å; L328-E332 PolarHBondContact O-N 3.42Å; L328-I406 HydrophobicContact CD1-CB 4.43Å; L328-I406 HydrophobicContact CD1-CG2 3.86Å; L328-I406 WeakPolarHBondContact CD1-O 3.49Å; L328-F409 HydrophobicContact CB-CB 4.34Å; L328-F409 HydrophobicContact CD1-CB 4Å; L328-L413 HydrophobicContact CD2-CD1 3.5Å
329	K	98.5	Very high	97.7	Very high	124 Å²	124	48.1 Å²	48.1	54%	0.539	25%	0.251	S	S	.	.	H	α-helix	trans	-56.7	-45.1	177.1	177.4	179	168.3	-177.5	0	111.9	K325 Y327 L331 E332 E333	K325-K329 WeakPolarHBondContact O-CB 3.2Å; K325-K329 PolarHBondContact O-N 3.23Å; Y327-K329 VanDerWaalsContact C-N 3.35Å; Y327-K329 PolarHBondContact O-N 2.81Å; K329-L331 VanDerWaalsContact C-N 3.33Å; K329-L331 PolarHBondContact O-N 3.23Å; K329-E332 PolarHBondContact O-N 3.34Å; K329-E333 WeakPolarHBondContact CE-OE1 3.42Å; K329-E333 IonicContact NZ-OE1 2.67Å; K329-E333 WeakPolarHBondContact O-CB 3.21Å; K329-E333 WeakPolarHBondContact O-CG 3.41Å; K329-E333 PolarHBondContact O-N 3.43Å
330	R	98.6	Very high	98.1	Very high	36 Å²	36	52.4 Å²	52.4	14%	0.136	25%	0.252	C	S	.	.	H	α-helix	trans	-64.9	-35	180	179.8	57.2	174.2	-175.2	-3	112.5	P183 S326 Y327 L328 L334 V366	P183-R330 PolarHBondContact O-NH2 3Å; S326-R330 VanDerWaalsContact O-CB 3.26Å; S326-R330 WeakPolarHBondContact O-CB 3.36Å; S326-R330 PolarHBondContact O-N 2.84Å; Y327-R330 PolarHBondContact O-N 3.48Å; Y327-R330 VanDerWaalsContact O-N 3.12Å; L328-R330 VanDerWaalsContact C-N 3.32Å; L328-R330 PolarHBondContact O-N 2.9Å; R330-L334 VanDerWaalsContact O-CB 3.28Å; R330-L334 WeakPolarHBondContact O-CB 3.32Å; R330-L334 PolarHBondContact O-N 2.77Å; R330-V366 HydrophobicContact CB-CG2 4.47Å; R330-V366 HydrophobicContact CG-CB 3.97Å; R330-V366 HydrophobicContact CG-CG2 4Å; R330-V366 PolarHBondContact NE-O 3.33Å; R330-V366 VanDerWaalsContact NE-O 3.1Å; R330-V366 PolarHBondContact NH2-O 2.98Å
331	L	98.8	Very high	98.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-70.6	-41.9	175	-66.8	170.9	0	0	0	111.7	Y327 L328 K329 L334 R335 L354 F356 V366 M402 L405 I406 F409	Y327-L331 VanDerWaalsContact O-CG 3.3Å; Y327-L331 WeakPolarHBondContact O-CG 3.38Å; Y327-L331 PolarHBondContact O-N 2.98Å; L328-L331 PolarHBondContact O-N 2.86Å; L328-L331 VanDerWaalsContact O-N 3.17Å; K329-L331 VanDerWaalsContact C-N 3.33Å; K329-L331 PolarHBondContact O-N 3.23Å; L331-L334 PolarHBondContact O-N 3.44Å; L331-R335 WeakPolarHBondContact O-CB 3.29Å; L331-R335 PolarHBondContact O-N 2.9Å; L331-L354 HydrophobicContact CD2-CD1 3.95Å; L331-F356 HydrophobicContact CD1-CE1 4.15Å; L331-F356 HydrophobicContact CD1-CZ 4.16Å; L331-F356 HydrophobicContact CD2-CE1 4.35Å; L331-F356 HydrophobicContact CD2-CZ 4Å; L331-V366 HydrophobicContact CD2-CG1 4.23Å; L331-V366 HydrophobicContact CD2-CG2 4.29Å; L331-M402 HydrophobicContact CB-SD 4.11Å; L331-M402 HydrophobicContact CD2-CE 4.41Å; L331-M402 HydrophobicContact CD2-SD 3.82Å; L331-L405 HydrophobicContact CD1-CD2 4.18Å; L331-L405 HydrophobicContact CD1-CG 3.98Å; L331-L405 HydrophobicContact CD2-CD2 4.04Å; L331-I406 HydrophobicContact CB-CD1 4.26Å; L331-I406 HydrophobicContact CB-CG1 3.74Å; L331-F409 HydrophobicContact CD1-CD2 4.29Å; L331-F409 HydrophobicContact CD1-CG 4.32Å
332	E	98.8	Very high	98.3	Very high	80 Å²	80	52.1 Å²	52.1	37%	0.374	25%	0.25	S	C	.	.	H	α-helix	trans	-62.9	-42.1	174.7	-68.8	176.6	139.2	0	0	112.3	L328 K329 S336 I406	L328-E332 HydrophobicContact CD1-CG 4.4Å; L328-E332 WeakPolarHBondContact O-CG 3.25Å; L328-E332 PolarHBondContact O-N 3.42Å; K329-E332 PolarHBondContact O-N 3.34Å; E332-S336 WeakPolarHBondContact O-CB 3.18Å; E332-S336 PolarHBondContact O-N 3.46Å; E332-S336 VanDerWaalsContact O-N 3.11Å; E332-S336 PolarHBondContact O-OG 3Å; E332-I406 HydrophobicContact CG-CD1 4.31Å; E332-I406 HydrophobicContact CG-CG2 4.11Å
333	E	98.8	Very high	98.5	Very high	76 Å²	76	46.8 Å²	46.8	36%	0.355	22%	0.224	S	C	.	.	H	α-helix	trans	-60.7	-49.1	172.1	-75.7	175.4	173.9	0	0	111.2	Y184 K329 S336 V337	Y184-E333 HydrophobicContact CE1-CB 4.39Å; K329-E333 WeakPolarHBondContact CE-OE1 3.42Å; K329-E333 IonicContact NZ-OE1 2.67Å; K329-E333 WeakPolarHBondContact O-CB 3.21Å; K329-E333 WeakPolarHBondContact O-CG 3.41Å; K329-E333 PolarHBondContact O-N 3.43Å; E333-S336 WeakPolarHBondContact O-CB 3.35Å; E333-S336 PolarHBondContact O-N 3.06Å; E333-V337 WeakPolarHBondContact O-CG2 3.37Å; E333-V337 PolarHBondContact O-N 3.09Å
334	L	98.8	Very high	98.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.6	-48.8	178.7	173.5	52	0	0	0	111.9	L181 Y184 R330 L331 S336 V337 L338 L354 M368 M402	L181-L334 HydrophobicContact CD2-CD1 3.86Å; Y184-L334 HydrophobicContact CD1-CB 3.72Å; Y184-L334 HydrophobicContact CD1-CD1 3.63Å; Y184-L334 HydrophobicContact CD1-CD2 4.46Å; Y184-L334 HydrophobicContact CD1-CG 4.11Å; Y184-L334 HydrophobicContact CE1-CB 3.82Å; Y184-L334 HydrophobicContact CE1-CD1 4.36Å; Y184-L334 HydrophobicContact CG-CD1 3.74Å; R330-L334 VanDerWaalsContact O-CB 3.28Å; R330-L334 WeakPolarHBondContact O-CB 3.32Å; R330-L334 PolarHBondContact O-N 2.77Å; L331-L334 PolarHBondContact O-N 3.44Å; L334-S336 VanDerWaalsContact C-N 3.26Å; L334-S336 PolarHBondContact O-N 2.97Å; L334-V337 PolarHBondContact O-N 2.67Å; L334-L338 HydrophobicContact CD1-CD1 3.9Å; L334-L338 HydrophobicContact CD1-CD2 4.34Å; L334-L338 HydrophobicContact CD1-CG 3.81Å; L334-L338 HydrophobicContact CG-CD1 3.83Å; L334-L338 HydrophobicContact CG-CG 4.27Å; L334-L338 WeakPolarHBondContact O-CG 3.44Å; L334-L338 PolarHBondContact O-N 2.6Å; L334-L354 HydrophobicContact CD2-CD2 3.65Å; L334-M368 HydrophobicContact CD1-CG 4.41Å; L334-M368 HydrophobicContact CD1-SD 3.98Å; L334-M368 HydrophobicContact CD2-CG 4.2Å; L334-M402 HydrophobicContact CD2-CE 3.74Å; L334-M402 HydrophobicContact CG-CE 3.88Å
335	R	98.8	Very high	98.6	Very high	60 Å²	60	52 Å²	52	23%	0.226	24%	0.244	C	C	.	.	H	α-helix	trans	-52	-47.3	173.9	-179.1	179.8	64.7	-170.5	-6.1	111.4	L331 V337 L338 E339 L399 M402 D403 I406	L331-R335 WeakPolarHBondContact O-CB 3.29Å; L331-R335 PolarHBondContact O-N 2.9Å; R335-V337 PolarHBondContact O-N 2.87Å; R335-V337 VanDerWaalsContact O-N 3.16Å; R335-L338 PolarHBondContact O-N 3.18Å; R335-E339 WeakPolarHBondContact O-CG 3.49Å; R335-E339 PolarHBondContact O-N 3.42Å; R335-E339 VanDerWaalsContact O-N 3.08Å; R335-L399 HydrophobicContact CG-CD2 4.13Å; R335-M402 HydrophobicContact CB-CG 3.92Å; R335-M402 HydrophobicContact CG-CG 4.31Å; R335-D403 WeakPolarHBondContact CD-OD1 3.41Å; R335-D403 IonicContact CZ-OD1 3.67Å; R335-D403 IonicContact NE-OD1 3.28Å; R335-D403 IonicContact NH1-OD1 3.17Å; R335-D403 PolarHBondContact NH1-OD1 2.92Å; R335-I406 HydrophobicContact CB-CD1 4.1Å
336	S	98.7	Very high	98.6	Very high	45 Å²	45	49.7 Å²	49.7	32%	0.315	24%	0.238	S	C	.	.	H	α-helix	trans	-66.3	-14.9	-179	-56.2	0	0	0	0	114.2	E332 E333 L334 K340	E332-S336 WeakPolarHBondContact O-CB 3.18Å; E332-S336 PolarHBondContact O-N 3.46Å; E332-S336 VanDerWaalsContact O-N 3.11Å; E332-S336 PolarHBondContact O-OG 3Å; E333-S336 WeakPolarHBondContact O-CB 3.35Å; E333-S336 PolarHBondContact O-N 3.06Å; L334-S336 VanDerWaalsContact C-N 3.26Å; L334-S336 PolarHBondContact O-N 2.97Å; S336-K340 WeakPolarHBondContact O-CD 3.44Å; S336-K340 WeakPolarHBondContact O-CE 3.45Å; S336-K340 PolarHBondContact O-NZ 3.28Å
337	V	98.8	Very high	98.6	Very high	26 Å²	26	47.5 Å²	47.5	16%	0.158	22%	0.223	C	C	.	.	H	α-helix	trans	-98.2	-39.2	174.4	175.9	0	0	0	0	111.2	V180 L181 Y184 E333 L334 R335 E339 K340 S341	V180-V337 HydrophobicContact CB-CG1 4Å; V180-V337 HydrophobicContact CG2-CG1 3.76Å; V180-V337 WeakPolarHBondContact O-CG1 3.24Å; L181-V337 HydrophobicContact CD2-CB 4.47Å; L181-V337 HydrophobicContact CD2-CG1 3.84Å; L181-V337 HydrophobicContact CG-CG1 4.32Å; Y184-V337 HydrophobicContact CD2-CG1 4.29Å; Y184-V337 HydrophobicContact CE2-CB 4.1Å; Y184-V337 HydrophobicContact CE2-CG1 4.04Å; Y184-V337 HydrophobicContact CE2-CG2 3.79Å; E333-V337 WeakPolarHBondContact O-CG2 3.37Å; E333-V337 PolarHBondContact O-N 3.09Å; L334-V337 PolarHBondContact O-N 2.67Å; R335-V337 PolarHBondContact O-N 2.87Å; R335-V337 VanDerWaalsContact O-N 3.16Å; V337-E339 VanDerWaalsContact C-N 3.31Å; V337-E339 PolarHBondContact O-N 2.6Å; V337-K340 CarbonylContact O-C 3.41Å; V337-K340 PolarHBondContact O-N 2.75Å; V337-S341 PolarHBondContact O-N 2.74Å; V337-S341 VanDerWaalsContact O-N 3.08Å
338	L	98.8	Very high	98.6	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-53.8	-46.9	172.3	-73.8	165.6	0	0	0	111.5	L181 L334 R335 K340 S341 F344 M368 Y398 L399 M402	L181-L338 HydrophobicContact CD1-CD2 3.94Å; L181-L338 HydrophobicContact CD2-CD2 3.66Å; L181-L338 HydrophobicContact CD2-CG 3.96Å; L181-L338 HydrophobicContact CG-CD2 4.45Å; L334-L338 HydrophobicContact CD1-CD1 3.9Å; L334-L338 HydrophobicContact CD1-CD2 4.34Å; L334-L338 HydrophobicContact CD1-CG 3.81Å; L334-L338 HydrophobicContact CG-CD1 3.83Å; L334-L338 HydrophobicContact CG-CG 4.27Å; L334-L338 WeakPolarHBondContact O-CG 3.44Å; L334-L338 PolarHBondContact O-N 2.6Å; R335-L338 PolarHBondContact O-N 3.18Å; L338-K340 PolarHBondContact O-N 3.17Å; L338-S341 PolarHBondContact O-N 2.86Å; L338-S341 VanDerWaalsContact O-N 3.09Å; L338-F344 HydrophobicContact CB-CD1 3.93Å; L338-F344 HydrophobicContact CB-CE1 3.99Å; L338-F344 HydrophobicContact CB-CG 4.42Å; L338-F344 HydrophobicContact CD2-CB 4.33Å; L338-F344 HydrophobicContact CD2-CD1 3.92Å; L338-F344 HydrophobicContact CD2-CD2 3.44Å; L338-F344 VanDerWaalsContact CD2-CD2 3.44Å; L338-F344 HydrophobicContact CD2-CE1 4.04Å; L338-F344 HydrophobicContact CD2-CE2 3.6Å; L338-F344 HydrophobicContact CD2-CG 3.63Å; L338-F344 HydrophobicContact CD2-CZ 3.9Å; L338-F344 HydrophobicContact CG-CE1 4.5Å; L338-F344 WeakPolarHBondContact O-CD1 3.43Å; L338-M368 HydrophobicContact CD2-CE 3.75Å; L338-M368 HydrophobicContact CD2-SD 3.8Å; L338-Y398 HydrophobicContact CD1-CD1 4.43Å; L338-Y398 HydrophobicContact CD1-CE1 3.96Å; L338-L399 HydrophobicContact CB-CD2 4.01Å; L338-L399 HydrophobicContact CD1-CD2 3.84Å; L338-M402 HydrophobicContact CD1-CE 3.83Å
