A0A087XXZ0_POEFO Loading...

RNA helicase

AlphaFold DB , UniProt , Accession A0A087XXZ0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 482 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.4	Very low	30.9	Very low	231 Å²	231	144.7 Å²	144.7	100%	1.138	79%	0.792	S	S	*	*				0	94	0	-53.9	-179.5	-166.4	0	0	106
2	S	29.7	Very low	30.4	Very low	106 Å²	106	146 Å²	146	74%	0.741	80%	0.796	S	S	*	*			cis	57.4	130.2	27.7	74.8	0	0	0	0	111.8
3	T	31	Very low	30.1	Very low	120 Å²	120	140.8 Å²	140.8	74%	0.736	80%	0.796	S	S	*	*			cis	-149.3	162.5	29.2	45.1	0	0	0	0	114.8
4	T	32	Very low	29.9	Very low	124 Å²	124	142.1 Å²	142.1	76%	0.761	80%	0.799	S	S	*	*			trans	48.2	132.2	146.9	52	0	0	0	0	121.3
5	R	31.9	Very low	29.7	Very low	198 Å²	198	140.5 Å²	140.5	75%	0.747	80%	0.801	S	S	*	*			cis	81.4	115.7	36.5	-167.9	-174.1	-174.8	179.9	1.8	115.1	E7	R5-E7 IonicContact CZ-OE1 3.25Å; R5-E7 IonicContact NE-OE1 3.1Å; R5-E7 PolarHBondContact NE-OE1 3.07Å; R5-E7 IonicContact NH2-OE1 2.82Å; R5-E7 PolarHBondContact NH2-OE1 3.13Å; R5-E7 IonicContact NH2-OE2 3.78Å
6	T	28.8	Very low	29.6	Very low	149 Å²	149	141.1 Å²	141.1	91%	0.914	80%	0.801	S	S	*	*			trans	-153	155.5	160.3	-4.9	0	0	0	0	109.6
7	E	29.1	Very low	29.6	Very low	118 Å²	118	144.5 Å²	144.5	55%	0.551	81%	0.809	S	S	*	*			trans	-140.3	140.2	-163.3	-65.5	174.5	-178.4	0	0	114.4	R5	R5-E7 IonicContact CZ-OE1 3.25Å; R5-E7 IonicContact NE-OE1 3.1Å; R5-E7 PolarHBondContact NE-OE1 3.07Å; R5-E7 IonicContact NH2-OE1 2.82Å; R5-E7 PolarHBondContact NH2-OE1 3.13Å; R5-E7 IonicContact NH2-OE2 3.78Å
8	N	25.2	Very low	29.6	Very low	146 Å²	146	145.2 Å²	145.2	78%	0.781	81%	0.81	S	S	*	*			trans	60.5	-168.7	147.8	-60.4	-25.1	0	0	0	117.8
9	P	43.8	Very low	29.6	Very low	109 Å²	109	141.7 Å²	141.7	71%	0.708	81%	0.81	S	S	*	*				-132.7	174.8	-81.7	41.6	-27.4	0	0	0	114.8
10	V	25.5	Very low	29.5	Very low	149 Å²	149	143.7 Å²	143.7	90%	0.903	81%	0.812	S	S	*	*			trans	-136.6	152.8	165.2	-176	0	0	0	0	110.8
11	I	27.6	Very low	29.6	Very low	142 Å²	142	145 Å²	145	73%	0.728	82%	0.816	S	S	*	*			trans	-140.1	151.6	-162.8	-100.3	171.8	0	0	0	112.3
12	L	25.1	Very low	29.2	Very low	160 Å²	160	145.7 Å²	145.7	84%	0.838	81%	0.806	S	S	*	*			trans	63.7	154.7	166.6	-112.3	75.4	0	0	0	120
13	G	26.1	Very low	29	Very low	78 Å²	78	146.2 Å²	146.2	80%	0.804	81%	0.81	S	S	*	*			trans	175.6	62.5	178.3	0	0	0	0	0	113.5
14	L	27.3	Very low	28.9	Very low	159 Å²	159	146.2 Å²	146.2	83%	0.832	82%	0.815	S	S	*	*			trans	-81.4	145.7	173.9	-79.8	165.2	0	0	0	111.5
15	S	27.1	Very low	28.7	Very low	118 Å²	118	146.9 Å²	146.9	83%	0.825	82%	0.819	S	S	*	*			trans	-147.9	124.4	162.9	49.8	0	0	0	0	112.1
16	N	27.9	Very low	28.7	Very low	151 Å²	151	146.7 Å²	146.7	81%	0.807	82%	0.823	S	S	*	*			trans	-97	148.4	172.1	-76	-25.3	0	0	0	109.9
17	Q	29.6	Very low	29.4	Very low	199 Å²	199	145.5 Å²	145.5	93%	0.93	82%	0.818	S	S	*	*			trans	-137.3	151.6	146.7	-76	-155.3	0.2	0	0	111.6
18	N	30.1	Very low	29.4	Very low	156 Å²	156	144.7 Å²	144.7	83%	0.834	83%	0.831	S	S	*	*			trans	-89.8	156.1	-157.7	-59.4	-51.5	0	0	0	114.5
19	G	28.2	Very low	29.5	Very low	79 Å²	79	141.6 Å²	141.6	81%	0.814	83%	0.834	S	S	*	*			trans	-148.2	119.8	156.9	0	0	0	0	0	109.4
20	Q	29.4	Very low	28.8	Very low	182 Å²	182	141 Å²	141	85%	0.85	84%	0.839	S	S	*	*			trans	-93.3	149.1	-166.8	-72.8	-178	-24.1	0	0	114.5
21	L	30.5	Very low	29.8	Very low	172 Å²	172	140.3 Å²	140.3	90%	0.901	84%	0.837	S	S	*	*			trans	-81.6	150.6	163.1	-75.8	159.9	0	0	0	111.4
22	R	27.8	Very low	29.8	Very low	244 Å²	244	137.3 Å²	137.3	92%	0.921	84%	0.841	S	S	*	*			trans	-139.3	159.4	155	-83.5	-164.3	173.5	-165	-1.7	110.3
23	S	24.8	Very low	29.9	Very low	118 Å²	118	133.9 Å²	133.9	83%	0.825	85%	0.845	S	S	*	*			trans	-132.6	154.7	-164.8	49.3	0	0	0	0	112.7
24	S	28.6	Very low	29.9	Very low	119 Å²	119	134.1 Å²	134.1	83%	0.832	85%	0.847	S	S	*	*			trans	-152.9	-167.2	161.4	65.3	0	0	0	0	110.9
25	V	29.3	Very low	29.8	Very low	139 Å²	139	130.9 Å²	130.9	84%	0.842	85%	0.852	S	S	*	*				-152.2	154.4	-124.3	143.6	0	0	0	0	114
26	K	30.3	Very low	29.8	Very low	193 Å²	193	129.1 Å²	129.1	84%	0.839	85%	0.852	S	S	*	*			trans	-78.9	170.9	172.2	-96.5	-175.7	-179.7	-176.3	0	111.8
27	P	43.7	Very low	29.6	Very low	124 Å²	124	125.6 Å²	125.6	81%	0.805	85%	0.852	S	S	*	*			cis	-125	-153.7	28.4	36.3	-13.3	0	0	0	111.6
28	A	30.3	Very low	30.1	Very low	101 Å²	101	121.7 Å²	121.7	84%	0.835	84%	0.844	S	S	*	*			cis	-154.8	-177.4	7.2	0	0	0	0	0	111.5
29	G	26.3	Very low	30.1	Very low	82 Å²	82	122 Å²	122	85%	0.845	84%	0.84	S	S	*	*			trans	134.3	112	160.8	0	0	0	0	0	116.1
30	A	30.3	Very low	30.3	Very low	97 Å²	97	124.4 Å²	124.4	80%	0.802	84%	0.841	S	S	*	*			trans	-148.5	174.2	169	0	0	0	0	0	107.2
31	P	45.6	Very low	30.2	Very low	133 Å²	133	121 Å²	121	86%	0.864	83%	0.833	S	S	*	*			cis	-135.2	-170.2	7.4	43.7	-25.9	0	0	0	114.5
32	G	27.8	Very low	30	Very low	79 Å²	79	120.9 Å²	120.9	81%	0.814	83%	0.828	S	S	*	*			trans	154.3	106.7	160.1	0	0	0	0	0	115.2
33	G	27.1	Very low	29.9	Very low	89 Å²	89	116.7 Å²	116.7	92%	0.918	82%	0.823	S	S	*	*			trans	-87.4	-164.3	-173.6	0	0	0	0	0	117.8
34	G	26.4	Very low	29.9	Very low	83 Å²	83	116.9 Å²	116.9	86%	0.856	82%	0.815	S	S	*	*			trans	122.2	110	164.6	0	0	0	0	0	115.9
35	G	25.9	Very low	29.8	Very low	90 Å²	90	118.4 Å²	118.4	93%	0.928	81%	0.809	S	S	*	*			trans	-82.6	-174.1	-176.8	0	0	0	0	0	117.6
36	G	25.5	Very low	29.7	Very low	81 Å²	81	119.3 Å²	119.3	84%	0.835	81%	0.806	S	S	*	*			trans	129.3	143.8	171.9	0	0	0	0	0	114.4
37	G	24	Very low	29.6	Very low	77 Å²	77	116.4 Å²	116.4	79%	0.794	80%	0.798	S	S	*	*			trans	-105.6	-155.5	155.1	0	0	0	0	0	109.4
38	P	40.4	Very low	28.7	Very low	118 Å²	118	119.9 Å²	119.9	77%	0.766	80%	0.801	S	S	*	*			cis	-135.9	178.7	0.3	43.5	-27.9	0	0	0	115
39	Q	29.8	Very low	28.4	Very low	163 Å²	163	118.5 Å²	118.5	76%	0.762	80%	0.796	S	S	*	*			trans	58.1	164.5	161.8	-72.1	-173.6	-5	0	0	118.7
40	P	33.1	Very low	28.5	Very low	129 Å²	129	121.3 Å²	121.3	84%	0.838	80%	0.797	S	S	*	*				-140.4	169.3	111.2	39.4	-28.2	0	0	0	114.8
41	T	26.3	Very low	28.4	Very low	111 Å²	111	124.2 Å²	124.2	68%	0.681	80%	0.797	S	S	*	*			trans	-124.4	146.2	-177.8	18	0	0	0	0	113.3
42	Q	27.5	Very low	27.5	Very low	168 Å²	168	125.8 Å²	125.8	79%	0.785	80%	0.798	S	S	*	*			trans	37.6	118.1	152	-59.2	-176.2	5.9	0	0	121.6
43	L	25.4	Very low	27.7	Very low	157 Å²	157	125.3 Å²	125.3	82%	0.822	79%	0.794	S	S	*	*				-165.2	138.6	111.8	-124.5	65.8	0	0	0	107.5
44	N	24.6	Very low	27.6	Very low	121 Å²	121	128.7 Å²	128.7	65%	0.647	79%	0.791	S	S	*	*			cis	59.3	129.8	48.4	-86.9	-19.1	0	0	0	113.1
45	Q	26.1	Very low	27.8	Very low	151 Å²	151	130.1 Å²	130.1	71%	0.706	79%	0.787	S	S	*	*			cis	-163.6	-174.4	9.9	-145.9	172.6	58.1	0	0	112.3
46	M	26.3	Very low	28	Very low	158 Å²	158	134.6 Å²	134.6	78%	0.778	78%	0.784	S	S	*	*			trans	90.8	139.6	164	-53.4	-160.3	-178.4	0	0	118.4
47	I	28.6	Very low	28.2	Very low	133 Å²	133	136.5 Å²	136.5	68%	0.682	78%	0.782	S	S	*	*			cis	-147.4	137.7	-9.5	-121	166.5	0	0	0	114.3
48	K	24.4	Very low	28.6	Very low	197 Å²	197	137 Å²	137	86%	0.857	78%	0.778	S	S	*	*			trans	12.4	136.9	155.2	-58.1	174.7	-179.3	178.4	0	123.2
49	G	25.6	Very low	28.1	Very low	71 Å²	71	136.8 Å²	136.8	73%	0.732	78%	0.777	S	S	*	*			trans	148.1	128.1	138.8	0	0	0	0	0	113.7
50	T	27.2	Very low	28.3	Very low	141 Å²	141	134.8 Å²	134.8	87%	0.865	78%	0.778	S	S	*	*			cis	-149.3	146.5	-9.8	-67.9	0	0	0	0	108.1
51	I	27.9	Very low	28.9	Very low	159 Å²	159	134.8 Å²	134.8	82%	0.815	78%	0.776	S	S	*	*			trans	-77.3	132.7	178.9	-62.2	171	0	0	0	110.2
52	N	27.6	Very low	29.8	Very low	166 Å²	166	136.7 Å²	136.7	89%	0.888	78%	0.782	S	S	*	*			trans	-139.7	113.5	153.8	-130.6	-5.2	0	0	0	108.4
53	G	31	Very low	30.3	Very low	69 Å²	69	132.6 Å²	132.6	71%	0.711	78%	0.777	S	S	*	*			trans	-86	131.4	-174.2	0	0	0	0	0	111.6
54	N	26.5	Very low	31.3	Very low	160 Å²	160	131.2 Å²	131.2	86%	0.856	78%	0.775	S	S	*	*			trans	-145.3	84.5	162.8	-143.8	-4.1	0	0	0	109.6	Q56	N54-Q56 PolarHBondContact O-N 3.16Å; N54-Q56 VanDerWaalsContact O-N 3.07Å
55	S	30.2	Very low	32.4	Very low	112 Å²	112	126.9 Å²	126.9	78%	0.783	75%	0.751	S	S	*	*			trans	-69.9	99.3	177.8	50.9	0	0	0	0	109.8	P57	S55-P57 WeakPolarHBondContact O-CD 3.41Å
56	Q	30.6	Very low	33.2	Very low	184 Å²	184	126.5 Å²	126.5	86%	0.86	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-58.4	125.6	170.3	-69.6	-174.7	-12.3	0	0	109.3	N54	N54-Q56 PolarHBondContact O-N 3.16Å; N54-Q56 VanDerWaalsContact O-N 3.07Å
57	P	29.3	Very low	33.9	Very low	122 Å²	122	125.4 Å²	125.4	79%	0.792	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-61.8	142.5	172.1	-21.3	33.3	0	0	0	110.5	S55	S55-P57 WeakPolarHBondContact O-CD 3.41Å
58	A	31.5	Very low	35.1	Very low	86 Å²	86	123 Å²	123	71%	0.711	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-59.2	143.5	164.8	0	0	0	0	0	109.5
59	P	31.2	Very low	36.7	Very low	115 Å²	115	117.4 Å²	117.4	75%	0.747	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-61.3	133.2	-179.6	25.4	-34	0	0	0	110.2	T61	P59-T61 PolarHBondContact O-N 2.76Å; P59-T61 VanDerWaalsContact O-N 3.16Å
60	P	34.2	Very low	38.8	Very low	120 Å²	120	117.7 Å²	117.7	78%	0.779	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-68.1	116.1	-173.9	26.2	-34.1	0	0	0	111.2
61	T	45.2	Very low	41.1	Very low	129 Å²	129	112.4 Å²	112.4	79%	0.791	69%	0.688	S	S	*	*	S	Bend	trans	-67.6	134.4	171	48.7	0	0	0	0	110.7	P59	P59-T61 PolarHBondContact O-N 2.76Å; P59-T61 VanDerWaalsContact O-N 3.16Å
62	N	45.2	Very low	43.4	Very low	151 Å²	151	108.2 Å²	108.2	81%	0.807	66%	0.664	S	S	*	*			trans	58.1	62.8	171.2	-61.4	-4.4	0	0	0	115.6	V64	N62-V64 PolarHBondContact O-N 3.38Å; N62-V64 VanDerWaalsContact O-N 3.13Å
63	A	38.3	Very low	45.6	Very low	82 Å²	82	108.1 Å²	108.1	68%	0.678	66%	0.656	S	S	*	*			trans	-63.4	109	154.1	0	0	0	0	0	109.3	I65	A63-I65 VanDerWaalsContact C-N 3.29Å; A63-I65 PolarHBondContact O-N 2.94Å
64	V	45	Very low	47.8	Very low	129 Å²	129	110.3 Å²	110.3	78%	0.782	65%	0.652	S	S	*	*			trans	-75.4	85.9	173.6	-177.4	0	0	0	0	108.6	N62 K66	N62-V64 PolarHBondContact O-N 3.38Å; N62-V64 VanDerWaalsContact O-N 3.13Å; V64-K66 PolarHBondContact O-N 2.61Å
65	I	48.6	Very low	50.4	Low	30 Å²	30	103.7 Å²	103.7	15%	0.154	62%	0.616	C	S	.	*	P	Polyproline II helix	trans	-56.2	128.5	176.7	-56.6	175.1	0	0	0	108.7	A63 D69 W71 R104 M108	A63-I65 VanDerWaalsContact C-N 3.29Å; A63-I65 PolarHBondContact O-N 2.94Å; I65-D69 HydrophobicContact CG2-CB 3.51Å; I65-W71 HydrophobicContact CD1-CB 4.49Å; I65-W71 HydrophobicContact CG2-CB 4.17Å; I65-R104 PolarHBondContact O-NH1 3.27Å; I65-R104 PolarHBondContact O-NH2 2.78Å; I65-M108 HydrophobicContact CD1-CE 4.36Å
66	K	43.4	Very low	52.7	Low	143 Å²	143	107.1 Å²	107.1	62%	0.622	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-85.7	161.4	-173.5	-66.1	178.9	-178.9	175.7	0	112.1	V64 G68 D69	V64-K66 PolarHBondContact O-N 2.61Å; K66-G68 PolarHBondContact O-N 3.14Å; K66-D69 PolarHBondContact N-OD2 3.28Å; K66-D69 PolarHBondContact O-N 3.08Å
67	P	40	Very low	55.2	Low	134 Å²	134	102.5 Å²	102.5	87%	0.87	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	128.6	164.7	-19.4	32.8	0	0	0	109.9
68	G	53.6	Low	57.6	Low	84 Å²	84	99.5 Å²	99.5	87%	0.866	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	96.5	-12.4	-176.8	0	0	0	0	0	115.4	K66	K66-G68 PolarHBondContact O-N 3.14Å
69	D	59	Low	59.9	Low	78 Å²	78	101.4 Å²	101.4	42%	0.417	58%	0.583	S	S	.	*	S	Bend	trans	-68.9	135.1	167.7	-73.6	-31.8	0	0	0	110	I65 K66 W71	I65-D69 HydrophobicContact CG2-CB 3.51Å; K66-D69 PolarHBondContact N-OD2 3.28Å; K66-D69 PolarHBondContact O-N 3.08Å; D69-W71 PolarHBondContact O-N 3.11Å
70	D	69.3	Low	62	Low	78 Å²	78	102.3 Å²	102.3	42%	0.417	58%	0.575	S	S	.	*			trans	-75.1	75.8	171.7	-173.6	-4.1	0	0	0	110.4	K72 K73	D70-K72 PolarHBondContact O-N 3.38Å; D70-K72 VanDerWaalsContact O-N 3.14Å; D70-K72 PolarHBondContact OD1-N 3.19Å; D70-K73 HydrophobicContact CB-CD 4.36Å; D70-K73 HydrophobicContact CB-CG 4.35Å; D70-K73 WeakPolarHBondContact O-CB 3.49Å; D70-K73 PolarHBondContact O-N 3.19Å; D70-K73 VanDerWaalsContact O-N 3.08Å; D70-K73 IonicContact OD2-NZ 2.61Å; D70-K73 PolarHBondContact OD2-NZ 2.66Å
71	W	75.3	Confident	64	Low	29 Å²	29	99.1 Å²	99.1	11%	0.11	55%	0.552	C	S	.	*	G	3₁₀ helix	trans	-57.6	-24.7	-177.6	56.2	-87.3	0	0	0	113.4	I65 D69 K73 N74 L75 E98 R104 L107 M108 F111	I65-W71 HydrophobicContact CD1-CB 4.49Å; I65-W71 HydrophobicContact CG2-CB 4.17Å; D69-W71 PolarHBondContact O-N 3.11Å; W71-K73 VanDerWaalsContact C-N 3.28Å; W71-K73 PolarHBondContact O-N 3.39Å; W71-N74 PolarHBondContact O-N 3.03Å; W71-N74 VanDerWaalsContact O-N 3.11Å; W71-L75 HydrophobicContact CE3-CD1 3.99Å; W71-L75 HydrophobicContact CE3-CG 4.46Å; W71-L75 HydrophobicContact CZ3-CD1 3.82Å; W71-E98 VanDerWaalsContact CZ2-OE1 3.3Å; W71-E98 WeakPolarHBondContact CZ2-OE1 3.41Å; W71-R104 HydrophobicContact CD2-CG 4.44Å; W71-L107 HydrophobicContact CH2-CB 3.71Å; W71-L107 HydrophobicContact CZ2-CB 4.3Å; W71-L107 HydrophobicContact CZ3-CB 4.38Å; W71-M108 HydrophobicContact CD2-CG 4.4Å; W71-M108 HydrophobicContact CE3-CG 3.56Å; W71-M108 HydrophobicContact CZ3-CB 4.48Å; W71-M108 HydrophobicContact CZ3-CG 3.82Å; W71-F111 AromaticContact CH2-CD2 3.56Å; W71-F111 HydrophobicContact CH2-CD2 3.56Å; W71-F111 AromaticContact CH2-CE2 3.75Å; W71-F111 HydrophobicContact CH2-CE2 3.75Å; W71-F111 AromaticContact CZ3-CD2 3.85Å; W71-F111 HydrophobicContact CZ3-CD2 3.85Å; W71-F111 HydrophobicContact CZ3-CE2 4.48Å
72	K	75.8	Confident	65.5	Low	72 Å²	72	100.7 Å²	100.7	31%	0.313	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-63.1	-33.4	176.7	-63.8	175.1	-178.4	168.6	0	111.7	D70 N74 L75 E98	D70-K72 PolarHBondContact O-N 3.38Å; D70-K72 VanDerWaalsContact O-N 3.14Å; D70-K72 PolarHBondContact OD1-N 3.19Å; K72-N74 PolarHBondContact O-N 3.01Å; K72-L75 PolarHBondContact O-N 3.05Å; K72-E98 WeakPolarHBondContact CE-OE1 3.44Å; K72-E98 IonicContact NZ-OE1 3.41Å; K72-E98 PolarHBondContact NZ-OE1 2.84Å; K72-E98 IonicContact NZ-OE2 3.41Å; K72-E98 PolarHBondContact NZ-OE2 3.47Å
73	K	73.7	Confident	67	Low	163 Å²	163	96.4 Å²	96.4	71%	0.709	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-60.9	-22.7	174.3	-72	-174.3	170.8	80.9	0	114	D70 W71	D70-K73 HydrophobicContact CB-CD 4.36Å; D70-K73 HydrophobicContact CB-CG 4.35Å; D70-K73 WeakPolarHBondContact O-CB 3.49Å; D70-K73 PolarHBondContact O-N 3.19Å; D70-K73 VanDerWaalsContact O-N 3.08Å; D70-K73 IonicContact OD2-NZ 2.61Å; D70-K73 PolarHBondContact OD2-NZ 2.66Å; W71-K73 VanDerWaalsContact C-N 3.28Å; W71-K73 PolarHBondContact O-N 3.39Å
74	N	77.8	Confident	69	Low	116 Å²	116	95.9 Å²	95.9	62%	0.62	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-94	-2.8	-178.4	-65.4	-37.4	0	0	0	113.5	W71 K72	W71-N74 PolarHBondContact O-N 3.03Å; W71-N74 VanDerWaalsContact O-N 3.11Å; K72-N74 PolarHBondContact O-N 3.01Å
75	L	80.8	Confident	70.7	Confident	20 Å²	20	92.8 Å²	92.8	11%	0.105	49%	0.485	C	S	.	.	S	Bend	trans	-85.8	143.5	-178.3	-59.5	-173.8	0	0	0	112.4	W71 K72 L77 M108 F111 E112	W71-L75 HydrophobicContact CE3-CD1 3.99Å; W71-L75 HydrophobicContact CE3-CG 4.46Å; W71-L75 HydrophobicContact CZ3-CD1 3.82Å; K72-L75 PolarHBondContact O-N 3.05Å; L75-L77 VanDerWaalsContact C-N 3.35Å; L75-L77 HydrophobicContact CB-CD2 3.87Å; L75-L77 HydrophobicContact CB-CG 4.3Å; L75-L77 HydrophobicContact CD1-CD2 4.19Å; L75-L77 PolarHBondContact O-N 3.31Å; L75-M108 HydrophobicContact CD2-CB 4.22Å; L75-M108 HydrophobicContact CD2-CE 4.13Å; L75-M108 HydrophobicContact CD2-CG 4.23Å; L75-F111 HydrophobicContact CD1-CB 3.56Å; L75-E112 HydrophobicContact CB-CG 4.24Å; L75-E112 HydrophobicContact CD2-CG 4.22Å
76	K	79.9	Confident	72.1	Confident	184 Å²	184	92.4 Å²	92.4	80%	0.8	49%	0.485	S	S	*	.			trans	-89	76.1	171	-66.8	-174.9	179.4	-177.5	0	109.7
77	L	81.8	Confident	73.8	Confident	88 Å²	88	88.8 Å²	88.8	46%	0.461	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-64	141.4	177.3	-54.9	-179.1	0	0	0	110.8	L75 F111	L75-L77 VanDerWaalsContact C-N 3.35Å; L75-L77 HydrophobicContact CB-CD2 3.87Å; L75-L77 HydrophobicContact CB-CG 4.3Å; L75-L77 HydrophobicContact CD1-CD2 4.19Å; L75-L77 PolarHBondContact O-N 3.31Å; L77-F111 HydrophobicContact CD2-CB 4.05Å; L77-F111 VanDerWaalsContact CD2-O 3.3Å; L77-F111 WeakPolarHBondContact CD2-O 3.07Å
78	P	80.4	Confident	75.3	Confident	58 Å²	58	83.9 Å²	83.9	38%	0.377	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-71.2	163.7	171.9	30.7	-34.6	0	0	0	111.4	G114	P78-G114 VanDerWaalsContact CG-CA 3.4Å
79	P	79.5	Confident	76.2	Confident	126 Å²	126	80.3 Å²	80.3	82%	0.818	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-56.4	138.6	172.9	-23.7	34.3	0	0	0	112.1	D81	P79-D81 PolarHBondContact O-N 3.08Å
80	K	75.7	Confident	77.2	Confident	135 Å²	135	80.1 Å²	80.1	59%	0.587	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-62.9	130.3	177.7	-77.1	-178.6	178.8	-77.8	0	111	M82 E116	K80-M82 HydrophobicContact CB-SD 4.33Å; K80-M82 PolarHBondContact O-N 3.16Å; K80-E116 IonicContact NZ-OE1 2.98Å; K80-E116 PolarHBondContact NZ-OE1 3.08Å; K80-E116 IonicContact NZ-OE2 3.79Å; K80-E116 PolarHBondContact NZ-OE2 2.63Å
81	D	76.3	Confident	77.6	Confident	52 Å²	52	79.6 Å²	79.6	28%	0.278	41%	0.413	S	S	.	.			trans	-85.5	98.6	177.5	179.1	10	0	0	0	111.2	P79 R83 K85 H429	P79-D81 PolarHBondContact O-N 3.08Å; D81-R83 VanDerWaalsContact C-N 3.29Å; D81-R83 VanDerWaalsContact CG-NH2 3.34Å; D81-R83 PolarHBondContact O-N 2.96Å; D81-R83 WeakPolarHBondContact OD1-CB 3.44Å; D81-R83 VanDerWaalsContact OD1-CG 3.32Å; D81-R83 WeakPolarHBondContact OD1-CG 3.45Å; D81-R83 IonicContact OD1-CZ 2.83Å; D81-R83 PolarHBondContact OD1-N 3.41Å; D81-R83 IonicContact OD1-NE 3.77Å; D81-R83 PolarHBondContact OD1-NE 3.41Å; D81-R83 IonicContact OD1-NH2 2.67Å; D81-R83 PolarHBondContact OD1-NH2 3.46Å; D81-R83 IonicContact OD2-CZ 2.69Å; D81-R83 IonicContact OD2-NE 3.96Å; D81-R83 PolarHBondContact OD2-NE 3.34Å; D81-R83 IonicContact OD2-NH2 3.15Å; D81-R83 PolarHBondContact OD2-NH2 3.3Å; D81-K85 PolarHBondContact O-NZ 2.77Å; D81-K85 VanDerWaalsContact O-NZ 3.09Å; D81-K85 WeakPolarHBondContact OD2-CE 3.36Å; D81-K85 IonicContact OD2-NZ 3.13Å; D81-H429 IonicContact OD1-CE1 2.75Å; D81-H429 IonicContact OD2-CE1 2.68Å; D81-H429 PolarHBondContact OD2-CE1 3.09Å; D81-H429 IonicContact OD2-NE2 2.7Å; D81-H429 PolarHBondContact OD2-NE2 2.86Å; D81-H429 VanDerWaalsContact OD2-NE2 3.14Å
82	M	77.3	Confident	77.8	Confident	162 Å²	162	80.2 Å²	80.2	80%	0.798	42%	0.42	S	S	*	.			trans	-80.2	0.4	-177.1	-58	-58.1	-66	0	0	114.4	K80	K80-M82 HydrophobicContact CB-SD 4.33Å; K80-M82 PolarHBondContact O-N 3.16Å
83	R	76.7	Confident	78	Confident	61 Å²	61	83.2 Å²	83.2	23%	0.23	43%	0.433	C	S	.	.	S	Bend	trans	-66.5	142.5	178.6	-65.4	175.4	-69.2	-173.4	-1.8	110.9	D81 Q400 H429 A470	D81-R83 VanDerWaalsContact C-N 3.29Å; D81-R83 VanDerWaalsContact CG-NH2 3.34Å; D81-R83 PolarHBondContact O-N 2.96Å; D81-R83 WeakPolarHBondContact OD1-CB 3.44Å; D81-R83 VanDerWaalsContact OD1-CG 3.32Å; D81-R83 WeakPolarHBondContact OD1-CG 3.45Å; D81-R83 IonicContact OD1-CZ 2.83Å; D81-R83 PolarHBondContact OD1-N 3.41Å; D81-R83 IonicContact OD1-NE 3.77Å; D81-R83 PolarHBondContact OD1-NE 3.41Å; D81-R83 IonicContact OD1-NH2 2.67Å; D81-R83 PolarHBondContact OD1-NH2 3.46Å; D81-R83 IonicContact OD2-CZ 2.69Å; D81-R83 IonicContact OD2-NE 3.96Å; D81-R83 PolarHBondContact OD2-NE 3.34Å; D81-R83 IonicContact OD2-NH2 3.15Å; D81-R83 PolarHBondContact OD2-NH2 3.3Å; R83-Q400 PolarHBondContact NH1-O 3.07Å; R83-H429 PolarHBondContact NE-CE1 3.26Å; R83-H429 PolarHBondContact NE-NE2 3.1Å; R83-H429 PolarHBondContact NH2-NE2 3.32Å; R83-A470 HydrophobicContact CG-CB 3.83Å
84	I	79.4	Confident	78.2	Confident	71 Å²	71	77.7 Å²	77.7	36%	0.364	42%	0.423	S	S	.	.			trans	-47.2	139.7	166.1	-71.5	172.6	0	0	0	110.9	H429 L430 H473	I84-H429 PolarHBondContact O-ND1 2.82Å; I84-L430 HydrophobicContact CG2-CD1 4.38Å; I84-L430 HydrophobicContact CG2-CG 4.29Å; I84-H473 HydrophobicContact CB-CB 4.44Å; I84-H473 HydrophobicContact CD1-CB 3.72Å; I84-H473 HydrophobicContact CG1-CB 3.94Å
85	K	80.1	Confident	78.5	Confident	64 Å²	64	75 Å²	75	28%	0.278	41%	0.408	S	S	.	.			trans	-134.8	131.3	178.8	-68.5	168.2	-168.7	160.7	0	109.5	D81 V89 T90 F427 G428 H429	D81-K85 PolarHBondContact O-NZ 2.77Å; D81-K85 VanDerWaalsContact O-NZ 3.09Å; D81-K85 WeakPolarHBondContact OD2-CE 3.36Å; D81-K85 IonicContact OD2-NZ 3.13Å; K85-V89 HydrophobicContact CB-CG2 3.89Å; K85-T90 HydrophobicContact CB-CG2 3.68Å; K85-F427 HydrophobicContact CD-CD1 4.26Å; K85-G428 CarbonylContact C-O 3.57Å; K85-G428 VanDerWaalsContact CA-O 3.3Å; K85-G428 WeakPolarHBondContact CA-O 3.26Å; K85-H429 VanDerWaalsContact CE-CE1 3.46Å; K85-H429 WeakPolarHBondContact CE-CE1 3.5Å
86	T	78.8	Confident	79	Confident	22 Å²	22	77.4 Å²	77.4	14%	0.135	42%	0.419	C	S	.	.			trans	-69.4	160.2	-178.8	52.3	0	0	0	0	113.4	D88 V89 T90 G428 L430	T86-D88 WeakPolarHBondContact CB-OD1 3.22Å; T86-D88 PolarHBondContact O-N 3.49Å; T86-D88 VanDerWaalsContact O-N 3.13Å; T86-D88 PolarHBondContact OG1-OD1 3.25Å; T86-V89 WeakPolarHBondContact O-CG2 3.45Å; T86-V89 PolarHBondContact O-N 2.92Å; T86-T90 PolarHBondContact O-N 2.96Å; T86-T90 PolarHBondContact O-OG1 3.19Å; T86-G428 WeakPolarHBondContact CG2-O 3.49Å; T86-G428 PolarHBondContact N-O 2.95Å; T86-G428 WeakPolarHBondContact OG1-CA 3.44Å; T86-G428 PolarHBondContact OG1-O 2.74Å; T86-L430 HydrophobicContact CG2-CD2 4.38Å
87	S	78.4	Confident	79.6	Confident	67 Å²	67	68.7 Å²	68.7	47%	0.469	38%	0.381	S	S	.	.	H	α-helix	trans	-55.7	-30.9	-176.9	48.3	0	0	0	0	114.3	V89 T90 A91	S87-V89 PolarHBondContact O-N 2.96Å; S87-V89 VanDerWaalsContact O-N 3.08Å; S87-T90 WeakPolarHBondContact CA-OG1 3.44Å; S87-T90 PolarHBondContact O-N 3.44Å; S87-A91 WeakPolarHBondContact O-CB 3.3Å; S87-A91 PolarHBondContact O-N 3.19Å
88	D	71.4	Confident	80	Confident	32 Å²	32	68 Å²	68	17%	0.171	38%	0.375	C	S	.	.	H	α-helix	trans	-66	-7.4	177.2	61.6	-97.3	0	0	0	115.5	T86 K140	T86-D88 WeakPolarHBondContact CB-OD1 3.22Å; T86-D88 PolarHBondContact O-N 3.49Å; T86-D88 VanDerWaalsContact O-N 3.13Å; T86-D88 PolarHBondContact OG1-OD1 3.25Å; D88-K140 IonicContact OD1-NZ 2.8Å; D88-K140 PolarHBondContact OD1-NZ 3.05Å; D88-K140 WeakPolarHBondContact OD2-CE 3.42Å; D88-K140 IonicContact OD2-NZ 3.57Å; D88-K140 PolarHBondContact OD2-NZ 3.16Å
89	V	73.8	Confident	80.5	Confident	8 Å²	8	69.7 Å²	69.7	5%	0.048	38%	0.382	C	S	.	.	H	α-helix	trans	-121.9	-9.1	168.4	-64.7	0	0	0	0	114.2	K85 T86 S87 T143	K85-V89 HydrophobicContact CB-CG2 3.89Å; T86-V89 WeakPolarHBondContact O-CG2 3.45Å; T86-V89 PolarHBondContact O-N 2.92Å; S87-V89 PolarHBondContact O-N 2.96Å; S87-V89 VanDerWaalsContact O-N 3.08Å; V89-T143 HydrophobicContact CG1-CG2 4.15Å
90	T	79.1	Confident	81.2	Confident	75 Å²	75	64.9 Å²	64.9	46%	0.46	35%	0.347	S	S	.	.	H	α-helix	trans	-115	-19.4	-178	56.2	0	0	0	0	115.1	K85 T86 S87 T92	K85-T90 HydrophobicContact CB-CG2 3.68Å; T86-T90 PolarHBondContact O-N 2.96Å; T86-T90 PolarHBondContact O-OG1 3.19Å; S87-T90 WeakPolarHBondContact CA-OG1 3.44Å; S87-T90 PolarHBondContact O-N 3.44Å; T90-T92 PolarHBondContact O-N 3.13Å
91	A	77.6	Confident	82	Confident	66 Å²	66	64 Å²	64	55%	0.545	36%	0.357	S	S	.	.			trans	-78.7	65.2	178.3	0	0	0	0	0	111.4	S87	S87-A91 WeakPolarHBondContact O-CB 3.3Å; S87-A91 PolarHBondContact O-N 3.19Å
92	T	78.9	Confident	83	Confident	42 Å²	42	62.2 Å²	62.2	26%	0.258	35%	0.347	S	S	.	.			trans	-82	158.6	175.2	63.3	0	0	0	0	111.1	T90 G94 P118 P120 E123	T90-T92 PolarHBondContact O-N 3.13Å; T92-G94 PolarHBondContact O-N 3.4Å; T92-P118 WeakPolarHBondContact CG2-O 3.3Å; T92-P120 HydrophobicContact CG2-CG 4.44Å; T92-E123 WeakPolarHBondContact CA-OE2 3.33Å; T92-E123 WeakPolarHBondContact CB-OE2 3.44Å
93	K	80.9	Confident	83.8	Confident	136 Å²	136	58 Å²	58	59%	0.591	32%	0.324	S	S	*	.			trans	-77.9	-5	172.9	-53.8	173.5	-175.2	175.4	0	112.4	E123 E124	K93-E123 WeakPolarHBondContact CA-OE1 3.49Å; K93-E123 WeakPolarHBondContact CB-OE1 3.38Å; K93-E123 VanDerWaalsContact N-CD 3.27Å; K93-E123 PolarHBondContact N-OE1 2.83Å; K93-E123 PolarHBondContact N-OE2 2.87Å; K93-E124 WeakPolarHBondContact CE-OE1 3.42Å; K93-E124 IonicContact NZ-OE1 3.16Å; K93-E124 PolarHBondContact NZ-OE1 3.26Å; K93-E124 IonicContact NZ-OE2 3.51Å; K93-E124 PolarHBondContact NZ-OE2 3.17Å
94	G	77.6	Confident	84.6	Confident	47 Å²	47	58.4 Å²	58.4	49%	0.485	33%	0.326	S	S	.	.	S	Bend	trans	106.3	1.4	174.3	0	0	0	0	0	115.2	T92 E123	T92-G94 PolarHBondContact O-N 3.4Å; G94-E123 PolarHBondContact N-OE1 2.95Å
95	N	85.1	Confident	85.3	Confident	59 Å²	59	58.1 Å²	58.1	32%	0.316	32%	0.323	S	S	.	.			trans	-69.9	150.1	-179.9	-57.7	-79.3	0	0	0	112	D99 P118 E123	N95-D99 WeakPolarHBondContact CA-OD2 3.5Å; N95-P118 VanDerWaalsContact O-CD 3.32Å; N95-P118 WeakPolarHBondContact O-CD 3.46Å; N95-P118 VanDerWaalsContact O-CG 3.3Å; N95-P118 WeakPolarHBondContact O-CG 3.49Å; N95-E123 PolarHBondContact N-OE1 3.36Å; N95-E123 PolarHBondContact ND2-OE1 3.34Å
96	E	90	Very high	86.1	Confident	71 Å²	71	55.1 Å²	55.1	33%	0.332	31%	0.31	S	S	.	.			trans	-101.2	163.5	169.2	-56	-66.5	-174.5	0	0	110.6	E98 D99 K117	E96-E98 PolarHBondContact O-N 3.13Å; E96-E98 VanDerWaalsContact O-N 3.15Å; E96-D99 PolarHBondContact N-OD2 3.23Å; E96-D99 PolarHBondContact O-N 3.06Å; E96-K117 IonicContact OE1-NZ 2.65Å; E96-K117 PolarHBondContact OE1-NZ 3.36Å; E96-K117 WeakPolarHBondContact OE2-CG 3.34Å; E96-K117 IonicContact OE2-NZ 3.97Å; E96-K117 PolarHBondContact OE2-NZ 2.7Å
97	F	92.4	Very high	86.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-62.1	-22.4	175.5	-77.9	-68.9	0	0	0	114.1	D99 Y100 L107 I110 W115 K117 P118 I126 I151	F97-D99 VanDerWaalsContact C-N 3.35Å; F97-Y100 HydrophobicContact CD1-CD2 4.17Å; F97-Y100 HydrophobicContact CD1-CE2 4.04Å; F97-L107 HydrophobicContact CB-CD2 3.95Å; F97-L107 WeakPolarHBondContact O-CD2 3.44Å; F97-I110 HydrophobicContact CB-CG2 4.4Å; F97-I110 HydrophobicContact CD1-CD1 4.34Å; F97-I110 HydrophobicContact CD1-CG2 4.08Å; F97-I110 HydrophobicContact CD2-CG2 3.55Å; F97-I110 HydrophobicContact CE1-CG2 4.18Å; F97-I110 HydrophobicContact CE2-CG2 3.66Å; F97-I110 HydrophobicContact CG-CG2 3.76Å; F97-I110 HydrophobicContact CZ-CG2 3.97Å; F97-W115 WeakPolarHBondContact CD2-O 3.43Å; F97-W115 HydrophobicContact CE2-CB 3.8Å; F97-W115 WeakPolarHBondContact CE2-O 3.18Å; F97-W115 HydrophobicContact CZ-CB 4.14Å; F97-K117 WeakPolarHBondContact CE2-O 3.28Å; F97-P118 HydrophobicContact CD1-CB 4.35Å; F97-P118 HydrophobicContact CE1-CB 3.91Å; F97-P118 HydrophobicContact CE2-CB 4.48Å; F97-P118 VanDerWaalsContact CZ-CA 3.48Å; F97-P118 HydrophobicContact CZ-CB 4Å; F97-I126 HydrophobicContact CD1-CD1 4.45Å; F97-I126 HydrophobicContact CE1-CD1 4.04Å; F97-I151 HydrophobicContact CD1-CD1 4.23Å; F97-I151 HydrophobicContact CE1-CD1 3.61Å; F97-I151 HydrophobicContact CZ-CD1 4.36Å
98	E	90.6	Very high	87.5	Confident	73 Å²	73	52.5 Å²	52.5	34%	0.341	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-73.8	-27	-179.3	-63.3	-180	131.1	0	0	112.2	W71 K72 E96 Y100 C101 L107 F111	W71-E98 VanDerWaalsContact CZ2-OE1 3.3Å; W71-E98 WeakPolarHBondContact CZ2-OE1 3.41Å; K72-E98 WeakPolarHBondContact CE-OE1 3.44Å; K72-E98 IonicContact NZ-OE1 3.41Å; K72-E98 PolarHBondContact NZ-OE1 2.84Å; K72-E98 IonicContact NZ-OE2 3.41Å; K72-E98 PolarHBondContact NZ-OE2 3.47Å; E96-E98 PolarHBondContact O-N 3.13Å; E96-E98 VanDerWaalsContact O-N 3.15Å; E98-Y100 PolarHBondContact O-N 2.93Å; E98-C101 PolarHBondContact O-N 3.17Å; E98-L107 HydrophobicContact CG-CD1 4.27Å; E98-L107 HydrophobicContact CG-CD2 4.45Å; E98-F111 HydrophobicContact CG-CE2 4.5Å
99	D	91.8	Very high	88.6	Confident	95 Å²	95	51 Å²	51	51%	0.508	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-67	-19.8	179.4	-58.7	-37.5	0	0	0	112.8	N95 E96 F97 C101	N95-D99 WeakPolarHBondContact CA-OD2 3.5Å; E96-D99 PolarHBondContact N-OD2 3.23Å; E96-D99 PolarHBondContact O-N 3.06Å; F97-D99 VanDerWaalsContact C-N 3.35Å; D99-C101 PolarHBondContact O-N 3.43Å
100	Y	93.3	Very high	89.6	Confident	25 Å²	25	50.6 Å²	50.6	10%	0.098	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-79.2	2.4	176.8	-53.4	-48.2	0	0	0	113.9	F97 E98 L102 P118 E123 I126 P127	F97-Y100 HydrophobicContact CD1-CD2 4.17Å; F97-Y100 HydrophobicContact CD1-CE2 4.04Å; E98-Y100 PolarHBondContact O-N 2.93Å; Y100-L102 PolarHBondContact O-N 3.44Å; Y100-P118 HydrophobicContact CE2-CB 4.14Å; Y100-P118 HydrophobicContact CE2-CG 4.17Å; Y100-P118 WeakPolarHBondContact OH-CG 3Å; Y100-E123 WeakPolarHBondContact OH-CA 3.43Å; Y100-I126 HydrophobicContact CD1-CG2 4.26Å; Y100-I126 HydrophobicContact CD2-CD1 4.35Å; Y100-I126 HydrophobicContact CD2-CG2 3.92Å; Y100-I126 HydrophobicContact CE2-CD1 4.16Å; Y100-I126 HydrophobicContact CE2-CG2 4.46Å; Y100-I126 HydrophobicContact CG-CG2 3.83Å; Y100-P127 HydrophobicContact CE1-CG 4.34Å
101	C	93.6	Very high	90.1	Very high	117 Å²	117	48.1 Å²	48.1	79%	0.791	26%	0.262	S	S	*	.			trans	53.4	36.1	176.7	-66.4	0	0	0	0	114.3	E98 D99	E98-C101 PolarHBondContact O-N 3.17Å; D99-C101 PolarHBondContact O-N 3.43Å
102	L	95.5	Very high	90.7	Very high	14 Å²	14	46.9 Å²	46.9	7%	0.073	25%	0.245	C	C	.	.			trans	-70.4	158.4	179.9	-60.6	171.5	0	0	0	112.1	Y100 R104 L106 L107 I110 L130 I151 E155	Y100-L102 PolarHBondContact O-N 3.44Å; L102-R104 PolarHBondContact O-N 2.98Å; L102-L106 HydrophobicContact CB-CD2 4.47Å; L102-L106 HydrophobicContact CD2-CD2 4.21Å; L102-L107 HydrophobicContact CB-CD2 4.13Å; L102-L107 HydrophobicContact CB-CG 4.04Å; L102-L107 HydrophobicContact CD1-CD2 3.92Å; L102-I110 HydrophobicContact CD1-CD1 3.84Å; L102-L130 HydrophobicContact CD2-CD1 3.93Å; L102-L130 HydrophobicContact CD2-CD2 4.35Å; L102-I151 HydrophobicContact CD1-CG2 3.53Å; L102-I151 HydrophobicContact CD2-CG2 3.94Å; L102-I151 HydrophobicContact CG-CG2 4.41Å; L102-E155 HydrophobicContact CD2-CB 4.08Å; L102-E155 HydrophobicContact CD2-CG 3.95Å
103	K	94.8	Very high	91.1	Very high	73 Å²	73	47.5 Å²	47.5	32%	0.317	25%	0.245	S	C	.	.			trans	-51.5	132	165.9	-73.2	156.6	-177.6	148.6	0	110	E105 L106 L107 E155 I157 M190	K103-E105 PolarHBondContact O-N 3.06Å; K103-E105 VanDerWaalsContact O-N 3.17Å; K103-L106 HydrophobicContact CB-CB 4.21Å; K103-L106 WeakPolarHBondContact O-CA 3.41Å; K103-L106 WeakPolarHBondContact O-CB 3.36Å; K103-L106 PolarHBondContact O-N 2.85Å; K103-L107 PolarHBondContact O-N 3.2Å; K103-E155 WeakPolarHBondContact CB-OE2 3.09Å; K103-E155 VanDerWaalsContact CD-OE1 3.26Å; K103-E155 WeakPolarHBondContact CD-OE1 3.26Å; K103-E155 WeakPolarHBondContact CD-OE2 3.5Å; K103-E155 WeakPolarHBondContact CE-OE1 3.44Å; K103-E155 WeakPolarHBondContact CG-OE1 3.3Å; K103-E155 VanDerWaalsContact CG-OE2 3.28Å; K103-E155 WeakPolarHBondContact CG-OE2 2.98Å; K103-E155 PolarHBondContact N-OE2 3.06Å; K103-E155 PolarHBondContact NZ-O 3.19Å; K103-E155 IonicContact NZ-OE1 3.93Å; K103-E155 PolarHBondContact NZ-OE1 3.49Å; K103-I157 PolarHBondContact NZ-O 2.86Å; K103-M190 HydrophobicContact CD-CE 3.94Å
104	R	93.6	Very high	91.4	Very high	70 Å²	70	42.6 Å²	42.6	26%	0.264	23%	0.233	S	C	.	.	H	α-helix	trans	-56.7	-36.6	179.9	-177	-172.5	61.7	175.6	-2.6	111.9	I65 W71 L102 L106 L107 M108	I65-R104 PolarHBondContact O-NH1 3.27Å; I65-R104 PolarHBondContact O-NH2 2.78Å; W71-R104 HydrophobicContact CD2-CG 4.44Å; L102-R104 PolarHBondContact O-N 2.98Å; R104-L106 PolarHBondContact O-N 2.71Å; R104-L107 WeakPolarHBondContact O-CB 3.2Å; R104-L107 PolarHBondContact O-N 3.32Å; R104-L107 VanDerWaalsContact O-N 3.17Å; R104-M108 HydrophobicContact CG-SD 4.48Å; R104-M108 WeakPolarHBondContact O-CG 3.31Å; R104-M108 PolarHBondContact O-N 2.7Å
105	E	94.4	Very high	92	Very high	65 Å²	65	42.5 Å²	42.5	30%	0.304	22%	0.218	S	C	.	.	H	α-helix	trans	-67.4	-26.6	179.8	-64.3	63.2	-136.4	0	0	111.9	K103 H189 M190	K103-E105 PolarHBondContact O-N 3.06Å; K103-E105 VanDerWaalsContact O-N 3.17Å; E105-H189 HydrophobicContact CB-CB 4.38Å; E105-H189 WeakPolarHBondContact O-CB 3.43Å; E105-M190 HydrophobicContact CB-CG 4.27Å
106	L	95.9	Very high	91.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-78.3	-42	170.6	177.8	57.6	0	0	0	110.9	L102 K103 R104 M108 G109 I110 I151 L154 E155 V186 M190	L102-L106 HydrophobicContact CB-CD2 4.47Å; L102-L106 HydrophobicContact CD2-CD2 4.21Å; K103-L106 HydrophobicContact CB-CB 4.21Å; K103-L106 WeakPolarHBondContact O-CA 3.41Å; K103-L106 WeakPolarHBondContact O-CB 3.36Å; K103-L106 PolarHBondContact O-N 2.85Å; R104-L106 PolarHBondContact O-N 2.71Å; L106-M108 VanDerWaalsContact C-N 3.31Å; L106-M108 PolarHBondContact O-N 2.91Å; L106-G109 PolarHBondContact O-N 2.87Å; L106-G109 VanDerWaalsContact O-N 3.13Å; L106-I110 HydrophobicContact CG-CD1 4.17Å; L106-I110 WeakPolarHBondContact O-CG1 3.38Å; L106-I110 PolarHBondContact O-N 3.15Å; L106-I151 HydrophobicContact CD2-CG2 4.28Å; L106-I151 WeakPolarHBondContact CD2-O 3.19Å; L106-L154 HydrophobicContact CD1-CB 3.94Å; L106-L154 HydrophobicContact CD1-CD1 3.94Å; L106-L154 HydrophobicContact CD2-CB 4.27Å; L106-E155 HydrophobicContact CD2-CB 3.91Å; L106-V186 HydrophobicContact CD1-CG1 3.52Å; L106-M190 HydrophobicContact CB-CE 4.32Å; L106-M190 HydrophobicContact CB-CG 4.49Å; L106-M190 HydrophobicContact CB-SD 4.14Å; L106-M190 HydrophobicContact CD1-SD 4.03Å
107	L	94.9	Very high	91.7	Very high	13 Å²	13	45 Å²	45	7%	0.068	23%	0.227	C	C	.	.	H	α-helix	trans	-57.6	-42	173.1	-67.4	170	0	0	0	112.1	W71 F97 E98 L102 K103 R104 G109 I110 F111	W71-L107 HydrophobicContact CH2-CB 3.71Å; W71-L107 HydrophobicContact CZ2-CB 4.3Å; W71-L107 HydrophobicContact CZ3-CB 4.38Å; F97-L107 HydrophobicContact CB-CD2 3.95Å; F97-L107 WeakPolarHBondContact O-CD2 3.44Å; E98-L107 HydrophobicContact CG-CD1 4.27Å; E98-L107 HydrophobicContact CG-CD2 4.45Å; L102-L107 HydrophobicContact CB-CD2 4.13Å; L102-L107 HydrophobicContact CB-CG 4.04Å; L102-L107 HydrophobicContact CD1-CD2 3.92Å; K103-L107 PolarHBondContact O-N 3.2Å; R104-L107 WeakPolarHBondContact O-CB 3.2Å; R104-L107 PolarHBondContact O-N 3.32Å; R104-L107 VanDerWaalsContact O-N 3.17Å; L107-G109 VanDerWaalsContact C-N 3.28Å; L107-G109 PolarHBondContact O-N 3.28Å; L107-I110 HydrophobicContact CD2-CD1 4.42Å; L107-I110 WeakPolarHBondContact O-CB 3.43Å; L107-I110 PolarHBondContact O-N 3.48Å; L107-I110 VanDerWaalsContact O-N 3.15Å; L107-F111 WeakPolarHBondContact O-CD2 3.47Å; L107-F111 PolarHBondContact O-N 2.78Å
108	M	93.3	Very high	91.7	Very high	21 Å²	21	45.1 Å²	45.1	10%	0.103	23%	0.227	C	C	.	.	H	α-helix	trans	-57.1	-39.5	175.1	-71.8	172.5	66.5	0	0	112.8	I65 W71 L75 R104 L106 E112 H189	I65-M108 HydrophobicContact CD1-CE 4.36Å; W71-M108 HydrophobicContact CD2-CG 4.4Å; W71-M108 HydrophobicContact CE3-CG 3.56Å; W71-M108 HydrophobicContact CZ3-CB 4.48Å; W71-M108 HydrophobicContact CZ3-CG 3.82Å; L75-M108 HydrophobicContact CD2-CB 4.22Å; L75-M108 HydrophobicContact CD2-CE 4.13Å; L75-M108 HydrophobicContact CD2-CG 4.23Å; R104-M108 HydrophobicContact CG-SD 4.48Å; R104-M108 WeakPolarHBondContact O-CG 3.31Å; R104-M108 PolarHBondContact O-N 2.7Å; L106-M108 VanDerWaalsContact C-N 3.31Å; L106-M108 PolarHBondContact O-N 2.91Å; M108-E112 PolarHBondContact O-N 3.09Å; M108-E112 VanDerWaalsContact O-N 3.13Å; M108-H189 HydrophobicContact CB-CB 4.22Å; M108-H189 HydrophobicContact CE-CB 4.38Å
109	G	94.2	Very high	91.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-72.6	-34.5	175.7	0	0	0	0	0	113.6	L106 L107 M113	L106-G109 PolarHBondContact O-N 2.87Å; L106-G109 VanDerWaalsContact O-N 3.13Å; L107-G109 VanDerWaalsContact C-N 3.28Å; L107-G109 PolarHBondContact O-N 3.28Å; G109-M113 VanDerWaalsContact O-CG 3.3Å; G109-M113 WeakPolarHBondContact O-CG 3.47Å; G109-M113 PolarHBondContact O-N 2.9Å; G109-M113 VanDerWaalsContact O-N 3.16Å
110	I	93.6	Very high	91.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-48.2	174.3	-69.1	166.2	0	0	0	110.6	F97 L102 L106 L107 M113 W115 I151 V186	F97-I110 HydrophobicContact CB-CG2 4.4Å; F97-I110 HydrophobicContact CD1-CD1 4.34Å; F97-I110 HydrophobicContact CD1-CG2 4.08Å; F97-I110 HydrophobicContact CD2-CG2 3.55Å; F97-I110 HydrophobicContact CE1-CG2 4.18Å; F97-I110 HydrophobicContact CE2-CG2 3.66Å; F97-I110 HydrophobicContact CG-CG2 3.76Å; F97-I110 HydrophobicContact CZ-CG2 3.97Å; L102-I110 HydrophobicContact CD1-CD1 3.84Å; L106-I110 HydrophobicContact CG-CD1 4.17Å; L106-I110 WeakPolarHBondContact O-CG1 3.38Å; L106-I110 PolarHBondContact O-N 3.15Å; L107-I110 HydrophobicContact CD2-CD1 4.42Å; L107-I110 WeakPolarHBondContact O-CB 3.43Å; L107-I110 PolarHBondContact O-N 3.48Å; L107-I110 VanDerWaalsContact O-N 3.15Å; I110-M113 WeakPolarHBondContact O-CB 3.25Å; I110-M113 PolarHBondContact O-N 3.34Å; I110-W115 HydrophobicContact CG2-CB 3.91Å; I110-W115 HydrophobicContact CG2-CE3 4.32Å; I110-W115 WeakPolarHBondContact O-CB 3.33Å; I110-W115 PolarHBondContact O-N 3.3Å; I110-I151 HydrophobicContact CD1-CD1 3.7Å; I110-I151 HydrophobicContact CD1-CG1 3.84Å; I110-I151 HydrophobicContact CD1-CG2 4.1Å; I110-I151 HydrophobicContact CG1-CD1 4Å; I110-I151 HydrophobicContact CG1-CG1 4.14Å; I110-V186 HydrophobicContact CG1-CG1 4.2Å
111	F	90.3	Very high	91.4	Very high	24 Å²	24	36.7 Å²	36.7	11%	0.105	19%	0.187	C	C	.	.	H	α-helix	trans	-70.5	-36.8	179.7	-78.3	-75.1	0	0	0	113.2	W71 L75 L77 E98 L107 M113 G114	W71-F111 AromaticContact CH2-CD2 3.56Å; W71-F111 HydrophobicContact CH2-CD2 3.56Å; W71-F111 AromaticContact CH2-CE2 3.75Å; W71-F111 HydrophobicContact CH2-CE2 3.75Å; W71-F111 AromaticContact CZ3-CD2 3.85Å; W71-F111 HydrophobicContact CZ3-CD2 3.85Å; W71-F111 HydrophobicContact CZ3-CE2 4.48Å; L75-F111 HydrophobicContact CD1-CB 3.56Å; L77-F111 HydrophobicContact CD2-CB 4.05Å; L77-F111 VanDerWaalsContact CD2-O 3.3Å; L77-F111 WeakPolarHBondContact CD2-O 3.07Å; E98-F111 HydrophobicContact CG-CE2 4.5Å; L107-F111 WeakPolarHBondContact O-CD2 3.47Å; L107-F111 PolarHBondContact O-N 2.78Å; F111-M113 PolarHBondContact O-N 3.06Å; F111-G114 PolarHBondContact O-N 3.18Å
112	E	90.8	Very high	91.4	Very high	39 Å²	39	31.2 Å²	31.2	18%	0.182	15%	0.15	C	C	.	.	H	α-helix	trans	-65.9	-22.8	172.2	-81.4	-167.3	147	0	0	113.7	L75 M108 G114 K188 H189	L75-E112 HydrophobicContact CB-CG 4.24Å; L75-E112 HydrophobicContact CD2-CG 4.22Å; M108-E112 PolarHBondContact O-N 3.09Å; M108-E112 VanDerWaalsContact O-N 3.13Å; E112-G114 PolarHBondContact O-N 3.05Å; E112-K188 VanDerWaalsContact CD-NZ 3.3Å; E112-K188 IonicContact OE1-NZ 2.73Å; E112-K188 PolarHBondContact OE1-NZ 3.49Å; E112-K188 WeakPolarHBondContact OE2-CD 3.48Å; E112-K188 WeakPolarHBondContact OE2-CE 3.4Å; E112-K188 IonicContact OE2-NZ 2.66Å; E112-K188 PolarHBondContact OE2-NZ 2.85Å; E112-H189 VanDerWaalsContact CD-NE2 3.33Å; E112-H189 IonicContact OE1-CE1 2.67Å; E112-H189 IonicContact OE1-NE2 2.69Å; E112-H189 IonicContact OE2-CD2 2.8Å; E112-H189 IonicContact OE2-CE1 3.47Å; E112-H189 PolarHBondContact OE2-CE1 2.95Å; E112-H189 IonicContact OE2-NE2 3.33Å; E112-H189 PolarHBondContact OE2-NE2 3.31Å
113	M	87.4	Confident	91.3	Very high	55 Å²	55	30.9 Å²	30.9	27%	0.271	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-2.1	169.3	-75.4	-72.8	-65.6	0	0	113.5	G109 I110 F111 W115 I182 Q185 V186	G109-M113 VanDerWaalsContact O-CG 3.3Å; G109-M113 WeakPolarHBondContact O-CG 3.47Å; G109-M113 PolarHBondContact O-N 2.9Å; G109-M113 VanDerWaalsContact O-N 3.16Å; I110-M113 WeakPolarHBondContact O-CB 3.25Å; I110-M113 PolarHBondContact O-N 3.34Å; F111-M113 PolarHBondContact O-N 3.06Å; M113-W115 VanDerWaalsContact C-N 3.3Å; M113-W115 HydrophobicContact CB-CD2 3.99Å; M113-W115 HydrophobicContact CB-CG 4.11Å; M113-W115 HydrophobicContact CB-CZ2 4.44Å; M113-W115 HydrophobicContact CE-CH2 4.3Å; M113-W115 HydrophobicContact CE-CZ2 3.59Å; M113-I182 HydrophobicContact CE-CG1 4.47Å; M113-I182 HydrophobicContact CE-CG2 4.18Å; M113-Q185 HydrophobicContact CG-CB 4.3Å; M113-Q185 HydrophobicContact SD-CB 3.51Å; M113-Q185 VanDerWaalsContact SD-CB 3.51Å; M113-Q185 HydrophobicContact SD-CG 4.19Å; M113-V186 HydrophobicContact CG-CG2 3.85Å
114	G	87	Confident	91.2	Very high	33 Å²	33	29.5 Å²	29.5	34%	0.34	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	15.5	-176.2	0	0	0	0	0	114	P78 F111 E112 E116	P78-G114 VanDerWaalsContact CG-CA 3.4Å; F111-G114 PolarHBondContact O-N 3.18Å; E112-G114 PolarHBondContact O-N 3.05Å; G114-E116 PolarHBondContact O-N 3.06Å; G114-E116 VanDerWaalsContact O-N 3.16Å
115	W	88.8	Confident	91.3	Very high	46 Å²	46	26.1 Å²	26.1	17%	0.174	13%	0.13	C	C	.	.			trans	-86.9	82.8	179.4	-58.1	-8.5	0	0	0	108.9	F97 I110 M113 I151 I182 V186	F97-W115 WeakPolarHBondContact CD2-O 3.43Å; F97-W115 HydrophobicContact CE2-CB 3.8Å; F97-W115 WeakPolarHBondContact CE2-O 3.18Å; F97-W115 HydrophobicContact CZ-CB 4.14Å; I110-W115 HydrophobicContact CG2-CB 3.91Å; I110-W115 HydrophobicContact CG2-CE3 4.32Å; I110-W115 WeakPolarHBondContact O-CB 3.33Å; I110-W115 PolarHBondContact O-N 3.3Å; M113-W115 VanDerWaalsContact C-N 3.3Å; M113-W115 HydrophobicContact CB-CD2 3.99Å; M113-W115 HydrophobicContact CB-CG 4.11Å; M113-W115 HydrophobicContact CB-CZ2 4.44Å; M113-W115 HydrophobicContact CE-CH2 4.3Å; M113-W115 HydrophobicContact CE-CZ2 3.59Å; W115-I151 HydrophobicContact CE3-CD1 4.28Å; W115-I151 HydrophobicContact CZ3-CD1 4.17Å; W115-I182 HydrophobicContact CH2-CG2 3.71Å; W115-I182 HydrophobicContact CZ2-CG2 4.08Å; W115-V186 HydrophobicContact CH2-CG2 3.79Å; W115-V186 HydrophobicContact CZ3-CG2 3.76Å
116	E	82.5	Confident	91.4	Very high	85 Å²	85	23 Å²	23	40%	0.397	12%	0.115	S	C	.	.			trans	-70	-37.9	-178.5	-60	-171.5	161.2	0	0	112.5	K80 G114	K80-E116 IonicContact NZ-OE1 2.98Å; K80-E116 PolarHBondContact NZ-OE1 3.08Å; K80-E116 IonicContact NZ-OE2 3.79Å; K80-E116 PolarHBondContact NZ-OE2 2.63Å; G114-E116 PolarHBondContact O-N 3.06Å; G114-E116 VanDerWaalsContact O-N 3.16Å
117	K	86.9	Confident	91.5	Very high	98 Å²	98	25.7 Å²	25.7	43%	0.426	13%	0.132	S	C	.	.	S	Bend	trans	-131.2	147.2	-178.9	-71.8	-171.8	165.1	-65.9	0	111.2	E96 F97	E96-K117 IonicContact OE1-NZ 2.65Å; E96-K117 PolarHBondContact OE1-NZ 3.36Å; E96-K117 WeakPolarHBondContact OE2-CG 3.34Å; E96-K117 IonicContact OE2-NZ 3.97Å; E96-K117 PolarHBondContact OE2-NZ 2.7Å; F97-K117 WeakPolarHBondContact CE2-O 3.28Å
118	P	91.7	Very high	91.6	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.013	14%	0.139	C	C	.	.			trans	-64.3	140.7	170.8	28	-34	0	0	0	110.7	T92 N95 F97 Y100 Q122 E123	T92-P118 WeakPolarHBondContact CG2-O 3.3Å; N95-P118 VanDerWaalsContact O-CD 3.32Å; N95-P118 WeakPolarHBondContact O-CD 3.46Å; N95-P118 VanDerWaalsContact O-CG 3.3Å; N95-P118 WeakPolarHBondContact O-CG 3.49Å; F97-P118 HydrophobicContact CD1-CB 4.35Å; F97-P118 HydrophobicContact CE1-CB 3.91Å; F97-P118 HydrophobicContact CE2-CB 4.48Å; F97-P118 VanDerWaalsContact CZ-CA 3.48Å; F97-P118 HydrophobicContact CZ-CB 4Å; Y100-P118 HydrophobicContact CE2-CB 4.14Å; Y100-P118 HydrophobicContact CE2-CG 4.17Å; Y100-P118 WeakPolarHBondContact OH-CG 3Å; P118-Q122 HydrophobicContact CB-CB 3.99Å; P118-E123 HydrophobicContact CB-CB 4.42Å
119	S	90.1	Very high	91.8	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.007	13%	0.134	C	C	.	.			trans	-76.9	163	165.2	71.3	0	0	0	0	110.7	I121 Q122 E123 T143	S119-I121 PolarHBondContact O-N 3.02Å; S119-I121 VanDerWaalsContact O-N 3.12Å; S119-I121 WeakPolarHBondContact OG-CG2 3.48Å; S119-Q122 CarbonylContact O-C 3.58Å; S119-Q122 WeakPolarHBondContact O-CA 3.42Å; S119-Q122 VanDerWaalsContact O-CB 3.3Å; S119-Q122 WeakPolarHBondContact O-CB 3.3Å; S119-Q122 PolarHBondContact O-N 3.24Å; S119-Q122 WeakPolarHBondContact OG-CG 3.39Å; S119-E123 PolarHBondContact O-N 3.28Å; S119-T143 WeakPolarHBondContact CB-O 3.28Å; S119-T143 PolarHBondContact OG-O 3.25Å
120	P	89.5	Confident	91.9	Very high	12 Å²	12	27.4 Å²	27.4	8%	0.078	14%	0.142	C	C	.	.	H	α-helix	trans	-56.5	-33.9	-177.2	-28.7	37.5	0	0	0	114.3	T92 Q122 E123 E124 L299	T92-P120 HydrophobicContact CG2-CG 4.44Å; P120-Q122 VanDerWaalsContact C-N 3.33Å; P120-Q122 PolarHBondContact O-N 3.29Å; P120-E123 PolarHBondContact O-N 2.69Å; P120-E124 WeakPolarHBondContact O-CG 3.48Å; P120-E124 PolarHBondContact O-N 3.33Å; P120-L299 HydrophobicContact CB-CD1 4.24Å
121	I	90.8	Very high	92	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.015	17%	0.167	C	C	.	.	H	α-helix	trans	-71.5	-26.1	174.1	-176	56	0	0	0	113	S119 S125 A137 A139 T143 K145 A148 Y275 I297 L299	S119-I121 PolarHBondContact O-N 3.02Å; S119-I121 VanDerWaalsContact O-N 3.12Å; S119-I121 WeakPolarHBondContact OG-CG2 3.48Å; I121-S125 WeakPolarHBondContact O-CB 3.44Å; I121-S125 PolarHBondContact O-N 3.25Å; I121-A137 HydrophobicContact CD1-CB 4.07Å; I121-A139 HydrophobicContact CB-CB 4.46Å; I121-A139 HydrophobicContact CD1-CB 4.02Å; I121-A139 HydrophobicContact CG1-CB 3.94Å; I121-T143 WeakPolarHBondContact CG2-O 3.33Å; I121-K145 HydrophobicContact CG1-CG 4.35Å; I121-A148 HydrophobicContact CG1-CB 4.25Å; I121-A148 WeakPolarHBondContact O-CB 3.32Å; I121-Y275 HydrophobicContact CD1-CE1 4.27Å; I121-Y275 HydrophobicContact CG1-CE1 4.37Å; I121-I297 HydrophobicContact CD1-CG2 3.92Å; I121-L299 VanDerWaalsContact CA-CD1 3.45Å; I121-L299 HydrophobicContact CB-CD1 3.74Å; I121-L299 HydrophobicContact CD1-CD1 4.03Å; I121-L299 HydrophobicContact CG1-CD1 4.46Å
122	Q	93.8	Very high	92.3	Very high	2 Å²	2	32 Å²	32	1%	0.009	18%	0.184	C	C	.	.	H	α-helix	trans	-76.7	-42.7	172	-66.1	169.4	-8.8	0	0	109.9	P118 S119 P120 S125 I126 G144 A148	P118-Q122 HydrophobicContact CB-CB 3.99Å; S119-Q122 CarbonylContact O-C 3.58Å; S119-Q122 WeakPolarHBondContact O-CA 3.42Å; S119-Q122 VanDerWaalsContact O-CB 3.3Å; S119-Q122 WeakPolarHBondContact O-CB 3.3Å; S119-Q122 PolarHBondContact O-N 3.24Å; S119-Q122 WeakPolarHBondContact OG-CG 3.39Å; P120-Q122 VanDerWaalsContact C-N 3.33Å; P120-Q122 PolarHBondContact O-N 3.29Å; Q122-S125 PolarHBondContact O-N 3.09Å; Q122-I126 HydrophobicContact CB-CD1 3.78Å; Q122-I126 HydrophobicContact CB-CG1 4.43Å; Q122-I126 VanDerWaalsContact O-CB 3.27Å; Q122-I126 WeakPolarHBondContact O-CB 3.22Å; Q122-I126 WeakPolarHBondContact O-CG1 3.28Å; Q122-I126 PolarHBondContact O-N 2.98Å; Q122-G144 PolarHBondContact NE2-O 3.32Å; Q122-A148 HydrophobicContact CB-CB 4.38Å; Q122-A148 HydrophobicContact CG-CB 3.78Å
123	E	93.4	Very high	92.6	Very high	7 Å²	7	35.2 Å²	35.2	3%	0.033	19%	0.194	C	C	.	.	H	α-helix	trans	-64.1	-40.8	-178.5	-172.1	171.9	-139.9	0	0	113.7	T92 K93 G94 N95 Y100 P118 S119 P120 P127	T92-E123 WeakPolarHBondContact CA-OE2 3.33Å; T92-E123 WeakPolarHBondContact CB-OE2 3.44Å; K93-E123 WeakPolarHBondContact CA-OE1 3.49Å; K93-E123 WeakPolarHBondContact CB-OE1 3.38Å; K93-E123 VanDerWaalsContact N-CD 3.27Å; K93-E123 PolarHBondContact N-OE1 2.83Å; K93-E123 PolarHBondContact N-OE2 2.87Å; G94-E123 PolarHBondContact N-OE1 2.95Å; N95-E123 PolarHBondContact N-OE1 3.36Å; N95-E123 PolarHBondContact ND2-OE1 3.34Å; Y100-E123 WeakPolarHBondContact OH-CA 3.43Å; P118-E123 HydrophobicContact CB-CB 4.42Å; S119-E123 PolarHBondContact O-N 3.28Å; P120-E123 PolarHBondContact O-N 2.69Å; E123-P127 VanDerWaalsContact O-CD 3.24Å; E123-P127 WeakPolarHBondContact O-CD 3.42Å; E123-P127 WeakPolarHBondContact O-CG 3.47Å
124	E	93.1	Very high	93.1	Very high	43 Å²	43	33 Å²	33	20%	0.201	18%	0.183	C	C	.	.	H	α-helix	trans	-75.6	-34.4	173.6	-59.8	-68.2	-161.4	0	0	112.9	K93 P120 I128 I297 L299	K93-E124 WeakPolarHBondContact CE-OE1 3.42Å; K93-E124 IonicContact NZ-OE1 3.16Å; K93-E124 PolarHBondContact NZ-OE1 3.26Å; K93-E124 IonicContact NZ-OE2 3.51Å; K93-E124 PolarHBondContact NZ-OE2 3.17Å; P120-E124 WeakPolarHBondContact O-CG 3.48Å; P120-E124 PolarHBondContact O-N 3.33Å; E124-I128 VanDerWaalsContact O-CG1 3.23Å; E124-I128 WeakPolarHBondContact O-CG1 3.39Å; E124-I297 HydrophobicContact CB-CD1 3.89Å; E124-I297 HydrophobicContact CB-CG1 4.2Å; E124-I297 HydrophobicContact CB-CG2 3.99Å; E124-I297 HydrophobicContact CG-CG2 4.37Å; E124-L299 HydrophobicContact CG-CD2 4.46Å
125	S	95.6	Very high	93.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-91.6	-39.6	-167.5	-164.8	0	0	0	0	114.1	I121 Q122 I128 A129 I135 Y275	I121-S125 WeakPolarHBondContact O-CB 3.44Å; I121-S125 PolarHBondContact O-N 3.25Å; Q122-S125 PolarHBondContact O-N 3.09Å; S125-I128 PolarHBondContact O-N 3.22Å; S125-A129 VanDerWaalsContact O-CB 3.26Å; S125-A129 WeakPolarHBondContact O-CB 3.21Å; S125-A129 PolarHBondContact O-N 3.03Å; S125-I135 WeakPolarHBondContact O-CD1 3.32Å; S125-I135 VanDerWaalsContact OG-CD1 3.27Å; S125-I135 WeakPolarHBondContact OG-CD1 3.49Å; S125-Y275 PolarHBondContact OG-OH 3.29Å
126	I	96.9	Very high	93.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-57.1	-56.6	-177.6	-67	169.5	0	0	0	112	F97 Y100 Q122 I128 A129 L130 I151	F97-I126 HydrophobicContact CD1-CD1 4.45Å; F97-I126 HydrophobicContact CE1-CD1 4.04Å; Y100-I126 HydrophobicContact CD1-CG2 4.26Å; Y100-I126 HydrophobicContact CD2-CD1 4.35Å; Y100-I126 HydrophobicContact CD2-CG2 3.92Å; Y100-I126 HydrophobicContact CE2-CD1 4.16Å; Y100-I126 HydrophobicContact CE2-CG2 4.46Å; Y100-I126 HydrophobicContact CG-CG2 3.83Å; Q122-I126 HydrophobicContact CB-CD1 3.78Å; Q122-I126 HydrophobicContact CB-CG1 4.43Å; Q122-I126 VanDerWaalsContact O-CB 3.27Å; Q122-I126 WeakPolarHBondContact O-CB 3.22Å; Q122-I126 WeakPolarHBondContact O-CG1 3.28Å; Q122-I126 PolarHBondContact O-N 2.98Å; I126-I128 VanDerWaalsContact C-N 3.3Å; I126-I128 PolarHBondContact O-N 3.16Å; I126-A129 PolarHBondContact O-N 3.15Å; I126-L130 HydrophobicContact CG2-CD1 3.74Å; I126-L130 HydrophobicContact CG2-CG 4.28Å; I126-L130 WeakPolarHBondContact O-CB 3.42Å; I126-L130 VanDerWaalsContact O-CG 3.25Å; I126-L130 WeakPolarHBondContact O-CG 3.22Å; I126-L130 PolarHBondContact O-N 3.32Å; I126-I151 HydrophobicContact CD1-CB 4.25Å; I126-I151 HydrophobicContact CD1-CD1 3.87Å; I126-I151 HydrophobicContact CD1-CG2 4.15Å; I126-I151 HydrophobicContact CG1-CB 4.47Å; I126-I151 HydrophobicContact CG1-CG2 4.45Å; I126-I151 HydrophobicContact CG2-CG2 4.3Å
127	P	96.1	Very high	94.5	Very high	55 Å²	55	25.4 Å²	25.4	36%	0.357	14%	0.141	S	C	.	.	H	α-helix	trans	-63.4	-35.5	-177.1	24.2	-34	0	0	0	112.6	Y100 E123 L130 S131	Y100-P127 HydrophobicContact CE1-CG 4.34Å; E123-P127 VanDerWaalsContact O-CD 3.24Å; E123-P127 WeakPolarHBondContact O-CD 3.42Å; E123-P127 WeakPolarHBondContact O-CG 3.47Å; P127-L130 PolarHBondContact O-N 3.18Å; P127-S131 PolarHBondContact O-N 3.17Å; P127-S131 VanDerWaalsContact O-N 3.1Å
128	I	97	Very high	94.5	Very high	39 Å²	39	23 Å²	23	20%	0.2	13%	0.129	C	C	.	.	H	α-helix	trans	-69.5	-42.2	177.6	-59.3	-66.1	0	0	0	111.1	E124 S125 I126 L130 S131 R133 I135 Y295	E124-I128 VanDerWaalsContact O-CG1 3.23Å; E124-I128 WeakPolarHBondContact O-CG1 3.39Å; S125-I128 PolarHBondContact O-N 3.22Å; I126-I128 VanDerWaalsContact C-N 3.3Å; I126-I128 PolarHBondContact O-N 3.16Å; I128-L130 VanDerWaalsContact C-N 3.33Å; I128-L130 PolarHBondContact O-N 3.25Å; I128-S131 WeakPolarHBondContact O-CB 3.49Å; I128-S131 PolarHBondContact O-N 3.12Å; I128-S131 VanDerWaalsContact O-N 3.08Å; I128-S131 PolarHBondContact O-OG 3.49Å; I128-R133 HydrophobicContact CG2-CB 4Å; I128-I135 HydrophobicContact CB-CD1 3.96Å; I128-I135 HydrophobicContact CG2-CD1 3.82Å; I128-I135 HydrophobicContact CG2-CG1 3.85Å; I128-Y295 HydrophobicContact CB-CD1 4.21Å; I128-Y295 HydrophobicContact CD1-CD1 4.19Å; I128-Y295 HydrophobicContact CD1-CD2 4.41Å; I128-Y295 HydrophobicContact CD1-CE1 4.16Å; I128-Y295 HydrophobicContact CD1-CE2 4.39Å; I128-Y295 HydrophobicContact CD1-CG 4.31Å; I128-Y295 HydrophobicContact CG1-CD1 3.72Å; I128-Y295 HydrophobicContact CG1-CE1 3.78Å; I128-Y295 HydrophobicContact CG1-CG 4.25Å; I128-Y295 HydrophobicContact CG2-CD1 3.82Å; I128-Y295 HydrophobicContact CG2-CG 3.82Å
129	A	97.5	Very high	94	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.7	-37.8	175.5	0	0	0	0	0	111.3	S125 I126 S131 G132 I135 P152 Q271 L273	S125-A129 VanDerWaalsContact O-CB 3.26Å; S125-A129 WeakPolarHBondContact O-CB 3.21Å; S125-A129 PolarHBondContact O-N 3.03Å; I126-A129 PolarHBondContact O-N 3.15Å; A129-S131 PolarHBondContact O-N 2.83Å; A129-G132 PolarHBondContact O-N 2.93Å; A129-I135 HydrophobicContact CB-CD1 3.9Å; A129-P152 HydrophobicContact CB-CB 3.51Å; A129-P152 HydrophobicContact CB-CG 3.54Å; A129-Q271 PolarHBondContact O-NE2 3.43Å; A129-L273 HydrophobicContact CB-CD1 4.1Å; A129-L273 HydrophobicContact CB-CD2 4.25Å
130	L	96.9	Very high	93.2	Very high	32 Å²	32	23.7 Å²	23.7	17%	0.168	13%	0.132	C	C	.	.	H	α-helix	trans	-65.5	-20.3	172.8	-68.2	173.4	0	0	0	113.3	L102 I126 P127 I128 G132 P152 E155 R156	L102-L130 HydrophobicContact CD2-CD1 3.93Å; L102-L130 HydrophobicContact CD2-CD2 4.35Å; I126-L130 HydrophobicContact CG2-CD1 3.74Å; I126-L130 HydrophobicContact CG2-CG 4.28Å; I126-L130 WeakPolarHBondContact O-CB 3.42Å; I126-L130 VanDerWaalsContact O-CG 3.25Å; I126-L130 WeakPolarHBondContact O-CG 3.22Å; I126-L130 PolarHBondContact O-N 3.32Å; P127-L130 PolarHBondContact O-N 3.18Å; I128-L130 VanDerWaalsContact C-N 3.33Å; I128-L130 PolarHBondContact O-N 3.25Å; L130-G132 VanDerWaalsContact C-N 3.29Å; L130-P152 HydrophobicContact CD2-CB 4.03Å; L130-P152 HydrophobicContact CG-CB 4.18Å; L130-E155 HydrophobicContact CD2-CB 3.82Å; L130-E155 HydrophobicContact CD2-CG 3.58Å; L130-R156 PolarHBondContact O-NH1 3.36Å
131	S	96.6	Very high	92.4	Very high	77 Å²	77	23.8 Å²	23.8	54%	0.538	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-8	171.7	81.7	0	0	0	0	114.4	P127 I128 A129 R133	P127-S131 PolarHBondContact O-N 3.17Å; P127-S131 VanDerWaalsContact O-N 3.1Å; I128-S131 WeakPolarHBondContact O-CB 3.49Å; I128-S131 PolarHBondContact O-N 3.12Å; I128-S131 VanDerWaalsContact O-N 3.08Å; I128-S131 PolarHBondContact O-OG 3.49Å; A129-S131 PolarHBondContact O-N 2.83Å; S131-R133 WeakPolarHBondContact OG-CG 3.24Å
132	G	96.3	Very high	91.3	Very high	43 Å²	43	24.2 Å²	24.2	44%	0.443	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	5.4	-177.1	0	0	0	0	0	115.1	A129 L130 Q271	A129-G132 PolarHBondContact O-N 2.93Å; L130-G132 VanDerWaalsContact C-N 3.29Å; G132-Q271 VanDerWaalsContact C-NE2 3.3Å
133	R	97.1	Very high	90.1	Very high	107 Å²	107	24.5 Å²	24.5	40%	0.404	14%	0.139	S	C	.	.			trans	-74.4	144.4	175.4	-74.1	-75.2	-66.4	-72.3	-1.2	112	I128 S131 Q271 K293	I128-R133 HydrophobicContact CG2-CB 4Å; S131-R133 WeakPolarHBondContact OG-CG 3.24Å; R133-Q271 PolarHBondContact O-NE2 3.04Å; R133-K293 PolarHBondContact NE-O 3.4Å; R133-K293 VanDerWaalsContact NE-O 3.12Å; R133-K293 PolarHBondContact NH2-O 2.96Å
134	D	98.1	Very high	89.6	Confident	7 Å²	7	25 Å²	25	4%	0.037	15%	0.146	C	C	.	.			trans	-61.9	148.7	164.5	-76	2.5	0	0	0	110.7	Q271 I272 L291 Q292 P294 Y295	D134-Q271 WeakPolarHBondContact OD1-CA 3.19Å; D134-I272 VanDerWaalsContact CA-O 3.29Å; D134-I272 WeakPolarHBondContact CA-O 3.21Å; D134-I272 WeakPolarHBondContact CB-O 3.47Å; D134-I272 PolarHBondContact OD1-N 3.32Å; D134-L291 HydrophobicContact CB-CG 4.49Å; D134-L291 WeakPolarHBondContact OD2-CA 3.27Å; D134-Q292 PolarHBondContact OD2-N 3.12Å; D134-P294 HydrophobicContact CB-CB 4.16Å; D134-P294 CarbonylContact O-C 3.54Å; D134-P294 WeakPolarHBondContact O-CA 3.46Å; D134-Y295 PolarHBondContact O-N 3.1Å
135	I	97.7	Very high	89.4	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135.4	-180	-65.7	-174.8	0	0	0	110.5	S125 I128 A129 A137 I272 L273 L274 I297	S125-I135 WeakPolarHBondContact O-CD1 3.32Å; S125-I135 VanDerWaalsContact OG-CD1 3.27Å; S125-I135 WeakPolarHBondContact OG-CD1 3.49Å; I128-I135 HydrophobicContact CB-CD1 3.96Å; I128-I135 HydrophobicContact CG2-CD1 3.82Å; I128-I135 HydrophobicContact CG2-CG1 3.85Å; A129-I135 HydrophobicContact CB-CD1 3.9Å; I135-A137 HydrophobicContact CG2-CB 3.97Å; I135-I272 PolarHBondContact N-O 3.42Å; I135-L273 HydrophobicContact CB-CD2 3.85Å; I135-L273 HydrophobicContact CD1-CD2 4.05Å; I135-L273 HydrophobicContact CG1-CD2 3.81Å; I135-L274 PolarHBondContact O-N 2.92Å; I135-I297 HydrophobicContact CD1-CD1 4.46Å; I135-I297 HydrophobicContact CG2-CD1 3.88Å; I135-I297 HydrophobicContact CG2-CG1 4.48Å
136	L	95.3	Very high	89.2	Confident	6 Å²	6	24.2 Å²	24.2	3%	0.031	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	108.6	162.6	175.8	68.7	0	0	0	108.3	L274 F279 M287 P294 Y295 E296 I297	L136-L274 HydrophobicContact CD1-CD2 3.88Å; L136-F279 HydrophobicContact CD1-CD1 4.44Å; L136-F279 HydrophobicContact CD1-CE1 3.57Å; L136-F279 HydrophobicContact CD1-CE2 4.41Å; L136-F279 HydrophobicContact CD1-CZ 3.56Å; L136-F279 HydrophobicContact CD2-CE2 4.38Å; L136-F279 HydrophobicContact CD2-CZ 4.26Å; L136-F279 HydrophobicContact CG-CE1 4.33Å; L136-F279 HydrophobicContact CG-CE2 4.37Å; L136-F279 HydrophobicContact CG-CZ 3.8Å; L136-M287 HydrophobicContact CD1-CE 4.22Å; L136-M287 HydrophobicContact CD1-CG 3.97Å; L136-M287 HydrophobicContact CD1-SD 3.56Å; L136-M287 VanDerWaalsContact CD1-SD 3.56Å; L136-M287 HydrophobicContact CD2-CE 3.41Å; L136-M287 VanDerWaalsContact CD2-CE 3.41Å; L136-M287 HydrophobicContact CD2-SD 3.91Å; L136-M287 HydrophobicContact CG-CE 4.42Å; L136-M287 HydrophobicContact CG-SD 4.38Å; L136-P294 HydrophobicContact CB-CB 4.28Å; L136-Y295 PolarHBondContact N-O 3.04Å; L136-E296 HydrophobicContact CB-CG 4.24Å; L136-E296 HydrophobicContact CD2-CB 4.38Å; L136-E296 HydrophobicContact CD2-CG 3.83Å; L136-E296 CarbonylContact O-C 3.59Å; L136-E296 WeakPolarHBondContact O-CA 3.46Å; L136-I297 PolarHBondContact O-N 3.39Å
137	A	93.3	Very high	89.1	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	115.1	-177.2	0	0	0	0	0	112	I121 I135 L274 Y275 S276 I297	I121-A137 HydrophobicContact CD1-CB 4.07Å; I135-A137 HydrophobicContact CG2-CB 3.97Å; A137-L274 PolarHBondContact N-O 2.69Å; A137-Y275 HydrophobicContact CB-CD1 3.41Å; A137-Y275 VanDerWaalsContact CB-CD1 3.41Å; A137-Y275 HydrophobicContact CB-CE1 3.57Å; A137-Y275 HydrophobicContact CB-CG 4.02Å; A137-Y275 WeakPolarHBondContact O-CA 3.38Å; A137-S276 PolarHBondContact O-N 3.31Å; A137-I297 HydrophobicContact CB-CB 4.5Å
138	R	88.4	Confident	89	Confident	48 Å²	48	21.7 Å²	21.7	18%	0.181	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	109.5	166.2	-157.5	-177.3	177.1	-163.4	3.3	109.4	S276 A277 F279 I297 N298 L299 M300 L303	R138-S276 WeakPolarHBondContact CA-O 3.4Å; R138-A277 PolarHBondContact NE-O 3.37Å; R138-F279 HydrophobicContact CB-CE2 3.56Å; R138-F279 HydrophobicContact CB-CZ 3.64Å; R138-F279 HydrophobicContact CG-CD2 4.32Å; R138-F279 HydrophobicContact CG-CE2 3.74Å; R138-F279 HydrophobicContact CG-CZ 4Å; R138-I297 PolarHBondContact N-O 2.84Å; R138-N298 WeakPolarHBondContact CD-OD1 3.49Å; R138-L299 PolarHBondContact O-N 3.28Å; R138-M300 HydrophobicContact CG-CB 4.48Å; R138-M300 HydrophobicContact CG-SD 4.09Å; R138-L303 VanDerWaalsContact NH2-CG 3.34Å
139	A	80.4	Confident	89	Confident	2 Å²	2	19.8 Å²	19.8	2%	0.017	12%	0.118	C	C	.	.			trans	-151.1	134.6	177.6	0	0	0	0	0	111.8	I121 K145 S276	I121-A139 HydrophobicContact CB-CB 4.46Å; I121-A139 HydrophobicContact CD1-CB 4.02Å; I121-A139 HydrophobicContact CG1-CB 3.94Å; A139-K145 HydrophobicContact CB-CD 3.91Å; A139-K145 HydrophobicContact CB-CG 4.03Å; A139-K145 WeakPolarHBondContact O-CE 3.35Å; A139-K145 PolarHBondContact O-NZ 3.44Å; A139-K145 VanDerWaalsContact O-NZ 3.08Å; A139-S276 PolarHBondContact N-O 3.32Å
140	K	73.7	Confident	89	Confident	14 Å²	14	19.8 Å²	19.8	6%	0.061	12%	0.118	C	C	.	.			trans	-59.3	159.1	178.6	77.4	-177.4	-165.7	-173.8	0	111	D88 T143 M300 L305 K306	D88-K140 IonicContact OD1-NZ 2.8Å; D88-K140 PolarHBondContact OD1-NZ 3.05Å; D88-K140 WeakPolarHBondContact OD2-CE 3.42Å; D88-K140 IonicContact OD2-NZ 3.57Å; D88-K140 PolarHBondContact OD2-NZ 3.16Å; K140-T143 HydrophobicContact CD-CG2 4.22Å; K140-T143 HydrophobicContact CG-CG2 3.53Å; K140-T143 PolarHBondContact O-OG1 3.4Å; K140-M300 HydrophobicContact CB-CE 4.03Å; K140-M300 HydrophobicContact CB-SD 4.07Å; K140-M300 PolarHBondContact N-SD 2.89Å; K140-L305 HydrophobicContact CB-CD2 3.83Å; K140-L305 HydrophobicContact CD-CD2 3.77Å; K140-L305 HydrophobicContact CG-CD2 4.14Å; K140-K306 PolarHBondContact NZ-O 3.05Å
141	N	72.6	Confident	89.1	Confident	15 Å²	15	18.3 Å²	18.3	8%	0.08	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	139.6	178.5	-78.7	-11.5	0	0	0	111.2	K145 E246 R423	N141-K145 WeakPolarHBondContact OD1-CE 3.38Å; N141-K145 PolarHBondContact OD1-NZ 2.91Å; N141-E246 PolarHBondContact ND2-OE1 3.38Å; N141-R423 PolarHBondContact ND2-NH2 3.06Å; N141-R423 VanDerWaalsContact ND2-NH2 3.12Å
142	G	68.3	Low	89.1	Confident	11 Å²	11	14.6 Å²	14.6	11%	0.113	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	94	-2.1	178.2	0	0	0	0	0	116.6	G144 F427	G142-G144 PolarHBondContact O-N 3Å; G142-F427 WeakPolarHBondContact O-CA 3.37Å; G142-F427 PolarHBondContact O-N 3.42Å