339	E	98.6	Very high	98.5	Very high	98 Å²	98	46.6 Å²	46.6	46%	0.458	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-10.2	177.5	-69.5	174	160.3	0	0	114.5	R335 V337 R386 L399	R335-E339 WeakPolarHBondContact O-CG 3.49Å; R335-E339 PolarHBondContact O-N 3.42Å; R335-E339 VanDerWaalsContact O-N 3.08Å; V337-E339 VanDerWaalsContact C-N 3.31Å; V337-E339 PolarHBondContact O-N 2.6Å; E339-R386 IonicContact OE1-CZ 2.65Å; E339-R386 IonicContact OE1-NH1 2.74Å; E339-R386 PolarHBondContact OE1-NH1 3.4Å; E339-R386 IonicContact OE1-NH2 3.24Å; E339-R386 PolarHBondContact OE1-NH2 2.93Å; E339-L399 HydrophobicContact CG-CD1 3.92Å
340	K	98.4	Very high	98.4	Very high	151 Å²	151	40.7 Å²	40.7	66%	0.657	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.4	-1.4	179.3	-60.3	176.3	-172.3	126.5	0	113.1	S336 V337 L338	S336-K340 WeakPolarHBondContact O-CD 3.44Å; S336-K340 WeakPolarHBondContact O-CE 3.45Å; S336-K340 PolarHBondContact O-NZ 3.28Å; V337-K340 CarbonylContact O-C 3.41Å; V337-K340 PolarHBondContact O-N 2.75Å; L338-K340 PolarHBondContact O-N 3.17Å
341	S	98.7	Very high	98.2	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.014	19%	0.194	C	C	.	.			trans	-83.2	123	-175.7	172.9	0	0	0	0	110.4	D179 L181 V337 L338 F343 F344 R345	D179-S341 WeakPolarHBondContact OD1-CB 3.35Å; D179-S341 PolarHBondContact OD1-OG 2.82Å; D179-S341 PolarHBondContact OD2-OG 2.64Å; D179-S341 VanDerWaalsContact OD2-OG 3.1Å; L181-S341 VanDerWaalsContact CD1-OG 3.27Å; L181-S341 WeakPolarHBondContact CD1-OG 3.43Å; V337-S341 PolarHBondContact O-N 2.74Å; V337-S341 VanDerWaalsContact O-N 3.08Å; L338-S341 PolarHBondContact O-N 2.86Å; L338-S341 VanDerWaalsContact O-N 3.09Å; S341-F343 VanDerWaalsContact C-N 3.33Å; S341-F343 PolarHBondContact OG-N 3.37Å; S341-F344 WeakPolarHBondContact OG-CB 3.15Å; S341-F344 PolarHBondContact OG-N 3.32Å; S341-R345 WeakPolarHBondContact O-CB 3.33Å; S341-R345 PolarHBondContact O-N 2.85Å
342	D	98.2	Very high	98.1	Very high	96 Å²	96	39.8 Å²	39.8	51%	0.513	19%	0.194	S	C	.	.	H	α-helix	trans	-68.8	-37.4	173.3	-81.3	-39.7	0	0	0	110.5	D179 R345 T346	D179-D342 PolarHBondContact OD2-N 3.05Å; D342-R345 IonicContact OD1-CZ 3.22Å; D342-R345 IonicContact OD1-NE 2.76Å; D342-R345 IonicContact OD1-NH2 3.74Å; D342-R345 PolarHBondContact OD1-NH2 3.39Å; D342-T346 WeakPolarHBondContact O-CB 3.42Å; D342-T346 WeakPolarHBondContact O-CG2 3.29Å; D342-T346 PolarHBondContact O-N 3.15Å; D342-T346 PolarHBondContact O-OG1 3.23Å
343	F	98.6	Very high	98.1	Very high	8 Å²	8	36 Å²	36	4%	0.035	18%	0.176	C	C	.	.	H	α-helix	trans	-56.1	-58	171.7	173.9	-93.6	0	0	0	110.7	C172 Q175 L176 D179 L181 S341 R345 T346 H347 T374	C172-F343 HydrophobicContact CB-CE2 4.2Å; C172-F343 HydrophobicContact CB-CZ 3.95Å; Q175-F343 HydrophobicContact CB-CD2 3.74Å; Q175-F343 HydrophobicContact CB-CE2 4.07Å; L176-F343 HydrophobicContact CD1-CE1 4.04Å; L176-F343 HydrophobicContact CD1-CZ 4.04Å; L176-F343 HydrophobicContact CD2-CD1 3.47Å; L176-F343 VanDerWaalsContact CD2-CD1 3.47Å; L176-F343 HydrophobicContact CD2-CE1 3.65Å; L176-F343 HydrophobicContact CD2-CG 3.99Å; L176-F343 HydrophobicContact CD2-CZ 4.29Å; L176-F343 HydrophobicContact CG-CD1 3.99Å; L176-F343 HydrophobicContact CG-CD2 4.37Å; L176-F343 HydrophobicContact CG-CE1 3.84Å; L176-F343 HydrophobicContact CG-CE2 4.23Å; L176-F343 HydrophobicContact CG-CG 4.26Å; L176-F343 HydrophobicContact CG-CZ 3.96Å; D179-F343 HydrophobicContact CB-CB 4.09Å; D179-F343 PolarHBondContact OD2-N 2.96Å; L181-F343 HydrophobicContact CD1-CD1 4.29Å; S341-F343 VanDerWaalsContact C-N 3.33Å; S341-F343 PolarHBondContact OG-N 3.37Å; F343-R345 PolarHBondContact O-N 3.07Å; F343-T346 CarbonylContact O-C 3.49Å; F343-T346 PolarHBondContact O-N 2.82Å; F343-T346 VanDerWaalsContact O-N 3.15Å; F343-T346 PolarHBondContact O-OG1 2.73Å; F343-H347 AromaticContact CD2-CE1 3.43Å; F343-H347 VanDerWaalsContact CD2-CE1 3.43Å; F343-H347 WeakPolarHBondContact CD2-CE1 3.06Å; F343-H347 AromaticContact CD2-ND1 3.65Å; F343-H347 AromaticContact CD2-NE2 3.79Å; F343-H347 AromaticContact CE2-CD2 3.57Å; F343-H347 AromaticContact CE2-CE1 3.54Å; F343-H347 AromaticContact CE2-CG 3.84Å; F343-H347 AromaticContact CE2-ND1 3.81Å; F343-H347 AromaticContact CE2-NE2 3.39Å; F343-H347 WeakPolarHBondContact CE2-NE2 3.22Å; F343-H347 AromaticContact CZ-CD2 3.89Å; F343-H347 PolarHBondContact O-N 2.78Å; F343-H347 PolarHBondContact O-ND1 2.83Å; F343-T374 HydrophobicContact CE1-CG2 4.18Å; F343-T374 HydrophobicContact CZ-CG2 3.8Å
344	F	98.7	Very high	98.1	Very high	1 Å²	1	32.3 Å²	32.3	0%	0.004	16%	0.159	C	C	.	.	H	α-helix	trans	-58	-54.6	-173.5	-170.8	-113.7	0	0	0	111.7	L181 L338 S341 T346 H347 V349 M368 H385 Y398 L399	L181-F344 HydrophobicContact CD1-CB 4.08Å; L338-F344 HydrophobicContact CB-CD1 3.93Å; L338-F344 HydrophobicContact CB-CE1 3.99Å; L338-F344 HydrophobicContact CB-CG 4.42Å; L338-F344 HydrophobicContact CD2-CB 4.33Å; L338-F344 HydrophobicContact CD2-CD1 3.92Å; L338-F344 HydrophobicContact CD2-CD2 3.44Å; L338-F344 VanDerWaalsContact CD2-CD2 3.44Å; L338-F344 HydrophobicContact CD2-CE1 4.04Å; L338-F344 HydrophobicContact CD2-CE2 3.6Å; L338-F344 HydrophobicContact CD2-CG 3.63Å; L338-F344 HydrophobicContact CD2-CZ 3.9Å; L338-F344 HydrophobicContact CG-CE1 4.5Å; L338-F344 WeakPolarHBondContact O-CD1 3.43Å; S341-F344 WeakPolarHBondContact OG-CB 3.15Å; S341-F344 PolarHBondContact OG-N 3.32Å; F344-T346 PolarHBondContact O-N 2.82Å; F344-H347 PolarHBondContact O-N 2.92Å; F344-H347 VanDerWaalsContact O-O 3.13Å; F344-V349 HydrophobicContact CD2-CG2 3.72Å; F344-V349 HydrophobicContact CE2-CB 4.12Å; F344-V349 HydrophobicContact CE2-CG1 4.26Å; F344-V349 HydrophobicContact CE2-CG2 3.78Å; F344-M368 HydrophobicContact CD2-CE 4.41Å; F344-M368 HydrophobicContact CE2-CE 4.44Å; F344-H385 AromaticContact CD1-CD2 3.57Å; F344-H385 AromaticContact CD1-NE2 3.47Å; F344-H385 WeakPolarHBondContact CD1-NE2 3.41Å; F344-H385 HydrophobicContact CE1-CB 3.88Å; F344-H385 AromaticContact CE1-CD2 3.17Å; F344-H385 WeakPolarHBondContact CE1-CD2 3.38Å; F344-H385 AromaticContact CE1-CE1 3.84Å; F344-H385 AromaticContact CE1-CG 3.36Å; F344-H385 AromaticContact CE1-ND1 3.79Å; F344-H385 AromaticContact CE1-NE2 3.5Å; F344-H385 AromaticContact CG-NE2 3.95Å; F344-H385 HydrophobicContact CZ-CB 3.92Å; F344-H385 AromaticContact CZ-CD2 3.79Å; F344-H385 AromaticContact CZ-CE1 3.84Å; F344-H385 AromaticContact CZ-CG 3.5Å; F344-H385 VanDerWaalsContact CZ-CG 3.5Å; F344-H385 AromaticContact CZ-ND1 3.56Å; F344-H385 AromaticContact CZ-NE2 3.99Å; F344-H385 PolarHBondContact O-CE1 2.82Å; F344-H385 VanDerWaalsContact O-CE1 3.24Å; F344-H385 PolarHBondContact O-NE2 3.26Å; F344-H385 VanDerWaalsContact O-NE2 3.09Å; F344-Y398 AromaticContact CE2-CD1 3.88Å; F344-Y398 HydrophobicContact CE2-CD1 3.88Å; F344-Y398 HydrophobicContact CE2-CD2 4.39Å; F344-Y398 HydrophobicContact CE2-CE1 4.31Å; F344-Y398 AromaticContact CE2-CG 3.96Å; F344-Y398 HydrophobicContact CE2-CG 3.96Å; F344-Y398 AromaticContact CZ-CD1 3.63Å; F344-Y398 HydrophobicContact CZ-CD1 3.63Å; F344-Y398 HydrophobicContact CZ-CE1 4.37Å; F344-Y398 AromaticContact CZ-CG 3.87Å; F344-Y398 HydrophobicContact CZ-CG 3.87Å; F344-L399 HydrophobicContact CE1-CD1 3.82Å; F344-L399 HydrophobicContact CE1-CD2 4.31Å; F344-L399 HydrophobicContact CE1-CG 3.73Å; F344-L399 HydrophobicContact CZ-CG 4.07Å
345	R	98.3	Very high	98.1	Very high	121 Å²	121	33.4 Å²	33.4	46%	0.457	16%	0.164	S	C	.	.	H	α-helix	trans	-56.3	-24.9	179.7	179.1	174.6	63.2	161.5	-2.2	114.3	S341 D342 F343 T382 L383	S341-R345 WeakPolarHBondContact O-CB 3.33Å; S341-R345 PolarHBondContact O-N 2.85Å; D342-R345 IonicContact OD1-CZ 3.22Å; D342-R345 IonicContact OD1-NE 2.76Å; D342-R345 IonicContact OD1-NH2 3.74Å; D342-R345 PolarHBondContact OD1-NH2 3.39Å; F343-R345 PolarHBondContact O-N 3.07Å; R345-T382 HydrophobicContact CG-CG2 3.76Å; R345-T382 VanDerWaalsContact O-CA 3.23Å; R345-T382 WeakPolarHBondContact O-CA 3.41Å; R345-L383 PolarHBondContact O-N 2.87Å; R345-L383 VanDerWaalsContact O-N 3.11Å
346	T	98.4	Very high	98.1	Very high	51 Å²	51	30.5 Å²	30.5	31%	0.313	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	8.4	-177.7	61.3	0	0	0	0	113.9	D342 F343 F344 L377	D342-T346 WeakPolarHBondContact O-CB 3.42Å; D342-T346 WeakPolarHBondContact O-CG2 3.29Å; D342-T346 PolarHBondContact O-N 3.15Å; D342-T346 PolarHBondContact O-OG1 3.23Å; F343-T346 CarbonylContact O-C 3.49Å; F343-T346 PolarHBondContact O-N 2.82Å; F343-T346 VanDerWaalsContact O-N 3.15Å; F343-T346 PolarHBondContact O-OG1 2.73Å; F344-T346 PolarHBondContact O-N 2.82Å; T346-L377 WeakPolarHBondContact O-CB 3.34Å; T346-L377 WeakPolarHBondContact O-CG 3.31Å; T346-L377 PolarHBondContact O-N 2.93Å