143	T	68.9	Low	89.2	Confident	8 Å²	8	12.6 Å²	12.6	5%	0.049	6%	0.064	C	C	.	.	S	Bend	trans	-80	9.1	-179.5	51.6	0	0	0	0	115.4	V89 S119 I121 K140	V89-T143 HydrophobicContact CG1-CG2 4.15Å; S119-T143 WeakPolarHBondContact CB-O 3.28Å; S119-T143 PolarHBondContact OG-O 3.25Å; I121-T143 WeakPolarHBondContact CG2-O 3.33Å; K140-T143 HydrophobicContact CD-CG2 4.22Å; K140-T143 HydrophobicContact CG-CG2 3.53Å; K140-T143 PolarHBondContact O-OG1 3.4Å
144	G	81.6	Confident	89.3	Confident	18 Å²	18	7.5 Å²	7.5	19%	0.186	4%	0.044	C	C	.	.	S	Bend	trans	87.5	15.9	-175.6	0	0	0	0	0	115.3	Q122 G142 S146 G147 A148	Q122-G144 PolarHBondContact NE2-O 3.32Å; G142-G144 PolarHBondContact O-N 3Å; G144-S146 PolarHBondContact O-N 3.33Å; G144-S146 VanDerWaalsContact O-N 3.1Å; G144-G147 WeakPolarHBondContact O-CA 3.3Å; G144-G147 PolarHBondContact O-N 3.48Å; G144-A148 PolarHBondContact O-N 3.08Å
145	K	88.8	Confident	89.3	Confident	10 Å²	10	8.3 Å²	8.3	4%	0.043	5%	0.048	C	C	.	.	H	α-helix	trans	-42	-44.5	176	-72.5	-167.6	-73.1	-174.7	0	114.2	I121 A139 N141 G147 A148 Y149 D245 Y275	I121-K145 HydrophobicContact CG1-CG 4.35Å; A139-K145 HydrophobicContact CB-CD 3.91Å; A139-K145 HydrophobicContact CB-CG 4.03Å; A139-K145 WeakPolarHBondContact O-CE 3.35Å; A139-K145 PolarHBondContact O-NZ 3.44Å; A139-K145 VanDerWaalsContact O-NZ 3.08Å; N141-K145 WeakPolarHBondContact OD1-CE 3.38Å; N141-K145 PolarHBondContact OD1-NZ 2.91Å; K145-G147 VanDerWaalsContact C-N 3.31Å; K145-G147 PolarHBondContact O-N 3.45Å; K145-A148 WeakPolarHBondContact O-CA 3.4Å; K145-A148 VanDerWaalsContact O-CB 3.29Å; K145-A148 WeakPolarHBondContact O-CB 3.43Å; K145-A148 PolarHBondContact O-N 3.45Å; K145-Y149 WeakPolarHBondContact O-CD1 3.48Å; K145-Y149 WeakPolarHBondContact O-CE1 3.37Å; K145-Y149 PolarHBondContact O-N 3.33Å; K145-D245 IonicContact NZ-OD1 2.67Å; K145-Y275 HydrophobicContact CB-CD1 4.35Å; K145-Y275 HydrophobicContact CD-CD1 4.09Å; K145-Y275 HydrophobicContact CG-CD1 4.21Å
146	S	92.2	Very high	89.2	Confident	17 Å²	17	13.8 Å²	13.8	12%	0.119	7%	0.068	C	C	.	.	H	α-helix	trans	-62.7	-34.3	179.4	-53.1	0	0	0	0	113.3	G144 Y149 L150	G144-S146 PolarHBondContact O-N 3.33Å; G144-S146 VanDerWaalsContact O-N 3.1Å; S146-Y149 PolarHBondContact OG-OH 2.86Å; S146-Y149 VanDerWaalsContact OG-OH 3.11Å; S146-L150 WeakPolarHBondContact O-CB 3.37Å; S146-L150 WeakPolarHBondContact O-CD1 3.46Å; S146-L150 WeakPolarHBondContact O-CG 3.39Å; S146-L150 PolarHBondContact O-N 3.15Å
147	G	93.4	Very high	89.3	Confident	1 Å²	1	13.8 Å²	13.8	1%	0.01	7%	0.069	C	C	.	.	H	α-helix	trans	-65.7	-41.2	169.6	0	0	0	0	0	111.9	G144 K145 Y149 L150 I151	G144-G147 WeakPolarHBondContact O-CA 3.3Å; G144-G147 PolarHBondContact O-N 3.48Å; K145-G147 VanDerWaalsContact C-N 3.31Å; K145-G147 PolarHBondContact O-N 3.45Å; G147-Y149 VanDerWaalsContact C-N 3.27Å; G147-Y149 PolarHBondContact O-N 3Å; G147-L150 PolarHBondContact O-N 3.08Å; G147-I151 WeakPolarHBondContact O-CB 3.48Å; G147-I151 WeakPolarHBondContact O-CD1 3.44Å; G147-I151 VanDerWaalsContact O-CG1 3.25Å; G147-I151 WeakPolarHBondContact O-CG1 3.5Å; G147-I151 PolarHBondContact O-N 3.28Å
148	A	95	Very high	89.5	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.6	-31.5	-177.2	0	0	0	0	0	113.6	I121 Q122 G144 K145 P152 Y275	I121-A148 HydrophobicContact CG1-CB 4.25Å; I121-A148 WeakPolarHBondContact O-CB 3.32Å; Q122-A148 HydrophobicContact CB-CB 4.38Å; Q122-A148 HydrophobicContact CG-CB 3.78Å; G144-A148 PolarHBondContact O-N 3.08Å; K145-A148 WeakPolarHBondContact O-CA 3.4Å; K145-A148 VanDerWaalsContact O-CB 3.29Å; K145-A148 WeakPolarHBondContact O-CB 3.43Å; K145-A148 PolarHBondContact O-N 3.45Å; A148-P152 VanDerWaalsContact O-CD 3.27Å; A148-P152 WeakPolarHBondContact O-CD 3.33Å; A148-P152 VanDerWaalsContact O-CG 3.28Å; A148-P152 WeakPolarHBondContact O-CG 3.35Å; A148-Y275 HydrophobicContact CB-CE1 4.26Å; A148-Y275 PolarHBondContact O-OH 3.02Å
149	Y	97	Very high	89.8	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-98.6	-34.1	171.8	58.1	-110.2	0	0	0	115	K145 S146 G147 I151 P152 L153 V168 V179 V243 D245 Y275	K145-Y149 WeakPolarHBondContact O-CD1 3.48Å; K145-Y149 WeakPolarHBondContact O-CE1 3.37Å; K145-Y149 PolarHBondContact O-N 3.33Å; S146-Y149 PolarHBondContact OG-OH 2.86Å; S146-Y149 VanDerWaalsContact OG-OH 3.11Å; G147-Y149 VanDerWaalsContact C-N 3.27Å; G147-Y149 PolarHBondContact O-N 3Å; Y149-I151 PolarHBondContact O-N 2.69Å; Y149-P152 WeakPolarHBondContact O-CD 3.42Å; Y149-P152 WeakPolarHBondContact O-CG 3.04Å; Y149-L153 WeakPolarHBondContact O-CB 3.31Å; Y149-L153 PolarHBondContact O-N 3.11Å; Y149-L153 VanDerWaalsContact O-N 3.12Å; Y149-V168 HydrophobicContact CE2-CG1 3.96Å; Y149-V179 HydrophobicContact CE2-CG1 3.86Å; Y149-V179 WeakPolarHBondContact OH-CG2 3.46Å; Y149-V243 HydrophobicContact CD1-CG1 3.79Å; Y149-V243 HydrophobicContact CD2-CG1 3.8Å; Y149-V243 HydrophobicContact CD2-CG2 4.31Å; Y149-V243 HydrophobicContact CE1-CG1 4.17Å; Y149-V243 HydrophobicContact CE2-CG1 4.2Å; Y149-V243 HydrophobicContact CG-CG1 3.59Å; Y149-V243 HydrophobicContact CG-CG2 4.37Å; Y149-D245 HydrophobicContact CE1-CB 3.9Å; Y149-D245 VanDerWaalsContact CE1-OD2 3.3Å; Y149-D245 WeakPolarHBondContact CE1-OD2 3.36Å; Y149-D245 PolarHBondContact OH-OD2 3.4Å; Y149-Y275 HydrophobicContact CD1-CD1 4.44Å; Y149-Y275 AromaticContact CD1-CD2 3.73Å; Y149-Y275 HydrophobicContact CD1-CD2 3.73Å; Y149-Y275 HydrophobicContact CD1-CE1 4.34Å; Y149-Y275 AromaticContact CD1-CE2 3.62Å; Y149-Y275 HydrophobicContact CD1-CE2 3.62Å; Y149-Y275 HydrophobicContact CD1-CG 4.16Å; Y149-Y275 AromaticContact CD1-CZ 3.93Å; Y149-Y275 HydrophobicContact CE1-CD2 4.43Å; Y149-Y275 HydrophobicContact CG-CE2 4.09Å
150	L	98	Very high	90.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-69.9	-33.5	-177.9	-70.2	174.1	0	0	0	112.6	S146 G147 L154 V168 V179 I182 C183	S146-L150 WeakPolarHBondContact O-CB 3.37Å; S146-L150 WeakPolarHBondContact O-CD1 3.46Å; S146-L150 WeakPolarHBondContact O-CG 3.39Å; S146-L150 PolarHBondContact O-N 3.15Å; G147-L150 PolarHBondContact O-N 3.08Å; L150-L154 VanDerWaalsContact O-CB 3.28Å; L150-L154 WeakPolarHBondContact O-CB 2.92Å; L150-L154 WeakPolarHBondContact O-CG 3.07Å; L150-L154 PolarHBondContact O-N 3.49Å; L150-V168 HydrophobicContact CD2-CG2 4.43Å; L150-V179 HydrophobicContact CD1-CG1 4.09Å; L150-V179 HydrophobicContact CD2-CG1 4.15Å; L150-V179 HydrophobicContact CG-CG1 4.42Å; L150-I182 HydrophobicContact CD1-CB 4.05Å; L150-I182 HydrophobicContact CD1-CG2 3.62Å; L150-C183 HydrophobicContact CD1-CB 3.94Å; L150-C183 HydrophobicContact CD2-CB 3.85Å; L150-C183 HydrophobicContact CG-CB 4.5Å
151	I	97.9	Very high	91.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.9	-58	178.1	-67.4	169.6	0	0	0	111.4	F97 L102 L106 I110 W115 I126 G147 Y149 L153 L154 E155	F97-I151 HydrophobicContact CD1-CD1 4.23Å; F97-I151 HydrophobicContact CE1-CD1 3.61Å; F97-I151 HydrophobicContact CZ-CD1 4.36Å; L102-I151 HydrophobicContact CD1-CG2 3.53Å; L102-I151 HydrophobicContact CD2-CG2 3.94Å; L102-I151 HydrophobicContact CG-CG2 4.41Å; L106-I151 HydrophobicContact CD2-CG2 4.28Å; L106-I151 WeakPolarHBondContact CD2-O 3.19Å; I110-I151 HydrophobicContact CD1-CD1 3.7Å; I110-I151 HydrophobicContact CD1-CG1 3.84Å; I110-I151 HydrophobicContact CD1-CG2 4.1Å; I110-I151 HydrophobicContact CG1-CD1 4Å; I110-I151 HydrophobicContact CG1-CG1 4.14Å; W115-I151 HydrophobicContact CE3-CD1 4.28Å; W115-I151 HydrophobicContact CZ3-CD1 4.17Å; I126-I151 HydrophobicContact CD1-CB 4.25Å; I126-I151 HydrophobicContact CD1-CD1 3.87Å; I126-I151 HydrophobicContact CD1-CG2 4.15Å; I126-I151 HydrophobicContact CG1-CB 4.47Å; I126-I151 HydrophobicContact CG1-CG2 4.45Å; I126-I151 HydrophobicContact CG2-CG2 4.3Å; G147-I151 WeakPolarHBondContact O-CB 3.48Å; G147-I151 WeakPolarHBondContact O-CD1 3.44Å; G147-I151 VanDerWaalsContact O-CG1 3.25Å; G147-I151 WeakPolarHBondContact O-CG1 3.5Å; G147-I151 PolarHBondContact O-N 3.28Å; Y149-I151 PolarHBondContact O-N 2.69Å; I151-L153 VanDerWaalsContact C-N 3.3Å; I151-L153 PolarHBondContact O-N 3.27Å; I151-L154 PolarHBondContact O-N 2.89Å; I151-E155 WeakPolarHBondContact O-CB 3.47Å; I151-E155 PolarHBondContact O-N 3.45Å
152	P	98.1	Very high	92.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-66.8	-30.3	178.4	26.3	-35.2	0	0	0	112.8	A129 L130 A148 Y149 R156	A129-P152 HydrophobicContact CB-CB 3.51Å; A129-P152 HydrophobicContact CB-CG 3.54Å; L130-P152 HydrophobicContact CD2-CB 4.03Å; L130-P152 HydrophobicContact CG-CB 4.18Å; A148-P152 VanDerWaalsContact O-CD 3.27Å; A148-P152 WeakPolarHBondContact O-CD 3.33Å; A148-P152 VanDerWaalsContact O-CG 3.28Å; A148-P152 WeakPolarHBondContact O-CG 3.35Å; Y149-P152 WeakPolarHBondContact O-CD 3.42Å; Y149-P152 WeakPolarHBondContact O-CG 3.04Å; P152-R156 WeakPolarHBondContact O-CG 3.36Å; P152-R156 PolarHBondContact O-N 2.87Å
153	L	98.3	Very high	94	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-61.8	-50.3	173.4	-177.5	158.9	0	0	0	111.4	Y149 I151 R156 I157 A166 V168 V217 M241 V243	Y149-L153 WeakPolarHBondContact O-CB 3.31Å; Y149-L153 PolarHBondContact O-N 3.11Å; Y149-L153 VanDerWaalsContact O-N 3.12Å; I151-L153 VanDerWaalsContact C-N 3.3Å; I151-L153 PolarHBondContact O-N 3.27Å; L153-R156 PolarHBondContact O-N 2.96Å; L153-R156 VanDerWaalsContact O-N 3.16Å; L153-I157 HydrophobicContact CD2-CD1 4.47Å; L153-I157 WeakPolarHBondContact O-CG1 3.21Å; L153-I157 PolarHBondContact O-N 2.99Å; L153-A166 HydrophobicContact CD1-CB 3.85Å; L153-A166 HydrophobicContact CD2-CB 3.78Å; L153-A166 HydrophobicContact CG-CB 3.62Å; L153-V168 HydrophobicContact CD1-CG2 3.56Å; L153-V217 HydrophobicContact CD2-CB 4.49Å; L153-V217 HydrophobicContact CD2-CG1 3.89Å; L153-V217 HydrophobicContact CD2-CG2 3.72Å; L153-M241 HydrophobicContact CB-SD 3.63Å; L153-M241 HydrophobicContact CD1-SD 4.27Å; L153-M241 HydrophobicContact CG-SD 3.95Å; L153-V243 HydrophobicContact CD1-CG2 3.94Å
154	L	98.1	Very high	95.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-65.7	-39.3	178.5	-73.5	172	0	0	0	111.7	L106 L150 I151 R156 I157 V186 M190 V193	L106-L154 HydrophobicContact CD1-CB 3.94Å; L106-L154 HydrophobicContact CD1-CD1 3.94Å; L106-L154 HydrophobicContact CD2-CB 4.27Å; L150-L154 VanDerWaalsContact O-CB 3.28Å; L150-L154 WeakPolarHBondContact O-CB 2.92Å; L150-L154 WeakPolarHBondContact O-CG 3.07Å; L150-L154 PolarHBondContact O-N 3.49Å; I151-L154 PolarHBondContact O-N 2.89Å; L154-R156 PolarHBondContact O-N 2.91Å; L154-I157 PolarHBondContact O-N 2.92Å; L154-I157 VanDerWaalsContact O-N 3.1Å; L154-V186 HydrophobicContact CD1-CB 4.05Å; L154-V186 HydrophobicContact CD1-CG1 3.66Å; L154-M190 HydrophobicContact CB-CE 4.47Å; L154-M190 HydrophobicContact CB-SD 4.05Å; L154-M190 HydrophobicContact CD2-SD 4.43Å; L154-V193 HydrophobicContact CD2-CG1 3.83Å; L154-V193 HydrophobicContact CD2-CG2 4.4Å
155	E	97.9	Very high	96.2	Very high	23 Å²	23	36.3 Å²	36.3	11%	0.107	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-29.1	173.5	-174.3	48.6	-114.3	0	0	112.4	L102 K103 L106 L130 I151	L102-E155 HydrophobicContact CD2-CB 4.08Å; L102-E155 HydrophobicContact CD2-CG 3.95Å; K103-E155 WeakPolarHBondContact CB-OE2 3.09Å; K103-E155 VanDerWaalsContact CD-OE1 3.26Å; K103-E155 WeakPolarHBondContact CD-OE1 3.26Å; K103-E155 WeakPolarHBondContact CD-OE2 3.5Å; K103-E155 WeakPolarHBondContact CE-OE1 3.44Å; K103-E155 WeakPolarHBondContact CG-OE1 3.3Å; K103-E155 VanDerWaalsContact CG-OE2 3.28Å; K103-E155 WeakPolarHBondContact CG-OE2 2.98Å; K103-E155 PolarHBondContact N-OE2 3.06Å; K103-E155 PolarHBondContact NZ-O 3.19Å; K103-E155 IonicContact NZ-OE1 3.93Å; K103-E155 PolarHBondContact NZ-OE1 3.49Å; L106-E155 HydrophobicContact CD2-CB 3.91Å; L130-E155 HydrophobicContact CD2-CB 3.82Å; L130-E155 HydrophobicContact CD2-CG 3.58Å; I151-E155 WeakPolarHBondContact O-CB 3.47Å; I151-E155 PolarHBondContact O-N 3.45Å
156	R	96.5	Very high	96.6	Very high	115 Å²	115	36 Å²	36	43%	0.434	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-9.4	174.7	-73	-57.4	98.5	111.4	0.8	115.4	L130 P152 L153 L154 D158 M241	L130-R156 PolarHBondContact O-NH1 3.36Å; P152-R156 WeakPolarHBondContact O-CG 3.36Å; P152-R156 PolarHBondContact O-N 2.87Å; L153-R156 PolarHBondContact O-N 2.96Å; L153-R156 VanDerWaalsContact O-N 3.16Å; L154-R156 PolarHBondContact O-N 2.91Å; R156-D158 PolarHBondContact O-N 2.94Å; R156-M241 HydrophobicContact CB-CE 4.4Å; R156-M241 HydrophobicContact CG-CE 3.98Å
157	I	97.1	Very high	96.9	Very high	7 Å²	7	35.1 Å²	35.1	4%	0.036	17%	0.166	C	C	.	.			trans	-72	129.7	179	-56.5	-58.1	0	0	0	111.6	K103 L153 L154 L159 Q165 A166 H216 V217	K103-I157 PolarHBondContact NZ-O 2.86Å; L153-I157 HydrophobicContact CD2-CD1 4.47Å; L153-I157 WeakPolarHBondContact O-CG1 3.21Å; L153-I157 PolarHBondContact O-N 2.99Å; L154-I157 PolarHBondContact O-N 2.92Å; L154-I157 VanDerWaalsContact O-N 3.1Å; I157-L159 HydrophobicContact CG2-CD2 3.85Å; I157-L159 HydrophobicContact CG2-CG 4.38Å; I157-Q165 HydrophobicContact CD1-CB 3.92Å; I157-A166 HydrophobicContact CD1-CB 4.13Å; I157-H216 HydrophobicContact CG2-CB 4.03Å; I157-V217 HydrophobicContact CD1-CG2 3.8Å; I157-V217 HydrophobicContact CG1-CG2 4.13Å
158	D	96.4	Very high	97.1	Very high	52 Å²	52	35.1 Å²	35.1	28%	0.278	17%	0.166	S	C	.	.			trans	-103.1	104.1	170.3	178.6	6.9	0	0	0	109.8	R156 K160 K161 Q165	R156-D158 PolarHBondContact O-N 2.94Å; D158-K160 PolarHBondContact O-N 2.99Å; D158-K160 VanDerWaalsContact O-N 3.16Å; D158-K160 WeakPolarHBondContact OD1-CB 3.5Å; D158-K160 PolarHBondContact OD1-N 2.73Å; D158-K160 VanDerWaalsContact OD1-N 3.08Å; D158-K161 HydrophobicContact CB-CD 4.38Å; D158-K161 PolarHBondContact O-N 3.36Å; D158-K161 WeakPolarHBondContact OD2-CD 3.39Å; D158-K161 WeakPolarHBondContact OD2-CE 3.38Å; D158-K161 IonicContact OD2-NZ 2.78Å; D158-K161 PolarHBondContact OD2-NZ 2.85Å; D158-Q165 PolarHBondContact O-NE2 3.07Å
159	L	95.3	Very high	97.3	Very high	68 Å²	68	35.1 Å²	35.1	36%	0.356	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	0.5	-177.7	-64.3	176.2	0	0	0	114.3	I157 K161 M190 V193	I157-L159 HydrophobicContact CG2-CD2 3.85Å; I157-L159 HydrophobicContact CG2-CG 4.38Å; L159-K161 VanDerWaalsContact C-N 3.28Å; L159-M190 WeakPolarHBondContact CD1-O 3.28Å; L159-V193 HydrophobicContact CD1-CG2 4.43Å; L159-V193 HydrophobicContact CD2-CB 4.4Å; L159-V193 HydrophobicContact CD2-CG2 3.86Å
160	K	95.1	Very high	97.2	Very high	191 Å²	191	35.1 Å²	35.1	83%	0.83	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	0.3	172.3	-58.6	177.4	-179.4	176.9	0	112.8	D158	D158-K160 PolarHBondContact O-N 2.99Å; D158-K160 VanDerWaalsContact O-N 3.16Å; D158-K160 WeakPolarHBondContact OD1-CB 3.5Å; D158-K160 PolarHBondContact OD1-N 2.73Å; D158-K160 VanDerWaalsContact OD1-N 3.08Å
161	K	95.3	Very high	96.8	Very high	99 Å²	99	36.2 Å²	36.2	43%	0.43	17%	0.173	S	C	.	.			trans	-124.6	105.8	-176.4	-65.7	174.6	-179.5	130.5	0	110.3	D158 L159 C163 Q165	D158-K161 HydrophobicContact CB-CD 4.38Å; D158-K161 PolarHBondContact O-N 3.36Å; D158-K161 WeakPolarHBondContact OD2-CD 3.39Å; D158-K161 WeakPolarHBondContact OD2-CE 3.38Å; D158-K161 IonicContact OD2-NZ 2.78Å; D158-K161 PolarHBondContact OD2-NZ 2.85Å; L159-K161 VanDerWaalsContact C-N 3.28Å; K161-C163 PolarHBondContact O-N 3.09Å; K161-Q165 PolarHBondContact O-NE2 2.67Å; K161-Q165 VanDerWaalsContact O-NE2 3.08Å
162	D	95.9	Very high	96.2	Very high	123 Å²	123	36.7 Å²	36.7	66%	0.658	18%	0.176	S	C	*	.			trans	-69.8	64.1	172.7	-68.4	-74.5	0	0	0	112.1	T214	D162-T214 HydrophobicContact CB-CG2 4.02Å; D162-T214 WeakPolarHBondContact OD1-CB 3.25Å; D162-T214 VanDerWaalsContact OD1-CG2 3.22Å; D162-T214 WeakPolarHBondContact OD1-CG2 3.4Å; D162-T214 PolarHBondContact OD1-OG1 2.99Å
163	C	96.6	Very high	95.7	Very high	30 Å²	30	40.6 Å²	40.6	20%	0.203	19%	0.191	C	C	.	.	S	Bend	trans	-149.4	161	-179.2	70.6	0	0	0	0	112.5	K161 Q165 V215 Q238	K161-C163 PolarHBondContact O-N 3.09Å; C163-Q165 PolarHBondContact O-N 3.07Å; C163-V215 CarbonylContact C-O 3.28Å; C163-V215 VanDerWaalsContact C-O 3.28Å; C163-Q238 HydrophobicContact CB-CB 4.27Å; C163-Q238 HydrophobicContact CB-CG 4.31Å
164	L	98	Very high	95	Very high	11 Å²	11	40.7 Å²	40.7	6%	0.058	19%	0.191	C	C	.	.			trans	-75.8	112.2	177.4	-179.2	51.3	0	0	0	110.3	A166 L167 V215 V218 V236 Q238 V239	L164-A166 WeakPolarHBondContact CD1-O 3.34Å; L164-L167 HydrophobicContact CD1-CD2 4.35Å; L164-L167 HydrophobicContact CD2-CD2 4.03Å; L164-L167 HydrophobicContact CG-CD2 4.4Å; L164-V215 VanDerWaalsContact CA-O 3.31Å; L164-V215 WeakPolarHBondContact CA-O 3.46Å; L164-V215 HydrophobicContact CD1-CG1 4.5Å; L164-V215 PolarHBondContact N-O 3.3Å; L164-V218 HydrophobicContact CD1-CB 3.93Å; L164-V218 HydrophobicContact CD1-CG2 3.67Å; L164-V218 HydrophobicContact CD2-CB 4.31Å; L164-V218 HydrophobicContact CD2-CG2 3.86Å; L164-V218 HydrophobicContact CG-CG2 4.43Å; L164-V236 HydrophobicContact CD2-CG1 4.03Å; L164-Q238 CarbonylContact O-C 3.4Å; L164-V239 HydrophobicContact CG-CG2 3.92Å; L164-V239 WeakPolarHBondContact O-CG2 3.3Å; L164-V239 PolarHBondContact O-N 3.48Å
165	Q	98.3	Very high	94.4	Very high	15 Å²	15	40.8 Å²	40.8	7%	0.07	19%	0.192	C	C	.	.			trans	-108.3	-25.1	-172.2	-68.5	170	47	0	0	113.1	I157 D158 K161 C163 H216 V239 Q240 M241	I157-Q165 HydrophobicContact CD1-CB 3.92Å; D158-Q165 PolarHBondContact O-NE2 3.07Å; K161-Q165 PolarHBondContact O-NE2 2.67Å; K161-Q165 VanDerWaalsContact O-NE2 3.08Å; C163-Q165 PolarHBondContact O-N 3.07Å; Q165-H216 PolarHBondContact N-O 2.92Å; Q165-V239 CarbonylContact O-C 3.58Å; Q165-V239 WeakPolarHBondContact O-CA 3.25Å; Q165-Q240 PolarHBondContact O-N 2.52Å; Q165-M241 PolarHBondContact O-N 3.02Å
166	A	98.3	Very high	94.1	Very high	2 Å²	2	39.7 Å²	39.7	2%	0.017	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	145.2	179.4	0	0	0	0	0	113.9	L153 I157 L164 H216 V217 V218 M241	L153-A166 HydrophobicContact CD1-CB 3.85Å; L153-A166 HydrophobicContact CD2-CB 3.78Å; L153-A166 HydrophobicContact CG-CB 3.62Å; I157-A166 HydrophobicContact CD1-CB 4.13Å; L164-A166 WeakPolarHBondContact CD1-O 3.34Å; A166-H216 PolarHBondContact N-O 3.45Å; A166-V217 HydrophobicContact CB-CG2 4.47Å; A166-V217 WeakPolarHBondContact O-CA 3.5Å; A166-V218 PolarHBondContact O-N 3.17Å; A166-V218 VanDerWaalsContact O-N 3.11Å; A166-M241 WeakPolarHBondContact CA-O 3.46Å
167	L	98.3	Very high	93.7	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	140.2	173.4	-67.5	179.6	0	0	0	111	L164 I169 V218 I225 V236 V239 M241 I242 V243 L266	L164-L167 HydrophobicContact CD1-CD2 4.35Å; L164-L167 HydrophobicContact CD2-CD2 4.03Å; L164-L167 HydrophobicContact CG-CD2 4.4Å; L167-I169 HydrophobicContact CB-CD1 4.3Å; L167-V218 CarbonylContact C-O 3.53Å; L167-V218 WeakPolarHBondContact CA-O 3.11Å; L167-V218 HydrophobicContact CD2-CB 3.8Å; L167-V218 HydrophobicContact CD2-CG1 4.15Å; L167-I225 HydrophobicContact CD2-CD1 4.42Å; L167-I225 HydrophobicContact CD2-CG1 4.44Å; L167-V236 HydrophobicContact CD1-CG1 4.23Å; L167-V239 HydrophobicContact CD1-CG1 4.24Å; L167-V239 HydrophobicContact CD1-CG2 4.36Å; L167-V239 HydrophobicContact CG-CG1 4.01Å; L167-V239 HydrophobicContact CG-CG2 4.09Å; L167-M241 PolarHBondContact N-O 3.01Å; L167-I242 HydrophobicContact CB-CB 4.3Å; L167-I242 HydrophobicContact CB-CD1 4.29Å; L167-I242 HydrophobicContact CB-CG1 4.03Å; L167-I242 HydrophobicContact CD1-CD1 4.24Å; L167-I242 CarbonylContact O-C 3.58Å; L167-I242 WeakPolarHBondContact O-CA 3.36Å; L167-V243 PolarHBondContact O-N 3.48Å; L167-L266 HydrophobicContact CD1-CD1 4.21Å; L167-L266 HydrophobicContact CD1-CD2 3.66Å
168	V	98.5	Very high	93.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120.5	163.8	-173.4	0	0	0	0	108.7	Y149 L150 L153 V170 V179 V218 I219 A220 V243	Y149-V168 HydrophobicContact CE2-CG1 3.96Å; L150-V168 HydrophobicContact CD2-CG2 4.43Å; L153-V168 HydrophobicContact CD1-CG2 3.56Å; V168-V170 HydrophobicContact CG1-CG1 4.3Å; V168-V179 HydrophobicContact CG1-CG1 4.22Å; V168-V218 PolarHBondContact N-O 2.84Å; V168-I219 HydrophobicContact CB-CB 4.45Å; V168-I219 HydrophobicContact CB-CG1 4.02Å; V168-I219 HydrophobicContact CB-CG2 4.28Å; V168-I219 HydrophobicContact CG2-CG1 4.13Å; V168-I219 CarbonylContact O-C 3.56Å; V168-I219 WeakPolarHBondContact O-CA 3.27Å; V168-A220 PolarHBondContact O-N 3.27Å; V168-V243 HydrophobicContact CB-CB 4.31Å; V168-V243 HydrophobicContact CG1-CB 4.01Å; V168-V243 HydrophobicContact CG1-CG1 4.12Å; V168-V243 HydrophobicContact CG2-CB 4.15Å; V168-V243 HydrophobicContact CG2-CG2 4.24Å
169	I	97.8	Very high	93.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	133.7	-177.6	-47.4	-60.1	0	0	0	109.3	L167 A220 P222 I225 I242 V243 D245 L250 M259 M262	L167-I169 HydrophobicContact CB-CD1 4.3Å; I169-A220 WeakPolarHBondContact CA-O 3.32Å; I169-P222 HydrophobicContact CG2-CG 3.73Å; I169-I225 HydrophobicContact CD1-CG2 4.04Å; I169-I242 HydrophobicContact CD1-CD1 4.37Å; I169-I242 HydrophobicContact CG1-CD1 3.76Å; I169-I242 HydrophobicContact CG1-CG1 4.06Å; I169-V243 PolarHBondContact N-O 3.35Å; I169-D245 PolarHBondContact O-N 3.06Å; I169-D245 VanDerWaalsContact O-N 3.08Å; I169-L250 HydrophobicContact CB-CD1 4.15Å; I169-L250 HydrophobicContact CG2-CD1 4Å; I169-L250 HydrophobicContact CG2-CD2 3.84Å; I169-L250 WeakPolarHBondContact O-CD1 3.5Å; I169-M259 HydrophobicContact CB-CE 4.35Å; I169-M259 HydrophobicContact CG2-CE 3.95Å; I169-M259 HydrophobicContact CG2-SD 3.89Å; I169-M262 HydrophobicContact CD1-CE 3.99Å; I169-M262 HydrophobicContact CD1-SD 3.77Å; I169-M262 HydrophobicContact CG1-CE 3.85Å; I169-M262 HydrophobicContact CG1-SD 4.3Å; I169-M262 HydrophobicContact CG2-CE 4.34Å
170	V	94.5	Very high	93.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.154	C	C	.	.			trans	-142	144.1	-173.9	-69.4	0	0	0	0	111.4	V168 T172 L175 A176 A220 T221 D245	V168-V170 HydrophobicContact CG1-CG1 4.3Å; V170-T172 PolarHBondContact O-N 3.49Å; V170-L175 HydrophobicContact CB-CB 4.39Å; V170-L175 HydrophobicContact CB-CD2 3.97Å; V170-L175 HydrophobicContact CB-CG 4.11Å; V170-L175 HydrophobicContact CG1-CD2 3.8Å; V170-L175 HydrophobicContact CG1-CG 3.9Å; V170-A176 HydrophobicContact CG2-CB 3.59Å; V170-A220 WeakPolarHBondContact CG2-O 3.09Å; V170-A220 PolarHBondContact N-O 3.07Å; V170-T221 WeakPolarHBondContact O-CA 3.47Å; V170-D245 HydrophobicContact CG1-CB 4.34Å
171	P	90.3	Very high	93	Very high	23 Å²	23	27.1 Å²	27.1	15%	0.149	13%	0.134	C	C	.	.	S	Bend	trans	-75.6	-21.6	-174	29.2	-37.8	0	0	0	114.2	D245 E246 K249 L250	P171-D245 VanDerWaalsContact CD-O 3.25Å; P171-D245 WeakPolarHBondContact CD-O 3.14Å; P171-E246 HydrophobicContact CG-CB 3.81Å; P171-K249 HydrophobicContact CB-CB 3.67Å; P171-K249 HydrophobicContact CG-CB 3.91Å; P171-L250 HydrophobicContact CB-CD2 4.15Å
172	T	86.7	Confident	92.9	Very high	11 Å²	11	24 Å²	24	7%	0.067	12%	0.122	C	C	.	.			trans	-121	151.7	-176.5	69.7	0	0	0	0	112.7	V170 E174 L175 A176 R395	V170-T172 PolarHBondContact O-N 3.49Å; T172-E174 VanDerWaalsContact C-N 3.32Å; T172-L175 PolarHBondContact O-N 3.5Å; T172-L175 WeakPolarHBondContact OG1-CB 3.42Å; T172-L175 PolarHBondContact OG1-N 3.23Å; T172-L175 VanDerWaalsContact OG1-N 3.17Å; T172-A176 PolarHBondContact O-N 3.41Å; T172-R395 HydrophobicContact CG2-CB 4.28Å
173	R	86.3	Confident	92.9	Very high	82 Å²	82	18.1 Å²	18.1	31%	0.309	9%	0.091	S	C	.	.	H	α-helix	trans	-68	-39.9	-179.7	-55.9	161.8	-178.5	-154.8	-16.1	110.1	A176 L177 T199 G200 T221 Q369	R173-A176 WeakPolarHBondContact O-CB 3.27Å; R173-A176 PolarHBondContact O-N 3.36Å; R173-L177 WeakPolarHBondContact O-CG 3.28Å; R173-L177 PolarHBondContact O-N 2.71Å; R173-L177 VanDerWaalsContact O-N 3.14Å; R173-T199 HydrophobicContact CB-CG2 4.41Å; R173-G200 WeakPolarHBondContact CD-O 3.32Å; R173-G200 WeakPolarHBondContact CG-O 3.4Å; R173-G200 PolarHBondContact NE-O 3.24Å; R173-G200 PolarHBondContact NH1-O 3.12Å; R173-G200 PolarHBondContact NH2-O 3.29Å; R173-T221 HydrophobicContact CG-CG2 4.29Å; R173-Q369 VanDerWaalsContact CD-CD 3.49Å
174	E	83.1	Confident	92.9	Very high	3 Å²	3	20.4 Å²	20.4	1%	0.014	10%	0.1	C	C	.	.	H	α-helix	trans	-67.6	-37.4	179.4	-64.2	76.9	-175	0	0	112.2	T172 L177 Q178 Q369 R372 I397	T172-E174 VanDerWaalsContact C-N 3.32Å; E174-L177 PolarHBondContact O-N 2.73Å; E174-Q178 PolarHBondContact O-N 3.4Å; E174-Q369 PolarHBondContact OE1-NE2 3.15Å; E174-R372 VanDerWaalsContact CD-NH2 3.27Å; E174-R372 IonicContact OE1-CZ 3.41Å; E174-R372 VanDerWaalsContact OE1-CZ 3.23Å; E174-R372 IonicContact OE1-NE 3.72Å; E174-R372 PolarHBondContact OE1-NE 2.9Å; E174-R372 IonicContact OE1-NH2 2.71Å; E174-R372 PolarHBondContact OE1-NH2 2.81Å; E174-R372 IonicContact OE2-NH2 3.36Å; E174-R372 PolarHBondContact OE2-NH2 2.8Å; E174-R372 VanDerWaalsContact OE2-NH2 3.12Å; E174-I397 HydrophobicContact CB-CD1 3.65Å; E174-I397 HydrophobicContact CB-CG1 4.15Å; E174-I397 HydrophobicContact CG-CD1 4.25Å
175	L	86.6	Confident	92.8	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-67.4	-37.3	172.2	-177.8	56.5	0	0	0	111.7	V170 T172 L177 Q178 V179	V170-L175 HydrophobicContact CB-CB 4.39Å; V170-L175 HydrophobicContact CB-CD2 3.97Å; V170-L175 HydrophobicContact CB-CG 4.11Å; V170-L175 HydrophobicContact CG1-CD2 3.8Å; V170-L175 HydrophobicContact CG1-CG 3.9Å; T172-L175 PolarHBondContact O-N 3.5Å; T172-L175 WeakPolarHBondContact OG1-CB 3.42Å; T172-L175 PolarHBondContact OG1-N 3.23Å; T172-L175 VanDerWaalsContact OG1-N 3.17Å; L175-L177 VanDerWaalsContact C-N 3.31Å; L175-L177 PolarHBondContact O-N 2.67Å; L175-Q178 PolarHBondContact O-N 3.3Å; L175-V179 HydrophobicContact CD1-CG2 3.61Å; L175-V179 HydrophobicContact CG-CG2 4.03Å; L175-V179 WeakPolarHBondContact O-CG2 3.37Å; L175-V179 PolarHBondContact O-N 2.78Å
176	A	91.3	Very high	92.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.3	-42.2	174.8	0	0	0	0	0	111.9	V170 T172 R173 S180 T199 I219	V170-A176 HydrophobicContact CG2-CB 3.59Å; T172-A176 PolarHBondContact O-N 3.41Å; R173-A176 WeakPolarHBondContact O-CB 3.27Å; R173-A176 PolarHBondContact O-N 3.36Å; A176-S180 VanDerWaalsContact O-CB 3.28Å; A176-S180 WeakPolarHBondContact O-CB 3.22Å; A176-S180 PolarHBondContact O-N 3.22Å; A176-S180 PolarHBondContact O-OG 3.16Å; A176-T199 HydrophobicContact CB-CG2 3.46Å; A176-T199 VanDerWaalsContact CB-CG2 3.46Å; A176-I219 HydrophobicContact CB-CG2 4.18Å
177	L	87.7	Confident	92.6	Very high	57 Å²	57	24.2 Å²	24.2	30%	0.298	12%	0.118	S	C	.	.	H	α-helix	trans	-64.9	-38.6	175	-67	173.6	0	0	0	112.3	R173 E174 L175 S180 Q181 A197	R173-L177 WeakPolarHBondContact O-CG 3.28Å; R173-L177 PolarHBondContact O-N 2.71Å; R173-L177 VanDerWaalsContact O-N 3.14Å; E174-L177 PolarHBondContact O-N 2.73Å; L175-L177 VanDerWaalsContact C-N 3.31Å; L175-L177 PolarHBondContact O-N 2.67Å; L177-S180 WeakPolarHBondContact CA-OG 3.3Å; L177-S180 PolarHBondContact O-OG 2.59Å; L177-S180 VanDerWaalsContact O-OG 3.08Å; L177-Q181 WeakPolarHBondContact O-CB 3.35Å; L177-Q181 WeakPolarHBondContact O-CG 3.41Å; L177-Q181 PolarHBondContact O-N 3.15Å; L177-Q181 VanDerWaalsContact O-N 3.08Å; L177-A197 HydrophobicContact CD2-CB 4.44Å
178	Q	87.5	Confident	92.4	Very high	12 Å²	12	29.5 Å²	29.5	6%	0.056	14%	0.141	C	C	.	.	H	α-helix	trans	-67.3	-49.5	175	-179.4	176.2	-74.9	0	0	112.7	E174 L175 S180 Q181 I182 G396 I397	E174-Q178 PolarHBondContact O-N 3.4Å; L175-Q178 PolarHBondContact O-N 3.3Å; Q178-S180 VanDerWaalsContact C-N 3.32Å; Q178-S180 PolarHBondContact O-N 2.86Å; Q178-Q181 PolarHBondContact O-N 3.34Å; Q178-I182 HydrophobicContact CG-CD1 4Å; Q178-I182 WeakPolarHBondContact O-CG1 3.42Å; Q178-I182 PolarHBondContact O-N 3.15Å; Q178-G396 PolarHBondContact NE2-O 3.42Å; Q178-G396 VanDerWaalsContact NE2-O 3.15Å; Q178-I397 VanDerWaalsContact OE1-CA 3.32Å
179	V	93.8	Very high	92.2	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67.5	-35.5	-177	177.3	0	0	0	0	110.7	Y149 L150 V168 L175 I182 C183 I219	Y149-V179 HydrophobicContact CE2-CG1 3.86Å; Y149-V179 WeakPolarHBondContact OH-CG2 3.46Å; L150-V179 HydrophobicContact CD1-CG1 4.09Å; L150-V179 HydrophobicContact CD2-CG1 4.15Å; L150-V179 HydrophobicContact CG-CG1 4.42Å; V168-V179 HydrophobicContact CG1-CG1 4.22Å; L175-V179 HydrophobicContact CD1-CG2 3.61Å; L175-V179 HydrophobicContact CG-CG2 4.03Å; L175-V179 WeakPolarHBondContact O-CG2 3.37Å; L175-V179 PolarHBondContact O-N 2.78Å; V179-I182 PolarHBondContact O-N 2.96Å; V179-C183 VanDerWaalsContact O-CB 3.22Å; V179-C183 WeakPolarHBondContact O-CB 3.42Å; V179-C183 PolarHBondContact O-N 2.91Å; V179-I219 HydrophobicContact CB-CG2 4.14Å; V179-I219 HydrophobicContact CG1-CD1 4.2Å; V179-I219 HydrophobicContact CG1-CG2 4.19Å
180	S	94.8	Very high	92	Very high	9 Å²	9	32.9 Å²	32.9	6%	0.063	16%	0.157	C	C	.	.	H	α-helix	trans	-68.2	-40.3	172.7	55.7	0	0	0	0	113.3	A176 L177 Q178 I182 C183 I184 I219	A176-S180 VanDerWaalsContact O-CB 3.28Å; A176-S180 WeakPolarHBondContact O-CB 3.22Å; A176-S180 PolarHBondContact O-N 3.22Å; A176-S180 PolarHBondContact O-OG 3.16Å; L177-S180 WeakPolarHBondContact CA-OG 3.3Å; L177-S180 PolarHBondContact O-OG 2.59Å; L177-S180 VanDerWaalsContact O-OG 3.08Å; Q178-S180 VanDerWaalsContact C-N 3.32Å; Q178-S180 PolarHBondContact O-N 2.86Å; S180-I182 PolarHBondContact O-N 3.49Å; S180-C183 PolarHBondContact O-N 3.24Å; S180-I184 WeakPolarHBondContact O-CB 3.49Å; S180-I184 WeakPolarHBondContact O-CD1 3.38Å; S180-I184 WeakPolarHBondContact O-CG1 3.32Å; S180-I184 PolarHBondContact O-N 3.05Å; S180-I219 VanDerWaalsContact CA-CD1 3.43Å
181	Q	92.5	Very high	91.4	Very high	90 Å²	90	36.6 Å²	36.6	42%	0.421	20%	0.196	S	C	.	.	H	α-helix	trans	-57.9	-47.2	171.3	-77.8	172.4	6.8	0	0	111.7	L177 Q178 I184 Q185	L177-Q181 WeakPolarHBondContact O-CB 3.35Å; L177-Q181 WeakPolarHBondContact O-CG 3.41Å; L177-Q181 PolarHBondContact O-N 3.15Å; L177-Q181 VanDerWaalsContact O-N 3.08Å; Q178-Q181 PolarHBondContact O-N 3.34Å; Q181-I184 PolarHBondContact O-N 3.38Å; Q181-Q185 WeakPolarHBondContact O-CG 3.4Å; Q181-Q185 PolarHBondContact O-N 2.75Å; Q181-Q185 VanDerWaalsContact O-N 3.12Å
182	I	93.9	Very high	91.3	Very high	33 Å²	33	36.9 Å²	36.9	17%	0.169	20%	0.203	C	C	.	.	H	α-helix	trans	-61.3	-48.2	176.9	-64.8	165.3	0	0	0	110.4	M113 W115 L150 Q178 V179 S180 I184 Q185 V186	M113-I182 HydrophobicContact CE-CG1 4.47Å; M113-I182 HydrophobicContact CE-CG2 4.18Å; W115-I182 HydrophobicContact CH2-CG2 3.71Å; W115-I182 HydrophobicContact CZ2-CG2 4.08Å; L150-I182 HydrophobicContact CD1-CB 4.05Å; L150-I182 HydrophobicContact CD1-CG2 3.62Å; Q178-I182 HydrophobicContact CG-CD1 4Å; Q178-I182 WeakPolarHBondContact O-CG1 3.42Å; Q178-I182 PolarHBondContact O-N 3.15Å; V179-I182 PolarHBondContact O-N 2.96Å; S180-I182 PolarHBondContact O-N 3.49Å; I182-I184 PolarHBondContact O-N 3.39Å; I182-Q185 PolarHBondContact O-N 2.98Å; I182-V186 HydrophobicContact CG2-CG2 4.18Å; I182-V186 WeakPolarHBondContact O-CB 3.09Å; I182-V186 VanDerWaalsContact O-CG2 3.32Å; I182-V186 WeakPolarHBondContact O-CG2 3.34Å; I182-V186 PolarHBondContact O-N 3.48Å
183	C	97.1	Very high	91.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.4	-45.7	179.4	-171.4	0	0	0	0	111.9	L150 V179 S180 Q185 V186 S187 V195 I219	L150-C183 HydrophobicContact CD1-CB 3.94Å; L150-C183 HydrophobicContact CD2-CB 3.85Å; L150-C183 HydrophobicContact CG-CB 4.5Å; V179-C183 VanDerWaalsContact O-CB 3.22Å; V179-C183 WeakPolarHBondContact O-CB 3.42Å; V179-C183 PolarHBondContact O-N 2.91Å; S180-C183 PolarHBondContact O-N 3.24Å; C183-Q185 PolarHBondContact O-N 3.27Å; C183-V186 PolarHBondContact O-N 2.91Å; C183-S187 VanDerWaalsContact O-CB 3.3Å; C183-S187 WeakPolarHBondContact O-CB 3.41Å; C183-S187 PolarHBondContact O-N 3.19Å; C183-S187 PolarHBondContact O-OG 2.89Å; C183-S187 VanDerWaalsContact O-OG 3.06Å; C183-V195 HydrophobicContact CB-CG1 4.14Å; C183-V195 HydrophobicContact CB-CG2 4.36Å; C183-V195 VanDerWaalsContact SG-CG2 3.57Å; C183-I219 HydrophobicContact CB-CD1 3.94Å
184	I	96.4	Very high	92.3	Very high	79 Å²	79	38 Å²	38	41%	0.405	21%	0.211	S	C	.	.	H	α-helix	trans	-63.3	-41	178.4	-70.1	165.4	0	0	0	112.2	S180 Q181 I182 S187 K188 V195	S180-I184 WeakPolarHBondContact O-CB 3.49Å; S180-I184 WeakPolarHBondContact O-CD1 3.38Å; S180-I184 WeakPolarHBondContact O-CG1 3.32Å; S180-I184 PolarHBondContact O-N 3.05Å; Q181-I184 PolarHBondContact O-N 3.38Å; I182-I184 PolarHBondContact O-N 3.39Å; I184-S187 PolarHBondContact O-OG 3.12Å; I184-K188 PolarHBondContact O-N 3.49Å; I184-V195 HydrophobicContact CD1-CB 4.32Å; I184-V195 HydrophobicContact CG1-CB 3.72Å; I184-V195 HydrophobicContact CG1-CG1 4.17Å; I184-V195 HydrophobicContact CG1-CG2 3.95Å
185	Q	94.4	Very high	93	Very high	97 Å²	97	39 Å²	39	45%	0.453	22%	0.216	S	C	.	.	H	α-helix	trans	-70.2	-43.9	177.3	-64.6	-53.8	-49.6	0	0	111.8	M113 Q181 I182 C183 S187 K188	M113-Q185 HydrophobicContact CG-CB 4.3Å; M113-Q185 HydrophobicContact SD-CB 3.51Å; M113-Q185 VanDerWaalsContact SD-CB 3.51Å; M113-Q185 HydrophobicContact SD-CG 4.19Å; Q181-Q185 WeakPolarHBondContact O-CG 3.4Å; Q181-Q185 PolarHBondContact O-N 2.75Å; Q181-Q185 VanDerWaalsContact O-N 3.12Å; I182-Q185 PolarHBondContact O-N 2.98Å; C183-Q185 PolarHBondContact O-N 3.27Å; Q185-S187 VanDerWaalsContact C-N 3.32Å; Q185-S187 PolarHBondContact O-N 2.96Å; Q185-K188 WeakPolarHBondContact O-CB 3.31Å; Q185-K188 PolarHBondContact O-N 3.35Å
186	V	95.9	Very high	93.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.3	-35.2	177.7	175.8	0	0	0	0	111.3	L106 I110 M113 W115 L154 I182 C183 K188	L106-V186 HydrophobicContact CD1-CG1 3.52Å; I110-V186 HydrophobicContact CG1-CG1 4.2Å; M113-V186 HydrophobicContact CG-CG2 3.85Å; W115-V186 HydrophobicContact CH2-CG2 3.79Å; W115-V186 HydrophobicContact CZ3-CG2 3.76Å; L154-V186 HydrophobicContact CD1-CB 4.05Å; L154-V186 HydrophobicContact CD1-CG1 3.66Å; I182-V186 HydrophobicContact CG2-CG2 4.18Å; I182-V186 WeakPolarHBondContact O-CB 3.09Å; I182-V186 VanDerWaalsContact O-CG2 3.32Å; I182-V186 WeakPolarHBondContact O-CG2 3.34Å; I182-V186 PolarHBondContact O-N 3.48Å; C183-V186 PolarHBondContact O-N 2.91Å; V186-K188 VanDerWaalsContact C-N 3.34Å; V186-K188 PolarHBondContact O-N 3.45Å
187	S	96.6	Very high	93.7	Very high	10 Å²	10	40.8 Å²	40.8	7%	0.07	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	0.9	177.3	75.5	0	0	0	0	114.9	C183 I184 Q185 H189 M190	C183-S187 VanDerWaalsContact O-CB 3.3Å; C183-S187 WeakPolarHBondContact O-CB 3.41Å; C183-S187 PolarHBondContact O-N 3.19Å; C183-S187 PolarHBondContact O-OG 2.89Å; C183-S187 VanDerWaalsContact O-OG 3.06Å; I184-S187 PolarHBondContact O-OG 3.12Å; Q185-S187 VanDerWaalsContact C-N 3.32Å; Q185-S187 PolarHBondContact O-N 2.96Å; S187-H189 VanDerWaalsContact C-N 3.33Å; S187-H189 PolarHBondContact O-N 2.82Å; S187-M190 WeakPolarHBondContact O-CB 3.37Å; S187-M190 PolarHBondContact O-N 3.45Å
188	K	94.6	Very high	94.1	Very high	111 Å²	111	38 Å²	38	48%	0.483	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-43.2	-167.6	173.2	-175.8	164.7	-163.4	0	114.4	E112 I184 Q185 V186	E112-K188 VanDerWaalsContact CD-NZ 3.3Å; E112-K188 IonicContact OE1-NZ 2.73Å; E112-K188 PolarHBondContact OE1-NZ 3.49Å; E112-K188 WeakPolarHBondContact OE2-CD 3.48Å; E112-K188 WeakPolarHBondContact OE2-CE 3.4Å; E112-K188 IonicContact OE2-NZ 2.66Å; E112-K188 PolarHBondContact OE2-NZ 2.85Å; I184-K188 PolarHBondContact O-N 3.49Å; Q185-K188 WeakPolarHBondContact O-CB 3.31Å; Q185-K188 PolarHBondContact O-N 3.35Å; V186-K188 VanDerWaalsContact C-N 3.34Å; V186-K188 PolarHBondContact O-N 3.45Å
189	H	95	Very high	94.4	Very high	54 Å²	54	37.8 Å²	37.8	25%	0.25	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-6.8	-177.6	-56	-83.6	0	0	0	113.7	E105 M108 E112 S187 G191	E105-H189 HydrophobicContact CB-CB 4.38Å; E105-H189 WeakPolarHBondContact O-CB 3.43Å; M108-H189 HydrophobicContact CB-CB 4.22Å; M108-H189 HydrophobicContact CE-CB 4.38Å; E112-H189 VanDerWaalsContact CD-NE2 3.33Å; E112-H189 IonicContact OE1-CE1 2.67Å; E112-H189 IonicContact OE1-NE2 2.69Å; E112-H189 IonicContact OE2-CD2 2.8Å; E112-H189 IonicContact OE2-CE1 3.47Å; E112-H189 PolarHBondContact OE2-CE1 2.95Å; E112-H189 IonicContact OE2-NE2 3.33Å; E112-H189 PolarHBondContact OE2-NE2 3.31Å; S187-H189 VanDerWaalsContact C-N 3.33Å; S187-H189 PolarHBondContact O-N 2.82Å; H189-G191 PolarHBondContact O-N 3.08Å
190	M	93.4	Very high	93.9	Very high	17 Å²	17	38.6 Å²	38.6	8%	0.084	22%	0.223	C	C	.	.	S	Bend	trans	-71.2	2.5	-177.6	-58.3	-176.2	77.2	0	0	113.9	K103 E105 L106 L154 L159 S187 G192 V193	K103-M190 HydrophobicContact CD-CE 3.94Å; E105-M190 HydrophobicContact CB-CG 4.27Å; L106-M190 HydrophobicContact CB-CE 4.32Å; L106-M190 HydrophobicContact CB-CG 4.49Å; L106-M190 HydrophobicContact CB-SD 4.14Å; L106-M190 HydrophobicContact CD1-SD 4.03Å; L154-M190 HydrophobicContact CB-CE 4.47Å; L154-M190 HydrophobicContact CB-SD 4.05Å; L154-M190 HydrophobicContact CD2-SD 4.43Å; L159-M190 WeakPolarHBondContact CD1-O 3.28Å; S187-M190 WeakPolarHBondContact O-CB 3.37Å; S187-M190 PolarHBondContact O-N 3.45Å; M190-G192 VanDerWaalsContact C-N 3.26Å; M190-G192 PolarHBondContact O-N 3.02Å; M190-V193 HydrophobicContact CB-CG2 3.8Å; M190-V193 HydrophobicContact CE-CG2 4.42Å; M190-V193 HydrophobicContact SD-CG2 4Å
191	G	80.9	Confident	93.1	Very high	79 Å²	79	40.3 Å²	40.3	81%	0.814	24%	0.242	S	C	*	.	S	Bend	trans	68.5	10.8	162.3	0	0	0	0	0	117.2	H189	H189-G191 PolarHBondContact O-N 3.08Å
192	G	89.1	Confident	92.5	Very high	28 Å²	28	38.3 Å²	38.3	29%	0.289	24%	0.236	S	C	.	.	S	Bend	trans	-176.5	-17.7	-179.6	0	0	0	0	0	117.4	M190 K194	M190-G192 VanDerWaalsContact C-N 3.26Å; M190-G192 PolarHBondContact O-N 3.02Å; G192-K194 WeakPolarHBondContact O-CG 3.18Å; G192-K194 PolarHBondContact O-N 3.03Å
193	V	96.1	Very high	92.3	Very high	20 Å²	20	40.8 Å²	40.8	12%	0.121	25%	0.25	C	C	.	.			trans	-53.5	130.3	-176.9	-178.4	0	0	0	0	110.8	L154 L159 M190 V195 V217	L154-V193 HydrophobicContact CD2-CG1 3.83Å; L154-V193 HydrophobicContact CD2-CG2 4.4Å; L159-V193 HydrophobicContact CD1-CG2 4.43Å; L159-V193 HydrophobicContact CD2-CB 4.4Å; L159-V193 HydrophobicContact CD2-CG2 3.86Å; M190-V193 HydrophobicContact CB-CG2 3.8Å; M190-V193 HydrophobicContact CE-CG2 4.42Å; M190-V193 HydrophobicContact SD-CG2 4Å; V193-V195 HydrophobicContact CG1-CG2 3.92Å; V193-V217 HydrophobicContact CG1-CG2 4.43Å
194	K	97.4	Very high	92	Very high	98 Å²	98	43.2 Å²	43.2	43%	0.426	26%	0.263	S	S	.	.			trans	-114.5	105	179	-57.5	-59.4	-180	174.6	0	108.8	G192 T214 H216 V217	G192-K194 WeakPolarHBondContact O-CG 3.18Å; G192-K194 PolarHBondContact O-N 3.03Å; K194-T214 VanDerWaalsContact CB-O 3.26Å; K194-T214 WeakPolarHBondContact CB-O 3.47Å; K194-T214 HydrophobicContact CG-CG2 4.29Å; K194-T214 WeakPolarHBondContact CG-O 3.11Å; K194-H216 WeakPolarHBondContact CB-ND1 3.44Å; K194-H216 PolarHBondContact N-ND1 3.19Å; K194-H216 VanDerWaalsContact N-ND1 3.15Å; K194-H216 PolarHBondContact O-N 3.39Å; K194-V217 PolarHBondContact O-N 3.14Å; K194-V217 VanDerWaalsContact O-N 3.09Å
195	V	97.8	Very high	91.9	Very high	22 Å²	22	48 Å²	48	13%	0.133	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	136.2	177.8	-171.8	0	0	0	0	109.1	C183 I184 V193 V217 I219	C183-V195 HydrophobicContact CB-CG1 4.14Å; C183-V195 HydrophobicContact CB-CG2 4.36Å; C183-V195 VanDerWaalsContact SG-CG2 3.57Å; I184-V195 HydrophobicContact CD1-CB 4.32Å; I184-V195 HydrophobicContact CG1-CB 3.72Å; I184-V195 HydrophobicContact CG1-CG1 4.17Å; I184-V195 HydrophobicContact CG1-CG2 3.95Å; V193-V195 HydrophobicContact CG1-CG2 3.92Å; V195-V217 WeakPolarHBondContact CA-O 3.49Å; V195-I219 HydrophobicContact CG1-CD1 3.59Å; V195-I219 HydrophobicContact CG1-CG1 4.4Å
196	M	96.9	Very high	91.8	Very high	13 Å²	13	47.8 Å²	47.8	6%	0.064	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	136.7	173.7	-175.1	-170.6	-179.6	0	0	110.2	D207 R210 L211 V215 V217 V218 I219	M196-D207 HydrophobicContact CE-CB 3.98Å; M196-D207 WeakPolarHBondContact CE-O 3.4Å; M196-R210 HydrophobicContact CE-CB 3.98Å; M196-R210 HydrophobicContact CE-CG 3.99Å; M196-R210 HydrophobicContact CG-CG 4.28Å; M196-R210 HydrophobicContact SD-CG 4.04Å; M196-L211 HydrophobicContact CE-CD1 4.39Å; M196-L211 HydrophobicContact CE-CG 4.13Å; M196-L211 HydrophobicContact SD-CD1 4.35Å; M196-L211 HydrophobicContact SD-CD2 3.78Å; M196-L211 HydrophobicContact SD-CG 3.75Å; M196-V215 HydrophobicContact CB-CG1 3.68Å; M196-V215 HydrophobicContact CB-CG2 4.12Å; M196-V215 HydrophobicContact SD-CG2 4.13Å; M196-V217 PolarHBondContact N-O 3.41Å; M196-V218 HydrophobicContact CB-CG2 4.37Å; M196-V218 WeakPolarHBondContact O-CA 3.17Å; M196-I219 PolarHBondContact O-N 3.09Å
197	A	96.3	Very high	91.8	Very high	27 Å²	27	48.3 Å²	48.3	22%	0.223	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.1	164.9	0	0	0	0	0	109.5	L177 I219	L177-A197 HydrophobicContact CD2-CB 4.44Å; A197-I219 VanDerWaalsContact CA-O 3.3Å; A197-I219 WeakPolarHBondContact CA-O 3.24Å
198	T	95.8	Very high	91.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	122.8	175.7	169.7	0	0	0	0	110.1	D207 V218 I219 A220 T221 R224 L228	T198-D207 WeakPolarHBondContact CB-OD2 3.32Å; T198-D207 PolarHBondContact OG1-OD2 3.44Å; T198-V218 HydrophobicContact CG2-CG1 3.56Å; T198-I219 PolarHBondContact N-O 2.97Å; T198-A220 HydrophobicContact CG2-CB 3.78Å; T198-A220 WeakPolarHBondContact O-CA 3.36Å; T198-A220 VanDerWaalsContact O-CB 3.28Å; T198-A220 WeakPolarHBondContact O-CB 3.24Å; T198-T221 PolarHBondContact O-N 3.43Å; T198-R224 WeakPolarHBondContact OG1-CG 3.23Å; T198-L228 HydrophobicContact CG2-CD1 4.06Å; T198-L228 WeakPolarHBondContact OG1-CD1 3.48Å
199	T	93.4	Very high	91.7	Very high	6 Å²	6	50.1 Å²	50.1	4%	0.037	29%	0.292	C	S	.	.			trans	-143.4	156.3	-172.3	73.3	0	0	0	0	111	R173 A176 G201 T202 T221 R224	R173-T199 HydrophobicContact CB-CG2 4.41Å; A176-T199 HydrophobicContact CB-CG2 3.46Å; A176-T199 VanDerWaalsContact CB-CG2 3.46Å; T199-G201 PolarHBondContact O-N 2.9Å; T199-G201 VanDerWaalsContact O-N 3.16Å; T199-T202 PolarHBondContact O-N 2.85Å; T199-T202 VanDerWaalsContact O-N 3.09Å; T199-T202 PolarHBondContact O-OG1 3.12Å; T199-T202 VanDerWaalsContact O-OG1 3.07Å; T199-T221 WeakPolarHBondContact CA-OG1 3.29Å; T199-T221 HydrophobicContact CG2-CG2 4.04Å; T199-R224 VanDerWaalsContact O-CZ 3.28Å; T199-R224 PolarHBondContact O-NH1 2.78Å
200	G	82.6	Confident	91.7	Very high	18 Å²	18	50.5 Å²	50.5	19%	0.186	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	127.6	167.4	0	0	0	0	0	109.8	R173 T221	R173-G200 WeakPolarHBondContact CD-O 3.32Å; R173-G200 WeakPolarHBondContact CG-O 3.4Å; R173-G200 PolarHBondContact NE-O 3.24Å; R173-G200 PolarHBondContact NH1-O 3.12Å; R173-G200 PolarHBondContact NH2-O 3.29Å; G200-T221 PolarHBondContact N-OG1 3.5Å
201	G	77.8	Confident	91.8	Very high	45 Å²	45	51 Å²	51	46%	0.464	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.8	-5.7	-178.2	0	0	0	0	0	116.3	T199	T199-G201 PolarHBondContact O-N 2.9Å; T199-G201 VanDerWaalsContact O-N 3.16Å
202	T	81.7	Confident	92.3	Very high	47 Å²	47	53.6 Å²	53.6	29%	0.288	29%	0.289	S	S	.	.	S	Bend	trans	-77.4	155.6	148.8	62	0	0	0	0	109.1	T199 L204 D207 R224	T199-T202 PolarHBondContact O-N 2.85Å; T199-T202 VanDerWaalsContact O-N 3.09Å; T199-T202 PolarHBondContact O-OG1 3.12Å; T199-T202 VanDerWaalsContact O-OG1 3.07Å; T202-L204 PolarHBondContact O-N 2.98Å; T202-D207 WeakPolarHBondContact CB-OD1 3.41Å; T202-D207 VanDerWaalsContact OG1-CG 3.23Å; T202-D207 PolarHBondContact OG1-OD1 2.8Å; T202-D207 PolarHBondContact OG1-OD2 3.48Å; T202-R224 PolarHBondContact O-NH1 3.39Å; T202-R224 VanDerWaalsContact O-NH1 3.07Å; T202-R224 PolarHBondContact O-NH2 2.88Å; T202-R224 PolarHBondContact OG1-NH1 2.99Å
203	N	88.8	Confident	92.6	Very high	85 Å²	85	58.1 Å²	58.1	46%	0.455	30%	0.302	S	S	.	.			trans	-67.5	122.6	176.7	178.8	6.9	0	0	0	110.1	R205 D206 D207	N203-R205 PolarHBondContact O-N 2.98Å; N203-R205 PolarHBondContact OD1-N 2.86Å; N203-D206 HydrophobicContact CB-CB 4.25Å; N203-D206 VanDerWaalsContact CB-OD2 3.25Å; N203-D206 WeakPolarHBondContact CB-OD2 3.3Å; N203-D206 PolarHBondContact ND2-OD1 3.28Å; N203-D206 PolarHBondContact ND2-OD2 2.79Å; N203-D206 PolarHBondContact O-N 3.17Å; N203-D207 PolarHBondContact O-N 3.36Å
204	L	91.9	Very high	92.5	Very high	52 Å²	52	59.1 Å²	59.1	27%	0.272	31%	0.309	S	S	.	.	H	α-helix	trans	-62.3	-31.4	-178.9	179.7	63.8	0	0	0	112.3	T202 I208 L228	T202-L204 PolarHBondContact O-N 2.98Å; L204-I208 HydrophobicContact CD1-CD1 4.21Å; L204-I208 HydrophobicContact CD1-CG1 4.35Å; L204-I208 HydrophobicContact CG-CD1 3.94Å; L204-I208 WeakPolarHBondContact O-CD1 3.32Å; L204-I208 WeakPolarHBondContact O-CG1 3.26Å; L204-I208 PolarHBondContact O-N 2.86Å; L204-L228 HydrophobicContact CD1-CD2 3.73Å; L204-L228 HydrophobicContact CD1-CG 4.29Å
205	R	93	Very high	92.6	Very high	180 Å²	180	54.8 Å²	54.8	68%	0.679	29%	0.29	S	S	*	.	H	α-helix	trans	-65.5	-43.2	177.8	-172.8	-178.9	-173.8	171.3	4	111.6	N203 I208 M209	N203-R205 PolarHBondContact O-N 2.98Å; N203-R205 PolarHBondContact OD1-N 2.86Å; R205-I208 PolarHBondContact O-N 3.08Å; R205-M209 HydrophobicContact CG-SD 4.25Å; R205-M209 WeakPolarHBondContact O-CG 3.46Å; R205-M209 PolarHBondContact O-N 3.39Å
206	D	93.5	Very high	92.6	Very high	91 Å²	91	54 Å²	54	49%	0.487	29%	0.285	S	S	.	.	H	α-helix	trans	-74.9	-35.9	-176	-50.3	-17.3	0	0	0	110.1	N203 I208 M209 R210	N203-D206 HydrophobicContact CB-CB 4.25Å; N203-D206 VanDerWaalsContact CB-OD2 3.25Å; N203-D206 WeakPolarHBondContact CB-OD2 3.3Å; N203-D206 PolarHBondContact ND2-OD1 3.28Å; N203-D206 PolarHBondContact ND2-OD2 2.79Å; N203-D206 PolarHBondContact O-N 3.17Å; D206-I208 VanDerWaalsContact C-N 3.35Å; D206-M209 PolarHBondContact O-N 2.79Å; D206-R210 WeakPolarHBondContact O-CB 3.33Å; D206-R210 PolarHBondContact O-N 3.16Å
207	D	94.8	Very high	92.7	Very high	12 Å²	12	53.4 Å²	53.4	6%	0.064	28%	0.282	C	S	.	.	H	α-helix	trans	-58.3	-43.2	167.9	-79.1	21.1	0	0	0	112	M196 T198 T202 N203 R210 L211 R224	M196-D207 HydrophobicContact CE-CB 3.98Å; M196-D207 WeakPolarHBondContact CE-O 3.4Å; T198-D207 WeakPolarHBondContact CB-OD2 3.32Å; T198-D207 PolarHBondContact OG1-OD2 3.44Å; T202-D207 WeakPolarHBondContact CB-OD1 3.41Å; T202-D207 VanDerWaalsContact OG1-CG 3.23Å; T202-D207 PolarHBondContact OG1-OD1 2.8Å; T202-D207 PolarHBondContact OG1-OD2 3.48Å; N203-D207 PolarHBondContact O-N 3.36Å; D207-R210 PolarHBondContact O-N 3.3Å; D207-L211 WeakPolarHBondContact O-CG 3.11Å; D207-L211 PolarHBondContact O-N 2.99Å; D207-R224 IonicContact OD1-NH1 3.99Å; D207-R224 IonicContact OD2-CZ 2.6Å; D207-R224 IonicContact OD2-NH1 3.82Å; D207-R224 PolarHBondContact OD2-NH1 3.08Å
208	I	94.3	Very high	92.8	Very high	47 Å²	47	52.1 Å²	52.1	24%	0.241	27%	0.272	C	S	.	.	H	α-helix	trans	-65.6	-51.2	178	-70.7	165.4	0	0	0	110.3	L204 R205 D206 R210 L211 D212 L228 V233	L204-I208 HydrophobicContact CD1-CD1 4.21Å; L204-I208 HydrophobicContact CD1-CG1 4.35Å; L204-I208 HydrophobicContact CG-CD1 3.94Å; L204-I208 WeakPolarHBondContact O-CD1 3.32Å; L204-I208 WeakPolarHBondContact O-CG1 3.26Å; L204-I208 PolarHBondContact O-N 2.86Å; R205-I208 PolarHBondContact O-N 3.08Å; D206-I208 VanDerWaalsContact C-N 3.35Å; I208-R210 PolarHBondContact O-N 2.84Å; I208-L211 WeakPolarHBondContact O-CA 3.39Å; I208-L211 PolarHBondContact O-N 3.42Å; I208-D212 PolarHBondContact O-N 3.34Å; I208-L228 HydrophobicContact CG1-CD2 3.83Å; I208-V233 HydrophobicContact CB-CG1 4.36Å; I208-V233 HydrophobicContact CG1-CG1 4.19Å; I208-V233 HydrophobicContact CG1-CG2 4.27Å; I208-V233 HydrophobicContact CG2-CG1 4.11Å; I208-V233 HydrophobicContact CG2-CG2 4.31Å
209	M	95	Very high	92.9	Very high	111 Å²	111	52.1 Å²	52.1	55%	0.547	27%	0.272	S	S	.	.	H	α-helix	trans	-60.5	-32.2	178.8	-71	176.4	59.9	0	0	112.3	R205 D206 L211 D212	R205-M209 HydrophobicContact CG-SD 4.25Å; R205-M209 WeakPolarHBondContact O-CG 3.46Å; R205-M209 PolarHBondContact O-N 3.39Å; D206-M209 PolarHBondContact O-N 2.79Å; M209-L211 VanDerWaalsContact C-N 3.32Å; M209-D212 PolarHBondContact O-N 3.19Å
210	R	95.2	Very high	93.1	Very high	63 Å²	63	51.9 Å²	51.9	24%	0.238	27%	0.27	C	S	.	.	H	α-helix	trans	-72.5	-22.8	173.4	-179.5	56.4	-170	93.5	-10.4	113.1	M196 D206 D207 I208 E213 T214	M196-R210 HydrophobicContact CE-CB 3.98Å; M196-R210 HydrophobicContact CE-CG 3.99Å; M196-R210 HydrophobicContact CG-CG 4.28Å; M196-R210 HydrophobicContact SD-CG 4.04Å; D206-R210 WeakPolarHBondContact O-CB 3.33Å; D206-R210 PolarHBondContact O-N 3.16Å; D207-R210 PolarHBondContact O-N 3.3Å; I208-R210 PolarHBondContact O-N 2.84Å; R210-E213 WeakPolarHBondContact CD-OE2 3.46Å; R210-E213 IonicContact CZ-OE2 3.78Å; R210-E213 IonicContact NE-OE2 3.51Å; R210-E213 PolarHBondContact NE-OE2 2.88Å; R210-E213 VanDerWaalsContact NH1-CB 3.27Å; R210-E213 PolarHBondContact NH1-O 3.2Å; R210-E213 IonicContact NH1-OE2 3.6Å; R210-E213 PolarHBondContact NH1-OE2 3.47Å; R210-E213 IonicContact NH2-OE2 2.7Å; R210-T214 PolarHBondContact NH1-O 3.28Å; R210-T214 PolarHBondContact NH2-O 3.34Å; R210-T214 VanDerWaalsContact NH2-O 3.09Å
211	L	95.3	Very high	93.7	Very high	28 Å²	28	51.8 Å²	51.8	15%	0.147	27%	0.266	C	S	.	.	H	α-helix	trans	-85.9	-7.6	175.8	-76.5	164.9	0	0	0	113.8	M196 D207 I208 M209 E213 V215 V218 L228 V233 A234	M196-L211 HydrophobicContact CE-CD1 4.39Å; M196-L211 HydrophobicContact CE-CG 4.13Å; M196-L211 HydrophobicContact SD-CD1 4.35Å; M196-L211 HydrophobicContact SD-CD2 3.78Å; M196-L211 HydrophobicContact SD-CG 3.75Å; D207-L211 WeakPolarHBondContact O-CG 3.11Å; D207-L211 PolarHBondContact O-N 2.99Å; I208-L211 WeakPolarHBondContact O-CA 3.39Å; I208-L211 PolarHBondContact O-N 3.42Å; M209-L211 VanDerWaalsContact C-N 3.32Å; L211-E213 VanDerWaalsContact C-N 3.31Å; L211-V215 HydrophobicContact CD2-CB 4.34Å; L211-V215 HydrophobicContact CD2-CG2 3.98Å; L211-V218 HydrophobicContact CD2-CG2 4.43Å; L211-L228 HydrophobicContact CD1-CD1 3.95Å; L211-L228 HydrophobicContact CD1-CD2 4.09Å; L211-L228 HydrophobicContact CD1-CG 4.44Å; L211-V233 HydrophobicContact CB-CG1 3.68Å; L211-V233 HydrophobicContact CD1-CG1 3.86Å; L211-V233 HydrophobicContact CG-CG1 4.42Å; L211-A234 HydrophobicContact CD1-CB 4.4Å
212	D	92.3	Very high	94.5	Very high	132 Å²	132	49.7 Å²	49.7	71%	0.706	25%	0.245	S	C	*	.	S	Bend	trans	-73.3	-25.2	165.4	-64.6	-44.7	0	0	0	111.7	I208 M209	I208-D212 PolarHBondContact O-N 3.34Å; M209-D212 PolarHBondContact O-N 3.19Å
213	E	94.4	Very high	95.1	Very high	123 Å²	123	49.1 Å²	49.1	58%	0.575	25%	0.248	S	C	*	.	S	Bend	trans	-85.4	156.1	168.3	-71.9	-179.1	-177.4	0	0	112.1	R210 L211 V215	R210-E213 WeakPolarHBondContact CD-OE2 3.46Å; R210-E213 IonicContact CZ-OE2 3.78Å; R210-E213 IonicContact NE-OE2 3.51Å; R210-E213 PolarHBondContact NE-OE2 2.88Å; R210-E213 VanDerWaalsContact NH1-CB 3.27Å; R210-E213 PolarHBondContact NH1-O 3.2Å; R210-E213 IonicContact NH1-OE2 3.6Å; R210-E213 PolarHBondContact NH1-OE2 3.47Å; R210-E213 IonicContact NH2-OE2 2.7Å; L211-E213 VanDerWaalsContact C-N 3.31Å; E213-V215 PolarHBondContact O-N 3.05Å
214	T	95.4	Very high	95.5	Very high	41 Å²	41	46.6 Å²	46.6	25%	0.252	23%	0.232	S	C	.	.			trans	-51.9	127.6	174.5	-52.8	0	0	0	0	113	D162 K194 R210	D162-T214 HydrophobicContact CB-CG2 4.02Å; D162-T214 WeakPolarHBondContact OD1-CB 3.25Å; D162-T214 VanDerWaalsContact OD1-CG2 3.22Å; D162-T214 WeakPolarHBondContact OD1-CG2 3.4Å; D162-T214 PolarHBondContact OD1-OG1 2.99Å; K194-T214 VanDerWaalsContact CB-O 3.26Å; K194-T214 WeakPolarHBondContact CB-O 3.47Å; K194-T214 HydrophobicContact CG-CG2 4.29Å; K194-T214 WeakPolarHBondContact CG-O 3.11Å; R210-T214 PolarHBondContact NH1-O 3.28Å; R210-T214 PolarHBondContact NH2-O 3.34Å; R210-T214 VanDerWaalsContact NH2-O 3.09Å
215	V	97.9	Very high	95.7	Very high	7 Å²	7	44.1 Å²	44.1	4%	0.042	22%	0.219	C	C	.	.			trans	-130.9	123	167.3	-177.2	0	0	0	0	108.5	C163 L164 M196 L211 E213 V217 V218	C163-V215 CarbonylContact C-O 3.28Å; C163-V215 VanDerWaalsContact C-O 3.28Å; L164-V215 VanDerWaalsContact CA-O 3.31Å; L164-V215 WeakPolarHBondContact CA-O 3.46Å; L164-V215 HydrophobicContact CD1-CG1 4.5Å; L164-V215 PolarHBondContact N-O 3.3Å; M196-V215 HydrophobicContact CB-CG1 3.68Å; M196-V215 HydrophobicContact CB-CG2 4.12Å; M196-V215 HydrophobicContact SD-CG2 4.13Å; L211-V215 HydrophobicContact CD2-CB 4.34Å; L211-V215 HydrophobicContact CD2-CG2 3.98Å; E213-V215 PolarHBondContact O-N 3.05Å; V215-V217 WeakPolarHBondContact CG1-O 3.3Å; V215-V218 HydrophobicContact CG1-CG2 3.58Å
216	H	98.4	Very high	95.9	Very high	6 Å²	6	36 Å²	36	3%	0.028	19%	0.189	C	C	.	.	S	Bend	trans	-91	-35.8	178	-65.3	97.2	0	0	0	111.6	I157 Q165 A166 K194	I157-H216 HydrophobicContact CG2-CB 4.03Å; Q165-H216 PolarHBondContact N-O 2.92Å; A166-H216 PolarHBondContact N-O 3.45Å; K194-H216 WeakPolarHBondContact CB-ND1 3.44Å; K194-H216 PolarHBondContact N-ND1 3.19Å; K194-H216 VanDerWaalsContact N-ND1 3.15Å; K194-H216 PolarHBondContact O-N 3.39Å
217	V	98.5	Very high	96.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	124.8	-175.9	-174.3	0	0	0	0	110.1	L153 I157 A166 V193 K194 V195 M196 V215 I219	L153-V217 HydrophobicContact CD2-CB 4.49Å; L153-V217 HydrophobicContact CD2-CG1 3.89Å; L153-V217 HydrophobicContact CD2-CG2 3.72Å; I157-V217 HydrophobicContact CD1-CG2 3.8Å; I157-V217 HydrophobicContact CG1-CG2 4.13Å; A166-V217 HydrophobicContact CB-CG2 4.47Å; A166-V217 WeakPolarHBondContact O-CA 3.5Å; V193-V217 HydrophobicContact CG1-CG2 4.43Å; K194-V217 PolarHBondContact O-N 3.14Å; K194-V217 VanDerWaalsContact O-N 3.09Å; V195-V217 WeakPolarHBondContact CA-O 3.49Å; M196-V217 PolarHBondContact N-O 3.41Å; V215-V217 WeakPolarHBondContact CG1-O 3.3Å; V217-I219 HydrophobicContact CG1-CD1 4.47Å; V217-I219 HydrophobicContact CG1-CG1 4.17Å
218	V	98.4	Very high	96.2	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.2	171.7	167	0	0	0	0	110.6	L164 A166 L167 V168 M196 T198 L211 V215 A220 I225	L164-V218 HydrophobicContact CD1-CB 3.93Å; L164-V218 HydrophobicContact CD1-CG2 3.67Å; L164-V218 HydrophobicContact CD2-CB 4.31Å; L164-V218 HydrophobicContact CD2-CG2 3.86Å; L164-V218 HydrophobicContact CG-CG2 4.43Å; A166-V218 PolarHBondContact O-N 3.17Å; A166-V218 VanDerWaalsContact O-N 3.11Å; L167-V218 CarbonylContact C-O 3.53Å; L167-V218 WeakPolarHBondContact CA-O 3.11Å; L167-V218 HydrophobicContact CD2-CB 3.8Å; L167-V218 HydrophobicContact CD2-CG1 4.15Å; V168-V218 PolarHBondContact N-O 2.84Å; M196-V218 HydrophobicContact CB-CG2 4.37Å; M196-V218 WeakPolarHBondContact O-CA 3.17Å; T198-V218 HydrophobicContact CG2-CG1 3.56Å; L211-V218 HydrophobicContact CD2-CG2 4.43Å; V215-V218 HydrophobicContact CG1-CG2 3.58Å; V218-A220 HydrophobicContact CG1-CB 3.96Å; V218-I225 HydrophobicContact CG1-CD1 4.03Å
219	I	98.4	Very high	96.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	115.9	179.8	-58.8	168.9	0	0	0	107.7	V168 A176 V179 S180 C183 V195 M196 A197 T198 V217	V168-I219 HydrophobicContact CB-CB 4.45Å; V168-I219 HydrophobicContact CB-CG1 4.02Å; V168-I219 HydrophobicContact CB-CG2 4.28Å; V168-I219 HydrophobicContact CG2-CG1 4.13Å; V168-I219 CarbonylContact O-C 3.56Å; V168-I219 WeakPolarHBondContact O-CA 3.27Å; A176-I219 HydrophobicContact CB-CG2 4.18Å; V179-I219 HydrophobicContact CB-CG2 4.14Å; V179-I219 HydrophobicContact CG1-CD1 4.2Å; V179-I219 HydrophobicContact CG1-CG2 4.19Å; S180-I219 VanDerWaalsContact CA-CD1 3.43Å; C183-I219 HydrophobicContact CB-CD1 3.94Å; V195-I219 HydrophobicContact CG1-CD1 3.59Å; V195-I219 HydrophobicContact CG1-CG1 4.4Å; M196-I219 PolarHBondContact O-N 3.09Å; A197-I219 VanDerWaalsContact CA-O 3.3Å; A197-I219 WeakPolarHBondContact CA-O 3.24Å; T198-I219 PolarHBondContact N-O 2.97Å; V217-I219 HydrophobicContact CG1-CD1 4.47Å; V217-I219 HydrophobicContact CG1-CG1 4.17Å
220	A	97.3	Very high	96.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	157.6	-159.9	0	0	0	0	0	117.2	V168 I169 V170 T198 V218 I225	V168-A220 PolarHBondContact O-N 3.27Å; I169-A220 WeakPolarHBondContact CA-O 3.32Å; V170-A220 WeakPolarHBondContact CG2-O 3.09Å; V170-A220 PolarHBondContact N-O 3.07Å; T198-A220 HydrophobicContact CG2-CB 3.78Å; T198-A220 WeakPolarHBondContact O-CA 3.36Å; T198-A220 VanDerWaalsContact O-CB 3.28Å; T198-A220 WeakPolarHBondContact O-CB 3.24Å; V218-A220 HydrophobicContact CG1-CB 3.96Å; A220-I225 HydrophobicContact CB-CB 3.73Å; A220-I225 HydrophobicContact CB-CG1 4.45Å; A220-I225 HydrophobicContact CB-CG2 3.96Å
221	T	95.3	Very high	96.5	Very high	17 Å²	17	33.6 Å²	33.6	10%	0.104	17%	0.173	C	C	.	.			trans	-88.1	135.6	167.3	58.2	0	0	0	0	110.9	V170 R173 T198 T199 G200 G223 R224 I225	V170-T221 WeakPolarHBondContact O-CA 3.47Å; R173-T221 HydrophobicContact CG-CG2 4.29Å; T198-T221 PolarHBondContact O-N 3.43Å; T199-T221 WeakPolarHBondContact CA-OG1 3.29Å; T199-T221 HydrophobicContact CG2-CG2 4.04Å; G200-T221 PolarHBondContact N-OG1 3.5Å; T221-G223 PolarHBondContact O-N 3.14Å; T221-R224 PolarHBondContact O-N 2.8Å; T221-I225 PolarHBondContact O-N 3.2Å
222	P	95.2	Very high	96.5	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-44.5	-56.5	-167.5	-31.8	32.9	0	0	0	116	I169 R224 I225 L226 L250 F255 M258 M259	I169-P222 HydrophobicContact CG2-CG 3.73Å; P222-R224 VanDerWaalsContact C-N 3.26Å; P222-R224 PolarHBondContact O-N 3.39Å; P222-R224 VanDerWaalsContact O-N 3.17Å; P222-I225 VanDerWaalsContact O-CG2 3.24Å; P222-I225 WeakPolarHBondContact O-CG2 3.12Å; P222-I225 PolarHBondContact O-N 2.98Å; P222-L226 WeakPolarHBondContact O-CB 3.47Å; P222-L226 PolarHBondContact O-N 3.4Å; P222-L250 HydrophobicContact CG-CD2 3.68Å; P222-F255 HydrophobicContact CB-CD1 4.21Å; P222-F255 HydrophobicContact CG-CD1 4.15Å; P222-M258 HydrophobicContact CB-CB 4.47Å; P222-M259 HydrophobicContact CB-SD 3.93Å; P222-M259 HydrophobicContact CG-SD 3.69Å
223	G	94.9	Very high	96.7	Very high	34 Å²	34	29.8 Å²	29.8	35%	0.351	17%	0.165	S	C	.	.	H	α-helix	trans	-64	-23.5	-174.7	0	0	0	0	0	115.2	T221 D227	T221-G223 PolarHBondContact O-N 3.14Å; G223-D227 WeakPolarHBondContact O-CB 3.43Å; G223-D227 PolarHBondContact O-N 2.89Å
224	R	95.5	Very high	96.8	Very high	32 Å²	32	24 Å²	24	12%	0.121	14%	0.139	C	C	.	.	H	α-helix	trans	-82.8	-44.1	177.3	172	57.7	67.1	80.9	1.2	111.8	T198 T199 T202 D207 T221 P222 L226 D227 L228	T198-R224 WeakPolarHBondContact OG1-CG 3.23Å; T199-R224 VanDerWaalsContact O-CZ 3.28Å; T199-R224 PolarHBondContact O-NH1 2.78Å; T202-R224 PolarHBondContact O-NH1 3.39Å; T202-R224 VanDerWaalsContact O-NH1 3.07Å; T202-R224 PolarHBondContact O-NH2 2.88Å; T202-R224 PolarHBondContact OG1-NH1 2.99Å; D207-R224 IonicContact OD1-NH1 3.99Å; D207-R224 IonicContact OD2-CZ 2.6Å; D207-R224 IonicContact OD2-NH1 3.82Å; D207-R224 PolarHBondContact OD2-NH1 3.08Å; T221-R224 PolarHBondContact O-N 2.8Å; P222-R224 VanDerWaalsContact C-N 3.26Å; P222-R224 PolarHBondContact O-N 3.39Å; P222-R224 VanDerWaalsContact O-N 3.17Å; R224-L226 VanDerWaalsContact C-N 3.33Å; R224-D227 PolarHBondContact O-N 3.24Å; R224-L228 HydrophobicContact CG-CD1 4.12Å; R224-L228 WeakPolarHBondContact O-CG 3.34Å; R224-L228 PolarHBondContact O-N 2.92Å
225	I	97.3	Very high	96.9	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-67	-37.7	176.8	-176.7	56.1	0	0	0	111	L167 I169 V218 A220 T221 P222 D227 L228 I229 A234 M262	L167-I225 HydrophobicContact CD2-CD1 4.42Å; L167-I225 HydrophobicContact CD2-CG1 4.44Å; I169-I225 HydrophobicContact CD1-CG2 4.04Å; V218-I225 HydrophobicContact CG1-CD1 4.03Å; A220-I225 HydrophobicContact CB-CB 3.73Å; A220-I225 HydrophobicContact CB-CG1 4.45Å; A220-I225 HydrophobicContact CB-CG2 3.96Å; T221-I225 PolarHBondContact O-N 3.2Å; P222-I225 VanDerWaalsContact O-CG2 3.24Å; P222-I225 WeakPolarHBondContact O-CG2 3.12Å; P222-I225 PolarHBondContact O-N 2.98Å; I225-D227 PolarHBondContact O-N 2.88Å; I225-L228 PolarHBondContact O-N 3.3Å; I225-I229 HydrophobicContact CD1-CD1 4.25Å; I225-I229 HydrophobicContact CD1-CG1 4.21Å; I225-I229 HydrophobicContact CG1-CD1 3.89Å; I225-I229 HydrophobicContact CG1-CG1 4.36Å; I225-I229 WeakPolarHBondContact O-CB 3.5Å; I225-I229 VanDerWaalsContact O-CG1 3.23Å; I225-I229 WeakPolarHBondContact O-CG1 3.41Å; I225-I229 PolarHBondContact O-N 3.32Å; I225-A234 HydrophobicContact CD1-CB 3.84Å; I225-M262 HydrophobicContact CG2-SD 3.69Å