347	H	98.4	Very high	98.1	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.009	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	147.3	177.3	-71.2	66	0	0	0	111.3	Q175 F343 F344 V349 T374 V375 H385	Q175-H347 PolarHBondContact NE2-NE2 3.06Å; Q175-H347 PolarHBondContact OE1-CE1 3.44Å; F343-H347 AromaticContact CD2-CE1 3.43Å; F343-H347 VanDerWaalsContact CD2-CE1 3.43Å; F343-H347 WeakPolarHBondContact CD2-CE1 3.06Å; F343-H347 AromaticContact CD2-ND1 3.65Å; F343-H347 AromaticContact CD2-NE2 3.79Å; F343-H347 AromaticContact CE2-CD2 3.57Å; F343-H347 AromaticContact CE2-CE1 3.54Å; F343-H347 AromaticContact CE2-CG 3.84Å; F343-H347 AromaticContact CE2-ND1 3.81Å; F343-H347 AromaticContact CE2-NE2 3.39Å; F343-H347 WeakPolarHBondContact CE2-NE2 3.22Å; F343-H347 AromaticContact CZ-CD2 3.89Å; F343-H347 PolarHBondContact O-N 2.78Å; F343-H347 PolarHBondContact O-ND1 2.83Å; F344-H347 PolarHBondContact O-N 2.92Å; F344-H347 VanDerWaalsContact O-O 3.13Å; H347-V349 HydrophobicContact CB-CG2 4.17Å; H347-T374 HydrophobicContact CB-CG2 3.91Å; H347-V375 CarbonylContact C-O 3.54Å; H347-V375 VanDerWaalsContact CA-O 3.26Å; H347-V375 WeakPolarHBondContact CA-O 3.35Å; H347-H385 PolarHBondContact O-CE1 2.93Å
348	E	97.8	Very high	98	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	112.7	163.6	164	176	174.8	0	0	108.1	R222 L225 E226 V350 T374 V375 L377 L383 R394	R222-E348 IonicContact CZ-OE1 2.7Å; R222-E348 IonicContact NH1-OE1 3.41Å; R222-E348 PolarHBondContact NH1-OE1 2.93Å; R222-E348 IonicContact NH2-OE1 3.62Å; R222-E348 PolarHBondContact NH2-OE1 2.74Å; R222-E348 IonicContact NH2-OE2 3.77Å; L225-E348 WeakPolarHBondContact CA-OE1 3.38Å; L225-E348 HydrophobicContact CD2-CG 3.87Å; L225-E348 WeakPolarHBondContact CD2-OE1 3.39Å; E226-E348 PolarHBondContact N-OE1 3.34Å; E348-V350 HydrophobicContact CG-CG2 3.63Å; E348-V350 PolarHBondContact O-N 3.4Å; E348-T374 VanDerWaalsContact O-CA 3.31Å; E348-T374 WeakPolarHBondContact O-CA 3.43Å; E348-V375 HydrophobicContact CB-CG2 3.88Å; E348-V375 HydrophobicContact CG-CG2 4.22Å; E348-V375 PolarHBondContact N-O 3.13Å; E348-V375 PolarHBondContact O-N 3.49Å; E348-L377 HydrophobicContact CB-CD2 4.06Å; E348-L383 HydrophobicContact CB-CD1 4.44Å; E348-R394 IonicContact OE2-CZ 3.64Å; E348-R394 IonicContact OE2-NE 3.02Å; E348-R394 PolarHBondContact OE2-NE 3.47Å; E348-R394 IonicContact OE2-NH2 3.51Å; E348-R394 PolarHBondContact OE2-NH2 3.44Å
349	V	98.1	Very high	97.9	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	63.6	-166.3	-170.2	0	0	0	0	110.8	F344 H347 S352 T374 D396 Y398	F344-V349 HydrophobicContact CD2-CG2 3.72Å; F344-V349 HydrophobicContact CE2-CB 4.12Å; F344-V349 HydrophobicContact CE2-CG1 4.26Å; F344-V349 HydrophobicContact CE2-CG2 3.78Å; H347-V349 HydrophobicContact CB-CG2 4.17Å; V349-S352 WeakPolarHBondContact CG1-OG 3.39Å; V349-T374 HydrophobicContact CB-CG2 4.39Å; V349-T374 HydrophobicContact CG1-CG2 4.32Å; V349-T374 HydrophobicContact CG2-CG2 4.01Å; V349-D396 PolarHBondContact N-OD2 2.73Å; V349-Y398 HydrophobicContact CB-CD2 4.26Å; V349-Y398 HydrophobicContact CG1-CD2 3.91Å; V349-Y398 HydrophobicContact CG1-CE2 3.97Å
350	V	96	Very high	97.7	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.006	16%	0.155	C	C	.	.			trans	-91.2	142.3	-176.2	174.1	0	0	0	0	112.1	L225 E348 S352 K373 D396	L225-V350 HydrophobicContact CD2-CB 4.03Å; L225-V350 HydrophobicContact CD2-CG2 4.24Å; E348-V350 HydrophobicContact CG-CG2 3.63Å; E348-V350 PolarHBondContact O-N 3.4Å; V350-S352 PolarHBondContact O-N 2.93Å; V350-K373 CarbonylContact O-C 3.48Å; V350-K373 VanDerWaalsContact O-CB 3.25Å; V350-K373 WeakPolarHBondContact O-CB 3.46Å; V350-D396 HydrophobicContact CG2-CB 4.2Å
351	G	93	Very high	97.5	Very high	16 Å²	16	25.9 Å²	25.9	17%	0.165	16%	0.157	C	C	.	.	S	Bend	trans	79.2	-4.1	168.3	0	0	0	0	0	115.7	K218	K218-G351 WeakPolarHBondContact CE-O 3.47Å
352	S	97.7	Very high	97.3	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.168	C	C	.	.			trans	-72.9	164.8	172.1	61.2	0	0	0	0	112.3	M219 V349 V350 I369 D370 Y398	M219-S352 PolarHBondContact N-O 2.85Å; V349-S352 WeakPolarHBondContact CG1-OG 3.39Å; V350-S352 PolarHBondContact O-N 2.93Å; S352-I369 WeakPolarHBondContact CA-O 3.41Å; S352-I369 WeakPolarHBondContact CB-O 3.4Å; S352-D370 VanDerWaalsContact CA-O 3.29Å; S352-D370 WeakPolarHBondContact CA-O 3.25Å; S352-D370 WeakPolarHBondContact CB-O 3.24Å; S352-Y398 WeakPolarHBondContact OG-CE2 3.14Å
353	S	98.4	Very high	97.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	155.8	179.9	-75.5	0	0	0	0	112.1	D216 C217 K218 M368 I369	D216-S353 WeakPolarHBondContact OD1-CB 3.17Å; D216-S353 PolarHBondContact OD1-OG 2.87Å; C217-S353 CarbonylContact O-C 3.57Å; C217-S353 WeakPolarHBondContact O-CA 3.49Å; C217-S353 WeakPolarHBondContact O-CB 3.45Å; K218-S353 WeakPolarHBondContact CA-OG 3.23Å; K218-S353 VanDerWaalsContact CE-OG 3.27Å; K218-S353 WeakPolarHBondContact CE-OG 3.22Å; K218-S353 PolarHBondContact N-OG 2.81Å; S353-M368 CarbonylContact O-C 3.54Å; S353-M368 WeakPolarHBondContact O-CA 3.41Å; S353-I369 PolarHBondContact N-O 3.37Å; S353-I369 PolarHBondContact O-N 3.16Å
354	L	98.8	Very high	97.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.4	157.7	-67.7	176.3	0	0	0	108.9	C217 M219 L331 L334 F356 V366 W367 M368 Y398 M402 L405	C217-L354 PolarHBondContact N-O 2.89Å; C217-L354 PolarHBondContact O-N 2.84Å; M219-L354 HydrophobicContact CE-CD1 3.9Å; M219-L354 HydrophobicContact CG-CB 4.48Å; M219-L354 HydrophobicContact CG-CD1 4.15Å; M219-L354 HydrophobicContact CG-CG 3.78Å; M219-L354 HydrophobicContact SD-CB 4.43Å; M219-L354 HydrophobicContact SD-CD1 3.63Å; M219-L354 HydrophobicContact SD-CG 3.88Å; L331-L354 HydrophobicContact CD2-CD1 3.95Å; L334-L354 HydrophobicContact CD2-CD2 3.65Å; L354-F356 HydrophobicContact CB-CD2 4.31Å; L354-F356 HydrophobicContact CB-CE2 3.82Å; L354-V366 HydrophobicContact CB-CG1 3.85Å; L354-V366 HydrophobicContact CD1-CG1 4.5Å; L354-V366 HydrophobicContact CD2-CG1 4.05Å; L354-V366 HydrophobicContact CG-CG1 4.34Å; L354-W367 CarbonylContact C-O 3.45Å; L354-W367 WeakPolarHBondContact CA-O 3.4Å; L354-M368 HydrophobicContact CD2-CG 3.8Å; L354-Y398 WeakPolarHBondContact CD2-OH 3.42Å; L354-M402 HydrophobicContact CD1-CE 3.71Å; L354-M402 HydrophobicContact CD1-SD 4.35Å; L354-M402 HydrophobicContact CD2-CE 4.35Å; L354-L405 HydrophobicContact CD1-CD2 3.67Å
355	L	98.6	Very high	97.2	Very high	22 Å²	22	27.6 Å²	27.6	12%	0.115	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	110.5	172.5	-167.6	74.1	0	0	0	109.4	L205 I214 V357 V366 W367 I369	L205-L355 HydrophobicContact CD1-CD2 3.85Å; I214-L355 HydrophobicContact CG2-CD1 3.61Å; I214-L355 HydrophobicContact CG2-CG 4.15Å; L355-V357 HydrophobicContact CD2-CG2 4.09Å; L355-V357 HydrophobicContact CG-CG2 4.13Å; L355-V366 WeakPolarHBondContact O-CA 3.39Å; L355-W367 PolarHBondContact N-O 3.01Å; L355-W367 PolarHBondContact O-N 3.06Å; L355-W367 VanDerWaalsContact O-N 3.15Å; L355-I369 HydrophobicContact CB-CD1 3.92Å; L355-I369 HydrophobicContact CB-CG1 4.19Å; L355-I369 HydrophobicContact CB-CG2 4.25Å; L355-I369 HydrophobicContact CD1-CD1 4.11Å; L355-I369 HydrophobicContact CG-CD1 4.41Å
356	F	98.7	Very high	97.2	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	128.3	172.6	-70.1	-106.9	0	0	0	108.9	I214 M215 C217 F316 Y327 L331 L354 V366 L405 F409	I214-F356 CarbonylContact C-O 3.59Å; I214-F356 VanDerWaalsContact CA-O 3.3Å; I214-F356 WeakPolarHBondContact CA-O 3.39Å; M215-F356 HydrophobicContact CB-CB 4.16Å; M215-F356 HydrophobicContact CE-CB 3.92Å; M215-F356 HydrophobicContact CE-CD1 3.88Å; M215-F356 HydrophobicContact CE-CD2 3.62Å; M215-F356 HydrophobicContact CE-CE1 4.29Å; M215-F356 HydrophobicContact CE-CE2 4.05Å; M215-F356 HydrophobicContact CE-CG 3.53Å; M215-F356 HydrophobicContact CE-CZ 4.37Å; M215-F356 PolarHBondContact N-O 2.87Å; M215-F356 PolarHBondContact O-N 3.3Å; C217-F356 HydrophobicContact CB-CE2 4.09Å; F316-F356 HydrophobicContact CE1-CB 3.89Å; F316-F356 HydrophobicContact CZ-CB 4.17Å; Y327-F356 AromaticContact CD1-CD1 3.66Å; Y327-F356 HydrophobicContact CD1-CD1 3.66Å; Y327-F356 HydrophobicContact CD1-CE1 4.23Å; Y327-F356 HydrophobicContact CD2-CD1 4.18Å; Y327-F356 HydrophobicContact CE1-CB 4.05Å; Y327-F356 AromaticContact CE1-CD1 3.67Å; Y327-F356 HydrophobicContact CE1-CD1 3.67Å; Y327-F356 HydrophobicContact CE1-CG 4.33Å; Y327-F356 HydrophobicContact CE2-CD1 4.16Å; Y327-F356 AromaticContact CG-CD1 3.91Å; Y327-F356 HydrophobicContact CG-CD1 3.91Å; Y327-F356 HydrophobicContact CG-CE1 4.25Å; Y327-F356 AromaticContact CZ-CD1 3.9Å; L331-F356 HydrophobicContact CD1-CE1 4.15Å; L331-F356 HydrophobicContact CD1-CZ 4.16Å; L331-F356 HydrophobicContact CD2-CE1 4.35Å; L331-F356 HydrophobicContact CD2-CZ 4Å; L354-F356 HydrophobicContact CB-CD2 4.31Å; L354-F356 HydrophobicContact CB-CE2 3.82Å; F356-V366 HydrophobicContact CD1-CG1 4.5Å; F356-V366 HydrophobicContact CD1-CG2 3.68Å; F356-V366 HydrophobicContact CD2-CG1 4.23Å; F356-V366 HydrophobicContact CE1-CG1 4.45Å; F356-V366 HydrophobicContact CE1-CG2 3.77Å; F356-V366 HydrophobicContact CE2-CG1 4.18Å; F356-V366 HydrophobicContact CG-CG1 4.37Å; F356-V366 HydrophobicContact CG-CG2 4.21Å; F356-V366 HydrophobicContact CZ-CG1 4.29Å; F356-V366 HydrophobicContact CZ-CG2 4.37Å; F356-L405 HydrophobicContact CE2-CD2 4.38Å; F356-L405 HydrophobicContact CZ-CD1 4.45Å; F356-L405 HydrophobicContact CZ-CD2 3.91Å; F356-L405 HydrophobicContact CZ-CG 4.43Å; F356-F409 HydrophobicContact CD1-CZ 4.26Å; F356-F409 HydrophobicContact CE1-CE1 4.18Å; F356-F409 HydrophobicContact CE1-CE2 4.17Å; F356-F409 AromaticContact CE1-CZ 3.62Å; F356-F409 HydrophobicContact CE1-CZ 3.62Å; F356-F409 HydrophobicContact CZ-CE2 4.39Å; F356-F409 HydrophobicContact CZ-CZ 4.25Å
357	V	98.4	Very high	97.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	133.4	174.4	-168	0	0	0	0	109.4	L206 F209 P212 S213 I214 Y327 L355 A364 S365 W367	L206-V357 HydrophobicContact CD2-CG1 3.78Å; L206-V357 HydrophobicContact CD2-CG2 3.9Å; F209-V357 HydrophobicContact CB-CG1 4.44Å; F209-V357 HydrophobicContact CD1-CG1 3.83Å; F209-V357 HydrophobicContact CD2-CB 4.5Å; F209-V357 HydrophobicContact CD2-CG1 3.72Å; F209-V357 HydrophobicContact CE1-CB 4.16Å; F209-V357 HydrophobicContact CE1-CG1 3.86Å; F209-V357 HydrophobicContact CE2-CB 4.05Å; F209-V357 HydrophobicContact CE2-CG1 3.76Å; F209-V357 HydrophobicContact CG-CG1 3.75Å; F209-V357 HydrophobicContact CZ-CB 3.85Å; F209-V357 HydrophobicContact CZ-CG1 3.83Å; P212-V357 HydrophobicContact CB-CG1 3.67Å; S213-V357 WeakPolarHBondContact O-CA 3.46Å; I214-V357 HydrophobicContact CG1-CG1 4.45Å; I214-V357 HydrophobicContact CG2-CG2 4.47Å; Y327-V357 PolarHBondContact OH-N 3.16Å; Y327-V357 PolarHBondContact OH-O 3.47Å; Y327-V357 VanDerWaalsContact OH-O 3.05Å; L355-V357 HydrophobicContact CD2-CG2 4.09Å; L355-V357 HydrophobicContact CG-CG2 4.13Å; V357-A364 WeakPolarHBondContact O-CA 3.4Å; V357-S365 PolarHBondContact N-O 2.91Å; V357-S365 PolarHBondContact O-N 3.22Å; V357-W367 HydrophobicContact CB-CZ3 4.1Å; V357-W367 HydrophobicContact CG2-CE3 4.4Å; V357-W367 HydrophobicContact CG2-CZ3 3.96Å
358	H	98.1	Very high	97.3	Very high	12 Å²	12	21.1 Å²	21.1	6%	0.056	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	163.5	170.7	72.5	82.9	0	0	0	112.1	P212 S213 F316 I323 Y327 K363 A364	P212-H358 CarbonylContact C-O 3.59Å; P212-H358 VanDerWaalsContact CA-O 3.32Å; P212-H358 WeakPolarHBondContact CA-O 3.44Å; S213-H358 WeakPolarHBondContact CB-CE1 3.04Å; S213-H358 WeakPolarHBondContact CB-NE2 3.43Å; S213-H358 PolarHBondContact N-O 3.32Å; S213-H358 PolarHBondContact O-N 3.35Å; S213-H358 PolarHBondContact OG-CE1 3.18Å; F316-H358 AromaticContact CE1-CD2 3.64Å; F316-H358 AromaticContact CE2-CD2 4Å; F316-H358 AromaticContact CE2-NE2 3.87Å; F316-H358 AromaticContact CZ-CD2 3.48Å; F316-H358 VanDerWaalsContact CZ-CD2 3.48Å; F316-H358 WeakPolarHBondContact CZ-CD2 3.35Å; F316-H358 AromaticContact CZ-NE2 3.82Å; F316-H358 PolarHBondContact O-CE1 3.31Å; F316-H358 PolarHBondContact O-NE2 2.72Å; I323-H358 HydrophobicContact CD1-CB 4.12Å; I323-H358 HydrophobicContact CG1-CB 4.39Å; I323-H358 HydrophobicContact CG2-CB 3.85Å; Y327-H358 HydrophobicContact CE2-CB 4.4Å; Y327-H358 AromaticContact CE2-CD2 3.9Å; Y327-H358 AromaticContact CZ-CD2 3.99Å; Y327-H358 WeakPolarHBondContact OH-CB 3.46Å; Y327-H358 PolarHBondContact OH-CD2 3.19Å; Y327-H358 VanDerWaalsContact OH-CD2 3.27Å; Y327-H358 PolarHBondContact OH-N 2.83Å; H358-K363 CarbonylContact C-O 3.6Å; H358-K363 WeakPolarHBondContact CA-O 3.33Å; H358-K363 WeakPolarHBondContact CB-O 3.25Å; H358-A364 HydrophobicContact CB-CB 3.91Å
359	D	96.8	Very high	97.3	Very high	7 Å²	7	22.2 Å²	22.2	4%	0.037	15%	0.148	C	C	.	.			trans	-137.4	172.6	170.7	65.3	38.4	0	0	0	113.4	F209 D210 S361 G362 K363	F209-D359 VanDerWaalsContact CA-OD2 3.32Å; F209-D359 WeakPolarHBondContact CA-OD2 3.26Å; F209-D359 HydrophobicContact CB-CB 4.38Å; F209-D359 HydrophobicContact CD1-CB 4.17Å; F209-D359 WeakPolarHBondContact CD1-OD2 3.21Å; D210-D359 PolarHBondContact N-OD2 3.36Å; D210-D359 WeakPolarHBondContact O-CB 3Å; D359-S361 PolarHBondContact O-N 3.14Å; D359-S361 VanDerWaalsContact O-N 3.11Å; D359-S361 WeakPolarHBondContact OD1-CA 3.19Å; D359-S361 WeakPolarHBondContact OD1-CB 3.15Å; D359-S361 PolarHBondContact OD1-N 3.24Å; D359-S361 PolarHBondContact OD1-OG 3.44Å; D359-G362 PolarHBondContact O-N 2.93Å; D359-K363 PolarHBondContact N-O 3.21Å
360	A	94.1	Very high	97.2	Very high	106 Å²	106	23.9 Å²	23.9	88%	0.876	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-12.6	-179.1	0	0	0	0	0	114.4	G362	A360-G362 PolarHBondContact O-N 2.92Å
361	S	94.7	Very high	97.3	Very high	99 Å²	99	23.9 Å²	23.9	69%	0.692	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-9	172	81	0	0	0	0	112.8	D359 K363	D359-S361 PolarHBondContact O-N 3.14Å; D359-S361 VanDerWaalsContact O-N 3.11Å; D359-S361 WeakPolarHBondContact OD1-CA 3.19Å; D359-S361 WeakPolarHBondContact OD1-CB 3.15Å; D359-S361 PolarHBondContact OD1-N 3.24Å; D359-S361 PolarHBondContact OD1-OG 3.44Å; S361-K363 VanDerWaalsContact C-N 3.34Å; S361-K363 PolarHBondContact OG-N 3.06Å
362	G	94.2	Very high	97.4	Very high	24 Å²	24	24.5 Å²	24.5	25%	0.247	16%	0.163	C	C	.	.	S	Bend	trans	86.2	4.8	-173.5	0	0	0	0	0	113.4	D359 A360 A364	D359-G362 PolarHBondContact O-N 2.93Å; A360-G362 PolarHBondContact O-N 2.92Å; G362-A364 PolarHBondContact O-N 3.19Å
363	K	96.5	Very high	97.3	Very high	80 Å²	80	26.3 Å²	26.3	35%	0.348	17%	0.171	S	C	.	.			trans	-67.8	129.1	170.2	-175.1	-177.6	172.9	174.9	0	108.8	D208 F209 H358 D359 S361	D208-K363 PolarHBondContact O-NZ 2.96Å; F209-K363 HydrophobicContact CD1-CB 4.39Å; F209-K363 HydrophobicContact CD1-CD 3.89Å; F209-K363 HydrophobicContact CD1-CG 4.1Å; F209-K363 HydrophobicContact CE1-CB 4.22Å; F209-K363 HydrophobicContact CE1-CD 3.78Å; F209-K363 HydrophobicContact CE1-CG 3.64Å; F209-K363 HydrophobicContact CG-CD 4.4Å; F209-K363 HydrophobicContact CZ-CD 4.19Å; F209-K363 HydrophobicContact CZ-CG 4.22Å; H358-K363 CarbonylContact C-O 3.6Å; H358-K363 WeakPolarHBondContact CA-O 3.33Å; H358-K363 WeakPolarHBondContact CB-O 3.25Å; D359-K363 PolarHBondContact N-O 3.21Å; S361-K363 VanDerWaalsContact C-N 3.34Å; S361-K363 PolarHBondContact OG-N 3.06Å
364	A	98.1	Very high	97.2	Very high	21 Å²	21	26.4 Å²	26.4	17%	0.174	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	142.1	177.6	0	0	0	0	0	110.9	I323 Y327 V357 H358 G362	I323-A364 HydrophobicContact CG1-CB 4.48Å; I323-A364 HydrophobicContact CG2-CB 4.08Å; Y327-A364 HydrophobicContact CD1-CB 4.12Å; Y327-A364 HydrophobicContact CE1-CB 3.85Å; Y327-A364 HydrophobicContact CE2-CB 4.48Å; V357-A364 WeakPolarHBondContact O-CA 3.4Å; H358-A364 HydrophobicContact CB-CB 3.91Å; G362-A364 PolarHBondContact O-N 3.19Å
365	S	98.2	Very high	97.1	Very high	18 Å²	18	27.6 Å²	27.6	13%	0.126	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	160.2	177.3	176.2	0	0	0	0	111.9	Y327 V357 W367	Y327-S365 WeakPolarHBondContact CE1-O 3.45Å; V357-S365 PolarHBondContact N-O 2.91Å; V357-S365 PolarHBondContact O-N 3.22Å; S365-W367 VanDerWaalsContact CB-CZ3 3.48Å; S365-W367 WeakPolarHBondContact OG-CH2 3.48Å; S365-W367 VanDerWaalsContact OG-CZ2 3.23Å; S365-W367 WeakPolarHBondContact OG-CZ2 3.26Å; S365-W367 WeakPolarHBondContact OG-CZ3 3.34Å
366	V	98.7	Very high	97.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	139.3	180	-165.1	0	0	0	0	109.6	Y327 R330 L331 L354 L355 F356	Y327-V366 HydrophobicContact CD1-CG2 3.55Å; Y327-V366 HydrophobicContact CE1-CG2 3.98Å; R330-V366 HydrophobicContact CB-CG2 4.47Å; R330-V366 HydrophobicContact CG-CB 3.97Å; R330-V366 HydrophobicContact CG-CG2 4Å; R330-V366 PolarHBondContact NE-O 3.33Å; R330-V366 VanDerWaalsContact NE-O 3.1Å; R330-V366 PolarHBondContact NH2-O 2.98Å; L331-V366 HydrophobicContact CD2-CG1 4.23Å; L331-V366 HydrophobicContact CD2-CG2 4.29Å; L354-V366 HydrophobicContact CB-CG1 3.85Å; L354-V366 HydrophobicContact CD1-CG1 4.5Å; L354-V366 HydrophobicContact CD2-CG1 4.05Å; L354-V366 HydrophobicContact CG-CG1 4.34Å; L355-V366 WeakPolarHBondContact O-CA 3.39Å; F356-V366 HydrophobicContact CD1-CG1 4.5Å; F356-V366 HydrophobicContact CD1-CG2 3.68Å; F356-V366 HydrophobicContact CD2-CG1 4.23Å; F356-V366 HydrophobicContact CE1-CG1 4.45Å; F356-V366 HydrophobicContact CE1-CG2 3.77Å; F356-V366 HydrophobicContact CE2-CG1 4.18Å; F356-V366 HydrophobicContact CG-CG1 4.37Å; F356-V366 HydrophobicContact CG-CG2 4.21Å; F356-V366 HydrophobicContact CZ-CG1 4.29Å; F356-V366 HydrophobicContact CZ-CG2 4.37Å