226	L	97.3	Very high	96.9	Very high	8 Å²	8	29.4 Å²	29.4	4%	0.042	16%	0.159	C	C	.	.	H	α-helix	trans	-61.1	-42.1	173.4	-177.8	60.8	0	0	0	112.7	P222 R224 I229 K230 M258 E261 M262 F265	P222-L226 WeakPolarHBondContact O-CB 3.47Å; P222-L226 PolarHBondContact O-N 3.4Å; R224-L226 VanDerWaalsContact C-N 3.33Å; L226-I229 PolarHBondContact O-N 2.83Å; L226-K230 HydrophobicContact CD1-CD 4.45Å; L226-K230 HydrophobicContact CD1-CG 4.42Å; L226-K230 HydrophobicContact CG-CD 4.36Å; L226-K230 WeakPolarHBondContact O-CB 3.26Å; L226-K230 VanDerWaalsContact O-CG 3.32Å; L226-K230 WeakPolarHBondContact O-CG 3.42Å; L226-K230 PolarHBondContact O-N 3.07Å; L226-M258 HydrophobicContact CD2-CB 3.74Å; L226-M258 HydrophobicContact CD2-CG 3.72Å; L226-E261 HydrophobicContact CD1-CB 4.34Å; L226-E261 HydrophobicContact CD1-CG 4.19Å; L226-M262 HydrophobicContact CD1-CB 4.19Å; L226-F265 HydrophobicContact CD1-CD2 4.43Å; L226-F265 HydrophobicContact CD1-CE2 4.17Å
227	D	96.8	Very high	96.8	Very high	52 Å²	52	35 Å²	35	28%	0.278	19%	0.189	S	C	.	.	H	α-helix	trans	-64.3	-40.3	175.4	-175.5	54.9	0	0	0	112.2	G223 R224 I225 K230 K231	G223-D227 WeakPolarHBondContact O-CB 3.43Å; G223-D227 PolarHBondContact O-N 2.89Å; R224-D227 PolarHBondContact O-N 3.24Å; I225-D227 PolarHBondContact O-N 2.88Å; D227-K230 PolarHBondContact O-N 3.1Å; D227-K231 VanDerWaalsContact O-CG 3.31Å; D227-K231 WeakPolarHBondContact O-CG 3.39Å; D227-K231 PolarHBondContact O-N 3.43Å; D227-K231 VanDerWaalsContact O-N 3.12Å; D227-K231 WeakPolarHBondContact OD1-CE 3.31Å; D227-K231 IonicContact OD1-NZ 2.7Å; D227-K231 PolarHBondContact OD1-NZ 3.02Å; D227-K231 WeakPolarHBondContact OD2-CE 3.09Å; D227-K231 IonicContact OD2-NZ 3.19Å; D227-K231 PolarHBondContact OD2-NZ 3.04Å
228	L	97.4	Very high	96.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-69.1	-35.2	175.9	-71.6	166.6	0	0	0	113.1	T198 L204 I208 L211 R224 I225 V233 A234	T198-L228 HydrophobicContact CG2-CD1 4.06Å; T198-L228 WeakPolarHBondContact OG1-CD1 3.48Å; L204-L228 HydrophobicContact CD1-CD2 3.73Å; L204-L228 HydrophobicContact CD1-CG 4.29Å; I208-L228 HydrophobicContact CG1-CD2 3.83Å; L211-L228 HydrophobicContact CD1-CD1 3.95Å; L211-L228 HydrophobicContact CD1-CD2 4.09Å; L211-L228 HydrophobicContact CD1-CG 4.44Å; R224-L228 HydrophobicContact CG-CD1 4.12Å; R224-L228 WeakPolarHBondContact O-CG 3.34Å; R224-L228 PolarHBondContact O-N 2.92Å; I225-L228 PolarHBondContact O-N 3.3Å; L228-V233 HydrophobicContact CD2-CB 4.42Å; L228-V233 HydrophobicContact CD2-CG1 4.36Å; L228-V233 PolarHBondContact O-N 3.27Å; L228-V233 VanDerWaalsContact O-N 3.09Å; L228-A234 HydrophobicContact CB-CB 3.83Å; L228-A234 PolarHBondContact O-N 3.1Å
229	I	97.6	Very high	96.7	Very high	11 Å²	11	39.8 Å²	39.8	6%	0.056	21%	0.211	C	C	.	.	H	α-helix	trans	-66.4	-49.4	172.9	-70.5	165.6	0	0	0	109.9	I225 L226 K231 G232 A234 V236 M262 F265	I225-I229 HydrophobicContact CD1-CD1 4.25Å; I225-I229 HydrophobicContact CD1-CG1 4.21Å; I225-I229 HydrophobicContact CG1-CD1 3.89Å; I225-I229 HydrophobicContact CG1-CG1 4.36Å; I225-I229 WeakPolarHBondContact O-CB 3.5Å; I225-I229 VanDerWaalsContact O-CG1 3.23Å; I225-I229 WeakPolarHBondContact O-CG1 3.41Å; I225-I229 PolarHBondContact O-N 3.32Å; L226-I229 PolarHBondContact O-N 2.83Å; I229-K231 PolarHBondContact O-N 3.14Å; I229-G232 PolarHBondContact O-N 2.67Å; I229-A234 HydrophobicContact CG1-CB 3.94Å; I229-V236 HydrophobicContact CD1-CG1 3.83Å; I229-V236 HydrophobicContact CD1-CG2 4.18Å; I229-V236 HydrophobicContact CG1-CG1 3.8Å; I229-V236 HydrophobicContact CG1-CG2 4.12Å; I229-V236 HydrophobicContact CG2-CG2 4.17Å; I229-M262 HydrophobicContact CD1-CG 4.04Å; I229-F265 HydrophobicContact CG2-CB 3.65Å; I229-F265 HydrophobicContact CG2-CD1 3.72Å; I229-F265 HydrophobicContact CG2-CD2 3.67Å; I229-F265 HydrophobicContact CG2-CE1 4.25Å; I229-F265 HydrophobicContact CG2-CE2 4.21Å; I229-F265 HydrophobicContact CG2-CG 3.4Å; I229-F265 VanDerWaalsContact CG2-CG 3.4Å; I229-F265 HydrophobicContact CG2-CZ 4.48Å
230	K	96.8	Very high	96.6	Very high	108 Å²	108	44.7 Å²	44.7	47%	0.47	23%	0.234	S	C	.	.	H	α-helix	trans	-60.5	-29.8	179.7	-77	-179.2	178.8	-171.8	0	113.7	L226 D227 G232 E261 F265	L226-K230 HydrophobicContact CD1-CD 4.45Å; L226-K230 HydrophobicContact CD1-CG 4.42Å; L226-K230 HydrophobicContact CG-CD 4.36Å; L226-K230 WeakPolarHBondContact O-CB 3.26Å; L226-K230 VanDerWaalsContact O-CG 3.32Å; L226-K230 WeakPolarHBondContact O-CG 3.42Å; L226-K230 PolarHBondContact O-N 3.07Å; D227-K230 PolarHBondContact O-N 3.1Å; K230-G232 VanDerWaalsContact C-N 3.27Å; K230-G232 PolarHBondContact O-N 3Å; K230-E261 WeakPolarHBondContact CE-OE1 3.18Å; K230-E261 VanDerWaalsContact CE-OE2 3.23Å; K230-E261 WeakPolarHBondContact CE-OE2 3.36Å; K230-E261 IonicContact NZ-OE1 2.74Å; K230-E261 PolarHBondContact NZ-OE1 2.98Å; K230-E261 IonicContact NZ-OE2 2.7Å; K230-E261 PolarHBondContact NZ-OE2 2.95Å; K230-F265 HydrophobicContact CG-CE2 4.29Å; K230-F265 HydrophobicContact CG-CZ 4.13Å
231	K	96	Very high	96.7	Very high	104 Å²	104	44.9 Å²	44.9	45%	0.452	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-2.1	173.6	-68.3	179.5	-141.3	-60	0	114.2	D227 I229 V233	D227-K231 VanDerWaalsContact O-CG 3.31Å; D227-K231 WeakPolarHBondContact O-CG 3.39Å; D227-K231 PolarHBondContact O-N 3.43Å; D227-K231 VanDerWaalsContact O-N 3.12Å; D227-K231 WeakPolarHBondContact OD1-CE 3.31Å; D227-K231 IonicContact OD1-NZ 2.7Å; D227-K231 PolarHBondContact OD1-NZ 3.02Å; D227-K231 WeakPolarHBondContact OD2-CE 3.09Å; D227-K231 IonicContact OD2-NZ 3.19Å; D227-K231 PolarHBondContact OD2-NZ 3.04Å; I229-K231 PolarHBondContact O-N 3.14Å; K231-V233 HydrophobicContact CB-CG2 3.93Å; K231-V233 PolarHBondContact O-N 3.35Å
232	G	95.4	Very high	96.8	Very high	48 Å²	48	44 Å²	44	50%	0.495	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	8.8	-176.2	0	0	0	0	0	114.8	I229 K230	I229-G232 PolarHBondContact O-N 2.67Å; K230-G232 VanDerWaalsContact C-N 3.27Å; K230-G232 PolarHBondContact O-N 3Å
233	V	96.2	Very high	96.9	Very high	31 Å²	31	44 Å²	44	19%	0.188	23%	0.229	C	C	.	.			trans	-81.3	-53.7	-178	-178.7	0	0	0	0	109.8	I208 L211 L228 K231 K235	I208-V233 HydrophobicContact CB-CG1 4.36Å; I208-V233 HydrophobicContact CG1-CG1 4.19Å; I208-V233 HydrophobicContact CG1-CG2 4.27Å; I208-V233 HydrophobicContact CG2-CG1 4.11Å; I208-V233 HydrophobicContact CG2-CG2 4.31Å; L211-V233 HydrophobicContact CB-CG1 3.68Å; L211-V233 HydrophobicContact CD1-CG1 3.86Å; L211-V233 HydrophobicContact CG-CG1 4.42Å; L228-V233 HydrophobicContact CD2-CB 4.42Å; L228-V233 HydrophobicContact CD2-CG1 4.36Å; L228-V233 PolarHBondContact O-N 3.27Å; L228-V233 VanDerWaalsContact O-N 3.09Å; K231-V233 HydrophobicContact CB-CG2 3.93Å; K231-V233 PolarHBondContact O-N 3.35Å; V233-K235 PolarHBondContact O-N 2.88Å
234	A	97.1	Very high	97	Very high	3 Å²	3	42.4 Å²	42.4	3%	0.025	21%	0.213	C	C	.	.	S	Bend	trans	-79.6	88.5	173.7	0	0	0	0	0	110.4	L211 I225 L228 I229 V236	L211-A234 HydrophobicContact CD1-CB 4.4Å; I225-A234 HydrophobicContact CD1-CB 3.84Å; L228-A234 HydrophobicContact CB-CB 3.83Å; L228-A234 PolarHBondContact O-N 3.1Å; I229-A234 HydrophobicContact CG1-CB 3.94Å; A234-V236 PolarHBondContact O-N 3.21Å
235	K	96.9	Very high	97	Very high	158 Å²	158	41.1 Å²	41.1	69%	0.687	21%	0.208	S	C	*	.			trans	-73.8	89.3	179.6	-65.8	166.5	-172.1	159.7	0	111.1	V233 N237	V233-K235 PolarHBondContact O-N 2.88Å; K235-N237 PolarHBondContact O-N 2.74Å
236	V	97.4	Very high	96.6	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.018	21%	0.208	C	C	.	.			trans	-85.6	2.4	-174	-70.3	0	0	0	0	115.6	L164 L167 I229 A234 Q238 V239 F265 L266 P267	L164-V236 HydrophobicContact CD2-CG1 4.03Å; L167-V236 HydrophobicContact CD1-CG1 4.23Å; I229-V236 HydrophobicContact CD1-CG1 3.83Å; I229-V236 HydrophobicContact CD1-CG2 4.18Å; I229-V236 HydrophobicContact CG1-CG1 3.8Å; I229-V236 HydrophobicContact CG1-CG2 4.12Å; I229-V236 HydrophobicContact CG2-CG2 4.17Å; A234-V236 PolarHBondContact O-N 3.21Å; V236-Q238 PolarHBondContact O-N 3.5Å; V236-V239 HydrophobicContact CB-CG2 3.92Å; V236-V239 HydrophobicContact CG1-CG2 4.09Å; V236-V239 WeakPolarHBondContact O-CB 3.24Å; V236-V239 WeakPolarHBondContact O-CG2 3.01Å; V236-V239 PolarHBondContact O-N 2.84Å; V236-F265 HydrophobicContact CG2-CB 4.04Å; V236-L266 HydrophobicContact CB-CD2 3.6Å; V236-L266 HydrophobicContact CG1-CD2 4.02Å; V236-L266 HydrophobicContact CG2-CD2 3.8Å; V236-P267 WeakPolarHBondContact O-CD 3.44Å
237	N	96.3	Very high	96.4	Very high	123 Å²	123	40.8 Å²	40.8	66%	0.658	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-11.5	-174.4	-55.5	19.8	0	0	0	114.8	K235 P267	K235-N237 PolarHBondContact O-N 2.74Å; N237-P267 WeakPolarHBondContact O-CG 3.29Å
238	Q	96.9	Very high	95.9	Very high	101 Å²	101	38.5 Å²	38.5	47%	0.472	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	2.2	177.9	-66.2	-65.9	-41.9	0	0	113.1	C163 L164 V236 Q240	C163-Q238 HydrophobicContact CB-CB 4.27Å; C163-Q238 HydrophobicContact CB-CG 4.31Å; L164-Q238 CarbonylContact O-C 3.4Å; V236-Q238 PolarHBondContact O-N 3.5Å; Q238-Q240 PolarHBondContact O-N 3.06Å; Q238-Q240 VanDerWaalsContact O-N 3.12Å; Q238-Q240 PolarHBondContact O-NE2 2.85Å
239	V	98	Very high	95.5	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.			trans	-66.5	111.2	180	173.5	0	0	0	0	110.4	L164 Q165 L167 V236 M241 L266	L164-V239 HydrophobicContact CG-CG2 3.92Å; L164-V239 WeakPolarHBondContact O-CG2 3.3Å; L164-V239 PolarHBondContact O-N 3.48Å; Q165-V239 CarbonylContact O-C 3.58Å; Q165-V239 WeakPolarHBondContact O-CA 3.25Å; L167-V239 HydrophobicContact CD1-CG1 4.24Å; L167-V239 HydrophobicContact CD1-CG2 4.36Å; L167-V239 HydrophobicContact CG-CG1 4.01Å; L167-V239 HydrophobicContact CG-CG2 4.09Å; V236-V239 HydrophobicContact CB-CG2 3.92Å; V236-V239 HydrophobicContact CG1-CG2 4.09Å; V236-V239 WeakPolarHBondContact O-CB 3.24Å; V236-V239 WeakPolarHBondContact O-CG2 3.01Å; V236-V239 PolarHBondContact O-N 2.84Å; V239-M241 WeakPolarHBondContact CG1-O 3.33Å; V239-L266 HydrophobicContact CB-CD2 4.39Å; V239-L266 HydrophobicContact CG1-CD2 4.44Å
240	Q	97.2	Very high	95.2	Very high	104 Å²	104	39.4 Å²	39.4	49%	0.486	20%	0.198	S	C	.	.			trans	-91.3	-24.1	178	-56.5	-52.1	-66	0	0	112.4	Q165 Q238 R270 Q271	Q165-Q240 PolarHBondContact O-N 2.52Å; Q238-Q240 PolarHBondContact O-N 3.06Å; Q238-Q240 VanDerWaalsContact O-N 3.12Å; Q238-Q240 PolarHBondContact O-NE2 2.85Å; Q240-R270 CarbonylContact O-C 3.58Å; Q240-R270 WeakPolarHBondContact O-CA 3.18Å; Q240-Q271 PolarHBondContact O-N 3.29Å
241	M	98.4	Very high	95	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.015	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	134.9	-177.1	-172.1	-172.3	-74.1	0	0	111.6	L153 R156 Q165 A166 L167 V239 V243 Q271 L273	L153-M241 HydrophobicContact CB-SD 3.63Å; L153-M241 HydrophobicContact CD1-SD 4.27Å; L153-M241 HydrophobicContact CG-SD 3.95Å; R156-M241 HydrophobicContact CB-CE 4.4Å; R156-M241 HydrophobicContact CG-CE 3.98Å; Q165-M241 PolarHBondContact O-N 3.02Å; A166-M241 WeakPolarHBondContact CA-O 3.46Å; L167-M241 PolarHBondContact N-O 3.01Å; V239-M241 WeakPolarHBondContact CG1-O 3.33Å; M241-V243 HydrophobicContact SD-CG2 4.45Å; M241-Q271 WeakPolarHBondContact CA-O 3.45Å; M241-Q271 VanDerWaalsContact CE-OE1 3.28Å; M241-Q271 HydrophobicContact CG-CB 4.46Å; M241-L273 HydrophobicContact CE-CD1 4.17Å; M241-L273 HydrophobicContact CG-CD1 4.32Å; M241-L273 HydrophobicContact CG-CG 4.46Å; M241-L273 HydrophobicContact SD-CD1 3.71Å; M241-L273 HydrophobicContact SD-CG 4.46Å
242	I	98.3	Very high	94.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	129.7	168.4	-179.3	164.5	0	0	0	110.9	L167 I169 L244 M262 L263 L266 Q271 I272 L273	L167-I242 HydrophobicContact CB-CB 4.3Å; L167-I242 HydrophobicContact CB-CD1 4.29Å; L167-I242 HydrophobicContact CB-CG1 4.03Å; L167-I242 HydrophobicContact CD1-CD1 4.24Å; L167-I242 CarbonylContact O-C 3.58Å; L167-I242 WeakPolarHBondContact O-CA 3.36Å; I169-I242 HydrophobicContact CD1-CD1 4.37Å; I169-I242 HydrophobicContact CG1-CD1 3.76Å; I169-I242 HydrophobicContact CG1-CG1 4.06Å; I242-L244 HydrophobicContact CG1-CD1 4.11Å; I242-M262 HydrophobicContact CD1-CE 4.14Å; I242-L263 HydrophobicContact CD1-CD2 4.13Å; I242-L266 HydrophobicContact CB-CD1 4.21Å; I242-L266 HydrophobicContact CD1-CD1 3.58Å; I242-L266 HydrophobicContact CG1-CD1 4.49Å; I242-L266 HydrophobicContact CG2-CD1 4.15Å; I242-Q271 PolarHBondContact N-O 2.61Å; I242-I272 HydrophobicContact CG2-CB 4.42Å; I242-I272 HydrophobicContact CG2-CG1 3.88Å; I242-I272 HydrophobicContact CG2-CG2 4.4Å; I242-I272 WeakPolarHBondContact O-CA 3.41Å; I242-L273 PolarHBondContact O-N 3.08Å
243	V	98.3	Very high	94	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	138.9	175.1	-177.2	0	0	0	0	109.7	Y149 L153 L167 V168 I169 M241 L273 Y275	Y149-V243 HydrophobicContact CD1-CG1 3.79Å; Y149-V243 HydrophobicContact CD2-CG1 3.8Å; Y149-V243 HydrophobicContact CD2-CG2 4.31Å; Y149-V243 HydrophobicContact CE1-CG1 4.17Å; Y149-V243 HydrophobicContact CE2-CG1 4.2Å; Y149-V243 HydrophobicContact CG-CG1 3.59Å; Y149-V243 HydrophobicContact CG-CG2 4.37Å; L153-V243 HydrophobicContact CD1-CG2 3.94Å; L167-V243 PolarHBondContact O-N 3.48Å; V168-V243 HydrophobicContact CB-CB 4.31Å; V168-V243 HydrophobicContact CG1-CB 4.01Å; V168-V243 HydrophobicContact CG1-CG1 4.12Å; V168-V243 HydrophobicContact CG2-CB 4.15Å; V168-V243 HydrophobicContact CG2-CG2 4.24Å; I169-V243 PolarHBondContact N-O 3.35Å; M241-V243 HydrophobicContact SD-CG2 4.45Å; V243-L273 CarbonylContact C-O 3.48Å; V243-L273 WeakPolarHBondContact CA-O 3.39Å; V243-L273 HydrophobicContact CG2-CB 4.3Å; V243-L273 HydrophobicContact CG2-CD1 4.29Å; V243-Y275 HydrophobicContact CG1-CD2 4.18Å; V243-Y275 HydrophobicContact CG1-CE2 4.36Å
244	L	97.1	Very high	93.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	109.9	171.1	-73.5	81.5	0	0	0	108.2	I242 A247 L250 M259 I272 L273 L274 Y275 F286	I242-L244 HydrophobicContact CG1-CD1 4.11Å; L244-A247 HydrophobicContact CB-CB 4.16Å; L244-L250 HydrophobicContact CB-CD1 3.79Å; L244-L250 HydrophobicContact CD2-CD1 4.35Å; L244-L250 HydrophobicContact CG-CD1 4.08Å; L244-M259 HydrophobicContact CD2-CE 3.5Å; L244-M259 VanDerWaalsContact CD2-CE 3.5Å; L244-M259 HydrophobicContact CG-CE 3.84Å; L244-I272 HydrophobicContact CD1-CG2 3.85Å; L244-L273 PolarHBondContact N-O 3.42Å; L244-L274 HydrophobicContact CB-CG 4.28Å; L244-L274 HydrophobicContact CD2-CD1 4.42Å; L244-Y275 PolarHBondContact O-N 2.73Å; L244-F286 HydrophobicContact CD2-CE1 3.69Å; L244-F286 HydrophobicContact CD2-CZ 3.62Å
245	D	94.1	Very high	93	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.027	22%	0.216	C	C	.	.	S	Bend	trans	-110.5	143.3	176.4	-166.7	10.3	0	0	0	111.4	K145 Y149 I169 V170 P171 A247	K145-D245 IonicContact NZ-OD1 2.67Å; Y149-D245 HydrophobicContact CE1-CB 3.9Å; Y149-D245 VanDerWaalsContact CE1-OD2 3.3Å; Y149-D245 WeakPolarHBondContact CE1-OD2 3.36Å; Y149-D245 PolarHBondContact OH-OD2 3.4Å; I169-D245 PolarHBondContact O-N 3.06Å; I169-D245 VanDerWaalsContact O-N 3.08Å; V170-D245 HydrophobicContact CG1-CB 4.34Å; P171-D245 VanDerWaalsContact CD-O 3.25Å; P171-D245 WeakPolarHBondContact CD-O 3.14Å; D245-A247 VanDerWaalsContact C-N 3.31Å
246	E	90	Very high	92.7	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.009	19%	0.192	C	C	.	.	S	Bend	trans	47.7	53.2	-159.1	-68.3	-174.4	151.4	0	0	111.3	N141 P171 D248 K249 L250 Y275 R395 G396 R423	N141-E246 PolarHBondContact ND2-OE1 3.38Å; P171-E246 HydrophobicContact CG-CB 3.81Å; E246-D248 VanDerWaalsContact C-N 3.28Å; E246-D248 PolarHBondContact O-N 2.88Å; E246-K249 WeakPolarHBondContact O-CA 3.49Å; E246-K249 WeakPolarHBondContact O-CB 3.44Å; E246-K249 PolarHBondContact O-N 3.36Å; E246-L250 PolarHBondContact O-N 2.91Å; E246-Y275 PolarHBondContact N-O 3.46Å; E246-R395 WeakPolarHBondContact OE2-CB 3.42Å; E246-G396 VanDerWaalsContact CD-N 3.31Å; E246-G396 PolarHBondContact OE1-N 3.19Å; E246-G396 PolarHBondContact OE2-N 2.97Å; E246-G396 VanDerWaalsContact OE2-N 3.14Å; E246-R423 IonicContact OE1-NH2 2.73Å
247	A	91.6	Very high	92.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-27.1	-173.9	0	0	0	0	0	114.6	L244 D245 K249 L250 L251 L274 Y275	L244-A247 HydrophobicContact CB-CB 4.16Å; D245-A247 VanDerWaalsContact C-N 3.31Å; A247-K249 PolarHBondContact O-N 3.19Å; A247-L250 PolarHBondContact O-N 3.11Å; A247-L251 WeakPolarHBondContact O-CB 3.46Å; A247-L251 WeakPolarHBondContact O-CG 3.42Å; A247-L251 PolarHBondContact O-N 2.81Å; A247-L274 HydrophobicContact CB-CD1 4.38Å; A247-L274 HydrophobicContact CB-CD2 3.42Å; A247-L274 VanDerWaalsContact CB-CD2 3.42Å; A247-L274 HydrophobicContact CB-CG 3.68Å; A247-Y275 WeakPolarHBondContact CB-O 3.01Å; A247-Y275 PolarHBondContact N-O 2.97Å
248	D	88.1	Confident	92.3	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-56.9	-24.7	168.1	44.5	24.7	0	0	0	113.3	E246 S276 A277 T278 P280 V283	E246-D248 VanDerWaalsContact C-N 3.28Å; E246-D248 PolarHBondContact O-N 2.88Å; D248-S276 WeakPolarHBondContact CB-OG 3.23Å; D248-S276 PolarHBondContact N-OG 3.42Å; D248-S276 VanDerWaalsContact N-OG 3.15Å; D248-S276 PolarHBondContact OD2-OG 3.38Å; D248-S276 VanDerWaalsContact OD2-OG 3.08Å; D248-A277 PolarHBondContact OD2-N 2.74Å; D248-T278 VanDerWaalsContact CB-OG1 3.27Å; D248-T278 WeakPolarHBondContact CB-OG1 3.24Å; D248-T278 PolarHBondContact OD2-N 3.03Å; D248-T278 PolarHBondContact OD2-OG1 2.88Å; D248-P280 HydrophobicContact CB-CG 4.44Å; D248-V283 HydrophobicContact CB-CG2 4.39Å
249	K	87.6	Confident	92.2	Very high	31 Å²	31	34.9 Å²	34.9	14%	0.135	18%	0.178	C	C	.	.	H	α-helix	trans	-93.4	-31.1	173	-58.3	-46.9	-177.4	-174.9	0	114.4	P171 E246 A247 L251 F255 E415 H419	P171-K249 HydrophobicContact CB-CB 3.67Å; P171-K249 HydrophobicContact CG-CB 3.91Å; E246-K249 WeakPolarHBondContact O-CA 3.49Å; E246-K249 WeakPolarHBondContact O-CB 3.44Å; E246-K249 PolarHBondContact O-N 3.36Å; A247-K249 PolarHBondContact O-N 3.19Å; K249-L251 PolarHBondContact O-N 3.15Å; K249-F255 WeakPolarHBondContact O-CD2 3.29Å; K249-E415 WeakPolarHBondContact CE-OE1 3.47Å; K249-E415 IonicContact NZ-OE1 3.5Å; K249-E415 PolarHBondContact NZ-OE1 2.86Å; K249-E415 IonicContact NZ-OE2 3.39Å; K249-E415 PolarHBondContact NZ-OE2 2.62Å; K249-H419 VanDerWaalsContact CE-NE2 3.27Å; K249-H419 WeakPolarHBondContact CE-NE2 3.42Å
250	L	91.9	Very high	91.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.3	-23.3	171.9	-61.3	177.2	0	0	0	112.4	I169 P171 P222 L244 E246 A247 F255 M259	I169-L250 HydrophobicContact CB-CD1 4.15Å; I169-L250 HydrophobicContact CG2-CD1 4Å; I169-L250 HydrophobicContact CG2-CD2 3.84Å; I169-L250 WeakPolarHBondContact O-CD1 3.5Å; P171-L250 HydrophobicContact CB-CD2 4.15Å; P222-L250 HydrophobicContact CG-CD2 3.68Å; L244-L250 HydrophobicContact CB-CD1 3.79Å; L244-L250 HydrophobicContact CD2-CD1 4.35Å; L244-L250 HydrophobicContact CG-CD1 4.08Å; E246-L250 PolarHBondContact O-N 2.91Å; A247-L250 PolarHBondContact O-N 3.11Å; L250-F255 WeakPolarHBondContact O-CB 3.34Å; L250-M259 HydrophobicContact CB-CE 4.27Å; L250-M259 HydrophobicContact CB-CG 4.45Å; L250-M259 HydrophobicContact CB-SD 4.32Å; L250-M259 HydrophobicContact CD1-CE 4.35Å; L250-M259 VanDerWaalsContact O-CG 3.22Å; L250-M259 WeakPolarHBondContact O-CG 3.42Å
251	L	91.3	Very high	91.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	29.7	-175.6	-55	172.4	0	0	0	111.6	A247 K249 V256 M259 L274 S282 V283 F286	A247-L251 WeakPolarHBondContact O-CB 3.46Å; A247-L251 WeakPolarHBondContact O-CG 3.42Å; A247-L251 PolarHBondContact O-N 2.81Å; K249-L251 PolarHBondContact O-N 3.15Å; L251-V256 HydrophobicContact CD2-CG2 4.46Å; L251-M259 HydrophobicContact CD2-CB 4.14Å; L251-M259 HydrophobicContact CD2-CG 4.14Å; L251-L274 HydrophobicContact CD1-CD1 4.32Å; L251-S282 WeakPolarHBondContact O-CB 3.33Å; L251-S282 PolarHBondContact O-OG 3.3Å; L251-V283 HydrophobicContact CB-CG2 4.14Å; L251-V283 HydrophobicContact CD1-CB 4.27Å; L251-V283 HydrophobicContact CD1-CG1 4.12Å; L251-V283 HydrophobicContact CD1-CG2 4.07Å; L251-F286 HydrophobicContact CD1-CB 3.71Å; L251-F286 HydrophobicContact CD1-CD1 3.59Å; L251-F286 HydrophobicContact CD1-CD2 4.1Å; L251-F286 HydrophobicContact CD1-CE1 4.2Å; L251-F286 HydrophobicContact CD1-CG 3.53Å; L251-F286 HydrophobicContact CD2-CB 4.17Å; L251-F286 HydrophobicContact CD2-CD1 4.28Å; L251-F286 HydrophobicContact CD2-CD2 3.3Å; L251-F286 HydrophobicContact CD2-CE2 3.61Å; L251-F286 HydrophobicContact CD2-CG 3.66Å; L251-F286 HydrophobicContact CD2-CZ 4.21Å; L251-F286 HydrophobicContact CG-CD2 4.35Å; L251-F286 HydrophobicContact CG-CG 4.25Å
252	S	88.1	Confident	91.7	Very high	29 Å²	29	38.3 Å²	38.3	20%	0.203	19%	0.194	C	C	.	.	S	Bend	trans	-73.8	166.8	161.6	81.3	0	0	0	0	110.7	D254 F255 V256	S252-D254 PolarHBondContact O-N 3.13Å; S252-D254 PolarHBondContact OG-N 3.05Å; S252-D254 PolarHBondContact OG-OD2 3.23Å; S252-D254 VanDerWaalsContact OG-OD2 3.08Å; S252-F255 PolarHBondContact O-N 2.93Å; S252-F255 VanDerWaalsContact O-N 3.1Å; S252-V256 WeakPolarHBondContact O-CB 3.23Å; S252-V256 PolarHBondContact O-N 2.91Å
253	Q	83.7	Confident	91.5	Very high	184 Å²	184	38.6 Å²	38.6	86%	0.86	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-33.2	177.6	-67.6	177.8	-12.2	0	0	112.8	F255	Q253-F255 VanDerWaalsContact C-N 3.32Å; Q253-F255 PolarHBondContact O-N 3.17Å
254	D	83	Confident	91.4	Very high	125 Å²	125	41.8 Å²	41.8	67%	0.668	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-24.9	-179.5	-40.4	-70.3	0	0	0	113.6	S252 M258	S252-D254 PolarHBondContact O-N 3.13Å; S252-D254 PolarHBondContact OG-N 3.05Å; S252-D254 PolarHBondContact OG-OD2 3.23Å; S252-D254 VanDerWaalsContact OG-OD2 3.08Å; D254-M258 WeakPolarHBondContact O-CE 2.95Å
255	F	88.2	Confident	91.3	Very high	62 Å²	62	46 Å²	46	27%	0.272	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-25.3	-170.1	-69.6	-67.7	0	0	0	114.7	P222 K249 L250 S252 Q253 V257 M258 M259	P222-F255 HydrophobicContact CB-CD1 4.21Å; P222-F255 HydrophobicContact CG-CD1 4.15Å; K249-F255 WeakPolarHBondContact O-CD2 3.29Å; L250-F255 WeakPolarHBondContact O-CB 3.34Å; S252-F255 PolarHBondContact O-N 2.93Å; S252-F255 VanDerWaalsContact O-N 3.1Å; Q253-F255 VanDerWaalsContact C-N 3.32Å; Q253-F255 PolarHBondContact O-N 3.17Å; F255-V257 VanDerWaalsContact C-N 3.31Å; F255-V257 PolarHBondContact O-N 3.49Å; F255-M258 HydrophobicContact CD1-CE 3.74Å; F255-M258 HydrophobicContact CE1-CE 4.18Å; F255-M258 WeakPolarHBondContact O-CB 3.38Å; F255-M258 PolarHBondContact O-N 3.08Å; F255-M259 WeakPolarHBondContact O-CG 3.36Å; F255-M259 PolarHBondContact O-N 2.83Å
256	V	90.4	Very high	91.4	Very high	31 Å²	31	46.2 Å²	46.2	19%	0.188	25%	0.248	C	C	.	.	H	α-helix	trans	-54.4	-42.8	-173.1	65.6	0	0	0	0	113.3	L251 S252 M258 M259 E260	L251-V256 HydrophobicContact CD2-CG2 4.46Å; S252-V256 WeakPolarHBondContact O-CB 3.23Å; S252-V256 PolarHBondContact O-N 2.91Å; V256-M258 PolarHBondContact O-N 2.96Å; V256-M259 WeakPolarHBondContact O-CB 3.34Å; V256-M259 PolarHBondContact O-N 3.12Å; V256-M259 VanDerWaalsContact O-N 3.11Å; V256-E260 HydrophobicContact CG2-CG 4.49Å; V256-E260 WeakPolarHBondContact O-CG 3.23Å; V256-E260 PolarHBondContact O-N 3.47Å
257	V	91.9	Very high	91.7	Very high	97 Å²	97	47.6 Å²	47.6	59%	0.588	26%	0.257	S	S	*	.	H	α-helix	trans	-64	-38.9	178.2	-175.8	0	0	0	0	111.9	F255 M259 E261	F255-V257 VanDerWaalsContact C-N 3.31Å; F255-V257 PolarHBondContact O-N 3.49Å; V257-M259 VanDerWaalsContact C-N 3.32Å; V257-E261 WeakPolarHBondContact O-CB 3.39Å; V257-E261 PolarHBondContact O-N 2.77Å
258	M	94.1	Very high	91.8	Very high	56 Å²	56	56.6 Å²	56.6	28%	0.276	30%	0.296	S	S	.	.	H	α-helix	trans	-69.3	-31.5	175.3	-71.4	-174.8	-91.3	0	0	112.1	P222 L226 D254 F255 V256 M262	P222-M258 HydrophobicContact CB-CB 4.47Å; L226-M258 HydrophobicContact CD2-CB 3.74Å; L226-M258 HydrophobicContact CD2-CG 3.72Å; D254-M258 WeakPolarHBondContact O-CE 2.95Å; F255-M258 HydrophobicContact CD1-CE 3.74Å; F255-M258 HydrophobicContact CE1-CE 4.18Å; F255-M258 WeakPolarHBondContact O-CB 3.38Å; F255-M258 PolarHBondContact O-N 3.08Å; V256-M258 PolarHBondContact O-N 2.96Å; M258-M262 VanDerWaalsContact O-CB 3.23Å; M258-M262 WeakPolarHBondContact O-CB 3.47Å; M258-M262 PolarHBondContact O-N 2.89Å
259	M	94.6	Very high	92	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-70.7	-47.7	175.1	-65.3	-59.6	-66.8	0	0	111.5	I169 P222 L244 L250 L251 F255 V256 V257 E261 M262 L263 F286	I169-M259 HydrophobicContact CB-CE 4.35Å; I169-M259 HydrophobicContact CG2-CE 3.95Å; I169-M259 HydrophobicContact CG2-SD 3.89Å; P222-M259 HydrophobicContact CB-SD 3.93Å; P222-M259 HydrophobicContact CG-SD 3.69Å; L244-M259 HydrophobicContact CD2-CE 3.5Å; L244-M259 VanDerWaalsContact CD2-CE 3.5Å; L244-M259 HydrophobicContact CG-CE 3.84Å; L250-M259 HydrophobicContact CB-CE 4.27Å; L250-M259 HydrophobicContact CB-CG 4.45Å; L250-M259 HydrophobicContact CB-SD 4.32Å; L250-M259 HydrophobicContact CD1-CE 4.35Å; L250-M259 VanDerWaalsContact O-CG 3.22Å; L250-M259 WeakPolarHBondContact O-CG 3.42Å; L251-M259 HydrophobicContact CD2-CB 4.14Å; L251-M259 HydrophobicContact CD2-CG 4.14Å; F255-M259 WeakPolarHBondContact O-CG 3.36Å; F255-M259 PolarHBondContact O-N 2.83Å; V256-M259 WeakPolarHBondContact O-CB 3.34Å; V256-M259 PolarHBondContact O-N 3.12Å; V256-M259 VanDerWaalsContact O-N 3.11Å; V257-M259 VanDerWaalsContact C-N 3.32Å; M259-E261 PolarHBondContact O-N 2.7Å; M259-M262 HydrophobicContact CE-CE 3.55Å; M259-M262 PolarHBondContact O-N 2.95Å; M259-M262 HydrophobicContact SD-CE 3.51Å; M259-M262 VanDerWaalsContact SD-CE 3.51Å; M259-L263 WeakPolarHBondContact O-CB 3.3Å; M259-L263 WeakPolarHBondContact O-CG 3.22Å; M259-L263 PolarHBondContact O-N 2.82Å; M259-F286 HydrophobicContact CB-CE2 4.26Å
260	E	92.9	Very high	92.3	Very high	98 Å²	98	64.7 Å²	64.7	46%	0.458	33%	0.333	S	S	.	.	H	α-helix	trans	-58.6	-46.1	175.9	-72.7	174	-175.5	0	0	111.5	V256 L263 G264	V256-E260 HydrophobicContact CG2-CG 4.49Å; V256-E260 WeakPolarHBondContact O-CG 3.23Å; V256-E260 PolarHBondContact O-N 3.47Å; E260-L263 PolarHBondContact O-N 2.99Å; E260-G264 PolarHBondContact O-N 3.37Å; E260-G264 VanDerWaalsContact O-N 3.16Å
261	E	95.1	Very high	92.6	Very high	80 Å²	80	65.6 Å²	65.6	37%	0.374	34%	0.337	S	S	.	.	H	α-helix	trans	-65.9	-44.2	179.1	-166.9	-178.5	-165.4	0	0	112.1	L226 K230 V257 M259 L263 G264 F265	L226-E261 HydrophobicContact CD1-CB 4.34Å; L226-E261 HydrophobicContact CD1-CG 4.19Å; K230-E261 WeakPolarHBondContact CE-OE1 3.18Å; K230-E261 VanDerWaalsContact CE-OE2 3.23Å; K230-E261 WeakPolarHBondContact CE-OE2 3.36Å; K230-E261 IonicContact NZ-OE1 2.74Å; K230-E261 PolarHBondContact NZ-OE1 2.98Å; K230-E261 IonicContact NZ-OE2 2.7Å; K230-E261 PolarHBondContact NZ-OE2 2.95Å; V257-E261 WeakPolarHBondContact O-CB 3.39Å; V257-E261 PolarHBondContact O-N 2.77Å; M259-E261 PolarHBondContact O-N 2.7Å; E261-L263 VanDerWaalsContact C-N 3.32Å; E261-L263 PolarHBondContact O-N 2.95Å; E261-G264 PolarHBondContact O-N 3.04Å; E261-F265 HydrophobicContact CG-CE2 4.2Å; E261-F265 VanDerWaalsContact O-CD2 3.26Å; E261-F265 WeakPolarHBondContact O-CD2 3.45Å
262	M	95.3	Very high	93	Very high	1 Å²	1	65.7 Å²	65.7	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-58.4	-43.8	173.7	175.5	179.5	58.1	0	0	111.6	I169 I225 L226 I229 I242 M258 M259 G264 F265	I169-M262 HydrophobicContact CD1-CE 3.99Å; I169-M262 HydrophobicContact CD1-SD 3.77Å; I169-M262 HydrophobicContact CG1-CE 3.85Å; I169-M262 HydrophobicContact CG1-SD 4.3Å; I169-M262 HydrophobicContact CG2-CE 4.34Å; I225-M262 HydrophobicContact CG2-SD 3.69Å; L226-M262 HydrophobicContact CD1-CB 4.19Å; I229-M262 HydrophobicContact CD1-CG 4.04Å; I242-M262 HydrophobicContact CD1-CE 4.14Å; M258-M262 VanDerWaalsContact O-CB 3.23Å; M258-M262 WeakPolarHBondContact O-CB 3.47Å; M258-M262 PolarHBondContact O-N 2.89Å; M259-M262 HydrophobicContact CE-CE 3.55Å; M259-M262 PolarHBondContact O-N 2.95Å; M259-M262 HydrophobicContact SD-CE 3.51Å; M259-M262 VanDerWaalsContact SD-CE 3.51Å; M262-G264 PolarHBondContact O-N 3.03Å; M262-F265 PolarHBondContact O-N 3.17Å; M262-F265 VanDerWaalsContact O-N 3.09Å
263	L	94.3	Very high	93.4	Very high	6 Å²	6	64.3 Å²	64.3	3%	0.031	33%	0.328	C	S	.	.	H	α-helix	trans	-62.5	-20.6	176.1	-79.7	-160.8	0	0	0	113.4	I242 M259 E260 E261 L266 R270 F286 H290	I242-L263 HydrophobicContact CD1-CD2 4.13Å; M259-L263 WeakPolarHBondContact O-CB 3.3Å; M259-L263 WeakPolarHBondContact O-CG 3.22Å; M259-L263 PolarHBondContact O-N 2.82Å; E260-L263 PolarHBondContact O-N 2.99Å; E261-L263 VanDerWaalsContact C-N 3.32Å; E261-L263 PolarHBondContact O-N 2.95Å; L263-L266 HydrophobicContact CD2-CD1 3.84Å; L263-R270 VanDerWaalsContact O-CZ 3.27Å; L263-R270 PolarHBondContact O-NH1 3.07Å; L263-R270 PolarHBondContact O-NH2 3.16Å; L263-F286 HydrophobicContact CD1-CE2 3.67Å; L263-F286 HydrophobicContact CD1-CZ 3.56Å; L263-F286 HydrophobicContact CG-CZ 4.45Å; L263-H290 HydrophobicContact CD1-CB 4.07Å
264	G	95.2	Very high	94.1	Very high	67 Å²	67	55.5 Å²	55.5	69%	0.691	29%	0.287	S	S	*	.	H	α-helix	trans	-71.3	-27.9	172.7	0	0	0	0	0	114.2	E260 E261 M262	E260-G264 PolarHBondContact O-N 3.37Å; E260-G264 VanDerWaalsContact O-N 3.16Å; E261-G264 PolarHBondContact O-N 3.04Å; M262-G264 PolarHBondContact O-N 3.03Å
265	F	96.7	Very high	94.6	Very high	89 Å²	89	49.6 Å²	49.6	39%	0.39	26%	0.255	S	S	.	.	H	α-helix	trans	-85.7	-20.5	178.5	-68.7	-81.6	0	0	0	113.9	L226 I229 K230 V236 E261 M262	L226-F265 HydrophobicContact CD1-CD2 4.43Å; L226-F265 HydrophobicContact CD1-CE2 4.17Å; I229-F265 HydrophobicContact CG2-CB 3.65Å; I229-F265 HydrophobicContact CG2-CD1 3.72Å; I229-F265 HydrophobicContact CG2-CD2 3.67Å; I229-F265 HydrophobicContact CG2-CE1 4.25Å; I229-F265 HydrophobicContact CG2-CE2 4.21Å; I229-F265 HydrophobicContact CG2-CG 3.4Å; I229-F265 VanDerWaalsContact CG2-CG 3.4Å; I229-F265 HydrophobicContact CG2-CZ 4.48Å; K230-F265 HydrophobicContact CG-CE2 4.29Å; K230-F265 HydrophobicContact CG-CZ 4.13Å; V236-F265 HydrophobicContact CG2-CB 4.04Å; E261-F265 HydrophobicContact CG-CE2 4.2Å; E261-F265 VanDerWaalsContact O-CD2 3.26Å; E261-F265 WeakPolarHBondContact O-CD2 3.45Å; M262-F265 PolarHBondContact O-N 3.17Å; M262-F265 VanDerWaalsContact O-N 3.09Å
266	L	96.3	Very high	94.6	Very high	9 Å²	9	46.6 Å²	46.6	5%	0.047	24%	0.242	C	C	.	.	S	Bend	trans	-78.8	152.8	-179.3	-52.7	-176.9	0	0	0	111.6	L167 V236 V239 I242 L263 R270	L167-L266 HydrophobicContact CD1-CD1 4.21Å; L167-L266 HydrophobicContact CD1-CD2 3.66Å; V236-L266 HydrophobicContact CB-CD2 3.6Å; V236-L266 HydrophobicContact CG1-CD2 4.02Å; V236-L266 HydrophobicContact CG2-CD2 3.8Å; V239-L266 HydrophobicContact CB-CD2 4.39Å; V239-L266 HydrophobicContact CG1-CD2 4.44Å; I242-L266 HydrophobicContact CB-CD1 4.21Å; I242-L266 HydrophobicContact CD1-CD1 3.58Å; I242-L266 HydrophobicContact CG1-CD1 4.49Å; I242-L266 HydrophobicContact CG2-CD1 4.15Å; L263-L266 HydrophobicContact CD2-CD1 3.84Å; L266-R270 PolarHBondContact O-NH1 3.09Å
267	P	96.3	Very high	94.2	Very high	30 Å²	30	45.3 Å²	45.3	20%	0.195	24%	0.235	C	C	.	.			trans	-49.4	143.7	172.1	-29.2	37.1	0	0	0	113.4	V236 N237 Q269 R270	V236-P267 WeakPolarHBondContact O-CD 3.44Å; N237-P267 WeakPolarHBondContact O-CG 3.29Å; P267-Q269 VanDerWaalsContact C-N 3.33Å; P267-R270 VanDerWaalsContact O-CD 3.24Å; P267-R270 WeakPolarHBondContact O-CD 3.45Å; P267-R270 VanDerWaalsContact O-CG 3.29Å; P267-R270 WeakPolarHBondContact O-CG 3.33Å; P267-R270 PolarHBondContact O-NH1 3.22Å
268	K	92.3	Very high	93.7	Very high	189 Å²	189	41.6 Å²	41.6	82%	0.822	21%	0.212	S	C	*	.	S	Bend	trans	-68.1	-32.8	178	-69.7	-171.8	177.7	-176.2	0	112.8	Q292	K268-Q292 PolarHBondContact O-NE2 2.86Å
269	Q	92.2	Very high	93.3	Very high	171 Å²	171	41.4 Å²	41.4	80%	0.799	21%	0.21	S	C	*	.	S	Bend	trans	-92	95.3	168.1	-72.1	176.5	-21.2	0	0	107.2	P267	P267-Q269 VanDerWaalsContact C-N 3.33Å
270	R	95.5	Very high	92.8	Very high	35 Å²	35	43.8 Å²	43.8	13%	0.132	23%	0.225	C	C	.	.			trans	-145.7	146.3	175.9	64	-177.9	175.2	-112.5	8.7	107.9	Q240 L263 L266 P267 I272	Q240-R270 CarbonylContact O-C 3.58Å; Q240-R270 WeakPolarHBondContact O-CA 3.18Å; L263-R270 VanDerWaalsContact O-CZ 3.27Å; L263-R270 PolarHBondContact O-NH1 3.07Å; L263-R270 PolarHBondContact O-NH2 3.16Å; L266-R270 PolarHBondContact O-NH1 3.09Å; P267-R270 VanDerWaalsContact O-CD 3.24Å; P267-R270 WeakPolarHBondContact O-CD 3.45Å; P267-R270 VanDerWaalsContact O-CG 3.29Å; P267-R270 WeakPolarHBondContact O-CG 3.33Å; P267-R270 PolarHBondContact O-NH1 3.22Å; R270-I272 HydrophobicContact CG-CG1 4.34Å
271	Q	98.3	Very high	92.4	Very high	18 Å²	18	45.1 Å²	45.1	8%	0.084	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	132.6	173.7	-170.1	177.6	10.8	0	0	109.8	A129 G132 R133 D134 Q240 M241 I242 L273	A129-Q271 PolarHBondContact O-NE2 3.43Å; G132-Q271 VanDerWaalsContact C-NE2 3.3Å; R133-Q271 PolarHBondContact O-NE2 3.04Å; D134-Q271 WeakPolarHBondContact OD1-CA 3.19Å; Q240-Q271 PolarHBondContact O-N 3.29Å; M241-Q271 WeakPolarHBondContact CA-O 3.45Å; M241-Q271 VanDerWaalsContact CE-OE1 3.28Å; M241-Q271 HydrophobicContact CG-CB 4.46Å; I242-Q271 PolarHBondContact N-O 2.61Å; Q271-L273 HydrophobicContact CG-CD2 3.97Å
272	I	98.1	Very high	92	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	119	178.7	-51.6	-174.5	0	0	0	109.6	D134 I135 I242 L244 R270 H290 L291	D134-I272 VanDerWaalsContact CA-O 3.29Å; D134-I272 WeakPolarHBondContact CA-O 3.21Å; D134-I272 WeakPolarHBondContact CB-O 3.47Å; D134-I272 PolarHBondContact OD1-N 3.32Å; I135-I272 PolarHBondContact N-O 3.42Å; I242-I272 HydrophobicContact CG2-CB 4.42Å; I242-I272 HydrophobicContact CG2-CG1 3.88Å; I242-I272 HydrophobicContact CG2-CG2 4.4Å; I242-I272 WeakPolarHBondContact O-CA 3.41Å; L244-I272 HydrophobicContact CD1-CG2 3.85Å; R270-I272 HydrophobicContact CG-CG1 4.34Å; I272-H290 HydrophobicContact CD1-CB 4.22Å; I272-L291 HydrophobicContact CB-CD1 4.17Å; I272-L291 HydrophobicContact CB-CG 4.4Å; I272-L291 HydrophobicContact CD1-CD1 4.24Å; I272-L291 HydrophobicContact CG2-CD1 3.76Å; I272-L291 HydrophobicContact CG2-CG 4.34Å
273	L	98.2	Very high	91.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	103.2	176	-48.1	-178.9	0	0	0	109.5	A129 I135 M241 I242 V243 L244 Q271 Y275	A129-L273 HydrophobicContact CB-CD1 4.1Å; A129-L273 HydrophobicContact CB-CD2 4.25Å; I135-L273 HydrophobicContact CB-CD2 3.85Å; I135-L273 HydrophobicContact CD1-CD2 4.05Å; I135-L273 HydrophobicContact CG1-CD2 3.81Å; M241-L273 HydrophobicContact CE-CD1 4.17Å; M241-L273 HydrophobicContact CG-CD1 4.32Å; M241-L273 HydrophobicContact CG-CG 4.46Å; M241-L273 HydrophobicContact SD-CD1 3.71Å; M241-L273 HydrophobicContact SD-CG 4.46Å; I242-L273 PolarHBondContact O-N 3.08Å; V243-L273 CarbonylContact C-O 3.48Å; V243-L273 WeakPolarHBondContact CA-O 3.39Å; V243-L273 HydrophobicContact CG2-CB 4.3Å; V243-L273 HydrophobicContact CG2-CD1 4.29Å; L244-L273 PolarHBondContact N-O 3.42Å; Q271-L273 HydrophobicContact CG-CD2 3.97Å; L273-Y275 HydrophobicContact CB-CE2 3.86Å
274	L	96.6	Very high	91.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.1	-174.1	-167.2	159.4	0	0	0	110.8	I135 L136 A137 L244 A247 L251 F279 V283 F286 M287 L291	I135-L274 PolarHBondContact O-N 2.92Å; L136-L274 HydrophobicContact CD1-CD2 3.88Å; A137-L274 PolarHBondContact N-O 2.69Å; L244-L274 HydrophobicContact CB-CG 4.28Å; L244-L274 HydrophobicContact CD2-CD1 4.42Å; A247-L274 HydrophobicContact CB-CD1 4.38Å; A247-L274 HydrophobicContact CB-CD2 3.42Å; A247-L274 VanDerWaalsContact CB-CD2 3.42Å; A247-L274 HydrophobicContact CB-CG 3.68Å; L251-L274 HydrophobicContact CD1-CD1 4.32Å; L274-F279 HydrophobicContact CD2-CE1 4.41Å; L274-V283 HydrophobicContact CD1-CG1 4.38Å; L274-V283 HydrophobicContact CD2-CG1 4.03Å; L274-F286 HydrophobicContact CD1-CD1 3.78Å; L274-F286 HydrophobicContact CD1-CE1 3.84Å; L274-M287 HydrophobicContact CD1-CG 4.42Å; L274-L291 HydrophobicContact CB-CD2 4.29Å; L274-L291 HydrophobicContact CD1-CD1 4.46Å; L274-L291 HydrophobicContact CD1-CD2 4.4Å
275	Y	93.9	Very high	91.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.1	-179.8	-68.7	-99.4	0	0	0	111	I121 S125 A137 K145 A148 Y149 V243 L244 E246 A247 L273	I121-Y275 HydrophobicContact CD1-CE1 4.27Å; I121-Y275 HydrophobicContact CG1-CE1 4.37Å; S125-Y275 PolarHBondContact OG-OH 3.29Å; A137-Y275 HydrophobicContact CB-CD1 3.41Å; A137-Y275 VanDerWaalsContact CB-CD1 3.41Å; A137-Y275 HydrophobicContact CB-CE1 3.57Å; A137-Y275 HydrophobicContact CB-CG 4.02Å; A137-Y275 WeakPolarHBondContact O-CA 3.38Å; K145-Y275 HydrophobicContact CB-CD1 4.35Å; K145-Y275 HydrophobicContact CD-CD1 4.09Å; K145-Y275 HydrophobicContact CG-CD1 4.21Å; A148-Y275 HydrophobicContact CB-CE1 4.26Å; A148-Y275 PolarHBondContact O-OH 3.02Å; Y149-Y275 HydrophobicContact CD1-CD1 4.44Å; Y149-Y275 AromaticContact CD1-CD2 3.73Å; Y149-Y275 HydrophobicContact CD1-CD2 3.73Å; Y149-Y275 HydrophobicContact CD1-CE1 4.34Å; Y149-Y275 AromaticContact CD1-CE2 3.62Å; Y149-Y275 HydrophobicContact CD1-CE2 3.62Å; Y149-Y275 HydrophobicContact CD1-CG 4.16Å; Y149-Y275 AromaticContact CD1-CZ 3.93Å; Y149-Y275 HydrophobicContact CE1-CD2 4.43Å; Y149-Y275 HydrophobicContact CG-CE2 4.09Å; V243-Y275 HydrophobicContact CG1-CD2 4.18Å; V243-Y275 HydrophobicContact CG1-CE2 4.36Å; L244-Y275 PolarHBondContact O-N 2.73Å; E246-Y275 PolarHBondContact N-O 3.46Å; A247-Y275 WeakPolarHBondContact CB-O 3.01Å; A247-Y275 PolarHBondContact N-O 2.97Å; L273-Y275 HydrophobicContact CB-CE2 3.86Å
276	S	88.7	Confident	90.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	162	179.9	-151.3	0	0	0	0	112.6	A137 R138 A139 D248 T278	A137-S276 PolarHBondContact O-N 3.31Å; R138-S276 WeakPolarHBondContact CA-O 3.4Å; A139-S276 PolarHBondContact N-O 3.32Å; D248-S276 WeakPolarHBondContact CB-OG 3.23Å; D248-S276 PolarHBondContact N-OG 3.42Å; D248-S276 VanDerWaalsContact N-OG 3.15Å; D248-S276 PolarHBondContact OD2-OG 3.38Å; D248-S276 VanDerWaalsContact OD2-OG 3.08Å; S276-T278 VanDerWaalsContact CB-O 3.31Å; S276-T278 WeakPolarHBondContact CB-O 3.46Å; S276-T278 PolarHBondContact OG-O 2.87Å
277	A	82.1	Confident	90.6	Very high	3 Å²	3	47.7 Å²	47.7	3%	0.025	23%	0.232	C	C	.	.	S	Bend	trans	-92.8	-38.3	165.2	0	0	0	0	0	110.5	R138 D248 L418	R138-A277 PolarHBondContact NE-O 3.37Å; D248-A277 PolarHBondContact OD2-N 2.74Å; A277-L418 HydrophobicContact CB-CD2 4.46Å
278	T	81.8	Confident	90.4	Very high	20 Å²	20	53 Å²	53	12%	0.123	26%	0.259	C	S	.	.			trans	-122.6	157.3	-179.6	70.3	0	0	0	0	112	D248 S276 P280 L303 E415	D248-T278 VanDerWaalsContact CB-OG1 3.27Å; D248-T278 WeakPolarHBondContact CB-OG1 3.24Å; D248-T278 PolarHBondContact OD2-N 3.03Å; D248-T278 PolarHBondContact OD2-OG1 2.88Å; S276-T278 VanDerWaalsContact CB-O 3.31Å; S276-T278 WeakPolarHBondContact CB-O 3.46Å; S276-T278 PolarHBondContact OG-O 2.87Å; T278-P280 VanDerWaalsContact C-CD 3.49Å; T278-L303 HydrophobicContact CG2-CD2 4.25Å; T278-E415 HydrophobicContact CG2-CB 4.35Å; T278-E415 HydrophobicContact CG2-CG 3.95Å
279	F	84.8	Confident	90.4	Very high	52 Å²	52	47.3 Å²	47.3	23%	0.228	25%	0.247	C	C	.	.			trans	-126.9	69.8	178.3	-63.9	-41.3	0	0	0	111.4	L136 R138 L274 V283 Q284	L136-F279 HydrophobicContact CD1-CD1 4.44Å; L136-F279 HydrophobicContact CD1-CE1 3.57Å; L136-F279 HydrophobicContact CD1-CE2 4.41Å; L136-F279 HydrophobicContact CD1-CZ 3.56Å; L136-F279 HydrophobicContact CD2-CE2 4.38Å; L136-F279 HydrophobicContact CD2-CZ 4.26Å; L136-F279 HydrophobicContact CG-CE1 4.33Å; L136-F279 HydrophobicContact CG-CE2 4.37Å; L136-F279 HydrophobicContact CG-CZ 3.8Å; R138-F279 HydrophobicContact CB-CE2 3.56Å; R138-F279 HydrophobicContact CB-CZ 3.64Å; R138-F279 HydrophobicContact CG-CD2 4.32Å; R138-F279 HydrophobicContact CG-CE2 3.74Å; R138-F279 HydrophobicContact CG-CZ 4Å; L274-F279 HydrophobicContact CD2-CE1 4.41Å; F279-V283 HydrophobicContact CD1-CG1 3.89Å; F279-V283 HydrophobicContact CE1-CG1 4.47Å; F279-Q284 PolarHBondContact O-NE2 2.79Å
280	P	83.6	Confident	90.5	Very high	49 Å²	49	41.7 Å²	41.7	32%	0.318	22%	0.221	S	C	.	.			trans	-62.7	164.4	170	29.1	-35.3	0	0	0	111.2	D248 T278 S282 V283 Q284	D248-P280 HydrophobicContact CB-CG 4.44Å; T278-P280 VanDerWaalsContact C-CD 3.49Å; P280-S282 PolarHBondContact O-N 3.41Å; P280-V283 HydrophobicContact CG-CG2 3.94Å; P280-V283 PolarHBondContact O-N 3.18Å; P280-Q284 PolarHBondContact O-N 3.37Å
281	L	85.8	Confident	90.4	Very high	127 Å²	127	40.8 Å²	40.8	67%	0.665	22%	0.219	S	C	*	.	H	α-helix	trans	-54.5	-26	-175.9	-67.2	172	0	0	0	114.5	K285	L281-K285 WeakPolarHBondContact O-CB 3.34Å; L281-K285 VanDerWaalsContact O-CG 3.31Å; L281-K285 WeakPolarHBondContact O-CG 3.15Å; L281-K285 PolarHBondContact O-N 2.73Å
282	S	86.8	Confident	90.2	Very high	41 Å²	41	45.8 Å²	45.8	29%	0.287	24%	0.242	S	C	.	.	H	α-helix	trans	-69.1	-40	174.5	54.4	0	0	0	0	112.8	L251 P280 K285 F286	L251-S282 WeakPolarHBondContact O-CB 3.33Å; L251-S282 PolarHBondContact O-OG 3.3Å; P280-S282 PolarHBondContact O-N 3.41Å; S282-K285 PolarHBondContact O-N 3.07Å; S282-F286 WeakPolarHBondContact O-CB 3.2Å; S282-F286 PolarHBondContact O-N 3.1Å
283	V	87.6	Confident	90	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-43.4	174.5	-174.6	0	0	0	0	110	D248 L251 L274 F279 P280 K285 F286 M287	D248-V283 HydrophobicContact CB-CG2 4.39Å; L251-V283 HydrophobicContact CB-CG2 4.14Å; L251-V283 HydrophobicContact CD1-CB 4.27Å; L251-V283 HydrophobicContact CD1-CG1 4.12Å; L251-V283 HydrophobicContact CD1-CG2 4.07Å; L274-V283 HydrophobicContact CD1-CG1 4.38Å; L274-V283 HydrophobicContact CD2-CG1 4.03Å; F279-V283 HydrophobicContact CD1-CG1 3.89Å; F279-V283 HydrophobicContact CE1-CG1 4.47Å; P280-V283 HydrophobicContact CG-CG2 3.94Å; P280-V283 PolarHBondContact O-N 3.18Å; V283-K285 PolarHBondContact O-N 3.31Å; V283-F286 PolarHBondContact O-N 2.98Å; V283-M287 HydrophobicContact CG1-CG 4.3Å; V283-M287 HydrophobicContact CG1-SD 3.95Å; V283-M287 WeakPolarHBondContact O-CB 3.48Å; V283-M287 WeakPolarHBondContact O-CG 3.38Å; V283-M287 PolarHBondContact O-N 2.96Å
284	Q	88.1	Confident	89.9	Confident	82 Å²	82	55.8 Å²	55.8	38%	0.383	29%	0.288	S	S	.	.	H	α-helix	trans	-61.5	-40.5	177.4	-60.1	177.1	18.8	0	0	112.5	F279 P280 N288	F279-Q284 PolarHBondContact O-NE2 2.79Å; P280-Q284 PolarHBondContact O-N 3.37Å; Q284-N288 VanDerWaalsContact O-CG 3.26Å; Q284-N288 PolarHBondContact O-N 2.98Å; Q284-N288 VanDerWaalsContact O-N 3.14Å; Q284-N288 PolarHBondContact O-ND2 2.73Å
285	K	90.5	Very high	89.9	Confident	158 Å²	158	59.8 Å²	59.8	69%	0.687	30%	0.304	S	S	*	.	H	α-helix	trans	-63.1	-47.1	173.6	-77.4	177.5	177.2	-171.7	0	112.1	L281 S282 V283 N288 A289	L281-K285 WeakPolarHBondContact O-CB 3.34Å; L281-K285 VanDerWaalsContact O-CG 3.31Å; L281-K285 WeakPolarHBondContact O-CG 3.15Å; L281-K285 PolarHBondContact O-N 2.73Å; S282-K285 PolarHBondContact O-N 3.07Å; V283-K285 PolarHBondContact O-N 3.31Å; K285-N288 PolarHBondContact O-N 3.26Å; K285-A289 WeakPolarHBondContact O-CB 3.41Å; K285-A289 PolarHBondContact O-N 2.82Å; K285-A289 VanDerWaalsContact O-N 3.07Å
286	F	90.9	Very high	89.9	Confident	4 Å²	4	66 Å²	66	2%	0.018	33%	0.333	C	S	.	.	H	α-helix	trans	-62	-42.7	178	179.9	-85.3	0	0	0	112.2	L244 L251 M259 L263 L274 S282 V283 A289 H290 L291	L244-F286 HydrophobicContact CD2-CE1 3.69Å; L244-F286 HydrophobicContact CD2-CZ 3.62Å; L251-F286 HydrophobicContact CD1-CB 3.71Å; L251-F286 HydrophobicContact CD1-CD1 3.59Å; L251-F286 HydrophobicContact CD1-CD2 4.1Å; L251-F286 HydrophobicContact CD1-CE1 4.2Å; L251-F286 HydrophobicContact CD1-CG 3.53Å; L251-F286 HydrophobicContact CD2-CB 4.17Å; L251-F286 HydrophobicContact CD2-CD1 4.28Å; L251-F286 HydrophobicContact CD2-CD2 3.3Å; L251-F286 HydrophobicContact CD2-CE2 3.61Å; L251-F286 HydrophobicContact CD2-CG 3.66Å; L251-F286 HydrophobicContact CD2-CZ 4.21Å; L251-F286 HydrophobicContact CG-CD2 4.35Å; L251-F286 HydrophobicContact CG-CG 4.25Å; M259-F286 HydrophobicContact CB-CE2 4.26Å; L263-F286 HydrophobicContact CD1-CE2 3.67Å; L263-F286 HydrophobicContact CD1-CZ 3.56Å; L263-F286 HydrophobicContact CG-CZ 4.45Å; L274-F286 HydrophobicContact CD1-CD1 3.78Å; L274-F286 HydrophobicContact CD1-CE1 3.84Å; S282-F286 WeakPolarHBondContact O-CB 3.2Å; S282-F286 PolarHBondContact O-N 3.1Å; V283-F286 PolarHBondContact O-N 2.98Å; F286-A289 PolarHBondContact O-N 2.89Å; F286-H290 AromaticContact CD2-CD2 3.41Å; F286-H290 VanDerWaalsContact CD2-CD2 3.41Å; F286-H290 WeakPolarHBondContact CD2-CD2 3.42Å; F286-H290 AromaticContact CD2-NE2 3.93Å; F286-H290 AromaticContact CE2-CD2 3.47Å; F286-H290 VanDerWaalsContact CE2-CD2 3.47Å; F286-H290 WeakPolarHBondContact CE2-CD2 3.27Å; F286-H290 AromaticContact CG-CD2 3.82Å; F286-H290 AromaticContact CZ-CD2 3.92Å; F286-H290 WeakPolarHBondContact O-CB 3.42Å; F286-H290 PolarHBondContact O-CD2 3.5Å; F286-H290 PolarHBondContact O-N 2.98Å; F286-L291 HydrophobicContact CD1-CD1 4.43Å; F286-L291 HydrophobicContact CE1-CD1 4.2Å
287	M	91.1	Very high	90.1	Very high	21 Å²	21	66.5 Å²	66.5	10%	0.103	34%	0.335	C	S	.	.	H	α-helix	trans	-53.3	-56.3	173.2	-73.5	159.7	42.5	0	0	110.8	L136 L274 V283 A289 H290 L291	L136-M287 HydrophobicContact CD1-CE 4.22Å; L136-M287 HydrophobicContact CD1-CG 3.97Å; L136-M287 HydrophobicContact CD1-SD 3.56Å; L136-M287 VanDerWaalsContact CD1-SD 3.56Å; L136-M287 HydrophobicContact CD2-CE 3.41Å; L136-M287 VanDerWaalsContact CD2-CE 3.41Å; L136-M287 HydrophobicContact CD2-SD 3.91Å; L136-M287 HydrophobicContact CG-CE 4.42Å; L136-M287 HydrophobicContact CG-SD 4.38Å; L274-M287 HydrophobicContact CD1-CG 4.42Å; V283-M287 HydrophobicContact CG1-CG 4.3Å; V283-M287 HydrophobicContact CG1-SD 3.95Å; V283-M287 WeakPolarHBondContact O-CB 3.48Å; V283-M287 WeakPolarHBondContact O-CG 3.38Å; V283-M287 PolarHBondContact O-N 2.96Å; M287-A289 PolarHBondContact O-N 3.35Å; M287-H290 PolarHBondContact O-N 3.05Å; M287-L291 HydrophobicContact CG-CD2 4.21Å; M287-L291 PolarHBondContact O-N 3.16Å
288	N	90.9	Very high	90.3	Very high	142 Å²	142	70.8 Å²	70.8	76%	0.759	36%	0.358	S	S	*	.	H	α-helix	trans	-64.8	-24	-177.1	-66.9	-13.9	0	0	0	113.5	Q284 K285	Q284-N288 VanDerWaalsContact O-CG 3.26Å; Q284-N288 PolarHBondContact O-N 2.98Å; Q284-N288 VanDerWaalsContact O-N 3.14Å; Q284-N288 PolarHBondContact O-ND2 2.73Å; K285-N288 PolarHBondContact O-N 3.26Å
289	A	92.4	Very high	90.1	Very high	69 Å²	69	73.3 Å²	73.3	57%	0.57	37%	0.37	S	S	*	.	H	α-helix	trans	-88.1	-22.6	179.4	0	0	0	0	0	114.3	K285 F286 M287	K285-A289 WeakPolarHBondContact O-CB 3.41Å; K285-A289 PolarHBondContact O-N 2.82Å; K285-A289 VanDerWaalsContact O-N 3.07Å; F286-A289 PolarHBondContact O-N 2.89Å; M287-A289 PolarHBondContact O-N 3.35Å
290	H	94.6	Very high	89.4	Confident	52 Å²	52	71.3 Å²	71.3	24%	0.241	36%	0.362	C	S	.	.	H	α-helix	trans	-133.8	-25.9	-166.8	-59.4	-47.4	0	0	0	116.6	L263 I272 F286 M287	L263-H290 HydrophobicContact CD1-CB 4.07Å; I272-H290 HydrophobicContact CD1-CB 4.22Å; F286-H290 AromaticContact CD2-CD2 3.41Å; F286-H290 VanDerWaalsContact CD2-CD2 3.41Å; F286-H290 WeakPolarHBondContact CD2-CD2 3.42Å; F286-H290 AromaticContact CD2-NE2 3.93Å; F286-H290 AromaticContact CE2-CD2 3.47Å; F286-H290 VanDerWaalsContact CE2-CD2 3.47Å; F286-H290 WeakPolarHBondContact CE2-CD2 3.27Å; F286-H290 AromaticContact CG-CD2 3.82Å; F286-H290 AromaticContact CZ-CD2 3.92Å; F286-H290 WeakPolarHBondContact O-CB 3.42Å; F286-H290 PolarHBondContact O-CD2 3.5Å; F286-H290 PolarHBondContact O-N 2.98Å; M287-H290 PolarHBondContact O-N 3.05Å
291	L	94.4	Very high	88.5	Confident	17 Å²	17	76.8 Å²	76.8	9%	0.089	38%	0.383	C	S	.	.			trans	-89.7	130.2	-175.8	-83.9	56.5	0	0	0	111.2	D134 I272 L274 F286 M287 K293 P294	D134-L291 HydrophobicContact CB-CG 4.49Å; D134-L291 WeakPolarHBondContact OD2-CA 3.27Å; I272-L291 HydrophobicContact CB-CD1 4.17Å; I272-L291 HydrophobicContact CB-CG 4.4Å; I272-L291 HydrophobicContact CD1-CD1 4.24Å; I272-L291 HydrophobicContact CG2-CD1 3.76Å; I272-L291 HydrophobicContact CG2-CG 4.34Å; L274-L291 HydrophobicContact CB-CD2 4.29Å; L274-L291 HydrophobicContact CD1-CD1 4.46Å; L274-L291 HydrophobicContact CD1-CD2 4.4Å; F286-L291 HydrophobicContact CD1-CD1 4.43Å; F286-L291 HydrophobicContact CE1-CD1 4.2Å; M287-L291 HydrophobicContact CG-CD2 4.21Å; M287-L291 PolarHBondContact O-N 3.16Å; L291-K293 PolarHBondContact O-N 3.38Å; L291-P294 HydrophobicContact CB-CB 4.13Å; L291-P294 HydrophobicContact CB-CG 3.93Å; L291-P294 HydrophobicContact CD2-CB 4.02Å; L291-P294 HydrophobicContact CD2-CG 4.21Å; L291-P294 HydrophobicContact CG-CB 4.49Å
292	Q	94	Very high	87.4	Confident	123 Å²	123	75.1 Å²	75.1	58%	0.575	37%	0.372	S	S	*	.	S	Bend	trans	-95.5	88.6	-171.9	-60.8	-173.1	31.1	0	0	111.4	D134 K268	D134-Q292 PolarHBondContact OD2-N 3.12Å; K268-Q292 PolarHBondContact O-NE2 2.86Å
293	K	93.4	Very high	86.3	Confident	182 Å²	182	75 Å²	75	79%	0.791	37%	0.368	S	S	*	.	S	Bend	trans	48.8	61.5	-173.9	-61.8	-178.1	179.4	-179.2	0	110.7	R133 L291	R133-K293 PolarHBondContact NE-O 3.4Å; R133-K293 VanDerWaalsContact NE-O 3.12Å; R133-K293 PolarHBondContact NH2-O 2.96Å; L291-K293 PolarHBondContact O-N 3.38Å
294	P	96.1	Very high	85.1	Confident	30 Å²	30	75.5 Å²	75.5	20%	0.195	37%	0.371	C	S	.	.			trans	-59.3	154.4	-176	27.2	-34.7	0	0	0	111.3	D134 L136 L291	D134-P294 HydrophobicContact CB-CB 4.16Å; D134-P294 CarbonylContact O-C 3.54Å; D134-P294 WeakPolarHBondContact O-CA 3.46Å; L136-P294 HydrophobicContact CB-CB 4.28Å; L291-P294 HydrophobicContact CB-CB 4.13Å; L291-P294 HydrophobicContact CB-CG 3.93Å; L291-P294 HydrophobicContact CD2-CB 4.02Å; L291-P294 HydrophobicContact CD2-CG 4.21Å; L291-P294 HydrophobicContact CG-CB 4.49Å
295	Y	96.4	Very high	84.1	Confident	84 Å²	84	72.1 Å²	72.1	33%	0.329	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	123.1	162.9	-173.3	-107.1	0	0	0	108.6	I128 D134 L136 I297	I128-Y295 HydrophobicContact CB-CD1 4.21Å; I128-Y295 HydrophobicContact CD1-CD1 4.19Å; I128-Y295 HydrophobicContact CD1-CD2 4.41Å; I128-Y295 HydrophobicContact CD1-CE1 4.16Å; I128-Y295 HydrophobicContact CD1-CE2 4.39Å; I128-Y295 HydrophobicContact CD1-CG 4.31Å; I128-Y295 HydrophobicContact CG1-CD1 3.72Å; I128-Y295 HydrophobicContact CG1-CE1 3.78Å; I128-Y295 HydrophobicContact CG1-CG 4.25Å; I128-Y295 HydrophobicContact CG2-CD1 3.82Å; I128-Y295 HydrophobicContact CG2-CG 3.82Å; D134-Y295 PolarHBondContact O-N 3.1Å; L136-Y295 PolarHBondContact N-O 3.04Å; Y295-I297 HydrophobicContact CD1-CD1 4.04Å; Y295-I297 HydrophobicContact CD1-CG1 3.57Å; Y295-I297 HydrophobicContact CE1-CD1 4.23Å; Y295-I297 HydrophobicContact CE1-CG1 3.63Å
296	E	94.3	Very high	83.4	Confident	131 Å²	131	68.2 Å²	68.2	61%	0.612	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	114	-176.7	-55.2	-161.8	172.4	0	0	110.7	L136	L136-E296 HydrophobicContact CB-CG 4.24Å; L136-E296 HydrophobicContact CD2-CB 4.38Å; L136-E296 HydrophobicContact CD2-CG 3.83Å; L136-E296 CarbonylContact O-C 3.59Å; L136-E296 WeakPolarHBondContact O-CA 3.46Å
297	I	92	Very high	82.9	Confident	9 Å²	9	68.9 Å²	68.9	5%	0.046	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	106.7	176.3	-58.9	171.7	0	0	0	107.3	I121 E124 I135 L136 A137 R138 Y295 L299	I121-I297 HydrophobicContact CD1-CG2 3.92Å; E124-I297 HydrophobicContact CB-CD1 3.89Å; E124-I297 HydrophobicContact CB-CG1 4.2Å; E124-I297 HydrophobicContact CB-CG2 3.99Å; E124-I297 HydrophobicContact CG-CG2 4.37Å; I135-I297 HydrophobicContact CD1-CD1 4.46Å; I135-I297 HydrophobicContact CG2-CD1 3.88Å; I135-I297 HydrophobicContact CG2-CG1 4.48Å; L136-I297 PolarHBondContact O-N 3.39Å; A137-I297 HydrophobicContact CB-CB 4.5Å; R138-I297 PolarHBondContact N-O 2.84Å; Y295-I297 HydrophobicContact CD1-CD1 4.04Å; Y295-I297 HydrophobicContact CD1-CG1 3.57Å; Y295-I297 HydrophobicContact CE1-CD1 4.23Å; Y295-I297 HydrophobicContact CE1-CG1 3.63Å; I297-L299 HydrophobicContact CG2-CD1 3.94Å; I297-L299 HydrophobicContact CG2-CG 3.87Å
298	N	87.3	Confident	82.8	Confident	94 Å²	94	68.3 Å²	68.3	50%	0.503	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	101	170.3	-177.9	27.2	0	0	0	111	R138 M300	R138-N298 WeakPolarHBondContact CD-OD1 3.49Å; N298-M300 VanDerWaalsContact C-N 3.33Å; N298-M300 PolarHBondContact ND2-O 3.06Å; N298-M300 PolarHBondContact OD1-N 3.24Å; N298-M300 VanDerWaalsContact OD1-N 3.08Å; N298-M300 PolarHBondContact OD1-O 3.23Å; N298-M300 VanDerWaalsContact OD1-O 3.13Å
299	L	76.3	Confident	82.9	Confident	72 Å²	72	63.1 Å²	63.1	38%	0.377	32%	0.318	S	S	.	.			trans	-100.5	27.6	174.8	-64.1	170.8	0	0	0	111.8	P120 I121 E124 R138 I297	P120-L299 HydrophobicContact CB-CD1 4.24Å; I121-L299 VanDerWaalsContact CA-CD1 3.45Å; I121-L299 HydrophobicContact CB-CD1 3.74Å; I121-L299 HydrophobicContact CD1-CD1 4.03Å; I121-L299 HydrophobicContact CG1-CD1 4.46Å; E124-L299 HydrophobicContact CG-CD2 4.46Å; R138-L299 PolarHBondContact O-N 3.28Å; I297-L299 HydrophobicContact CG2-CD1 3.94Å; I297-L299 HydrophobicContact CG2-CG 3.87Å
300	M	71.4	Confident	83.1	Confident	10 Å²	10	60.7 Å²	60.7	5%	0.049	30%	0.295	C	S	.	.			trans	-132.2	96.9	-179	-66.9	-171.3	69.6	0	0	110.5	R138 K140 N298 E302	R138-M300 HydrophobicContact CG-CB 4.48Å; R138-M300 HydrophobicContact CG-SD 4.09Å; K140-M300 HydrophobicContact CB-CE 4.03Å; K140-M300 HydrophobicContact CB-SD 4.07Å; K140-M300 PolarHBondContact N-SD 2.89Å; N298-M300 VanDerWaalsContact C-N 3.33Å; N298-M300 PolarHBondContact ND2-O 3.06Å; N298-M300 PolarHBondContact OD1-N 3.24Å; N298-M300 VanDerWaalsContact OD1-N 3.08Å; N298-M300 PolarHBondContact OD1-O 3.23Å; N298-M300 VanDerWaalsContact OD1-O 3.13Å; M300-E302 WeakPolarHBondContact CE-O 3.47Å
301	E	63.9	Low	83.2	Confident	165 Å²	165	59.4 Å²	59.4	77%	0.771	29%	0.288	S	S	*	.	S	Bend	trans	-65.3	-52.2	165.3	-59.2	161.2	127.9	0	0	109.4	K306	E301-K306 IonicContact OE2-NZ 2.78Å; E301-K306 PolarHBondContact OE2-NZ 2.7Å
302	E	63.8	Low	83.4	Confident	91 Å²	91	60.5 Å²	60.5	43%	0.425	29%	0.291	S	S	.	.	S	Bend	trans	-99.7	156.7	174.8	-81.5	177.7	-144.7	0	0	111.7	M300 T304	M300-E302 WeakPolarHBondContact CE-O 3.47Å; E302-T304 HydrophobicContact CB-CG2 4.04Å; E302-T304 HydrophobicContact CG-CG2 4.45Å; E302-T304 PolarHBondContact O-N 3.15Å; E302-T304 WeakPolarHBondContact OE2-CB 3.43Å; E302-T304 WeakPolarHBondContact OE2-CG2 3.47Å; E302-T304 PolarHBondContact OE2-OG1 3.12Å
303	L	62.7	Low	83.6	Confident	39 Å²	39	55 Å²	55	20%	0.204	27%	0.267	C	S	.	.	S	Bend	trans	-77.4	-1.1	168.9	-93.4	162.9	0	0	0	113.3	R138 T278 L418 Q451 L452	R138-L303 VanDerWaalsContact NH2-CG 3.34Å; T278-L303 HydrophobicContact CG2-CD2 4.25Å; L303-L418 HydrophobicContact CD2-CD2 4.33Å; L303-L418 WeakPolarHBondContact O-CD1 3.29Å; L303-L418 WeakPolarHBondContact O-CD2 3.33Å; L303-Q451 VanDerWaalsContact CD1-O 3.31Å; L303-Q451 WeakPolarHBondContact CD1-O 3.48Å; L303-L452 HydrophobicContact CB-CB 4.26Å; L303-L452 HydrophobicContact CB-CD2 3.91Å; L303-L452 WeakPolarHBondContact CB-O 3.2Å; L303-L452 HydrophobicContact CD1-CD2 4.39Å
304	T	62.9	Low	83.8	Confident	11 Å²	11	52 Å²	52	7%	0.067	25%	0.252	C	S	.	.	S	Bend	trans	-87.4	179.5	-168.4	77.1	0	0	0	0	113.6	E302 L452 T454	E302-T304 HydrophobicContact CB-CG2 4.04Å; E302-T304 HydrophobicContact CG-CG2 4.45Å; E302-T304 PolarHBondContact O-N 3.15Å; E302-T304 WeakPolarHBondContact OE2-CB 3.43Å; E302-T304 WeakPolarHBondContact OE2-CG2 3.47Å; E302-T304 PolarHBondContact OE2-OG1 3.12Å; T304-L452 WeakPolarHBondContact CG2-O 3.5Å; T304-T454 VanDerWaalsContact CG2-CB 3.43Å; T304-T454 WeakPolarHBondContact CG2-OG1 2.95Å
305	L	67.6	Low	83.8	Confident	10 Å²	10	51.5 Å²	51.5	5%	0.052	25%	0.247	C	C	.	.			trans	-109.6	91.3	170.5	-56.6	-178	0	0	0	110.2	K140 G307 V308 L418 I421	K140-L305 HydrophobicContact CB-CD2 3.83Å; K140-L305 HydrophobicContact CD-CD2 3.77Å; K140-L305 HydrophobicContact CG-CD2 4.14Å; L305-G307 PolarHBondContact O-N 2.95Å; L305-V308 HydrophobicContact CB-CB 4.1Å; L305-V308 HydrophobicContact CB-CG2 3.82Å; L305-V308 HydrophobicContact CD1-CG2 4.03Å; L305-V308 PolarHBondContact O-N 2.89Å; L305-L418 HydrophobicContact CD1-CD1 4.41Å; L305-L418 HydrophobicContact CD2-CD1 3.69Å; L305-L418 HydrophobicContact CG-CD1 3.76Å; L305-I421 HydrophobicContact CB-CD1 4.47Å; L305-I421 VanDerWaalsContact CD1-C 3.45Å; L305-I421 HydrophobicContact CD1-CB 4.23Å; L305-I421 HydrophobicContact CD1-CD1 3.82Å; L305-I421 HydrophobicContact CD1-CG1 3.64Å; L305-I421 HydrophobicContact CG-CD1 4.07Å; L305-I421 HydrophobicContact CG-CG1 4.33Å
306	K	75	Confident	83.9	Confident	76 Å²	76	51.1 Å²	51.1	33%	0.33	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	125.1	161.5	-61.6	-173.8	-177.1	-175.4	0	108.6	K140 E301	K140-K306 PolarHBondContact NZ-O 3.05Å; E301-K306 IonicContact OE2-NZ 2.78Å; E301-K306 PolarHBondContact OE2-NZ 2.7Å
307	G	81.4	Confident	84	Confident	18 Å²	18	49 Å²	49	19%	0.186	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	104.6	-21.4	-174.8	0	0	0	0	0	115.8	L305 L430 G431	L305-G307 PolarHBondContact O-N 2.95Å; G307-L430 WeakPolarHBondContact O-CA 3.31Å; G307-G431 PolarHBondContact O-N 2.76Å; G307-G431 VanDerWaalsContact O-N 3.14Å
308	V	88.9	Confident	84.1	Confident	10 Å²	10	60.1 Å²	60.1	6%	0.061	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	113.3	-179.8	-176.3	0	0	0	0	111.1	L305 Q310 G431 A433	L305-V308 HydrophobicContact CB-CB 4.1Å; L305-V308 HydrophobicContact CB-CG2 3.82Å; L305-V308 HydrophobicContact CD1-CG2 4.03Å; L305-V308 PolarHBondContact O-N 2.89Å; V308-Q310 HydrophobicContact CG1-CG 4.31Å; V308-G431 CarbonylContact C-O 3.49Å; V308-G431 WeakPolarHBondContact CA-O 3.4Å; V308-A433 HydrophobicContact CG1-CB 3.78Å
309	T	92.7	Very high	84.6	Confident	33 Å²	33	60.4 Å²	60.4	20%	0.202	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	129.4	171.4	-62.9	0	0	0	0	109.8	Y311 G431 L432 A433 L467	T309-Y311 HydrophobicContact CG2-CD2 4.13Å; T309-Y311 HydrophobicContact CG2-CE2 3.47Å; T309-Y311 VanDerWaalsContact CG2-CE2 3.47Å; T309-G431 PolarHBondContact N-O 2.89Å; T309-L432 HydrophobicContact CG2-CD1 3.96Å; T309-A433 PolarHBondContact O-N 3.17Å; T309-L467 HydrophobicContact CG2-CD1 4.09Å
310	Q	95.1	Very high	85.6	Confident	17 Å²	17	57 Å²	57	8%	0.079	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.7	-171.3	-63.7	173.3	77.7	0	0	111.9	V308 Y417 I421 A433 T454 I456 K457	V308-Q310 HydrophobicContact CG1-CG 4.31Å; Q310-Y417 PolarHBondContact OE1-OH 3.12Å; Q310-I421 HydrophobicContact CG-CD1 4.5Å; Q310-A433 WeakPolarHBondContact CA-O 3.49Å; Q310-A433 HydrophobicContact CG-CB 4.21Å; Q310-T454 PolarHBondContact NE2-OG1 2.95Å; Q310-I456 HydrophobicContact CB-CG1 4.24Å; Q310-I456 HydrophobicContact CB-CG2 4.31Å; Q310-K457 PolarHBondContact O-N 3Å
311	Y	97.6	Very high	86.9	Confident	25 Å²	25	58.6 Å²	58.6	10%	0.098	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	157.5	175.9	-65.1	-62.6	0	0	0	113.1	T309 L432 A433 N435 K457 I459 P460 I463	T309-Y311 HydrophobicContact CG2-CD2 4.13Å; T309-Y311 HydrophobicContact CG2-CE2 3.47Å; T309-Y311 VanDerWaalsContact CG2-CE2 3.47Å; Y311-L432 HydrophobicContact CD2-CD1 3.75Å; Y311-L432 HydrophobicContact CE2-CD1 3.8Å; Y311-A433 PolarHBondContact N-O 2.93Å; Y311-N435 WeakPolarHBondContact O-CB 3.42Å; Y311-N435 PolarHBondContact O-N 2.83Å; Y311-N435 PolarHBondContact O-ND2 2.77Å; Y311-K457 CarbonylContact C-O 3.56Å; Y311-K457 WeakPolarHBondContact CA-O 3.49Å; Y311-K457 HydrophobicContact CD1-CB 3.69Å; Y311-K457 HydrophobicContact CE1-CB 3.85Å; Y311-I459 HydrophobicContact CG-CG1 4.49Å; Y311-P460 HydrophobicContact CE1-CG 4.02Å; Y311-P460 HydrophobicContact CE2-CG 4.49Å; Y311-I463 HydrophobicContact CD2-CD1 3.88Å; Y311-I463 HydrophobicContact CD2-CG1 4.19Å; Y311-I463 HydrophobicContact CE2-CD1 4.01Å; Y311-I463 HydrophobicContact CE2-CG1 3.83Å; Y311-I463 HydrophobicContact CE2-CG2 3.92Å
312	Y	97.9	Very high	88.4	Confident	41 Å²	41	57.1 Å²	57.1	16%	0.161	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	149.6	165.8	74.7	-98.4	0	0	0	112.9	Y314 N435 I437 L445 I456 K457 P458 I459	Y312-Y314 HydrophobicContact CD2-CD2 4.39Å; Y312-Y314 HydrophobicContact CD2-CE2 4.37Å; Y312-Y314 AromaticContact CE2-CD2 3.76Å; Y312-Y314 HydrophobicContact CE2-CD2 3.76Å; Y312-Y314 AromaticContact CE2-CE2 3.51Å; Y312-Y314 HydrophobicContact CE2-CE2 3.51Å; Y312-Y314 HydrophobicContact CE2-CG 4.41Å; Y312-Y314 AromaticContact CE2-CZ 3.96Å; Y312-N435 CarbonylContact C-O 3.41Å; Y312-N435 WeakPolarHBondContact CA-O 3.32Å; Y312-I437 HydrophobicContact CD2-CG1 4.46Å; Y312-I437 HydrophobicContact CG-CG1 4.36Å; Y312-L445 HydrophobicContact CD1-CD2 3.97Å; Y312-L445 HydrophobicContact CD2-CD2 4.42Å; Y312-L445 HydrophobicContact CE1-CD2 4.23Å; Y312-L445 HydrophobicContact CG-CD2 4.08Å; Y312-I456 HydrophobicContact CD1-CG2 4.03Å; Y312-I456 WeakPolarHBondContact CD1-O 3.34Å; Y312-I456 WeakPolarHBondContact CE1-O 3.22Å; Y312-K457 WeakPolarHBondContact CD1-O 3.36Å; Y312-K457 PolarHBondContact N-O 2.76Å; Y312-P458 HydrophobicContact CE1-CB 4.26Å; Y312-P458 HydrophobicContact CE2-CB 4.33Å; Y312-I459 WeakPolarHBondContact O-CB 3.48Å; Y312-I459 WeakPolarHBondContact O-CG2 3.44Å; Y312-I459 PolarHBondContact O-N 3.19Å