367	W	98.8	Very high	97	Very high	37 Å²	37	31.1 Å²	31.1	14%	0.14	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	150.5	173.9	-64.1	-97.8	0	0	0	111.5	Y184 L205 F209 L354 L355 V357 S365	Y184-W367 CarbonylContact O-C 3.53Å; Y184-W367 WeakPolarHBondContact O-CA 3.37Å; L205-W367 HydrophobicContact CD1-CB 3.71Å; L205-W367 HydrophobicContact CD1-CD2 3.91Å; L205-W367 HydrophobicContact CD1-CE3 4.08Å; L205-W367 HydrophobicContact CD1-CG 3.77Å; L205-W367 HydrophobicContact CD2-CD2 3.91Å; L205-W367 HydrophobicContact CD2-CG 3.93Å; L205-W367 HydrophobicContact CD2-CZ2 4.39Å; L205-W367 HydrophobicContact CG-CD2 4.38Å; L205-W367 HydrophobicContact CG-CG 4.48Å; F209-W367 AromaticContact CE2-CH2 3.73Å; F209-W367 HydrophobicContact CE2-CH2 3.73Å; F209-W367 HydrophobicContact CE2-CZ3 4.16Å; F209-W367 AromaticContact CZ-CH2 3.83Å; F209-W367 HydrophobicContact CZ-CH2 3.83Å; F209-W367 HydrophobicContact CZ-CZ3 4.14Å; L354-W367 CarbonylContact C-O 3.45Å; L354-W367 WeakPolarHBondContact CA-O 3.4Å; L355-W367 PolarHBondContact N-O 3.01Å; L355-W367 PolarHBondContact O-N 3.06Å; L355-W367 VanDerWaalsContact O-N 3.15Å; V357-W367 HydrophobicContact CB-CZ3 4.1Å; V357-W367 HydrophobicContact CG2-CE3 4.4Å; V357-W367 HydrophobicContact CG2-CZ3 3.96Å; S365-W367 VanDerWaalsContact CB-CZ3 3.48Å; S365-W367 WeakPolarHBondContact OG-CH2 3.48Å; S365-W367 VanDerWaalsContact OG-CZ2 3.23Å; S365-W367 WeakPolarHBondContact OG-CZ2 3.26Å; S365-W367 WeakPolarHBondContact OG-CZ3 3.34Å
368	M	98.8	Very high	96.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	134.9	166.9	-52.5	165	71.7	0	0	109.6	L181 Y184 V185 P186 L334 L338 F344 S353 L354 F371 Y398	L181-M368 HydrophobicContact CD1-SD 4.33Å; L181-M368 HydrophobicContact CD2-SD 4.08Å; Y184-M368 PolarHBondContact O-N 3.11Å; V185-M368 HydrophobicContact CG1-CB 4.21Å; P186-M368 WeakPolarHBondContact CD-O 3.24Å; L334-M368 HydrophobicContact CD1-CG 4.41Å; L334-M368 HydrophobicContact CD1-SD 3.98Å; L334-M368 HydrophobicContact CD2-CG 4.2Å; L338-M368 HydrophobicContact CD2-CE 3.75Å; L338-M368 HydrophobicContact CD2-SD 3.8Å; F344-M368 HydrophobicContact CD2-CE 4.41Å; F344-M368 HydrophobicContact CE2-CE 4.44Å; S353-M368 CarbonylContact O-C 3.54Å; S353-M368 WeakPolarHBondContact O-CA 3.41Å; L354-M368 HydrophobicContact CD2-CG 3.8Å; M368-F371 HydrophobicContact CB-CE1 4.23Å; M368-F371 HydrophobicContact CB-CZ 3.76Å; M368-F371 HydrophobicContact CE-CE1 4.31Å; M368-Y398 HydrophobicContact CE-CE1 4.41Å; M368-Y398 HydrophobicContact CE-CE2 4.37Å
369	I	98.2	Very high	96.1	Very high	23 Å²	23	40.4 Å²	40.4	12%	0.118	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	171.4	179.7	61.6	161.7	0	0	0	111.2	P186 L205 S352 S353 L355	P186-I369 HydrophobicContact CG-CG2 4.08Å; L205-I369 HydrophobicContact CD1-CG2 4.04Å; S352-I369 WeakPolarHBondContact CA-O 3.41Å; S352-I369 WeakPolarHBondContact CB-O 3.4Å; S353-I369 PolarHBondContact N-O 3.37Å; S353-I369 PolarHBondContact O-N 3.16Å; L355-I369 HydrophobicContact CB-CD1 3.92Å; L355-I369 HydrophobicContact CB-CG1 4.19Å; L355-I369 HydrophobicContact CB-CG2 4.25Å; L355-I369 HydrophobicContact CD1-CD1 4.11Å; L355-I369 HydrophobicContact CG-CD1 4.41Å
370	D	96.4	Very high	95.7	Very high	36 Å²	36	45.8 Å²	45.8	19%	0.193	30%	0.301	C	S	.	.			trans	63.9	66.1	172.9	-71.4	0.1	0	0	0	115	K163 E169 S352 G372	K163-D370 IonicContact NZ-OD1 2.78Å; K163-D370 PolarHBondContact NZ-OD1 3.23Å; E169-D370 WeakPolarHBondContact OE1-CA 3.16Å; S352-D370 VanDerWaalsContact CA-O 3.29Å; S352-D370 WeakPolarHBondContact CA-O 3.25Å; S352-D370 WeakPolarHBondContact CB-O 3.24Å; D370-G372 VanDerWaalsContact C-N 3.34Å; D370-G372 PolarHBondContact O-N 3.21Å
371	F	97.5	Very high	95.7	Very high	1 Å²	1	43.1 Å²	43.1	0%	0.004	27%	0.271	C	S	.	.			trans	-87.2	7.4	-178.3	-55.7	-76.2	0	0	0	114.5	E169 C172 L173 L176 V185 M368 K373 T374	E169-F371 HydrophobicContact CG-CB 4.21Å; E169-F371 PolarHBondContact OE1-N 2.65Å; C172-F371 HydrophobicContact CB-CB 3.61Å; C172-F371 HydrophobicContact CB-CG 4.18Å; L173-F371 HydrophobicContact CD2-CD2 3.91Å; L173-F371 HydrophobicContact CD2-CE2 4.07Å; L173-F371 HydrophobicContact CG-CD2 4.38Å; L176-F371 HydrophobicContact CD1-CD1 4.06Å; L176-F371 HydrophobicContact CD1-CD2 3.95Å; L176-F371 HydrophobicContact CD1-CE1 3.81Å; L176-F371 HydrophobicContact CD1-CE2 3.69Å; L176-F371 HydrophobicContact CD1-CG 4.12Å; L176-F371 HydrophobicContact CD1-CZ 3.62Å; V185-F371 HydrophobicContact CB-CE2 4.44Å; V185-F371 HydrophobicContact CB-CZ 4.47Å; V185-F371 HydrophobicContact CG1-CE2 4.16Å; V185-F371 HydrophobicContact CG1-CZ 3.72Å; M368-F371 HydrophobicContact CB-CE1 4.23Å; M368-F371 HydrophobicContact CB-CZ 3.76Å; M368-F371 HydrophobicContact CE-CE1 4.31Å; F371-K373 PolarHBondContact O-N 3.5Å; F371-T374 WeakPolarHBondContact O-CB 3.45Å; F371-T374 PolarHBondContact O-N 2.79Å
372	G	95.6	Very high	95.9	Very high	28 Å²	28	42.3 Å²	42.3	29%	0.289	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-3.1	-176.9	0	0	0	0	0	116.2	C168 D370	C168-G372 PolarHBondContact SG-O 2.86Å; D370-G372 VanDerWaalsContact C-N 3.34Å; D370-G372 PolarHBondContact O-N 3.21Å
373	K	95.1	Very high	96.1	Very high	39 Å²	39	41.7 Å²	41.7	17%	0.17	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.6	16	170.6	-73.5	-169.9	171	-156.3	0	113	L225 E228 V350 F371	L225-K373 HydrophobicContact CD1-CB 4.36Å; L225-K373 WeakPolarHBondContact CD2-O 3.32Å; L225-K373 HydrophobicContact CG-CB 4.5Å; E228-K373 WeakPolarHBondContact OE1-CE 3.47Å; E228-K373 IonicContact OE1-NZ 2.82Å; E228-K373 PolarHBondContact OE1-NZ 3.17Å; E228-K373 IonicContact OE2-NZ 3.85Å; E228-K373 PolarHBondContact OE2-NZ 3.45Å; V350-K373 CarbonylContact O-C 3.48Å; V350-K373 VanDerWaalsContact O-CB 3.25Å; V350-K373 WeakPolarHBondContact O-CB 3.46Å; F371-K373 PolarHBondContact O-N 3.5Å
374	T	97.7	Very high	96.2	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	119.5	173.1	-62.6	0	0	0	0	108.4	C168 C172 F343 H347 E348 V349 F371	C168-T374 PolarHBondContact SG-O 2.85Å; C172-T374 PolarHBondContact SG-O 3.16Å; F343-T374 HydrophobicContact CE1-CG2 4.18Å; F343-T374 HydrophobicContact CZ-CG2 3.8Å; H347-T374 HydrophobicContact CB-CG2 3.91Å; E348-T374 VanDerWaalsContact O-CA 3.31Å; E348-T374 WeakPolarHBondContact O-CA 3.43Å; V349-T374 HydrophobicContact CB-CG2 4.39Å; V349-T374 HydrophobicContact CG1-CG2 4.32Å; V349-T374 HydrophobicContact CG2-CG2 4.01Å; F371-T374 WeakPolarHBondContact O-CB 3.45Å; F371-T374 PolarHBondContact O-N 2.79Å
375	V	96.9	Very high	96.2	Very high	26 Å²	26	40.7 Å²	40.7	16%	0.158	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	141	-170.6	-61	0	0	0	0	111.6	L225 H347 E348	L225-V375 HydrophobicContact CD1-CG1 3.95Å; L225-V375 HydrophobicContact CD2-CG1 4.2Å; L225-V375 HydrophobicContact CD2-CG2 3.63Å; H347-V375 CarbonylContact C-O 3.54Å; H347-V375 VanDerWaalsContact CA-O 3.26Å; H347-V375 WeakPolarHBondContact CA-O 3.35Å; E348-V375 HydrophobicContact CB-CG2 3.88Å; E348-V375 HydrophobicContact CG-CG2 4.22Å; E348-V375 PolarHBondContact N-O 3.13Å; E348-V375 PolarHBondContact O-N 3.49Å
376	P	97.4	Very high	96.2	Very high	79 Å²	79	43.8 Å²	43.8	51%	0.513	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	143	177.4	28.3	-34.7	0	0	0	111.3
377	L	96.6	Very high	96.2	Very high	16 Å²	16	46.6 Å²	46.6	8%	0.084	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-77.8	163.1	175.3	-60.4	169.9	0	0	0	111.3	T346 E348 M381 L383 R394	T346-L377 WeakPolarHBondContact O-CB 3.34Å; T346-L377 WeakPolarHBondContact O-CG 3.31Å; T346-L377 PolarHBondContact O-N 2.93Å; E348-L377 HydrophobicContact CB-CD2 4.06Å; L377-M381 HydrophobicContact CB-CB 4.2Å; L377-M381 HydrophobicContact CB-CG 4.45Å; L377-M381 HydrophobicContact CD1-CG 4.36Å; L377-M381 HydrophobicContact CD2-SD 4.38Å; L377-L383 HydrophobicContact CD1-CD1 4.26Å; L377-L383 HydrophobicContact CD1-CD2 4.46Å; L377-L383 HydrophobicContact CD1-CG 3.73Å; L377-L383 HydrophobicContact CD2-CD1 4.28Å; L377-L383 HydrophobicContact CD2-CG 4.35Å; L377-R394 HydrophobicContact CD2-CB 4.25Å
378	P	93.9	Very high	96.1	Very high	63 Å²	63	49.8 Å²	49.8	41%	0.409	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-56.6	149.7	170.5	-25.2	35.3	0	0	0	112.4	S380 M381	P378-S380 PolarHBondContact O-N 3.49Å; P378-M381 PolarHBondContact O-N 3.46Å
379	P	84.7	Confident	96	Very high	145 Å²	145	52.8 Å²	52.8	94%	0.942	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	17	-166.1	-26.2	36.6	0	0	0	119.6
380	S	88.3	Confident	95.7	Very high	119 Å²	119	55.8 Å²	55.8	83%	0.832	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.2	5.3	176.2	62.1	0	0	0	0	113.1	P378	P378-S380 PolarHBondContact O-N 3.49Å
381	M	94.4	Very high	95.4	Very high	51 Å²	51	59.1 Å²	59.1	25%	0.251	35%	0.345	S	S	.	.			trans	-104.4	141.7	-176.6	-175.6	173.7	-173.8	0	0	110.1	L377 P378 L383 N393 R394	L377-M381 HydrophobicContact CB-CB 4.2Å; L377-M381 HydrophobicContact CB-CG 4.45Å; L377-M381 HydrophobicContact CD1-CG 4.36Å; L377-M381 HydrophobicContact CD2-SD 4.38Å; P378-M381 PolarHBondContact O-N 3.46Å; M381-L383 HydrophobicContact CE-CD2 4.17Å; M381-N393 WeakPolarHBondContact CE-O 3.48Å; M381-R394 HydrophobicContact CE-CB 3.83Å; M381-R394 HydrophobicContact CE-CG 3.96Å
382	T	97.7	Very high	95.2	Very high	82 Å²	82	61.7 Å²	61.7	50%	0.503	37%	0.372	S	S	.	.			trans	-139.2	146.3	176.2	56.2	0	0	0	0	109.3	R345	R345-T382 HydrophobicContact CG-CG2 3.76Å; R345-T382 VanDerWaalsContact O-CA 3.23Å; R345-T382 WeakPolarHBondContact O-CA 3.41Å