313	A	97.9	Very high	90	Very high	8 Å²	8	53.9 Å²	53.9	7%	0.066	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	123.9	171.7	0	0	0	0	0	109.2	V315 N435 L436 I437 I459	A313-V315 HydrophobicContact CB-CG1 4.47Å; A313-V315 PolarHBondContact O-N 2.88Å; A313-N435 PolarHBondContact N-O 3.01Å; A313-L436 HydrophobicContact CB-CD2 4.23Å; A313-I437 PolarHBondContact O-N 3.08Å; A313-I459 HydrophobicContact CB-CG2 3.91Å
314	Y	97.8	Very high	91.6	Very high	119 Å²	119	52 Å²	52	47%	0.467	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	120.1	171.1	-82.1	-54.8	0	0	0	110.3	Y312 I437 R442	Y312-Y314 HydrophobicContact CD2-CD2 4.39Å; Y312-Y314 HydrophobicContact CD2-CE2 4.37Å; Y312-Y314 AromaticContact CE2-CD2 3.76Å; Y312-Y314 HydrophobicContact CE2-CD2 3.76Å; Y312-Y314 AromaticContact CE2-CE2 3.51Å; Y312-Y314 HydrophobicContact CE2-CE2 3.51Å; Y312-Y314 HydrophobicContact CE2-CG 4.41Å; Y312-Y314 AromaticContact CE2-CZ 3.96Å; Y314-I437 WeakPolarHBondContact CA-O 3.26Å; Y314-I437 HydrophobicContact CD1-CB 4.15Å; Y314-I437 HydrophobicContact CD1-CG2 3.75Å; Y314-I437 HydrophobicContact CE1-CB 4.34Å; Y314-I437 HydrophobicContact CE1-CG2 3.52Å; Y314-R442 HydrophobicContact CE1-CG 3.75Å
315	V	97.8	Very high	93.2	Very high	18 Å²	18	53.8 Å²	53.8	11%	0.109	26%	0.256	C	S	.	.			trans	-145.5	143.6	-177.3	-68.8	0	0	0	0	111.4	A313 Q319 K320 C323 L436 I437 T438	A313-V315 HydrophobicContact CB-CG1 4.47Å; A313-V315 PolarHBondContact O-N 2.88Å; V315-Q319 HydrophobicContact CB-CB 4.35Å; V315-K320 HydrophobicContact CB-CG 4.47Å; V315-K320 HydrophobicContact CG2-CG 3.65Å; V315-C323 HydrophobicContact CG1-CB 3.86Å; V315-L436 HydrophobicContact CG2-CB 3.82Å; V315-L436 HydrophobicContact CG2-CD2 4.39Å; V315-I437 PolarHBondContact N-O 2.79Å; V315-T438 WeakPolarHBondContact O-CA 3.2Å
316	T	97.7	Very high	94.5	Very high	77 Å²	77	55.5 Å²	55.5	47%	0.472	27%	0.266	S	S	.	.			trans	-75.1	157	163.8	64.7	0	0	0	0	110.5	R318 Q319 K320	T316-R318 PolarHBondContact O-N 2.8Å; T316-R318 VanDerWaalsContact O-N 3.15Å; T316-Q319 WeakPolarHBondContact O-CA 3.36Å; T316-Q319 PolarHBondContact O-N 2.85Å; T316-Q319 VanDerWaalsContact OG1-CD 3.28Å; T316-Q319 WeakPolarHBondContact OG1-CG 3.41Å; T316-Q319 PolarHBondContact OG1-OE1 3.38Å; T316-K320 PolarHBondContact O-N 3.28Å; T316-K320 VanDerWaalsContact O-N 3.16Å
317	E	96	Very high	95.5	Very high	87 Å²	87	52.4 Å²	52.4	41%	0.407	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-39.7	174.2	-82	-70.4	119.3	0	0	113	Q319 K320 R345 T438	E317-Q319 VanDerWaalsContact C-N 3.28Å; E317-Q319 PolarHBondContact O-N 3.01Å; E317-K320 PolarHBondContact O-N 3.36Å; E317-K320 VanDerWaalsContact OE1-CD 3.31Å; E317-K320 WeakPolarHBondContact OE1-CD 3.43Å; E317-K320 WeakPolarHBondContact OE1-CE 3.49Å; E317-K320 IonicContact OE1-NZ 3.81Å; E317-K320 PolarHBondContact OE1-NZ 2.86Å; E317-R345 VanDerWaalsContact CD-NH2 3.35Å; E317-R345 IonicContact OE1-NH2 3.12Å; E317-R345 PolarHBondContact OE1-NH2 3.16Å; E317-R345 VanDerWaalsContact OE1-NH2 3.16Å; E317-R345 IonicContact OE2-CZ 2.95Å; E317-R345 IonicContact OE2-NH1 2.93Å; E317-R345 PolarHBondContact OE2-NH1 3Å; E317-R345 IonicContact OE2-NH2 2.67Å; E317-R345 PolarHBondContact OE2-NH2 3.19Å; E317-T438 HydrophobicContact CG-CG2 4.31Å
318	R	95.2	Very high	96.2	Very high	241 Å²	241	52.4 Å²	52.4	91%	0.909	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-29.1	177.5	-64.4	-177.4	-178.7	178	0.6	112.9	T316	T316-R318 PolarHBondContact O-N 2.8Å; T316-R318 VanDerWaalsContact O-N 3.15Å
319	Q	96.8	Very high	96.4	Very high	100 Å²	100	56.2 Å²	56.2	47%	0.467	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-18.1	-178.9	-71.5	162.4	-44.4	0	0	113.6	V315 T316 E317 V321 H322 C323	V315-Q319 HydrophobicContact CB-CB 4.35Å; T316-Q319 WeakPolarHBondContact O-CA 3.36Å; T316-Q319 PolarHBondContact O-N 2.85Å; T316-Q319 VanDerWaalsContact OG1-CD 3.28Å; T316-Q319 WeakPolarHBondContact OG1-CG 3.41Å; T316-Q319 PolarHBondContact OG1-OE1 3.38Å; E317-Q319 VanDerWaalsContact C-N 3.28Å; E317-Q319 PolarHBondContact O-N 3.01Å; Q319-V321 VanDerWaalsContact C-N 3.32Å; Q319-V321 PolarHBondContact O-N 3.05Å; Q319-H322 PolarHBondContact O-N 3.5Å; Q319-C323 PolarHBondContact O-N 3.21Å
320	K	97.9	Very high	96.4	Very high	2 Å²	2	63 Å²	63	1%	0.009	30%	0.297	C	S	.	.	H	α-helix	trans	-52.3	-43.4	-174.4	-78.9	-173.4	168.2	177.6	0	114.1	V315 T316 E317 C323 L324 F408 D409 L436	V315-K320 HydrophobicContact CB-CG 4.47Å; V315-K320 HydrophobicContact CG2-CG 3.65Å; T316-K320 PolarHBondContact O-N 3.28Å; T316-K320 VanDerWaalsContact O-N 3.16Å; E317-K320 PolarHBondContact O-N 3.36Å; E317-K320 VanDerWaalsContact OE1-CD 3.31Å; E317-K320 WeakPolarHBondContact OE1-CD 3.43Å; E317-K320 WeakPolarHBondContact OE1-CE 3.49Å; E317-K320 IonicContact OE1-NZ 3.81Å; E317-K320 PolarHBondContact OE1-NZ 2.86Å; K320-C323 PolarHBondContact O-N 3.48Å; K320-L324 WeakPolarHBondContact O-CB 3.25Å; K320-L324 PolarHBondContact O-N 2.95Å; K320-F408 HydrophobicContact CB-CD2 4.37Å; K320-F408 HydrophobicContact CB-CE1 4.19Å; K320-F408 HydrophobicContact CB-CE2 3.65Å; K320-F408 HydrophobicContact CB-CZ 3.54Å; K320-F408 HydrophobicContact CD-CD1 4.29Å; K320-F408 HydrophobicContact CD-CE1 4.03Å; K320-F408 HydrophobicContact CD-CZ 4.25Å; K320-F408 VanDerWaalsContact CD-O 3.31Å; K320-F408 WeakPolarHBondContact CD-O 3.35Å; K320-F408 WeakPolarHBondContact CE-O 3.34Å; K320-F408 PolarHBondContact NZ-O 3.48Å; K320-D409 IonicContact NZ-OD1 2.66Å; K320-D409 PolarHBondContact NZ-OD1 2.81Å; K320-L436 HydrophobicContact CB-CD1 3.99Å; K320-L436 HydrophobicContact CD-CB 4.37Å; K320-L436 HydrophobicContact CD-CD1 4.47Å; K320-L436 HydrophobicContact CG-CB 4.26Å; K320-L436 HydrophobicContact CG-CD1 3.99Å
321	V	97.3	Very high	96.4	Very high	42 Å²	42	63.1 Å²	63.1	26%	0.255	30%	0.298	S	S	.	.	H	α-helix	trans	-68.2	-37.7	178.4	-179.1	0	0	0	0	112.1	Q319 L324 N325 L349 K352 L356 F408	Q319-V321 VanDerWaalsContact C-N 3.32Å; Q319-V321 PolarHBondContact O-N 3.05Å; V321-L324 PolarHBondContact O-N 3.25Å; V321-N325 PolarHBondContact O-N 2.87Å; V321-L349 HydrophobicContact CG2-CD1 4.2Å; V321-K352 HydrophobicContact CG1-CG 4.06Å; V321-L356 HydrophobicContact CG1-CD1 4.19Å; V321-F408 HydrophobicContact CG2-CE2 4.21Å; V321-F408 HydrophobicContact CG2-CZ 3.94Å
322	H	96.9	Very high	96.2	Very high	135 Å²	135	64.7 Å²	64.7	63%	0.625	31%	0.306	S	S	*	.	H	α-helix	trans	-69.8	-40.3	176	178	76	0	0	0	111.7	Q319 N325 T326	Q319-H322 PolarHBondContact O-N 3.5Å; H322-N325 WeakPolarHBondContact O-CB 3.32Å; H322-N325 PolarHBondContact O-N 3.14Å; H322-T326 PolarHBondContact O-N 3.27Å; H322-T326 PolarHBondContact O-OG1 2.9Å
323	C	97.1	Very high	96	Very high	22 Å²	22	63.4 Å²	63.4	15%	0.149	30%	0.302	C	S	.	.	H	α-helix	trans	-60	-48.3	172.4	-176.3	0	0	0	0	111.2	V315 Q319 K320 N325 T326 L327 L436	V315-C323 HydrophobicContact CG1-CB 3.86Å; Q319-C323 PolarHBondContact O-N 3.21Å; K320-C323 PolarHBondContact O-N 3.48Å; C323-N325 VanDerWaalsContact C-N 3.32Å; C323-N325 PolarHBondContact O-N 2.87Å; C323-T326 WeakPolarHBondContact O-CB 3.32Å; C323-T326 PolarHBondContact O-N 3.3Å; C323-T326 VanDerWaalsContact O-N 3.1Å; C323-L327 WeakPolarHBondContact O-CG 3.25Å; C323-L327 PolarHBondContact O-N 2.77Å; C323-L436 HydrophobicContact CB-CD2 4.45Å
324	L	96.8	Very high	95.7	Very high	1 Å²	1	67.5 Å²	67.5	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-56.8	-42.7	175.8	-178.9	64.7	0	0	0	112.4	K320 V321 T326 L327 F328 I338 L349 I353 I406 F408	K320-L324 WeakPolarHBondContact O-CB 3.25Å; K320-L324 PolarHBondContact O-N 2.95Å; V321-L324 PolarHBondContact O-N 3.25Å; L324-T326 PolarHBondContact O-N 2.86Å; L324-L327 PolarHBondContact O-N 3.41Å; L324-F328 HydrophobicContact CD1-CD1 4.13Å; L324-F328 HydrophobicContact CD1-CE1 3.79Å; L324-F328 HydrophobicContact CD1-CE2 4.28Å; L324-F328 HydrophobicContact CD1-CZ 3.9Å; L324-F328 HydrophobicContact CG-CD2 4.4Å; L324-F328 HydrophobicContact CG-CE2 4.25Å; L324-F328 HydrophobicContact CG-CZ 4.36Å; L324-F328 WeakPolarHBondContact O-CB 3.36Å; L324-F328 WeakPolarHBondContact O-CG 3.22Å; L324-F328 PolarHBondContact O-N 3.22Å; L324-I338 HydrophobicContact CD1-CD1 4.36Å; L324-I338 HydrophobicContact CD2-CD1 4.17Å; L324-L349 HydrophobicContact CD2-CD1 3.96Å; L324-L349 HydrophobicContact CD2-CD2 4.35Å; L324-I353 HydrophobicContact CD2-CG2 3.9Å; L324-I406 HydrophobicContact CD1-CD1 3.57Å; L324-I406 HydrophobicContact CD1-CG2 4.22Å; L324-F408 HydrophobicContact CD2-CD2 4.05Å; L324-F408 HydrophobicContact CD2-CE2 4.18Å
325	N	95.8	Very high	95.5	Very high	48 Å²	48	62.2 Å²	62.2	26%	0.257	30%	0.302	S	S	.	.	H	α-helix	trans	-60.7	-43.1	175.1	-172.2	86.5	0	0	0	112.2	V321 H322 C323 F328 S329 Y358	V321-N325 PolarHBondContact O-N 2.87Å; H322-N325 WeakPolarHBondContact O-CB 3.32Å; H322-N325 PolarHBondContact O-N 3.14Å; C323-N325 VanDerWaalsContact C-N 3.32Å; C323-N325 PolarHBondContact O-N 2.87Å; N325-F328 PolarHBondContact O-N 3.01Å; N325-S329 PolarHBondContact O-N 3Å; N325-S329 PolarHBondContact O-OG 2.97Å; N325-Y358 WeakPolarHBondContact OD1-CE2 3.27Å; N325-Y358 PolarHBondContact OD1-OH 3.27Å
326	T	95.7	Very high	95.4	Very high	46 Å²	46	61.3 Å²	61.3	28%	0.282	30%	0.297	S	S	.	.	H	α-helix	trans	-65.8	-38.2	176	-63.2	0	0	0	0	112.2	H322 C323 L324 S329 R330	H322-T326 PolarHBondContact O-N 3.27Å; H322-T326 PolarHBondContact O-OG1 2.9Å; C323-T326 WeakPolarHBondContact O-CB 3.32Å; C323-T326 PolarHBondContact O-N 3.3Å; C323-T326 VanDerWaalsContact O-N 3.1Å; L324-T326 PolarHBondContact O-N 2.86Å; T326-S329 PolarHBondContact O-N 3.11Å; T326-R330 WeakPolarHBondContact O-CB 3.37Å; T326-R330 WeakPolarHBondContact O-CG 3.47Å; T326-R330 PolarHBondContact O-N 3.12Å; T326-R330 VanDerWaalsContact O-N 3.16Å
327	L	96	Very high	95.3	Very high	11 Å²	11	57.9 Å²	57.9	6%	0.058	28%	0.276	C	S	.	.	H	α-helix	trans	-62.6	-48.1	172.7	-66.4	175.5	0	0	0	111.1	C323 L324 S329 R330 L331 I406 I434 L436 I459	C323-L327 WeakPolarHBondContact O-CG 3.25Å; C323-L327 PolarHBondContact O-N 2.77Å; L324-L327 PolarHBondContact O-N 3.41Å; L327-S329 PolarHBondContact O-N 2.96Å; L327-R330 PolarHBondContact O-N 2.94Å; L327-R330 VanDerWaalsContact O-N 3.09Å; L327-L331 HydrophobicContact CB-CD1 4.07Å; L327-L331 HydrophobicContact CD2-CD1 4.37Å; L327-L331 WeakPolarHBondContact O-CB 3.23Å; L327-L331 WeakPolarHBondContact O-CG 3.47Å; L327-L331 PolarHBondContact O-N 3.19Å; L327-I406 HydrophobicContact CD1-CD1 4.45Å; L327-I434 HydrophobicContact CD1-CD1 4.26Å; L327-I434 HydrophobicContact CD1-CG2 3.84Å; L327-I434 HydrophobicContact CD2-CD1 3.83Å; L327-I434 HydrophobicContact CD2-CG2 4.45Å; L327-L436 HydrophobicContact CD1-CD2 4.36Å; L327-I459 HydrophobicContact CD2-CD1 3.67Å
328	F	94.8	Very high	95.3	Very high	18 Å²	18	53.7 Å²	53.7	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-22.3	177.9	-77.5	-1.6	0	0	0	114.2	L324 N325 I333 I338 I353 Y358 N386 I406	L324-F328 HydrophobicContact CD1-CD1 4.13Å; L324-F328 HydrophobicContact CD1-CE1 3.79Å; L324-F328 HydrophobicContact CD1-CE2 4.28Å; L324-F328 HydrophobicContact CD1-CZ 3.9Å; L324-F328 HydrophobicContact CG-CD2 4.4Å; L324-F328 HydrophobicContact CG-CE2 4.25Å; L324-F328 HydrophobicContact CG-CZ 4.36Å; L324-F328 WeakPolarHBondContact O-CB 3.36Å; L324-F328 WeakPolarHBondContact O-CG 3.22Å; L324-F328 PolarHBondContact O-N 3.22Å; N325-F328 PolarHBondContact O-N 3.01Å; F328-I333 HydrophobicContact CD1-CD1 3.42Å; F328-I333 VanDerWaalsContact CD1-CD1 3.42Å; F328-I333 HydrophobicContact CE1-CD1 3.67Å; F328-I333 HydrophobicContact CG-CD1 4.44Å; F328-I338 HydrophobicContact CE2-CD1 4.28Å; F328-I338 HydrophobicContact CZ-CD1 3.6Å; F328-I338 HydrophobicContact CZ-CG1 4.39Å; F328-I353 HydrophobicContact CE2-CD1 4.47Å; F328-Y358 HydrophobicContact CB-CD1 4.36Å; F328-Y358 HydrophobicContact CB-CE1 3.58Å; F328-Y358 AromaticContact CD2-CD1 3.58Å; F328-Y358 HydrophobicContact CD2-CD1 3.58Å; F328-Y358 AromaticContact CD2-CD2 4Å; F328-Y358 HydrophobicContact CD2-CD2 4Å; F328-Y358 AromaticContact CD2-CE1 3.59Å; F328-Y358 HydrophobicContact CD2-CE1 3.59Å; F328-Y358 HydrophobicContact CD2-CE2 4Å; F328-Y358 AromaticContact CD2-CG 3.8Å; F328-Y358 HydrophobicContact CD2-CG 3.8Å; F328-Y358 AromaticContact CD2-CZ 3.81Å; F328-Y358 HydrophobicContact CE2-CD1 4.23Å; F328-Y358 HydrophobicContact CE2-CD2 4.47Å; F328-Y358 HydrophobicContact CE2-CG 4.15Å; F328-Y358 HydrophobicContact CG-CD1 4.38Å; F328-Y358 HydrophobicContact CG-CE1 4.06Å; F328-N386 HydrophobicContact CZ-CB 4.44Å; F328-N386 WeakPolarHBondContact CZ-OD1 3.35Å; F328-I406 HydrophobicContact CD1-CD1 4.29Å; F328-I406 HydrophobicContact CE1-CD1 3.73Å
329	S	92.7	Very high	95.4	Very high	89 Å²	89	42.2 Å²	42.2	62%	0.622	21%	0.213	S	C	*	.	H	α-helix	trans	-91.3	-13.1	175	-58.3	0	0	0	0	114	N325 T326 L327	N325-S329 PolarHBondContact O-N 3Å; N325-S329 PolarHBondContact O-OG 2.97Å; T326-S329 PolarHBondContact O-N 3.11Å; L327-S329 PolarHBondContact O-N 2.96Å
330	R	93.3	Very high	95.4	Very high	177 Å²	177	37.5 Å²	37.5	67%	0.668	19%	0.191	S	C	*	.	H	α-helix	trans	-109.4	-24.5	-178.7	-72.4	-174.3	-178	-159.4	2.2	114.5	T326 L327 G461	T326-R330 WeakPolarHBondContact O-CB 3.37Å; T326-R330 WeakPolarHBondContact O-CG 3.47Å; T326-R330 PolarHBondContact O-N 3.12Å; T326-R330 VanDerWaalsContact O-N 3.16Å; L327-R330 PolarHBondContact O-N 2.94Å; L327-R330 VanDerWaalsContact O-N 3.09Å; R330-G461 PolarHBondContact NH1-O 3.11Å
331	L	94.7	Very high	95.2	Very high	18 Å²	18	40.6 Å²	40.6	9%	0.094	21%	0.208	C	C	.	.	S	Bend	trans	-97	139.2	-173.9	-64	172.5	0	0	0	112.3	L327 I333 V404 L432 I434 I463 Y468	L327-L331 HydrophobicContact CB-CD1 4.07Å; L327-L331 HydrophobicContact CD2-CD1 4.37Å; L327-L331 WeakPolarHBondContact O-CB 3.23Å; L327-L331 WeakPolarHBondContact O-CG 3.47Å; L327-L331 PolarHBondContact O-N 3.19Å; L331-I333 VanDerWaalsContact C-N 3.25Å; L331-I333 HydrophobicContact CB-CD1 4.18Å; L331-I333 HydrophobicContact CB-CG1 3.79Å; L331-I333 PolarHBondContact O-N 2.7Å; L331-V404 HydrophobicContact CD1-CG1 4.33Å; L331-L432 HydrophobicContact CD1-CD2 4.16Å; L331-L432 HydrophobicContact CD2-CD2 3.67Å; L331-I434 HydrophobicContact CD1-CD1 3.62Å; L331-I463 HydrophobicContact CD2-CB 4.44Å; L331-I463 HydrophobicContact CD2-CD1 4.02Å; L331-Y468 WeakPolarHBondContact CA-OH 3.47Å; L331-Y468 HydrophobicContact CB-CE2 4.44Å; L331-Y468 HydrophobicContact CD2-CE1 4.44Å; L331-Y468 HydrophobicContact CD2-CE2 4.38Å; L331-Y468 WeakPolarHBondContact CD2-OH 3.09Å
332	Q	94	Very high	95.1	Very high	59 Å²	59	40.8 Å²	40.8	28%	0.276	21%	0.211	S	C	.	.			trans	-82.1	74	171.9	-172	168.3	-23.7	0	0	110.1	N403 Y468 V469 E471	Q332-N403 PolarHBondContact O-ND2 3.29Å; Q332-N403 VanDerWaalsContact O-ND2 3.1Å; Q332-Y468 PolarHBondContact N-OH 3.25Å; Q332-V469 HydrophobicContact CB-CG2 3.94Å; Q332-V469 HydrophobicContact CG-CG1 4.14Å; Q332-V469 HydrophobicContact CG-CG2 4.36Å; Q332-E471 PolarHBondContact NE2-OE2 3.42Å
333	I	93.4	Very high	95	Very high	14 Å²	14	35.3 Å²	35.3	7%	0.072	19%	0.187	C	C	.	.			trans	-78.1	122.6	179.9	-61.3	173.3	0	0	0	109.6	F328 L331 V404	F328-I333 HydrophobicContact CD1-CD1 3.42Å; F328-I333 VanDerWaalsContact CD1-CD1 3.42Å; F328-I333 HydrophobicContact CE1-CD1 3.67Å; F328-I333 HydrophobicContact CG-CD1 4.44Å; L331-I333 VanDerWaalsContact C-N 3.25Å; L331-I333 HydrophobicContact CB-CD1 4.18Å; L331-I333 HydrophobicContact CB-CG1 3.79Å; L331-I333 PolarHBondContact O-N 2.7Å; I333-V404 HydrophobicContact CG1-CB 4.33Å; I333-V404 HydrophobicContact CG1-CG2 3.93Å
334	N	92.4	Very high	95	Very high	94 Å²	94	40.9 Å²	40.9	50%	0.503	21%	0.211	S	C	.	.	S	Bend	trans	-78.4	-73.4	164.5	179.6	-8.7	0	0	0	108.3	A401 N403	N334-A401 WeakPolarHBondContact CB-O 3.41Å; N334-N403 PolarHBondContact N-OD1 3.42Å
335	Q	93.9	Very high	95	Very high	7 Å²	7	44.3 Å²	44.3	3%	0.033	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	152.1	161.3	-62.8	-170	-58.5	0	0	111.7	F379 C384 R385 A401 V402 N403	Q335-F379 HydrophobicContact CB-CE2 4.07Å; Q335-F379 HydrophobicContact CB-CZ 4.1Å; Q335-F379 HydrophobicContact CG-CE2 4.24Å; Q335-F379 VanDerWaalsContact NE2-CE2 3.33Å; Q335-F379 PolarHBondContact NE2-O 3.06Å; Q335-C384 PolarHBondContact NE2-O 2.98Å; Q335-R385 CarbonylContact C-O 3.55Å; Q335-R385 WeakPolarHBondContact CA-O 3.47Å; Q335-A401 HydrophobicContact CG-CB 4.16Å; Q335-A401 PolarHBondContact N-O 3.3Å; Q335-A401 VanDerWaalsContact N-O 3.07Å; Q335-V402 HydrophobicContact CB-CG2 3.96Å; Q335-V402 WeakPolarHBondContact O-CA 3.38Å; Q335-N403 PolarHBondContact O-N 3.47Å; Q335-N403 PolarHBondContact O-OD1 2.92Å
336	S	95	Very high	95	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	154.1	172.1	83.9	0	0	0	0	114.2	F379 R385 N386 L387 V404	S336-F379 WeakPolarHBondContact O-CZ 3.31Å; S336-R385 PolarHBondContact N-O 3.21Å; S336-N386 WeakPolarHBondContact O-CA 3.07Å; S336-N386 PolarHBondContact OG-OD1 3.02Å; S336-L387 PolarHBondContact O-N 3.36Å; S336-V404 WeakPolarHBondContact CA-O 3.46Å; S336-V404 WeakPolarHBondContact CB-O 3.47Å
337	I	95.2	Very high	95.1	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.021	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.4	167.7	-62	179.7	0	0	0	109.2	F339 F379 L387 C389 T394 V402 V404 V405 I406 R423	I337-F339 HydrophobicContact CB-CE2 4.39Å; I337-F339 HydrophobicContact CG2-CD2 4.14Å; I337-F339 HydrophobicContact CG2-CE1 4.05Å; I337-F339 HydrophobicContact CG2-CE2 3.59Å; I337-F339 HydrophobicContact CG2-CZ 3.54Å; I337-F379 HydrophobicContact CD1-CE1 4.24Å; I337-F379 HydrophobicContact CG1-CE1 3.94Å; I337-F379 HydrophobicContact CG1-CZ 4.09Å; I337-L387 CarbonylContact C-O 3.57Å; I337-L387 WeakPolarHBondContact CA-O 3.49Å; I337-L387 HydrophobicContact CG1-CB 4.35Å; I337-L387 HydrophobicContact CG1-CD2 4.45Å; I337-C389 VanDerWaalsContact CG2-SG 3.57Å; I337-T394 HydrophobicContact CD1-CG2 4.36Å; I337-T394 HydrophobicContact CG2-CG2 4.21Å; I337-V402 HydrophobicContact CD1-CG1 4.17Å; I337-V402 HydrophobicContact CD1-CG2 4.08Å; I337-V402 HydrophobicContact CG1-CG1 3.98Å; I337-V402 HydrophobicContact CG1-CG2 4.02Å; I337-V404 PolarHBondContact N-O 3.1Å; I337-V404 VanDerWaalsContact N-O 3.15Å; I337-V405 WeakPolarHBondContact O-CA 3.4Å; I337-I406 PolarHBondContact O-N 3.45Å; I337-R423 HydrophobicContact CD1-CB 3.9Å; I337-R423 HydrophobicContact CD1-CG 4.16Å
338	I	96.7	Very high	95.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.3	-179.5	-40.4	179	0	0	0	109.3	L324 F328 L349 I353 L387 V388 C389 I406 F408	L324-I338 HydrophobicContact CD1-CD1 4.36Å; L324-I338 HydrophobicContact CD2-CD1 4.17Å; F328-I338 HydrophobicContact CE2-CD1 4.28Å; F328-I338 HydrophobicContact CZ-CD1 3.6Å; F328-I338 HydrophobicContact CZ-CG1 4.39Å; I338-L349 HydrophobicContact CG2-CD2 3.87Å; I338-I353 HydrophobicContact CD1-CD1 3.86Å; I338-L387 PolarHBondContact N-O 2.99Å; I338-V388 HydrophobicContact CB-CG1 4.45Å; I338-V388 HydrophobicContact CB-CG2 4.49Å; I338-V388 HydrophobicContact CD1-CG2 4.07Å; I338-V388 CarbonylContact O-C 3.56Å; I338-V388 WeakPolarHBondContact O-CA 3.34Å; I338-C389 PolarHBondContact O-N 3.07Å; I338-I406 CarbonylContact C-O 3.59Å; I338-I406 WeakPolarHBondContact CA-O 3.48Å; I338-I406 HydrophobicContact CG2-CB 4.32Å; I338-I406 HydrophobicContact CG2-CG2 4.46Å; I338-F408 HydrophobicContact CG2-CB 3.67Å; I338-F408 HydrophobicContact CG2-CG 4.5Å
339	F	97.1	Very high	95.3	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	129	-179.7	-70.1	-74.6	0	0	0	113	I337 C389 T394 V405 I406 F408 D409 R420 R423	I337-F339 HydrophobicContact CB-CE2 4.39Å; I337-F339 HydrophobicContact CG2-CD2 4.14Å; I337-F339 HydrophobicContact CG2-CE1 4.05Å; I337-F339 HydrophobicContact CG2-CE2 3.59Å; I337-F339 HydrophobicContact CG2-CZ 3.54Å; F339-C389 WeakPolarHBondContact CA-O 3.13Å; F339-C389 VanDerWaalsContact CE1-SG 3.51Å; F339-T394 HydrophobicContact CE1-CG2 3.63Å; F339-T394 WeakPolarHBondContact CE1-OG1 3.46Å; F339-T394 HydrophobicContact CZ-CG2 3.69Å; F339-T394 VanDerWaalsContact CZ-OG1 3.26Å; F339-T394 WeakPolarHBondContact CZ-OG1 3.31Å; F339-V405 HydrophobicContact CD2-CG1 3.82Å; F339-V405 HydrophobicContact CE2-CG1 3.72Å; F339-I406 PolarHBondContact N-O 3.19Å; F339-F408 WeakPolarHBondContact O-CB 3.48Å; F339-F408 PolarHBondContact O-N 2.58Å; F339-D409 PolarHBondContact O-N 2.61Å; F339-D409 VanDerWaalsContact O-N 3.07Å; F339-R420 HydrophobicContact CD1-CG 3.92Å; F339-R420 HydrophobicContact CD2-CB 3.78Å; F339-R420 HydrophobicContact CD2-CG 3.79Å; F339-R420 HydrophobicContact CE1-CG 3.99Å; F339-R420 HydrophobicContact CE2-CB 3.62Å; F339-R420 HydrophobicContact CE2-CG 3.85Å; F339-R420 HydrophobicContact CG-CB 4.33Å; F339-R420 HydrophobicContact CG-CG 3.82Å; F339-R420 HydrophobicContact CZ-CB 4.06Å; F339-R420 HydrophobicContact CZ-CG 3.95Å; F339-R423 HydrophobicContact CZ-CG 4.26Å
340	C	96.6	Very high	95.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.203	C	C	.	.			trans	-122.1	148.2	170.2	-53.5	0	0	0	0	110.7	S342 R345 V346 L349 C389 D409	C340-S342 VanDerWaalsContact C-N 3.28Å; C340-S342 PolarHBondContact O-N 2.89Å; C340-R345 HydrophobicContact CB-CB 3.94Å; C340-V346 HydrophobicContact CB-CG2 3.83Å; C340-L349 VanDerWaalsContact SG-CD2 3.57Å; C340-C389 PolarHBondContact N-O 3.31Å; C340-D409 VanDerWaalsContact CA-OD2 3.29Å; C340-D409 WeakPolarHBondContact CA-OD2 3.22Å; C340-D409 WeakPolarHBondContact CB-OD2 3.45Å
341	N	94.7	Very high	95.6	Very high	68 Å²	68	38.6 Å²	38.6	36%	0.364	19%	0.192	S	C	.	.	S	Bend	trans	-79.6	-4.6	-173.4	-71.6	-4	0	0	0	113.7	D409 F410 R420	N341-D409 HydrophobicContact CB-CB 3.88Å; N341-D409 PolarHBondContact N-OD2 3.18Å; N341-D409 WeakPolarHBondContact OD1-CB 3.21Å; N341-D409 PolarHBondContact OD1-O 2.81Å; N341-F410 PolarHBondContact ND2-O 3.42Å; N341-R420 PolarHBondContact OD1-NH2 2.78Å
342	S	94.3	Very high	95.7	Very high	45 Å²	45	42.3 Å²	42.3	32%	0.315	21%	0.207	S	C	.	.	S	Bend	trans	-147.9	153.1	176.3	86.4	0	0	0	0	113.5	C340 Q344 R345 V346	C340-S342 VanDerWaalsContact C-N 3.28Å; C340-S342 PolarHBondContact O-N 2.89Å; S342-Q344 VanDerWaalsContact C-N 3.26Å; S342-Q344 PolarHBondContact O-N 3.5Å; S342-R345 PolarHBondContact O-N 3.11Å; S342-R345 VanDerWaalsContact O-N 3.15Å; S342-R345 PolarHBondContact OG-N 3.42Å; S342-V346 PolarHBondContact O-N 2.95Å
343	S	94.7	Very high	95.8	Very high	20 Å²	20	39.6 Å²	39.6	14%	0.14	20%	0.195	C	C	.	.	H	α-helix	trans	-56.8	-37.9	177.3	-59.8	0	0	0	0	113.3	V346 E347 H364	S343-V346 WeakPolarHBondContact O-CB 3.46Å; S343-V346 PolarHBondContact O-N 3.34Å; S343-E347 PolarHBondContact O-N 3.14Å; S343-H364 WeakPolarHBondContact CB-ND1 2.92Å
344	Q	96.4	Very high	95.9	Very high	139 Å²	139	41.8 Å²	41.8	65%	0.65	21%	0.212	S	C	*	.	H	α-helix	trans	-67.5	-38.8	179.2	-174	-179.2	2.5	0	0	111.3	S342 E347 L348	S342-Q344 VanDerWaalsContact C-N 3.26Å; S342-Q344 PolarHBondContact O-N 3.5Å; Q344-E347 PolarHBondContact O-N 3.15Å; Q344-L348 HydrophobicContact CG-CD1 3.98Å; Q344-L348 WeakPolarHBondContact O-CB 3.12Å; Q344-L348 VanDerWaalsContact O-CG 3.24Å; Q344-L348 WeakPolarHBondContact O-CG 3.46Å; Q344-L348 PolarHBondContact O-N 2.82Å
345	R	96.8	Very high	96.1	Very high	74 Å²	74	44.4 Å²	44.4	28%	0.279	22%	0.221	S	C	.	.	H	α-helix	trans	-68.9	-36.8	175.1	-71	178.8	69.7	91.9	-5.8	111.8	E317 C340 S342 L348 L349 D409	E317-R345 VanDerWaalsContact CD-NH2 3.35Å; E317-R345 IonicContact OE1-NH2 3.12Å; E317-R345 PolarHBondContact OE1-NH2 3.16Å; E317-R345 VanDerWaalsContact OE1-NH2 3.16Å; E317-R345 IonicContact OE2-CZ 2.95Å; E317-R345 IonicContact OE2-NH1 2.93Å; E317-R345 PolarHBondContact OE2-NH1 3Å; E317-R345 IonicContact OE2-NH2 2.67Å; E317-R345 PolarHBondContact OE2-NH2 3.19Å; C340-R345 HydrophobicContact CB-CB 3.94Å; S342-R345 PolarHBondContact O-N 3.11Å; S342-R345 VanDerWaalsContact O-N 3.15Å; S342-R345 PolarHBondContact OG-N 3.42Å; R345-L348 PolarHBondContact O-N 3.01Å; R345-L349 WeakPolarHBondContact O-CB 3.34Å; R345-L349 PolarHBondContact O-N 3.01Å; R345-D409 WeakPolarHBondContact CD-OD2 3.37Å; R345-D409 IonicContact CZ-OD1 2.73Å; R345-D409 VanDerWaalsContact CZ-OD1 3.25Å; R345-D409 IonicContact CZ-OD2 3.32Å; R345-D409 VanDerWaalsContact NE-CG 3.31Å; R345-D409 IonicContact NE-OD1 2.71Å; R345-D409 PolarHBondContact NE-OD1 2.98Å; R345-D409 VanDerWaalsContact NE-OD1 3.1Å; R345-D409 IonicContact NE-OD2 3.19Å; R345-D409 PolarHBondContact NE-OD2 2.89Å; R345-D409 IonicContact NH2-OD1 3.23Å; R345-D409 PolarHBondContact NH2-OD1 2.89Å; R345-D409 IonicContact NH2-OD2 2.7Å
346	V	97.1	Very high	96.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-56.5	-53.2	170.9	169.1	0	0	0	0	111.3	C340 S342 S343 A350 Y362 H364 V388 C389 T390	C340-V346 HydrophobicContact CB-CG2 3.83Å; S342-V346 PolarHBondContact O-N 2.95Å; S343-V346 WeakPolarHBondContact O-CB 3.46Å; S343-V346 PolarHBondContact O-N 3.34Å; V346-A350 VanDerWaalsContact O-CB 3.25Å; V346-A350 WeakPolarHBondContact O-CB 3.32Å; V346-A350 PolarHBondContact O-N 2.86Å; V346-Y362 HydrophobicContact CG1-CD2 4.17Å; V346-Y362 HydrophobicContact CG1-CG 4.37Å; V346-H364 HydrophobicContact CB-CB 4.34Å; V346-H364 HydrophobicContact CG1-CB 4.23Å; V346-V388 HydrophobicContact CB-CG1 4.33Å; V346-V388 HydrophobicContact CG1-CB 4.29Å; V346-V388 HydrophobicContact CG1-CG1 4.05Å; V346-V388 WeakPolarHBondContact CG1-O 3.45Å; V346-V388 HydrophobicContact CG2-CG1 4.37Å; V346-C389 VanDerWaalsContact CG2-C 3.46Å; V346-T390 HydrophobicContact CG2-CG2 3.73Å
347	E	96.6	Very high	96.1	Very high	57 Å²	57	51.2 Å²	51.2	27%	0.266	27%	0.274	S	S	.	.	H	α-helix	trans	-61.4	-46.9	179.2	-75.7	-169.5	-125.2	0	0	112.9	S343 Q344 K351 Y362 H364	S343-E347 PolarHBondContact O-N 3.14Å; Q344-E347 PolarHBondContact O-N 3.15Å; E347-K351 VanDerWaalsContact O-CB 3.32Å; E347-K351 WeakPolarHBondContact O-CB 3.35Å; E347-K351 WeakPolarHBondContact O-CD 3.29Å; E347-K351 WeakPolarHBondContact O-CG 3.11Å; E347-K351 PolarHBondContact O-N 3.08Å; E347-K351 IonicContact OE2-NZ 2.59Å; E347-K351 PolarHBondContact OE2-NZ 3.32Å; E347-Y362 HydrophobicContact CG-CE2 4.05Å; E347-H364 WeakPolarHBondContact CG-NE2 3.41Å; E347-H364 IonicContact OE1-CE1 3.14Å; E347-H364 IonicContact OE1-NE2 2.86Å
348	L	97.3	Very high	96.1	Very high	103 Å²	103	53 Å²	53	54%	0.539	28%	0.281	S	S	.	.	H	α-helix	trans	-65.2	-42.5	-177.9	-72.4	171.5	0	0	0	111.7	Q344 R345 K352	Q344-L348 HydrophobicContact CG-CD1 3.98Å; Q344-L348 WeakPolarHBondContact O-CB 3.12Å; Q344-L348 VanDerWaalsContact O-CG 3.24Å; Q344-L348 WeakPolarHBondContact O-CG 3.46Å; Q344-L348 PolarHBondContact O-N 2.82Å; R345-L348 PolarHBondContact O-N 3.01Å; L348-K352 VanDerWaalsContact O-CB 3.3Å; L348-K352 WeakPolarHBondContact O-CB 3.47Å; L348-K352 PolarHBondContact O-N 3.44Å
349	L	97.9	Very high	95.9	Very high	7 Å²	7	56 Å²	56	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-66.6	-46.5	177.5	-177.5	60.6	0	0	0	111.2	V321 L324 I338 C340 R345 K352 I353 V388 F408	V321-L349 HydrophobicContact CG2-CD1 4.2Å; L324-L349 HydrophobicContact CD2-CD1 3.96Å; L324-L349 HydrophobicContact CD2-CD2 4.35Å; I338-L349 HydrophobicContact CG2-CD2 3.87Å; C340-L349 VanDerWaalsContact SG-CD2 3.57Å; R345-L349 WeakPolarHBondContact O-CB 3.34Å; R345-L349 PolarHBondContact O-N 3.01Å; L349-K352 PolarHBondContact O-N 3.32Å; L349-K352 VanDerWaalsContact O-N 3.11Å; L349-I353 HydrophobicContact CD1-CG2 3.93Å; L349-I353 HydrophobicContact CG-CG2 4.42Å; L349-I353 WeakPolarHBondContact O-CG1 3.33Å; L349-I353 PolarHBondContact O-N 2.82Å; L349-V388 HydrophobicContact CB-CG1 4.34Å; L349-V388 HydrophobicContact CD2-CG1 4.05Å; L349-V388 HydrophobicContact CG-CG1 4.41Å; L349-F408 HydrophobicContact CD1-CD2 4.11Å; L349-F408 HydrophobicContact CD1-CE1 4.36Å; L349-F408 HydrophobicContact CD1-CE2 3.54Å; L349-F408 HydrophobicContact CD1-CZ 3.69Å; L349-F408 HydrophobicContact CD2-CB 4.09Å; L349-F408 HydrophobicContact CD2-CD1 3.86Å; L349-F408 HydrophobicContact CD2-CD2 3.6Å; L349-F408 HydrophobicContact CD2-CE1 4.14Å; L349-F408 HydrophobicContact CD2-CE2 3.88Å; L349-F408 HydrophobicContact CD2-CG 3.58Å; L349-F408 HydrophobicContact CD2-CZ 4.15Å; L349-F408 HydrophobicContact CG-CE2 4.38Å; L349-F408 HydrophobicContact CG-CZ 4.48Å
350	A	97.1	Very high	95.9	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-58.1	-52.2	177.9	0	0	0	0	0	111.4	V346 K352 I353 S354 Y362 V388	V346-A350 VanDerWaalsContact O-CB 3.25Å; V346-A350 WeakPolarHBondContact O-CB 3.32Å; V346-A350 PolarHBondContact O-N 2.86Å; A350-K352 PolarHBondContact O-N 3.38Å; A350-I353 PolarHBondContact O-N 2.64Å; A350-S354 PolarHBondContact O-N 3.08Å; A350-S354 PolarHBondContact O-OG 3.05Å; A350-S354 VanDerWaalsContact O-OG 3.05Å; A350-Y362 HydrophobicContact CB-CD1 3.59Å; A350-Y362 HydrophobicContact CB-CG 3.86Å; A350-V388 HydrophobicContact CB-CB 4.33Å; A350-V388 HydrophobicContact CB-CG2 4.1Å
351	K	96.8	Very high	95.8	Very high	100 Å²	100	59.7 Å²	59.7	44%	0.435	32%	0.319	S	S	.	.	H	α-helix	trans	-54.2	-40.2	174.6	-72.7	163	-179.1	164.1	0	111.4	E347 Q355	E347-K351 VanDerWaalsContact O-CB 3.32Å; E347-K351 WeakPolarHBondContact O-CB 3.35Å; E347-K351 WeakPolarHBondContact O-CD 3.29Å; E347-K351 WeakPolarHBondContact O-CG 3.11Å; E347-K351 PolarHBondContact O-N 3.08Å; E347-K351 IonicContact OE2-NZ 2.59Å; E347-K351 PolarHBondContact OE2-NZ 3.32Å; K351-Q355 VanDerWaalsContact O-CG 3.27Å; K351-Q355 WeakPolarHBondContact O-CG 3.21Å; K351-Q355 PolarHBondContact O-N 2.69Å
352	K	96.6	Very high	95.8	Very high	96 Å²	96	60.1 Å²	60.1	42%	0.417	32%	0.316	S	S	.	.	H	α-helix	trans	-73.5	-38.2	-179.4	-170.2	56.1	175.9	173.4	0	114	V321 L348 L349 A350 Q355 L356	V321-K352 HydrophobicContact CG1-CG 4.06Å; L348-K352 VanDerWaalsContact O-CB 3.3Å; L348-K352 WeakPolarHBondContact O-CB 3.47Å; L348-K352 PolarHBondContact O-N 3.44Å; L349-K352 PolarHBondContact O-N 3.32Å; L349-K352 VanDerWaalsContact O-N 3.11Å; A350-K352 PolarHBondContact O-N 3.38Å; K352-Q355 PolarHBondContact O-N 2.67Å; K352-L356 WeakPolarHBondContact O-CG 3.49Å; K352-L356 PolarHBondContact O-N 3.09Å