383	L	98.3	Very high	95.1	Very high	10 Å²	10	62 Å²	62	5%	0.052	37%	0.367	C	S	.	.			trans	-100.6	153.7	172.5	-59.5	178.5	0	0	0	110.8	R345 E348 L377 M381 N393 R394 E395	R345-L383 PolarHBondContact O-N 2.87Å; R345-L383 VanDerWaalsContact O-N 3.11Å; E348-L383 HydrophobicContact CB-CD1 4.44Å; L377-L383 HydrophobicContact CD1-CD1 4.26Å; L377-L383 HydrophobicContact CD1-CD2 4.46Å; L377-L383 HydrophobicContact CD1-CG 3.73Å; L377-L383 HydrophobicContact CD2-CD1 4.28Å; L377-L383 HydrophobicContact CD2-CG 4.35Å; M381-L383 HydrophobicContact CE-CD2 4.17Å; L383-N393 WeakPolarHBondContact CD2-O 3.19Å; L383-R394 VanDerWaalsContact CD1-O 3.29Å; L383-R394 WeakPolarHBondContact CD1-O 3.19Å; L383-R394 HydrophobicContact CD2-CB 4.39Å; L383-E395 WeakPolarHBondContact CA-OE1 3.37Å; L383-E395 WeakPolarHBondContact CB-OE1 3.46Å; L383-E395 HydrophobicContact CD2-CG 4.04Å
384	D	98.3	Very high	95.2	Very high	77 Å²	77	61.5 Å²	61.5	41%	0.412	36%	0.364	S	S	.	.			trans	-96.9	-10.1	165.3	73	28.1	0	0	0	112.3	R386 T387 E395	D384-R386 PolarHBondContact O-N 2.77Å; D384-R386 WeakPolarHBondContact OD1-CA 3.39Å; D384-R386 PolarHBondContact OD1-N 2.98Å; D384-T387 WeakPolarHBondContact OD1-CB 3.32Å; D384-T387 PolarHBondContact OD1-N 2.7Å; D384-T387 PolarHBondContact OD1-OG1 2.79Å; D384-T387 PolarHBondContact OD2-OG1 3.24Å; D384-E395 PolarHBondContact N-OE1 3.25Å
385	H	98.6	Very high	95.2	Very high	3 Å²	3	62 Å²	62	1%	0.014	37%	0.366	C	S	.	.	S	Bend	trans	60.6	17.8	178.6	-51.1	-93.9	0	0	0	114.1	F344 H347 E395 D396 G397 Y398 L399 W400	F344-H385 AromaticContact CD1-CD2 3.57Å; F344-H385 AromaticContact CD1-NE2 3.47Å; F344-H385 WeakPolarHBondContact CD1-NE2 3.41Å; F344-H385 HydrophobicContact CE1-CB 3.88Å; F344-H385 AromaticContact CE1-CD2 3.17Å; F344-H385 WeakPolarHBondContact CE1-CD2 3.38Å; F344-H385 AromaticContact CE1-CE1 3.84Å; F344-H385 AromaticContact CE1-CG 3.36Å; F344-H385 AromaticContact CE1-ND1 3.79Å; F344-H385 AromaticContact CE1-NE2 3.5Å; F344-H385 AromaticContact CG-NE2 3.95Å; F344-H385 HydrophobicContact CZ-CB 3.92Å; F344-H385 AromaticContact CZ-CD2 3.79Å; F344-H385 AromaticContact CZ-CE1 3.84Å; F344-H385 AromaticContact CZ-CG 3.5Å; F344-H385 VanDerWaalsContact CZ-CG 3.5Å; F344-H385 AromaticContact CZ-ND1 3.56Å; F344-H385 AromaticContact CZ-NE2 3.99Å; F344-H385 PolarHBondContact O-CE1 2.82Å; F344-H385 VanDerWaalsContact O-CE1 3.24Å; F344-H385 PolarHBondContact O-NE2 3.26Å; F344-H385 VanDerWaalsContact O-NE2 3.09Å; H347-H385 PolarHBondContact O-CE1 2.93Å; H385-E395 WeakPolarHBondContact CA-OE2 3.46Å; H385-E395 PolarHBondContact N-OE1 2.97Å; H385-E395 PolarHBondContact N-OE2 3.47Å; H385-D396 WeakPolarHBondContact CB-OD1 3.49Å; H385-D396 IonicContact CE1-OD2 2.73Å; H385-D396 PolarHBondContact CE1-OD2 3.18Å; H385-D396 IonicContact CG-OD1 2.77Å; H385-D396 VanDerWaalsContact ND1-CG 3.32Å; H385-D396 IonicContact ND1-OD1 2.78Å; H385-D396 PolarHBondContact ND1-OD1 3.41Å; H385-D396 IonicContact ND1-OD2 3.34Å; H385-D396 PolarHBondContact ND1-OD2 3.06Å; H385-G397 CarbonylContact O-C 3.52Å; H385-G397 VanDerWaalsContact O-CA 3.31Å; H385-G397 WeakPolarHBondContact O-CA 3.1Å; H385-Y398 PolarHBondContact O-N 2.96Å; H385-Y398 VanDerWaalsContact O-N 3.16Å; H385-L399 HydrophobicContact CB-CB 3.92Å; H385-L399 HydrophobicContact CB-CD1 4.2Å; H385-L399 HydrophobicContact CB-CG 3.93Å; H385-L399 WeakPolarHBondContact O-CA 3.15Å; H385-L399 WeakPolarHBondContact O-CB 3.49Å; H385-L399 PolarHBondContact O-N 3.39Å; H385-W400 PolarHBondContact O-N 3.3Å; H385-W400 VanDerWaalsContact O-N 3.1Å
386	R	98.4	Very high	95.2	Very high	83 Å²	83	60.8 Å²	60.8	31%	0.313	36%	0.359	S	S	.	.			trans	-129.5	-35.7	-178	-69	-175.6	164.7	109.5	-6.2	112.9	E339 D384 L399 D403	E339-R386 IonicContact OE1-CZ 2.65Å; E339-R386 IonicContact OE1-NH1 2.74Å; E339-R386 PolarHBondContact OE1-NH1 3.4Å; E339-R386 IonicContact OE1-NH2 3.24Å; E339-R386 PolarHBondContact OE1-NH2 2.93Å; D384-R386 PolarHBondContact O-N 2.77Å; D384-R386 WeakPolarHBondContact OD1-CA 3.39Å; D384-R386 PolarHBondContact OD1-N 2.98Å; R386-L399 HydrophobicContact CG-CB 3.64Å; R386-D403 IonicContact CZ-OD2 2.6Å; R386-D403 VanDerWaalsContact CZ-OD2 3.24Å; R386-D403 IonicContact NE-OD2 3.44Å; R386-D403 PolarHBondContact NE-OD2 3.18Å; R386-D403 IonicContact NH2-OD1 2.88Å; R386-D403 PolarHBondContact NH2-OD1 2.75Å; R386-D403 IonicContact NH2-OD2 3.97Å; R386-D403 PolarHBondContact NH2-OD2 2.9Å
387	T	98.1	Very high	95.2	Very high	59 Å²	59	57 Å²	57	36%	0.362	34%	0.335	S	S	.	.	S	Bend	trans	-59.1	132.5	177.3	-77.4	0	0	0	0	108.9	D384 W389 E395	D384-T387 WeakPolarHBondContact OD1-CB 3.32Å; D384-T387 PolarHBondContact OD1-N 2.7Å; D384-T387 PolarHBondContact OD1-OG1 2.79Å; D384-T387 PolarHBondContact OD2-OG1 3.24Å; T387-W389 PolarHBondContact O-N 3.41Å; T387-E395 HydrophobicContact CG2-CG 4.15Å; T387-E395 VanDerWaalsContact O-CB 3.29Å; T387-E395 WeakPolarHBondContact O-CB 3.29Å; T387-E395 WeakPolarHBondContact O-CG 3.47Å
388	P	97.2	Very high	95.3	Very high	104 Å²	104	56.3 Å²	56.3	68%	0.675	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-55.8	135.8	-179.7	-28.1	35.8	0	0	0	112.5	V390 N393	P388-V390 PolarHBondContact O-N 3.11Å; P388-N393 PolarHBondContact O-ND2 3.45Å
389	W	95.7	Very high	95.6	Very high	63 Å²	63	53.5 Å²	53.5	24%	0.239	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-61.4	131.3	174.9	176.7	70.3	0	0	0	111.6	R222 E226 L229 T387 E391 E395	R222-W389 VanDerWaalsContact NE-CD1 3.34Å; E226-W389 PolarHBondContact OE2-NE1 3.35Å; L229-W389 HydrophobicContact CD1-CH2 3.76Å; L229-W389 HydrophobicContact CD1-CZ2 3.67Å; T387-W389 PolarHBondContact O-N 3.41Å; W389-E391 HydrophobicContact CH2-CB 4.38Å; W389-E391 HydrophobicContact CZ2-CB 4.1Å; W389-E395 HydrophobicContact CB-CB 4.49Å; W389-E395 WeakPolarHBondContact CB-O 3.13Å
390	V	93.4	Very high	96.2	Very high	86 Å²	86	50.5 Å²	50.5	52%	0.521	28%	0.282	S	S	.	.			trans	-134.4	146	163.8	-63.3	0	0	0	0	108.4	P388 G392 N393	P388-V390 PolarHBondContact O-N 3.11Å; V390-G392 PolarHBondContact O-N 2.89Å; V390-N393 HydrophobicContact CG2-CB 3.89Å; V390-N393 PolarHBondContact N-OD1 3.4Å; V390-N393 VanDerWaalsContact O-CG 3.31Å; V390-N393 PolarHBondContact O-N 3.1Å; V390-N393 PolarHBondContact O-OD1 2.67Å
391	E	90.3	Very high	96.7	Very high	107 Å²	107	44.8 Å²	44.8	50%	0.5	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	125.7	179.6	-170	171.6	164.8	0	0	110.8	K233 W389	K233-E391 IonicContact NZ-OE1 3Å; K233-E391 PolarHBondContact NZ-OE1 3.47Å; K233-E391 IonicContact NZ-OE2 3.65Å; K233-E391 PolarHBondContact NZ-OE2 2.97Å; W389-E391 HydrophobicContact CH2-CB 4.38Å; W389-E391 HydrophobicContact CZ2-CB 4.1Å
392	G	91.8	Very high	96.9	Very high	55 Å²	55	42.4 Å²	42.4	57%	0.567	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	101.6	-22.4	-171.8	0	0	0	0	0	114.8	E226 V390	E226-G392 VanDerWaalsContact OE1-CA 3.23Å; E226-G392 WeakPolarHBondContact OE1-CA 3.22Å; E226-G392 PolarHBondContact OE1-N 2.72Å; E226-G392 PolarHBondContact OE2-N 3.13Å; V390-G392 PolarHBondContact O-N 2.89Å
393	N	95.1	Very high	97	Very high	33 Å²	33	40.5 Å²	40.5	18%	0.176	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-13.6	-177.6	89.9	-14.8	0	0	0	114.8	M381 L383 P388 V390 E395	M381-N393 WeakPolarHBondContact CE-O 3.48Å; L383-N393 WeakPolarHBondContact CD2-O 3.19Å; P388-N393 PolarHBondContact O-ND2 3.45Å; V390-N393 HydrophobicContact CG2-CB 3.89Å; V390-N393 PolarHBondContact N-OD1 3.4Å; V390-N393 VanDerWaalsContact O-CG 3.31Å; V390-N393 PolarHBondContact O-N 3.1Å; V390-N393 PolarHBondContact O-OD1 2.67Å; N393-E395 PolarHBondContact O-N 3.12Å; N393-E395 PolarHBondContact OD1-N 2.78Å
394	R	95.9	Very high	97	Very high	29 Å²	29	41.7 Å²	41.7	11%	0.109	22%	0.224	C	C	.	.			trans	53.9	10.2	-179.7	-53.6	-177.2	67.6	134.2	11.6	116.4	R222 E226 E227 E348 L377 M381 L383 D396	R222-R394 VanDerWaalsContact NH2-C 3.26Å; R222-R394 PolarHBondContact NH2-O 3Å; E226-R394 PolarHBondContact OE2-N 3.33Å; E227-R394 IonicContact OE1-CZ 3.91Å; E227-R394 IonicContact OE1-NH1 2.92Å; E227-R394 PolarHBondContact OE1-NH1 3.14Å; E227-R394 IonicContact OE1-NH2 3.54Å; E227-R394 PolarHBondContact OE1-NH2 3.01Å; E227-R394 IonicContact OE2-NH2 2.69Å; E227-R394 PolarHBondContact OE2-NH2 3.21Å; E348-R394 IonicContact OE2-CZ 3.64Å; E348-R394 IonicContact OE2-NE 3.02Å; E348-R394 PolarHBondContact OE2-NE 3.47Å; E348-R394 IonicContact OE2-NH2 3.51Å; E348-R394 PolarHBondContact OE2-NH2 3.44Å; L377-R394 HydrophobicContact CD2-CB 4.25Å; M381-R394 HydrophobicContact CE-CB 3.83Å; M381-R394 HydrophobicContact CE-CG 3.96Å; L383-R394 VanDerWaalsContact CD1-O 3.29Å; L383-R394 WeakPolarHBondContact CD1-O 3.19Å; L383-R394 HydrophobicContact CD2-CB 4.39Å; R394-D396 PolarHBondContact O-N 3.48Å
395	E	97.9	Very high	97	Very high	12 Å²	12	38 Å²	38	6%	0.056	20%	0.204	C	C	.	.			trans	-59.4	138	177.2	-83.3	-66.2	166	0	0	111.3	R222 L383 D384 H385 T387 W389 N393	R222-E395 PolarHBondContact NE-O 2.63Å; R222-E395 PolarHBondContact NH2-O 3.42Å; L383-E395 WeakPolarHBondContact CA-OE1 3.37Å; L383-E395 WeakPolarHBondContact CB-OE1 3.46Å; L383-E395 HydrophobicContact CD2-CG 4.04Å; D384-E395 PolarHBondContact N-OE1 3.25Å; H385-E395 WeakPolarHBondContact CA-OE2 3.46Å; H385-E395 PolarHBondContact N-OE1 2.97Å; H385-E395 PolarHBondContact N-OE2 3.47Å; T387-E395 HydrophobicContact CG2-CG 4.15Å; T387-E395 VanDerWaalsContact O-CB 3.29Å; T387-E395 WeakPolarHBondContact O-CB 3.29Å; T387-E395 WeakPolarHBondContact O-CG 3.47Å; W389-E395 HydrophobicContact CB-CB 4.49Å; W389-E395 WeakPolarHBondContact CB-O 3.13Å; N393-E395 PolarHBondContact O-N 3.12Å; N393-E395 PolarHBondContact OD1-N 2.78Å
396	D	97.4	Very high	97	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.207	C	C	.	.			trans	-103	-17.5	-178.1	56.5	34.3	0	0	0	113.3	G220 S221 V349 V350 H385 R394 Y398	G220-D396 CarbonylContact C-O 3.12Å; G220-D396 WeakPolarHBondContact CA-O 3.44Å; S221-D396 PolarHBondContact N-O 2.79Å; S221-D396 PolarHBondContact OG-O 3.03Å; V349-D396 PolarHBondContact N-OD2 2.73Å; V350-D396 HydrophobicContact CG2-CB 4.2Å; H385-D396 WeakPolarHBondContact CB-OD1 3.49Å; H385-D396 IonicContact CE1-OD2 2.73Å; H385-D396 PolarHBondContact CE1-OD2 3.18Å; H385-D396 IonicContact CG-OD1 2.77Å; H385-D396 VanDerWaalsContact ND1-CG 3.32Å; H385-D396 IonicContact ND1-OD1 2.78Å; H385-D396 PolarHBondContact ND1-OD1 3.41Å; H385-D396 IonicContact ND1-OD2 3.34Å; H385-D396 PolarHBondContact ND1-OD2 3.06Å; R394-D396 PolarHBondContact O-N 3.48Å; D396-Y398 VanDerWaalsContact C-N 3.26Å; D396-Y398 PolarHBondContact O-N 3.2Å; D396-Y398 WeakPolarHBondContact OD1-CB 3.38Å; D396-Y398 PolarHBondContact OD1-N 3.03Å
397	G	98.1	Very high	97	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.01	22%	0.215	C	C	.	.			trans	68.5	20.2	-176.8	0	0	0	0	0	114	H385 W400 G401	H385-G397 CarbonylContact O-C 3.52Å; H385-G397 VanDerWaalsContact O-CA 3.31Å; H385-G397 WeakPolarHBondContact O-CA 3.1Å; G397-W400 PolarHBondContact O-N 3.11Å; G397-G401 PolarHBondContact O-N 3.3Å
398	Y	98.7	Very high	97	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63	-45.2	-175.6	-170.7	-69.4	0	0	0	112.6	M219 L338 F344 V349 S352 L354 M368 H385 D396 G401 M402	M219-Y398 HydrophobicContact CB-CD2 3.52Å; M219-Y398 HydrophobicContact CB-CE1 4.48Å; M219-Y398 HydrophobicContact CB-CE2 3.29Å; M219-Y398 HydrophobicContact CB-CG 4.2Å; M219-Y398 HydrophobicContact CE-CE1 4.4Å; M219-Y398 HydrophobicContact CG-CD2 4.37Å; M219-Y398 HydrophobicContact CG-CE1 4.42Å; M219-Y398 HydrophobicContact CG-CE2 3.73Å; L338-Y398 HydrophobicContact CD1-CD1 4.43Å; L338-Y398 HydrophobicContact CD1-CE1 3.96Å; F344-Y398 AromaticContact CE2-CD1 3.88Å; F344-Y398 HydrophobicContact CE2-CD1 3.88Å; F344-Y398 HydrophobicContact CE2-CD2 4.39Å; F344-Y398 HydrophobicContact CE2-CE1 4.31Å; F344-Y398 AromaticContact CE2-CG 3.96Å; F344-Y398 HydrophobicContact CE2-CG 3.96Å; F344-Y398 AromaticContact CZ-CD1 3.63Å; F344-Y398 HydrophobicContact CZ-CD1 3.63Å; F344-Y398 HydrophobicContact CZ-CE1 4.37Å; F344-Y398 AromaticContact CZ-CG 3.87Å; F344-Y398 HydrophobicContact CZ-CG 3.87Å; V349-Y398 HydrophobicContact CB-CD2 4.26Å; V349-Y398 HydrophobicContact CG1-CD2 3.91Å; V349-Y398 HydrophobicContact CG1-CE2 3.97Å; S352-Y398 WeakPolarHBondContact OG-CE2 3.14Å; L354-Y398 WeakPolarHBondContact CD2-OH 3.42Å; M368-Y398 HydrophobicContact CE-CE1 4.41Å; M368-Y398 HydrophobicContact CE-CE2 4.37Å; H385-Y398 PolarHBondContact O-N 2.96Å; H385-Y398 VanDerWaalsContact O-N 3.16Å; D396-Y398 VanDerWaalsContact C-N 3.26Å; D396-Y398 PolarHBondContact O-N 3.2Å; D396-Y398 WeakPolarHBondContact OD1-CB 3.38Å; D396-Y398 PolarHBondContact OD1-N 3.03Å; Y398-G401 WeakPolarHBondContact O-CA 3.03Å; Y398-G401 PolarHBondContact O-N 2.93Å; Y398-M402 HydrophobicContact CE1-CE 4.22Å; Y398-M402 PolarHBondContact O-N 3.49Å
399	L	98.9	Very high	97	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-74.2	-29.9	177.5	-77.3	-179.5	0	0	0	112.6	R335 L338 E339 F344 H385 R386 G401 M402 D403	R335-L399 HydrophobicContact CG-CD2 4.13Å; L338-L399 HydrophobicContact CB-CD2 4.01Å; L338-L399 HydrophobicContact CD1-CD2 3.84Å; E339-L399 HydrophobicContact CG-CD1 3.92Å; F344-L399 HydrophobicContact CE1-CD1 3.82Å; F344-L399 HydrophobicContact CE1-CD2 4.31Å; F344-L399 HydrophobicContact CE1-CG 3.73Å; F344-L399 HydrophobicContact CZ-CG 4.07Å; H385-L399 HydrophobicContact CB-CB 3.92Å; H385-L399 HydrophobicContact CB-CD1 4.2Å; H385-L399 HydrophobicContact CB-CG 3.93Å; H385-L399 WeakPolarHBondContact O-CA 3.15Å; H385-L399 WeakPolarHBondContact O-CB 3.49Å; H385-L399 PolarHBondContact O-N 3.39Å; R386-L399 HydrophobicContact CG-CB 3.64Å; L399-G401 VanDerWaalsContact C-N 3.29Å; L399-G401 PolarHBondContact O-N 3.42Å; L399-M402 HydrophobicContact CD2-CB 4.16Å; L399-M402 HydrophobicContact CD2-CG 4.4Å; L399-M402 WeakPolarHBondContact O-CB 3.47Å; L399-M402 PolarHBondContact O-N 3Å; L399-D403 WeakPolarHBondContact O-CB 3.45Å; L399-D403 PolarHBondContact O-N 2.82Å
400	W	98.8	Very high	97.1	Very high	82 Å²	82	29.7 Å²	29.7	31%	0.311	17%	0.17	S	C	.	.	H	α-helix	trans	-60.5	-42.1	166.5	174.7	61.7	0	0	0	111	T281 G283 H385 G397 D403 N404	T281-W400 WeakPolarHBondContact O-CZ2 3.29Å; G283-W400 VanDerWaalsContact CA-CE3 3.45Å; G283-W400 VanDerWaalsContact CA-CZ3 3.42Å; H385-W400 PolarHBondContact O-N 3.3Å; H385-W400 VanDerWaalsContact O-N 3.1Å; G397-W400 PolarHBondContact O-N 3.11Å; W400-D403 PolarHBondContact O-N 3.2Å; W400-N404 VanDerWaalsContact CE2-ND2 3.3Å; W400-N404 PolarHBondContact NE1-ND2 2.89Å; W400-N404 PolarHBondContact O-N 2.77Å; W400-N404 VanDerWaalsContact O-N 3.13Å; W400-N404 PolarHBondContact O-ND2 3.35Å
401	G	98.6	Very high	97.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-56.2	-49.4	169.8	0	0	0	0	0	113.5	L282 G283 G397 Y398 L399 N404 L405	L282-G401 WeakPolarHBondContact O-CA 3.37Å; G283-G401 VanDerWaalsContact O-CA 3.29Å; G283-G401 WeakPolarHBondContact O-CA 3.26Å; G397-G401 PolarHBondContact O-N 3.3Å; Y398-G401 WeakPolarHBondContact O-CA 3.03Å; Y398-G401 PolarHBondContact O-N 2.93Å; L399-G401 VanDerWaalsContact C-N 3.29Å; L399-G401 PolarHBondContact O-N 3.42Å; G401-N404 PolarHBondContact O-N 3.15Å; G401-L405 VanDerWaalsContact O-CB 3.32Å; G401-L405 WeakPolarHBondContact O-CB 3.42Å; G401-L405 PolarHBondContact O-N 2.7Å
402	M	98.6	Very high	97.5	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.2	-43.5	177.7	-176.4	64.9	73.7	0	0	112.6	L331 L334 R335 L338 L354 Y398 L399 L405 I406	L331-M402 HydrophobicContact CB-SD 4.11Å; L331-M402 HydrophobicContact CD2-CE 4.41Å; L331-M402 HydrophobicContact CD2-SD 3.82Å; L334-M402 HydrophobicContact CD2-CE 3.74Å; L334-M402 HydrophobicContact CG-CE 3.88Å; R335-M402 HydrophobicContact CB-CG 3.92Å; R335-M402 HydrophobicContact CG-CG 4.31Å; L338-M402 HydrophobicContact CD1-CE 3.83Å; L354-M402 HydrophobicContact CD1-CE 3.71Å; L354-M402 HydrophobicContact CD1-SD 4.35Å; L354-M402 HydrophobicContact CD2-CE 4.35Å; Y398-M402 HydrophobicContact CE1-CE 4.22Å; Y398-M402 PolarHBondContact O-N 3.49Å; L399-M402 HydrophobicContact CD2-CB 4.16Å; L399-M402 HydrophobicContact CD2-CG 4.4Å; L399-M402 WeakPolarHBondContact O-CB 3.47Å; L399-M402 PolarHBondContact O-N 3Å; M402-L405 WeakPolarHBondContact O-CB 3.48Å; M402-L405 PolarHBondContact O-N 2.83Å; M402-I406 HydrophobicContact CG-CD1 3.9Å; M402-I406 WeakPolarHBondContact O-CB 3.49Å; M402-I406 WeakPolarHBondContact O-CG1 3.27Å; M402-I406 PolarHBondContact O-N 3.06Å; M402-I406 HydrophobicContact SD-CD1 4.21Å; M402-I406 HydrophobicContact SD-CG1 4.45Å
403	D	98.8	Very high	97.6	Very high	42 Å²	42	24.2 Å²	24.2	23%	0.225	13%	0.132	C	C	.	.	H	α-helix	trans	-66.2	-41.7	-179.5	-73.2	-35.9	0	0	0	111.7	R335 R386 L399 W400 L405 I406 D407	R335-D403 WeakPolarHBondContact CD-OD1 3.41Å; R335-D403 IonicContact CZ-OD1 3.67Å; R335-D403 IonicContact NE-OD1 3.28Å; R335-D403 IonicContact NH1-OD1 3.17Å; R335-D403 PolarHBondContact NH1-OD1 2.92Å; R386-D403 IonicContact CZ-OD2 2.6Å; R386-D403 VanDerWaalsContact CZ-OD2 3.24Å; R386-D403 IonicContact NE-OD2 3.44Å; R386-D403 PolarHBondContact NE-OD2 3.18Å; R386-D403 IonicContact NH2-OD1 2.88Å; R386-D403 PolarHBondContact NH2-OD1 2.75Å; R386-D403 IonicContact NH2-OD2 3.97Å; R386-D403 PolarHBondContact NH2-OD2 2.9Å; L399-D403 WeakPolarHBondContact O-CB 3.45Å; L399-D403 PolarHBondContact O-N 2.82Å; W400-D403 PolarHBondContact O-N 3.2Å; D403-L405 VanDerWaalsContact C-N 3.33Å; D403-L405 PolarHBondContact O-N 3.42Å; D403-I406 PolarHBondContact O-N 3.14Å; D403-D407 WeakPolarHBondContact O-CB 3.36Å; D403-D407 PolarHBondContact O-N 3.29Å
404	N	98.8	Very high	97	Very high	36 Å²	36	27.2 Å²	27.2	19%	0.193	15%	0.154	C	C	.	.	H	α-helix	trans	-64.4	-37	173.3	-68.1	-44.8	0	0	0	112.2	L282 F284 W400 G401 D407 I408	L282-N404 VanDerWaalsContact C-ND2 3.33Å; L282-N404 HydrophobicContact CB-CB 4.42Å; L282-N404 WeakPolarHBondContact O-CB 3.46Å; L282-N404 PolarHBondContact O-ND2 3.32Å; F284-N404 HydrophobicContact CE1-CB 4.23Å; W400-N404 VanDerWaalsContact CE2-ND2 3.3Å; W400-N404 PolarHBondContact NE1-ND2 2.89Å; W400-N404 PolarHBondContact O-N 2.77Å; W400-N404 VanDerWaalsContact O-N 3.13Å; W400-N404 PolarHBondContact O-ND2 3.35Å; G401-N404 PolarHBondContact O-N 3.15Å; N404-D407 PolarHBondContact O-N 3.24Å; N404-I408 WeakPolarHBondContact O-CB 3.29Å; N404-I408 WeakPolarHBondContact O-CD1 3.4Å; N404-I408 VanDerWaalsContact O-CG1 3.25Å; N404-I408 WeakPolarHBondContact O-CG1 3.47Å; N404-I408 PolarHBondContact O-N 3.01Å
405	L	98.2	Very high	95.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.2	-44.8	177.8	-170.9	63.4	0	0	0	111.2	M219 F284 F313 L331 L354 F356 G401 M402 D403 I408 F409	M219-L405 HydrophobicContact CE-CD2 4.39Å; M219-L405 HydrophobicContact SD-CD2 4.44Å; F284-L405 HydrophobicContact CD1-CB 4.28Å; F284-L405 HydrophobicContact CD1-CD1 4.49Å; F284-L405 HydrophobicContact CD2-CD1 4.28Å; F284-L405 HydrophobicContact CE1-CB 3.99Å; F284-L405 HydrophobicContact CE1-CD1 4.03Å; F284-L405 HydrophobicContact CE2-CD1 3.81Å; F284-L405 HydrophobicContact CZ-CB 4.45Å; F284-L405 HydrophobicContact CZ-CD1 3.66Å; F313-L405 HydrophobicContact CE1-CD1 4.47Å; F313-L405 HydrophobicContact CE2-CD1 3.77Å; F313-L405 HydrophobicContact CZ-CD1 3.44Å; F313-L405 VanDerWaalsContact CZ-CD1 3.44Å; L331-L405 HydrophobicContact CD1-CD2 4.18Å; L331-L405 HydrophobicContact CD1-CG 3.98Å; L331-L405 HydrophobicContact CD2-CD2 4.04Å; L354-L405 HydrophobicContact CD1-CD2 3.67Å; F356-L405 HydrophobicContact CE2-CD2 4.38Å; F356-L405 HydrophobicContact CZ-CD1 4.45Å; F356-L405 HydrophobicContact CZ-CD2 3.91Å; F356-L405 HydrophobicContact CZ-CG 4.43Å; G401-L405 VanDerWaalsContact O-CB 3.32Å; G401-L405 WeakPolarHBondContact O-CB 3.42Å; G401-L405 PolarHBondContact O-N 2.7Å; M402-L405 WeakPolarHBondContact O-CB 3.48Å; M402-L405 PolarHBondContact O-N 2.83Å; D403-L405 VanDerWaalsContact C-N 3.33Å; D403-L405 PolarHBondContact O-N 3.42Å; L405-I408 PolarHBondContact O-N 3.26Å; L405-F409 HydrophobicContact CD1-CD2 4.13Å; L405-F409 HydrophobicContact CD1-CE2 3.83Å; L405-F409 HydrophobicContact CG-CD2 4.38Å; L405-F409 HydrophobicContact CG-CE2 4.37Å; L405-F409 VanDerWaalsContact O-CD2 3.3Å; L405-F409 WeakPolarHBondContact O-CD2 3.26Å; L405-F409 PolarHBondContact O-N 2.9Å
406	I	98.7	Very high	95.5	Very high	14 Å²	14	42.3 Å²	42.3	7%	0.072	21%	0.213	C	C	.	.	H	α-helix	trans	-60.9	-46	173.9	-72.1	168.5	0	0	0	110.9	L328 L331 E332 R335 M402 D403 I408 F409 G410	L328-I406 HydrophobicContact CD1-CB 4.43Å; L328-I406 HydrophobicContact CD1-CG2 3.86Å; L328-I406 WeakPolarHBondContact CD1-O 3.49Å; L331-I406 HydrophobicContact CB-CD1 4.26Å; L331-I406 HydrophobicContact CB-CG1 3.74Å; E332-I406 HydrophobicContact CG-CD1 4.31Å; E332-I406 HydrophobicContact CG-CG2 4.11Å; R335-I406 HydrophobicContact CB-CD1 4.1Å; M402-I406 HydrophobicContact CG-CD1 3.9Å; M402-I406 WeakPolarHBondContact O-CB 3.49Å; M402-I406 WeakPolarHBondContact O-CG1 3.27Å; M402-I406 PolarHBondContact O-N 3.06Å; M402-I406 HydrophobicContact SD-CD1 4.21Å; M402-I406 HydrophobicContact SD-CG1 4.45Å; D403-I406 PolarHBondContact O-N 3.14Å; I406-I408 PolarHBondContact O-N 3.38Å; I406-F409 PolarHBondContact O-N 3.39Å; I406-G410 PolarHBondContact O-N 2.93Å
407	D	98.5	Very high	95.4	Very high	89 Å²	89	44.5 Å²	44.5	48%	0.476	22%	0.224	S	C	.	.	H	α-helix	trans	-60.7	-42.6	176.7	172.8	67.9	0	0	0	112.5	R306 D403 N404 G410 S411	R306-D407 IonicContact CZ-OD2 3.98Å; R306-D407 IonicContact NE-OD2 3.81Å; R306-D407 IonicContact NH2-OD2 2.74Å; R306-D407 PolarHBondContact NH2-OD2 3.28Å; D403-D407 WeakPolarHBondContact O-CB 3.36Å; D403-D407 PolarHBondContact O-N 3.29Å; N404-D407 PolarHBondContact O-N 3.24Å; D407-G410 PolarHBondContact O-N 3.44Å; D407-S411 WeakPolarHBondContact O-CB 3.45Å; D407-S411 PolarHBondContact O-N 3.13Å; D407-S411 PolarHBondContact O-OG 3.22Å
408	I	98.3	Very high	95.2	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-53.8	176	-73.9	163.8	0	0	0	110.6	L282 F284 R306 V309 V310 F313 N404 L405 I406 G410 S411 M412	L282-I408 HydrophobicContact CD1-CD1 4.1Å; F284-I408 HydrophobicContact CE1-CD1 4.19Å; F284-I408 HydrophobicContact CZ-CD1 3.84Å; R306-I408 HydrophobicContact CG-CD1 4.09Å; R306-I408 HydrophobicContact CG-CG1 4.01Å; V309-I408 HydrophobicContact CG1-CD1 4.2Å; V310-I408 HydrophobicContact CG2-CG2 3.85Å; F313-I408 HydrophobicContact CD2-CG2 3.6Å; F313-I408 HydrophobicContact CE2-CG2 3.73Å; N404-I408 WeakPolarHBondContact O-CB 3.29Å; N404-I408 WeakPolarHBondContact O-CD1 3.4Å; N404-I408 VanDerWaalsContact O-CG1 3.25Å; N404-I408 WeakPolarHBondContact O-CG1 3.47Å; N404-I408 PolarHBondContact O-N 3.01Å; L405-I408 PolarHBondContact O-N 3.26Å; I406-I408 PolarHBondContact O-N 3.38Å; I408-G410 VanDerWaalsContact C-N 3.31Å; I408-G410 PolarHBondContact O-N 2.84Å; I408-S411 PolarHBondContact O-N 3.36Å; I408-S411 VanDerWaalsContact O-N 3.1Å; I408-S411 PolarHBondContact O-OG 3.08Å; I408-M412 HydrophobicContact CG2-SD 4.08Å; I408-M412 WeakPolarHBondContact O-CG 3.42Å; I408-M412 PolarHBondContact O-N 3.22Å; I408-M412 VanDerWaalsContact O-N 3.13Å
409	F	97.4	Very high	95	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.3	-38.9	178.9	-88.7	-108.3	0	0	0	112.4	F313 L324 Y327 L328 L331 F356 L405 I406 M412	F313-F409 HydrophobicContact CD1-CE2 4.14Å; F313-F409 HydrophobicContact CD1-CZ 4.26Å; F313-F409 HydrophobicContact CD2-CD2 4.18Å; F313-F409 AromaticContact CD2-CE2 3.68Å; F313-F409 HydrophobicContact CD2-CE2 3.68Å; F313-F409 HydrophobicContact CD2-CZ 4.4Å; F313-F409 HydrophobicContact CE1-CE2 4.09Å; F313-F409 HydrophobicContact CE1-CZ 4.48Å; F313-F409 HydrophobicContact CE2-CD2 4.13Å; F313-F409 AromaticContact CE2-CE2 3.61Å; F313-F409 HydrophobicContact CE2-CE2 3.61Å; F313-F409 AromaticContact CG-CE2 3.95Å; F313-F409 HydrophobicContact CG-CE2 3.95Å; F313-F409 HydrophobicContact CG-CZ 4.23Å; F313-F409 AromaticContact CZ-CE2 3.83Å; F313-F409 HydrophobicContact CZ-CE2 3.83Å; L324-F409 HydrophobicContact CD1-CD1 3.49Å; L324-F409 VanDerWaalsContact CD1-CD1 3.49Å; L324-F409 HydrophobicContact CD1-CE1 3.87Å; L324-F409 HydrophobicContact CD1-CG 4.25Å; Y327-F409 AromaticContact CD2-CE1 3.86Å; Y327-F409 HydrophobicContact CD2-CE1 3.86Å; Y327-F409 HydrophobicContact CG-CE1 4.04Å; L328-F409 HydrophobicContact CB-CB 4.34Å; L328-F409 HydrophobicContact CD1-CB 4Å; L331-F409 HydrophobicContact CD1-CD2 4.29Å; L331-F409 HydrophobicContact CD1-CG 4.32Å; F356-F409 HydrophobicContact CD1-CZ 4.26Å; F356-F409 HydrophobicContact CE1-CE1 4.18Å; F356-F409 HydrophobicContact CE1-CE2 4.17Å; F356-F409 AromaticContact CE1-CZ 3.62Å; F356-F409 HydrophobicContact CE1-CZ 3.62Å; F356-F409 HydrophobicContact CZ-CE2 4.39Å; F356-F409 HydrophobicContact CZ-CZ 4.25Å; L405-F409 HydrophobicContact CD1-CD2 4.13Å; L405-F409 HydrophobicContact CD1-CE2 3.83Å; L405-F409 HydrophobicContact CG-CD2 4.38Å; L405-F409 HydrophobicContact CG-CE2 4.37Å; L405-F409 VanDerWaalsContact O-CD2 3.3Å; L405-F409 WeakPolarHBondContact O-CD2 3.26Å; L405-F409 PolarHBondContact O-N 2.9Å; I406-F409 PolarHBondContact O-N 3.39Å; F409-M412 PolarHBondContact O-N 3.49Å
410	G	97.4	Very high	94.8	Very high	32 Å²	32	52.6 Å²	52.6	33%	0.33	26%	0.264	S	S	.	.	H	α-helix	trans	-63.9	-41.1	173.6	0	0	0	0	0	112.7	I406 D407 I408 M412 L413	I406-G410 PolarHBondContact O-N 2.93Å; D407-G410 PolarHBondContact O-N 3.44Å; I408-G410 VanDerWaalsContact C-N 3.31Å; I408-G410 PolarHBondContact O-N 2.84Å; G410-M412 VanDerWaalsContact C-N 3.28Å; G410-M412 PolarHBondContact O-N 3.31Å; G410-L413 PolarHBondContact O-N 2.99Å
411	S	96.8	Very high	94.5	Very high	62 Å²	62	50.6 Å²	50.6	43%	0.434	26%	0.261	S	S	.	.	H	α-helix	trans	-70.9	-19.3	179	72.4	0	0	0	0	114.5	R306 D407 I408	R306-S411 PolarHBondContact NH2-OG 3.48Å; D407-S411 WeakPolarHBondContact O-CB 3.45Å; D407-S411 PolarHBondContact O-N 3.13Å; D407-S411 PolarHBondContact O-OG 3.22Å; I408-S411 PolarHBondContact O-N 3.36Å; I408-S411 VanDerWaalsContact O-N 3.1Å; I408-S411 PolarHBondContact O-OG 3.08Å
412	M	95.8	Very high	94.2	Very high	32 Å²	32	54.2 Å²	54.2	16%	0.158	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-12.3	174.8	-69.4	167.9	60.7	0	0	113.6	V310 F313 E314 L324 I408 F409 G410	V310-M412 HydrophobicContact CG1-CG 4.13Å; F313-M412 HydrophobicContact CB-CE 3.66Å; F313-M412 HydrophobicContact CB-SD 3.8Å; F313-M412 HydrophobicContact CD2-SD 4.22Å; E314-M412 HydrophobicContact CG-CE 3.85Å; L324-M412 HydrophobicContact CD1-CB 4.28Å; L324-M412 HydrophobicContact CD1-CE 3.7Å; L324-M412 HydrophobicContact CD1-SD 4.26Å; L324-M412 HydrophobicContact CD2-CB 3.73Å; L324-M412 HydrophobicContact CD2-CE 4.41Å; I408-M412 HydrophobicContact CG2-SD 4.08Å; I408-M412 WeakPolarHBondContact O-CG 3.42Å; I408-M412 PolarHBondContact O-N 3.22Å; I408-M412 VanDerWaalsContact O-N 3.13Å; F409-M412 PolarHBondContact O-N 3.49Å; G410-M412 VanDerWaalsContact C-N 3.28Å; G410-M412 PolarHBondContact O-N 3.31Å
413	L	93.4	Very high	93.9	Very high	39 Å²	39	58.4 Å²	58.4	20%	0.204	30%	0.301	C	S	.	.	S	Bend	trans	-74.8	140.7	179.4	-72.8	171.9	0	0	0	111.5	V321 L324 K325 L328 G410 R415	V321-L413 HydrophobicContact CG1-CD2 4.13Å; L324-L413 HydrophobicContact CB-CD2 4.47Å; L324-L413 HydrophobicContact CD2-CD2 3.75Å; L324-L413 HydrophobicContact CD2-CG 4.2Å; L324-L413 HydrophobicContact CG-CD2 4.02Å; K325-L413 HydrophobicContact CD-CD2 4.41Å; K325-L413 HydrophobicContact CG-CD1 4.36Å; K325-L413 HydrophobicContact CG-CD2 3.51Å; L328-L413 HydrophobicContact CD2-CD1 3.5Å; G410-L413 PolarHBondContact O-N 2.99Å; L413-R415 PolarHBondContact O-N 3.49Å
414	P	83	Confident	93.5	Very high	96 Å²	96	59.8 Å²	59.8	62%	0.623	31%	0.307	S	S	*	.			trans	-56.4	134.6	169.9	-23.1	33.2	0	0	0	111.1	V321	V321-P414 HydrophobicContact CG1-CG 4.44Å; V321-P414 HydrophobicContact CG2-CG 4.11Å
415	R	65.8	Low	93	Very high	316 Å²	316	61.9 Å²	61.9	100%	1.192	32%	0.318	S	S	*	.			trans	-79.1	0	177.1	-66.5	-174.2	179.1	-169.3	-0.4	112.5	L413	L413-R415 PolarHBondContact O-N 3.49Å

Retrieved 415 of 415 residues in 270.8 ms (Link to these results)

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