353	I	95.6	Very high	95.7	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-78.1	-31	178.1	68.1	-179	0	0	0	112.2	L324 F328 I338 L349 A350 Q355 L356 G357 Y358 C360 V388	L324-I353 HydrophobicContact CD2-CG2 3.9Å; F328-I353 HydrophobicContact CE2-CD1 4.47Å; I338-I353 HydrophobicContact CD1-CD1 3.86Å; L349-I353 HydrophobicContact CD1-CG2 3.93Å; L349-I353 HydrophobicContact CG-CG2 4.42Å; L349-I353 WeakPolarHBondContact O-CG1 3.33Å; L349-I353 PolarHBondContact O-N 2.82Å; A350-I353 PolarHBondContact O-N 2.64Å; I353-Q355 VanDerWaalsContact C-N 3.32Å; I353-Q355 PolarHBondContact O-N 3.16Å; I353-L356 CarbonylContact O-C 3.58Å; I353-L356 WeakPolarHBondContact O-CA 3.47Å; I353-L356 WeakPolarHBondContact O-CB 3.2Å; I353-L356 PolarHBondContact O-N 3.02Å; I353-G357 PolarHBondContact O-N 2.9Å; I353-Y358 HydrophobicContact CB-CD2 4.1Å; I353-Y358 WeakPolarHBondContact O-CB 3.38Å; I353-Y358 PolarHBondContact O-N 2.86Å; I353-C360 HydrophobicContact CD1-CB 3.95Å; I353-C360 HydrophobicContact CG1-CB 4.34Å; I353-V388 HydrophobicContact CD1-CG2 3.78Å
354	S	95.4	Very high	95.5	Very high	61 Å²	61	57.6 Å²	57.6	43%	0.427	30%	0.297	S	S	.	.	H	α-helix	trans	-62.3	-38.9	168.7	-56.2	0	0	0	0	112	A350 L356 G357 C360	A350-S354 PolarHBondContact O-N 3.08Å; A350-S354 PolarHBondContact O-OG 3.05Å; A350-S354 VanDerWaalsContact O-OG 3.05Å; S354-L356 PolarHBondContact O-N 2.95Å; S354-G357 PolarHBondContact O-N 3.14Å; S354-C360 PolarHBondContact OG-SG 3.13Å
355	Q	95.8	Very high	95	Very high	148 Å²	148	53.4 Å²	53.4	69%	0.692	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-21.2	172	-76.5	172.5	-3.8	0	0	113.8	K351 K352 I353 G357	K351-Q355 VanDerWaalsContact O-CG 3.27Å; K351-Q355 WeakPolarHBondContact O-CG 3.21Å; K351-Q355 PolarHBondContact O-N 2.69Å; K352-Q355 PolarHBondContact O-N 2.67Å; I353-Q355 VanDerWaalsContact C-N 3.32Å; I353-Q355 PolarHBondContact O-N 3.16Å; Q355-G357 VanDerWaalsContact C-N 3.31Å
356	L	94.3	Very high	94.5	Very high	79 Å²	79	58.4 Å²	58.4	41%	0.414	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	8.3	173.3	-65	170.9	0	0	0	112.5	V321 K352 I353 S354 Y358	V321-L356 HydrophobicContact CG1-CD1 4.19Å; K352-L356 WeakPolarHBondContact O-CG 3.49Å; K352-L356 PolarHBondContact O-N 3.09Å; I353-L356 CarbonylContact O-C 3.58Å; I353-L356 WeakPolarHBondContact O-CA 3.47Å; I353-L356 WeakPolarHBondContact O-CB 3.2Å; I353-L356 PolarHBondContact O-N 3.02Å; S354-L356 PolarHBondContact O-N 2.95Å; L356-Y358 HydrophobicContact CB-CD2 3.82Å; L356-Y358 HydrophobicContact CB-CE2 3.85Å; L356-Y358 HydrophobicContact CD1-CE2 4.5Å
357	G	94.6	Very high	94.1	Very high	71 Å²	71	60.2 Å²	60.2	73%	0.732	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	2.5	178.4	0	0	0	0	0	115.3	I353 S354 Q355 S359	I353-G357 PolarHBondContact O-N 2.9Å; S354-G357 PolarHBondContact O-N 3.14Å; Q355-G357 VanDerWaalsContact C-N 3.31Å; G357-S359 PolarHBondContact O-N 2.8Å
358	Y	95.4	Very high	93.6	Very high	43 Å²	43	66.2 Å²	66.2	17%	0.169	34%	0.339	C	S	.	.			trans	-77.9	122.1	179.7	-63.7	-71.4	0	0	0	111.9	N325 F328 I353 L356 C360	N325-Y358 WeakPolarHBondContact OD1-CE2 3.27Å; N325-Y358 PolarHBondContact OD1-OH 3.27Å; F328-Y358 HydrophobicContact CB-CD1 4.36Å; F328-Y358 HydrophobicContact CB-CE1 3.58Å; F328-Y358 AromaticContact CD2-CD1 3.58Å; F328-Y358 HydrophobicContact CD2-CD1 3.58Å; F328-Y358 AromaticContact CD2-CD2 4Å; F328-Y358 HydrophobicContact CD2-CD2 4Å; F328-Y358 AromaticContact CD2-CE1 3.59Å; F328-Y358 HydrophobicContact CD2-CE1 3.59Å; F328-Y358 HydrophobicContact CD2-CE2 4Å; F328-Y358 AromaticContact CD2-CG 3.8Å; F328-Y358 HydrophobicContact CD2-CG 3.8Å; F328-Y358 AromaticContact CD2-CZ 3.81Å; F328-Y358 HydrophobicContact CE2-CD1 4.23Å; F328-Y358 HydrophobicContact CE2-CD2 4.47Å; F328-Y358 HydrophobicContact CE2-CG 4.15Å; F328-Y358 HydrophobicContact CG-CD1 4.38Å; F328-Y358 HydrophobicContact CG-CE1 4.06Å; I353-Y358 HydrophobicContact CB-CD2 4.1Å; I353-Y358 WeakPolarHBondContact O-CB 3.38Å; I353-Y358 PolarHBondContact O-N 2.86Å; L356-Y358 HydrophobicContact CB-CD2 3.82Å; L356-Y358 HydrophobicContact CB-CE2 3.85Å; L356-Y358 HydrophobicContact CD1-CE2 4.5Å; Y358-C360 PolarHBondContact O-N 2.73Å; Y358-C360 VanDerWaalsContact O-N 3.13Å
359	S	94	Very high	92.8	Very high	63 Å²	63	62.2 Å²	62.2	44%	0.441	32%	0.318	S	S	.	.			trans	-62.1	111.2	167.8	174.5	0	0	0	0	110	G357 C384 N386	G357-S359 PolarHBondContact O-N 2.8Å; S359-C384 WeakPolarHBondContact OG-CA 3.2Å; S359-C384 WeakPolarHBondContact OG-CB 3.4Å; S359-N386 PolarHBondContact O-N 3.36Å; S359-N386 PolarHBondContact O-ND2 2.98Å
360	C	95.6	Very high	92.1	Very high	15 Å²	15	68.3 Å²	68.3	10%	0.101	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	152.5	176.1	70	0	0	0	0	112.2	I353 S354 Y358 N386	I353-C360 HydrophobicContact CD1-CB 3.95Å; I353-C360 HydrophobicContact CG1-CB 4.34Å; S354-C360 PolarHBondContact OG-SG 3.13Å; Y358-C360 PolarHBondContact O-N 2.73Å; Y358-C360 VanDerWaalsContact O-N 3.13Å; C360-N386 CarbonylContact C-O 3.55Å; C360-N386 WeakPolarHBondContact CA-O 3.34Å; C360-N386 HydrophobicContact CB-CB 3.85Å; C360-N386 VanDerWaalsContact CB-O 3.31Å; C360-N386 WeakPolarHBondContact CB-O 3.34Å
361	F	95.4	Very high	91.6	Very high	61 Å²	61	73.3 Å²	73.3	27%	0.268	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	173.5	156.7	-57.2	-42	0	0	0	110.4	V375 D378 F379 L383 C384 N386 V388	F361-V375 HydrophobicContact CB-CG1 3.38Å; F361-V375 HydrophobicContact CD2-CG1 3.99Å; F361-V375 HydrophobicContact CG-CG1 3.92Å; F361-D378 HydrophobicContact CD2-CB 4.35Å; F361-D378 HydrophobicContact CE2-CB 3.6Å; F361-D378 HydrophobicContact CZ-CB 4.26Å; F361-F379 HydrophobicContact CD2-CB 4.35Å; F361-L383 HydrophobicContact CE2-CB 4.36Å; F361-L383 HydrophobicContact CZ-CB 4.44Å; F361-C384 HydrophobicContact CD1-CB 4.4Å; F361-C384 HydrophobicContact CD2-CB 3.94Å; F361-C384 WeakPolarHBondContact CD2-SG 3.29Å; F361-C384 HydrophobicContact CE1-CB 4.32Å; F361-C384 HydrophobicContact CE2-CB 3.81Å; F361-C384 HydrophobicContact CG-CB 4.21Å; F361-C384 VanDerWaalsContact CG-SG 3.57Å; F361-C384 HydrophobicContact CZ-CB 4.02Å; F361-C384 PolarHBondContact N-SG 2.95Å; F361-C384 VanDerWaalsContact N-SG 3.38Å; F361-N386 PolarHBondContact N-O 2.88Å; F361-V388 PolarHBondContact O-N 3.04Å
362	Y	94.9	Very high	91.1	Very high	78 Å²	78	69.2 Å²	69.2	31%	0.306	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	148.8	176.3	70.8	-99.7	0	0	0	111.9	V346 E347 A350 H364 M367 V388	V346-Y362 HydrophobicContact CG1-CD2 4.17Å; V346-Y362 HydrophobicContact CG1-CG 4.37Å; E347-Y362 HydrophobicContact CG-CE2 4.05Å; A350-Y362 HydrophobicContact CB-CD1 3.59Å; A350-Y362 HydrophobicContact CB-CG 3.86Å; Y362-H364 AromaticContact CD2-CD2 3.64Å; Y362-H364 AromaticContact CD2-NE2 3.89Å; Y362-H364 AromaticContact CE2-CD2 3.75Å; Y362-H364 AromaticContact CE2-NE2 3.47Å; Y362-H364 WeakPolarHBondContact CE2-NE2 2.99Å; Y362-M367 HydrophobicContact CD2-SD 3.96Å; Y362-M367 HydrophobicContact CE2-CE 4.35Å; Y362-M367 HydrophobicContact CE2-SD 3.86Å; Y362-V388 CarbonylContact C-O 3.55Å; Y362-V388 WeakPolarHBondContact CA-O 3.47Å
363	I	91.6	Very high	90.4	Very high	4 Å²	4	67.2 Å²	67.2	2%	0.021	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	131.7	172.4	-28.3	162.7	0	0	0	112.6	M367 R372 V375 F376 L387 V388 C389 F393	I363-M367 HydrophobicContact CB-SD 4.36Å; I363-M367 HydrophobicContact CG2-CE 4.08Å; I363-M367 HydrophobicContact CG2-SD 3.76Å; I363-R372 HydrophobicContact CG2-CB 4.03Å; I363-R372 HydrophobicContact CG2-CG 3.75Å; I363-V375 HydrophobicContact CD1-CB 4.14Å; I363-V375 HydrophobicContact CD1-CG1 3.84Å; I363-V375 HydrophobicContact CG1-CB 3.94Å; I363-V375 HydrophobicContact CG1-CG1 3.45Å; I363-V375 VanDerWaalsContact CG1-CG1 3.45Å; I363-F376 HydrophobicContact CD1-CB 4.22Å; I363-L387 HydrophobicContact CB-CD1 4.49Å; I363-L387 HydrophobicContact CD1-CD1 3.87Å; I363-L387 HydrophobicContact CD1-CD2 4.45Å; I363-L387 HydrophobicContact CG1-CD1 3.66Å; I363-V388 PolarHBondContact N-O 3.36Å; I363-C389 VanDerWaalsContact O-CA 3.23Å; I363-C389 WeakPolarHBondContact O-CA 3.24Å; I363-C389 WeakPolarHBondContact O-CB 3.38Å; I363-F393 HydrophobicContact CB-CD1 3.6Å; I363-F393 HydrophobicContact CB-CE1 3.73Å; I363-F393 HydrophobicContact CB-CG 4.07Å; I363-F393 HydrophobicContact CB-CZ 4.31Å; I363-F393 HydrophobicContact CD1-CD1 4.11Å; I363-F393 HydrophobicContact CG1-CD1 4.47Å; I363-F393 HydrophobicContact CG2-CD1 3.51Å; I363-F393 HydrophobicContact CG2-CE1 3.1Å; I363-F393 HydrophobicContact CG2-CG 4.36Å; I363-F393 HydrophobicContact CG2-CZ 3.69Å
364	H	91.3	Very high	90	Very high	7 Å²	7	75.4 Å²	75.4	3%	0.032	38%	0.376	C	S	.	.			trans	-145.7	164.4	179.1	60.1	87	0	0	0	112.4	S343 V346 E347 Y362 K366 M367 T390 F393	S343-H364 WeakPolarHBondContact CB-ND1 2.92Å; V346-H364 HydrophobicContact CB-CB 4.34Å; V346-H364 HydrophobicContact CG1-CB 4.23Å; E347-H364 WeakPolarHBondContact CG-NE2 3.41Å; E347-H364 IonicContact OE1-CE1 3.14Å; E347-H364 IonicContact OE1-NE2 2.86Å; Y362-H364 AromaticContact CD2-CD2 3.64Å; Y362-H364 AromaticContact CD2-NE2 3.89Å; Y362-H364 AromaticContact CE2-CD2 3.75Å; Y362-H364 AromaticContact CE2-NE2 3.47Å; Y362-H364 WeakPolarHBondContact CE2-NE2 2.99Å; H364-K366 PolarHBondContact O-N 3.23Å; H364-M367 WeakPolarHBondContact O-CB 3.45Å; H364-M367 PolarHBondContact O-N 3.39Å; H364-T390 HydrophobicContact CB-CG2 4.2Å; H364-F393 WeakPolarHBondContact O-CZ 3.12Å
365	A	84.6	Confident	89.7	Confident	51 Å²	51	73.7 Å²	73.7	42%	0.421	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.6	-164	0	0	0	0	0	114.9	M367 L392	A365-M367 VanDerWaalsContact C-N 3.27Å; A365-M367 PolarHBondContact O-N 2.92Å; A365-L392 HydrophobicContact CB-CD2 3.59Å
366	K	87.6	Confident	89.2	Confident	179 Å²	179	67.7 Å²	67.7	78%	0.778	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-3.9	-180	-56.8	-173.2	177.5	-173.8	0	114.7	H364	H364-K366 PolarHBondContact O-N 3.23Å
367	M	88.5	Confident	88.8	Confident	38 Å²	38	68.6 Å²	68.6	19%	0.187	34%	0.336	C	S	.	.	S	Bend	trans	-83.5	146.3	179.7	-66.9	172.1	67.6	0	0	112.7	Y362 I363 H364 A365 H371 R372	Y362-M367 HydrophobicContact CD2-SD 3.96Å; Y362-M367 HydrophobicContact CE2-CE 4.35Å; Y362-M367 HydrophobicContact CE2-SD 3.86Å; I363-M367 HydrophobicContact CB-SD 4.36Å; I363-M367 HydrophobicContact CG2-CE 4.08Å; I363-M367 HydrophobicContact CG2-SD 3.76Å; H364-M367 WeakPolarHBondContact O-CB 3.45Å; H364-M367 PolarHBondContact O-N 3.39Å; A365-M367 VanDerWaalsContact C-N 3.27Å; A365-M367 PolarHBondContact O-N 2.92Å; M367-H371 HydrophobicContact CE-CB 4.41Å; M367-R372 HydrophobicContact CB-CG 3.99Å; M367-R372 WeakPolarHBondContact O-CD 3.39Å
368	R	86.4	Confident	88.6	Confident	183 Å²	183	66.6 Å²	66.6	69%	0.691	31%	0.309	S	S	*	.			trans	-58.3	143.3	172.5	-67.9	-174.5	177.9	-171.3	0	111.2	E370 H371 R372	R368-E370 PolarHBondContact O-N 3.07Å; R368-H371 WeakPolarHBondContact O-CB 3.45Å; R368-H371 PolarHBondContact O-N 3.31Å; R368-H371 VanDerWaalsContact O-N 3.08Å; R368-R372 WeakPolarHBondContact O-CG 3.5Å; R368-R372 PolarHBondContact O-N 3.03Å
369	Q	79.6	Confident	88.4	Confident	19 Å²	19	64.5 Å²	64.5	9%	0.089	30%	0.301	C	S	.	.	H	α-helix	trans	-62.7	-38.6	-173.7	-167.5	62.5	43.8	0	0	113.4	R173 E174 H371 R372 N373	R173-Q369 VanDerWaalsContact CD-CD 3.49Å; E174-Q369 PolarHBondContact OE1-NE2 3.15Å; Q369-H371 VanDerWaalsContact C-N 3.28Å; Q369-H371 PolarHBondContact O-N 2.8Å; Q369-R372 WeakPolarHBondContact O-CB 3.36Å; Q369-R372 PolarHBondContact O-N 3.26Å; Q369-R372 VanDerWaalsContact OE1-NE 3.1Å; Q369-N373 PolarHBondContact NE2-OD1 2.82Å; Q369-N373 WeakPolarHBondContact O-CB 3.44Å; Q369-N373 VanDerWaalsContact O-CG 3.23Å; Q369-N373 PolarHBondContact O-N 2.91Å; Q369-N373 PolarHBondContact O-OD1 2.76Å
370	E	83.3	Confident	88	Confident	136 Å²	136	66.6 Å²	66.6	64%	0.636	30%	0.299	S	S	*	.	H	α-helix	trans	-56	-43.8	173.6	-65.8	138.3	-149.3	0	0	111.8	R368 N373 R374	R368-E370 PolarHBondContact O-N 3.07Å; E370-N373 PolarHBondContact O-N 3.19Å; E370-R374 WeakPolarHBondContact O-CB 3.36Å; E370-R374 PolarHBondContact O-N 2.88Å
371	H	87.3	Confident	87.7	Confident	106 Å²	106	69.9 Å²	69.9	49%	0.491	32%	0.315	S	S	.	.	H	α-helix	trans	-69.6	-38.6	178.3	-66.9	-145.5	0	0	0	111.1	M367 R368 Q369 V375	M367-H371 HydrophobicContact CE-CB 4.41Å; R368-H371 WeakPolarHBondContact O-CB 3.45Å; R368-H371 PolarHBondContact O-N 3.31Å; R368-H371 VanDerWaalsContact O-N 3.08Å; Q369-H371 VanDerWaalsContact C-N 3.28Å; Q369-H371 PolarHBondContact O-N 2.8Å; H371-V375 WeakPolarHBondContact O-CB 3.47Å; H371-V375 VanDerWaalsContact O-CG2 3.31Å; H371-V375 WeakPolarHBondContact O-CG2 3.49Å; H371-V375 PolarHBondContact O-N 3.48Å
372	R	85.5	Confident	87.4	Confident	14 Å²	14	69.2 Å²	69.2	5%	0.053	33%	0.326	C	S	.	.	H	α-helix	trans	-57.9	-51.1	172.7	-65.4	171.2	48.9	142.5	0.8	110.9	E174 I363 M367 R368 Q369 V375 F376 F393	E174-R372 VanDerWaalsContact CD-NH2 3.27Å; E174-R372 IonicContact OE1-CZ 3.41Å; E174-R372 VanDerWaalsContact OE1-CZ 3.23Å; E174-R372 IonicContact OE1-NE 3.72Å; E174-R372 PolarHBondContact OE1-NE 2.9Å; E174-R372 IonicContact OE1-NH2 2.71Å; E174-R372 PolarHBondContact OE1-NH2 2.81Å; E174-R372 IonicContact OE2-NH2 3.36Å; E174-R372 PolarHBondContact OE2-NH2 2.8Å; E174-R372 VanDerWaalsContact OE2-NH2 3.12Å; I363-R372 HydrophobicContact CG2-CB 4.03Å; I363-R372 HydrophobicContact CG2-CG 3.75Å; M367-R372 HydrophobicContact CB-CG 3.99Å; M367-R372 WeakPolarHBondContact O-CD 3.39Å; R368-R372 WeakPolarHBondContact O-CG 3.5Å; R368-R372 PolarHBondContact O-N 3.03Å; Q369-R372 WeakPolarHBondContact O-CB 3.36Å; Q369-R372 PolarHBondContact O-N 3.26Å; Q369-R372 VanDerWaalsContact OE1-NE 3.1Å; R372-V375 PolarHBondContact O-N 3.13Å; R372-F376 WeakPolarHBondContact O-CB 3.44Å; R372-F376 PolarHBondContact O-N 2.82Å; R372-F393 HydrophobicContact CB-CE1 4.03Å; R372-F393 HydrophobicContact CG-CE1 3.63Å; R372-F393 HydrophobicContact CG-CZ 3.96Å
373	N	81.7	Confident	87.3	Confident	54 Å²	54	70.8 Å²	70.8	29%	0.289	34%	0.339	S	S	.	.	H	α-helix	trans	-61.5	-46.6	-179.5	-68.8	0.5	0	0	0	111.3	Q369 E370 F376 H377	Q369-N373 PolarHBondContact NE2-OD1 2.82Å; Q369-N373 WeakPolarHBondContact O-CB 3.44Å; Q369-N373 VanDerWaalsContact O-CG 3.23Å; Q369-N373 PolarHBondContact O-N 2.91Å; Q369-N373 PolarHBondContact O-OD1 2.76Å; E370-N373 PolarHBondContact O-N 3.19Å; N373-F376 PolarHBondContact O-N 2.86Å; N373-H377 WeakPolarHBondContact O-CB 3.4Å; N373-H377 PolarHBondContact O-N 3.36Å
374	R	87.4	Confident	87.3	Confident	174 Å²	174	70.7 Å²	70.7	66%	0.657	34%	0.338	S	S	*	.	H	α-helix	trans	-59.5	-53.9	177.3	176.2	174.8	175.8	172	3.7	111.6	E370 F376 H377 D378	E370-R374 WeakPolarHBondContact O-CB 3.36Å; E370-R374 PolarHBondContact O-N 2.88Å; R374-F376 VanDerWaalsContact C-N 3.27Å; R374-F376 PolarHBondContact O-N 2.8Å; R374-H377 PolarHBondContact O-N 3.28Å; R374-H377 VanDerWaalsContact O-N 3.08Å; R374-D378 VanDerWaalsContact CG-OD2 3.24Å; R374-D378 WeakPolarHBondContact CG-OD2 3.27Å; R374-D378 IonicContact NE-OD2 3.27Å; R374-D378 PolarHBondContact NE-OD2 2.97Å; R374-D378 VanDerWaalsContact NE-OD2 3.15Å; R374-D378 WeakPolarHBondContact O-CB 3.39Å; R374-D378 VanDerWaalsContact O-CG 3.24Å; R374-D378 PolarHBondContact O-N 3.05Å
375	V	89.4	Confident	87.4	Confident	25 Å²	25	77 Å²	77	15%	0.152	36%	0.362	C	S	.	.	H	α-helix	trans	-62.3	-36.2	-177.8	174.5	0	0	0	0	111.8	F361 I363 H371 R372 F379	F361-V375 HydrophobicContact CB-CG1 3.38Å; F361-V375 HydrophobicContact CD2-CG1 3.99Å; F361-V375 HydrophobicContact CG-CG1 3.92Å; I363-V375 HydrophobicContact CD1-CB 4.14Å; I363-V375 HydrophobicContact CD1-CG1 3.84Å; I363-V375 HydrophobicContact CG1-CB 3.94Å; I363-V375 HydrophobicContact CG1-CG1 3.45Å; I363-V375 VanDerWaalsContact CG1-CG1 3.45Å; H371-V375 WeakPolarHBondContact O-CB 3.47Å; H371-V375 VanDerWaalsContact O-CG2 3.31Å; H371-V375 WeakPolarHBondContact O-CG2 3.49Å; H371-V375 PolarHBondContact O-N 3.48Å; R372-V375 PolarHBondContact O-N 3.13Å; V375-F379 VanDerWaalsContact O-CB 3.29Å; V375-F379 WeakPolarHBondContact O-CB 3.37Å; V375-F379 PolarHBondContact O-N 3Å
376	F	84.8	Confident	88	Confident	21 Å²	21	74.8 Å²	74.8	9%	0.092	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-44.2	172.7	168.9	-122.8	0	0	0	112.4	I363 R372 N373 R374 F379 R380 I397 I399	I363-F376 HydrophobicContact CD1-CB 4.22Å; R372-F376 WeakPolarHBondContact O-CB 3.44Å; R372-F376 PolarHBondContact O-N 2.82Å; N373-F376 PolarHBondContact O-N 2.86Å; R374-F376 VanDerWaalsContact C-N 3.27Å; R374-F376 PolarHBondContact O-N 2.8Å; F376-F379 PolarHBondContact O-N 3.16Å; F376-R380 HydrophobicContact CE2-CB 4.27Å; F376-R380 VanDerWaalsContact O-CB 3.3Å; F376-R380 WeakPolarHBondContact O-CB 3.27Å; F376-R380 PolarHBondContact O-N 3.36Å; F376-I397 HydrophobicContact CD2-CD1 4.07Å; F376-I397 HydrophobicContact CD2-CG2 4.35Å; F376-I397 HydrophobicContact CE1-CD1 4.41Å; F376-I397 HydrophobicContact CE2-CD1 3.89Å; F376-I397 HydrophobicContact CE2-CG2 3.4Å; F376-I397 HydrophobicContact CG-CD1 4.44Å; F376-I397 HydrophobicContact CZ-CD1 4.06Å; F376-I397 HydrophobicContact CZ-CG1 4.5Å; F376-I397 HydrophobicContact CZ-CG2 3.69Å; F376-I399 HydrophobicContact CD2-CD1 4.45Å; F376-I399 HydrophobicContact CE2-CD1 4Å; F376-I399 HydrophobicContact CE2-CG1 4.19Å
377	H	85.8	Confident	88.3	Confident	99 Å²	99	66.5 Å²	66.5	46%	0.458	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-48.6	176.5	-174	60.8	0	0	0	111.7	N373 R374 F379 R380 N381	N373-H377 WeakPolarHBondContact O-CB 3.4Å; N373-H377 PolarHBondContact O-N 3.36Å; R374-H377 PolarHBondContact O-N 3.28Å; R374-H377 VanDerWaalsContact O-N 3.08Å; H377-F379 VanDerWaalsContact C-N 3.3Å; H377-F379 PolarHBondContact O-N 3.37Å; H377-R380 PolarHBondContact O-N 3.43Å; H377-N381 PolarHBondContact CD2-ND2 2.99Å; H377-N381 VanDerWaalsContact CD2-ND2 3.33Å; H377-N381 PolarHBondContact CE1-ND2 3.43Å; H377-N381 VanDerWaalsContact CE1-ND2 3.25Å; H377-N381 PolarHBondContact NE2-ND2 2.72Å; H377-N381 WeakPolarHBondContact O-CB 3.19Å; H377-N381 PolarHBondContact O-N 3.47Å; H377-N381 PolarHBondContact O-ND2 2.95Å; H377-N381 PolarHBondContact O-OD1 3.08Å
378	D	91	Very high	88.7	Confident	28 Å²	28	64.7 Å²	64.7	15%	0.15	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-40	178.7	-65.3	-11.9	0	0	0	110.8	F361 R374 L383	F361-D378 HydrophobicContact CD2-CB 4.35Å; F361-D378 HydrophobicContact CE2-CB 3.6Å; F361-D378 HydrophobicContact CZ-CB 4.26Å; R374-D378 VanDerWaalsContact CG-OD2 3.24Å; R374-D378 WeakPolarHBondContact CG-OD2 3.27Å; R374-D378 IonicContact NE-OD2 3.27Å; R374-D378 PolarHBondContact NE-OD2 2.97Å; R374-D378 VanDerWaalsContact NE-OD2 3.15Å; R374-D378 WeakPolarHBondContact O-CB 3.39Å; R374-D378 VanDerWaalsContact O-CG 3.24Å; R374-D378 PolarHBondContact O-N 3.05Å; D378-L383 HydrophobicContact CB-CB 4.47Å; D378-L383 HydrophobicContact CB-CD1 3.99Å; D378-L383 VanDerWaalsContact O-CB 3.22Å; D378-L383 WeakPolarHBondContact O-CB 3.47Å; D378-L383 WeakPolarHBondContact O-CG 3.3Å; D378-L383 PolarHBondContact O-N 3.23Å
379	F	90.7	Very high	89.1	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-68.5	-46.4	173.1	179.9	-126.5	0	0	0	113	Q335 S336 I337 F361 V375 F376 H377 N381 G382 C384 L387 I399 V402	Q335-F379 HydrophobicContact CB-CE2 4.07Å; Q335-F379 HydrophobicContact CB-CZ 4.1Å; Q335-F379 HydrophobicContact CG-CE2 4.24Å; Q335-F379 VanDerWaalsContact NE2-CE2 3.33Å; Q335-F379 PolarHBondContact NE2-O 3.06Å; S336-F379 WeakPolarHBondContact O-CZ 3.31Å; I337-F379 HydrophobicContact CD1-CE1 4.24Å; I337-F379 HydrophobicContact CG1-CE1 3.94Å; I337-F379 HydrophobicContact CG1-CZ 4.09Å; F361-F379 HydrophobicContact CD2-CB 4.35Å; V375-F379 VanDerWaalsContact O-CB 3.29Å; V375-F379 WeakPolarHBondContact O-CB 3.37Å; V375-F379 PolarHBondContact O-N 3Å; F376-F379 PolarHBondContact O-N 3.16Å; H377-F379 VanDerWaalsContact C-N 3.3Å; H377-F379 PolarHBondContact O-N 3.37Å; F379-N381 PolarHBondContact O-N 3.08Å; F379-G382 PolarHBondContact O-N 3.15Å; F379-C384 VanDerWaalsContact CD2-SG 3.57Å; F379-L387 HydrophobicContact CD1-CB 3.69Å; F379-L387 HydrophobicContact CD1-CD2 3.54Å; F379-L387 HydrophobicContact CD1-CG 4.2Å; F379-L387 HydrophobicContact CD2-CB 4.15Å; F379-L387 HydrophobicContact CE1-CB 3.43Å; F379-L387 VanDerWaalsContact CE1-CB 3.43Å; F379-L387 HydrophobicContact CE1-CD2 3.62Å; F379-L387 HydrophobicContact CE1-CG 4.16Å; F379-L387 HydrophobicContact CE2-CB 3.92Å; F379-L387 HydrophobicContact CG-CB 4.05Å; F379-L387 HydrophobicContact CG-CD2 4.44Å; F379-L387 HydrophobicContact CZ-CB 3.55Å; F379-I399 HydrophobicContact CD1-CD1 3.48Å; F379-I399 VanDerWaalsContact CD1-CD1 3.48Å; F379-I399 HydrophobicContact CE1-CD1 3.42Å; F379-I399 VanDerWaalsContact CE1-CD1 3.42Å; F379-V402 HydrophobicContact CE1-CG2 4.17Å; F379-V402 HydrophobicContact CZ-CG2 3.98Å
380	R	86.1	Confident	89.7	Confident	107 Å²	107	55.8 Å²	55.8	40%	0.404	27%	0.265	S	S	.	.	H	α-helix	trans	-61.9	-28.9	178.4	-178.8	176.9	172.7	-159.2	-3.3	112.5	F376 H377 G382	F376-R380 HydrophobicContact CE2-CB 4.27Å; F376-R380 VanDerWaalsContact O-CB 3.3Å; F376-R380 WeakPolarHBondContact O-CB 3.27Å; F376-R380 PolarHBondContact O-N 3.36Å; H377-R380 PolarHBondContact O-N 3.43Å; R380-G382 VanDerWaalsContact C-N 3.27Å; R380-G382 PolarHBondContact O-N 2.67Å
381	N	88.2	Confident	89.6	Confident	84 Å²	84	50.9 Å²	50.9	45%	0.449	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	2.7	174.8	-62.9	-10.9	0	0	0	113.5	H377 F379 L383	H377-N381 PolarHBondContact CD2-ND2 2.99Å; H377-N381 VanDerWaalsContact CD2-ND2 3.33Å; H377-N381 PolarHBondContact CE1-ND2 3.43Å; H377-N381 VanDerWaalsContact CE1-ND2 3.25Å; H377-N381 PolarHBondContact NE2-ND2 2.72Å; H377-N381 WeakPolarHBondContact O-CB 3.19Å; H377-N381 PolarHBondContact O-N 3.47Å; H377-N381 PolarHBondContact O-ND2 2.95Å; H377-N381 PolarHBondContact O-OD1 3.08Å; F379-N381 PolarHBondContact O-N 3.08Å; N381-L383 HydrophobicContact CB-CG 4.38Å
382	G	89.8	Confident	88.7	Confident	47 Å²	47	49.6 Å²	49.6	49%	0.485	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	7.6	178	0	0	0	0	0	115.9	F379 R380 C384	F379-G382 PolarHBondContact O-N 3.15Å; R380-G382 VanDerWaalsContact C-N 3.27Å; R380-G382 PolarHBondContact O-N 2.67Å; G382-C384 PolarHBondContact O-N 3.27Å; G382-C384 VanDerWaalsContact O-N 3.15Å
383	L	92.8	Very high	87.6	Confident	111 Å²	111	49.2 Å²	49.2	58%	0.581	24%	0.239	S	C	*	.	S	Bend	trans	-69.6	-11.3	-175.6	-54.9	-177.1	0	0	0	113.9	F361 D378 N381	F361-L383 HydrophobicContact CE2-CB 4.36Å; F361-L383 HydrophobicContact CZ-CB 4.44Å; D378-L383 HydrophobicContact CB-CB 4.47Å; D378-L383 HydrophobicContact CB-CD1 3.99Å; D378-L383 VanDerWaalsContact O-CB 3.22Å; D378-L383 WeakPolarHBondContact O-CB 3.47Å; D378-L383 WeakPolarHBondContact O-CG 3.3Å; D378-L383 PolarHBondContact O-N 3.23Å; N381-L383 HydrophobicContact CB-CG 4.38Å
384	C	91.9	Very high	86.4	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.014	23%	0.227	C	C	.	.			trans	-143.2	159.5	162.3	82.4	0	0	0	0	111.2	Q335 S359 F361 F379 G382 N386	Q335-C384 PolarHBondContact NE2-O 2.98Å; S359-C384 WeakPolarHBondContact OG-CA 3.2Å; S359-C384 WeakPolarHBondContact OG-CB 3.4Å; F361-C384 HydrophobicContact CD1-CB 4.4Å; F361-C384 HydrophobicContact CD2-CB 3.94Å; F361-C384 WeakPolarHBondContact CD2-SG 3.29Å; F361-C384 HydrophobicContact CE1-CB 4.32Å; F361-C384 HydrophobicContact CE2-CB 3.81Å; F361-C384 HydrophobicContact CG-CB 4.21Å; F361-C384 VanDerWaalsContact CG-SG 3.57Å; F361-C384 HydrophobicContact CZ-CB 4.02Å; F361-C384 PolarHBondContact N-SG 2.95Å; F361-C384 VanDerWaalsContact N-SG 3.38Å; F379-C384 VanDerWaalsContact CD2-SG 3.57Å; G382-C384 PolarHBondContact O-N 3.27Å; G382-C384 VanDerWaalsContact O-N 3.15Å; C384-N386 PolarHBondContact SG-O 3.49Å; C384-N386 VanDerWaalsContact SG-O 3.36Å
385	R	94.1	Very high	85.6	Confident	138 Å²	138	40.6 Å²	40.6	52%	0.521	20%	0.203	S	C	.	.	S	Bend	trans	-87.8	-18.9	-179.5	-59.7	-147.9	-52.5	-161.7	5.6	114.2	Q335 S336	Q335-R385 CarbonylContact C-O 3.55Å; Q335-R385 WeakPolarHBondContact CA-O 3.47Å; S336-R385 PolarHBondContact N-O 3.21Å
386	N	95.4	Very high	84.3	Confident	6 Å²	6	39.7 Å²	39.7	3%	0.032	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	132.5	-171.3	-51.4	-74.7	0	0	0	112.1	F328 S336 S359 C360 F361 C384	F328-N386 HydrophobicContact CZ-CB 4.44Å; F328-N386 WeakPolarHBondContact CZ-OD1 3.35Å; S336-N386 WeakPolarHBondContact O-CA 3.07Å; S336-N386 PolarHBondContact OG-OD1 3.02Å; S359-N386 PolarHBondContact O-N 3.36Å; S359-N386 PolarHBondContact O-ND2 2.98Å; C360-N386 CarbonylContact C-O 3.55Å; C360-N386 WeakPolarHBondContact CA-O 3.34Å; C360-N386 HydrophobicContact CB-CB 3.85Å; C360-N386 VanDerWaalsContact CB-O 3.31Å; C360-N386 WeakPolarHBondContact CB-O 3.34Å; F361-N386 PolarHBondContact N-O 2.88Å; C384-N386 PolarHBondContact SG-O 3.49Å; C384-N386 VanDerWaalsContact SG-O 3.36Å
387	L	95	Very high	83.6	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.026	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	117.5	173.3	166.3	58.9	0	0	0	110.5	S336 I337 I338 I363 F379 C389	S336-L387 PolarHBondContact O-N 3.36Å; I337-L387 CarbonylContact C-O 3.57Å; I337-L387 WeakPolarHBondContact CA-O 3.49Å; I337-L387 HydrophobicContact CG1-CB 4.35Å; I337-L387 HydrophobicContact CG1-CD2 4.45Å; I338-L387 PolarHBondContact N-O 2.99Å; I363-L387 HydrophobicContact CB-CD1 4.49Å; I363-L387 HydrophobicContact CD1-CD1 3.87Å; I363-L387 HydrophobicContact CD1-CD2 4.45Å; I363-L387 HydrophobicContact CG1-CD1 3.66Å; F379-L387 HydrophobicContact CD1-CB 3.69Å; F379-L387 HydrophobicContact CD1-CD2 3.54Å; F379-L387 HydrophobicContact CD1-CG 4.2Å; F379-L387 HydrophobicContact CD2-CB 4.15Å; F379-L387 HydrophobicContact CE1-CB 3.43Å; F379-L387 VanDerWaalsContact CE1-CB 3.43Å; F379-L387 HydrophobicContact CE1-CD2 3.62Å; F379-L387 HydrophobicContact CE1-CG 4.16Å; F379-L387 HydrophobicContact CE2-CB 3.92Å; F379-L387 HydrophobicContact CG-CB 4.05Å; F379-L387 HydrophobicContact CG-CD2 4.44Å; F379-L387 HydrophobicContact CZ-CB 3.55Å; L387-C389 HydrophobicContact CD1-CB 4.31Å; L387-C389 HydrophobicContact CG-CB 4.34Å
388	V	96.5	Very high	82.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	122.8	172.4	-165.2	0	0	0	0	110.1	I338 V346 L349 A350 I353 F361 Y362 I363	I338-V388 HydrophobicContact CB-CG1 4.45Å; I338-V388 HydrophobicContact CB-CG2 4.49Å; I338-V388 HydrophobicContact CD1-CG2 4.07Å; I338-V388 CarbonylContact O-C 3.56Å; I338-V388 WeakPolarHBondContact O-CA 3.34Å; V346-V388 HydrophobicContact CB-CG1 4.33Å; V346-V388 HydrophobicContact CG1-CB 4.29Å; V346-V388 HydrophobicContact CG1-CG1 4.05Å; V346-V388 WeakPolarHBondContact CG1-O 3.45Å; V346-V388 HydrophobicContact CG2-CG1 4.37Å; L349-V388 HydrophobicContact CB-CG1 4.34Å; L349-V388 HydrophobicContact CD2-CG1 4.05Å; L349-V388 HydrophobicContact CG-CG1 4.41Å; A350-V388 HydrophobicContact CB-CB 4.33Å; A350-V388 HydrophobicContact CB-CG2 4.1Å; I353-V388 HydrophobicContact CD1-CG2 3.78Å; F361-V388 PolarHBondContact O-N 3.04Å; Y362-V388 CarbonylContact C-O 3.55Å; Y362-V388 WeakPolarHBondContact CA-O 3.47Å; I363-V388 PolarHBondContact N-O 3.36Å
389	C	94.6	Very high	82.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	162.9	-174.7	62.2	0	0	0	0	116.5	I337 I338 F339 C340 V346 I363 L387 F393 T394	I337-C389 VanDerWaalsContact CG2-SG 3.57Å; I338-C389 PolarHBondContact O-N 3.07Å; F339-C389 WeakPolarHBondContact CA-O 3.13Å; F339-C389 VanDerWaalsContact CE1-SG 3.51Å; C340-C389 PolarHBondContact N-O 3.31Å; V346-C389 VanDerWaalsContact CG2-C 3.46Å; I363-C389 VanDerWaalsContact O-CA 3.23Å; I363-C389 WeakPolarHBondContact O-CA 3.24Å; I363-C389 WeakPolarHBondContact O-CB 3.38Å; L387-C389 HydrophobicContact CD1-CB 4.31Å; L387-C389 HydrophobicContact CG-CB 4.34Å; C389-F393 HydrophobicContact CB-CB 4.12Å; C389-T394 VanDerWaalsContact SG-CG2 3.53Å
390	T	92.3	Very high	81.8	Confident	14 Å²	14	41.1 Å²	41.1	9%	0.086	21%	0.207	C	C	.	.			trans	-91	158.9	166.3	55.1	0	0	0	0	111.5	V346 H364 L392 F393	V346-T390 HydrophobicContact CG2-CG2 3.73Å; H364-T390 HydrophobicContact CB-CG2 4.2Å; T390-L392 PolarHBondContact O-N 2.78Å; T390-F393 PolarHBondContact O-N 3.27Å; T390-F393 VanDerWaalsContact O-N 3.12Å
391	D	81.8	Confident	81.8	Confident	34 Å²	34	37.5 Å²	37.5	18%	0.182	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-46.4	-30.7	-178.5	-65.4	-78.9	0	0	0	117.3	F393 T416 R420	D391-F393 PolarHBondContact O-N 3.38Å; D391-F393 VanDerWaalsContact O-N 3.11Å; D391-T416 WeakPolarHBondContact OD1-CG2 3.45Å; D391-R420 IonicContact OD1-CZ 3.59Å; D391-R420 IonicContact OD1-NE 3.7Å; D391-R420 PolarHBondContact OD1-NE 2.92Å; D391-R420 IonicContact OD1-NH2 2.66Å; D391-R420 PolarHBondContact OD1-NH2 2.6Å; D391-R420 IonicContact OD2-CZ 3.08Å; D391-R420 IonicContact OD2-NE 3.9Å; D391-R420 IonicContact OD2-NH2 3.91Å; D391-R420 PolarHBondContact OD2-NH2 2.65Å
392	L	67.1	Low	81.9	Confident	79 Å²	79	33.8 Å²	33.8	41%	0.414	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-59.3	-21.5	-179.7	-174.3	62.7	0	0	0	113.7	A365 T390	A365-L392 HydrophobicContact CB-CD2 3.59Å; T390-L392 PolarHBondContact O-N 2.78Å
393	F	62.7	Low	82	Confident	6 Å²	6	32.4 Å²	32.4	3%	0.026	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-91.8	-29.6	-164.6	-81.2	-84.9	0	0	0	115.8	I363 H364 R372 C389 T390 D391 I397	I363-F393 HydrophobicContact CB-CD1 3.6Å; I363-F393 HydrophobicContact CB-CE1 3.73Å; I363-F393 HydrophobicContact CB-CG 4.07Å; I363-F393 HydrophobicContact CB-CZ 4.31Å; I363-F393 HydrophobicContact CD1-CD1 4.11Å; I363-F393 HydrophobicContact CG1-CD1 4.47Å; I363-F393 HydrophobicContact CG2-CD1 3.51Å; I363-F393 HydrophobicContact CG2-CE1 3.1Å; I363-F393 HydrophobicContact CG2-CG 4.36Å; I363-F393 HydrophobicContact CG2-CZ 3.69Å; H364-F393 WeakPolarHBondContact O-CZ 3.12Å; R372-F393 HydrophobicContact CB-CE1 4.03Å; R372-F393 HydrophobicContact CG-CE1 3.63Å; R372-F393 HydrophobicContact CG-CZ 3.96Å; C389-F393 HydrophobicContact CB-CB 4.12Å; T390-F393 PolarHBondContact O-N 3.27Å; T390-F393 VanDerWaalsContact O-N 3.12Å; D391-F393 PolarHBondContact O-N 3.38Å; D391-F393 VanDerWaalsContact O-N 3.11Å; F393-I397 WeakPolarHBondContact O-CD1 3.39Å
394	T	58	Low	82.1	Confident	5 Å²	5	27.1 Å²	27.1	3%	0.031	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	-12.3	-161.3	57.3	0	0	0	0	113.3	I337 F339 C389 I397 R423	I337-T394 HydrophobicContact CD1-CG2 4.36Å; I337-T394 HydrophobicContact CG2-CG2 4.21Å; F339-T394 HydrophobicContact CE1-CG2 3.63Å; F339-T394 WeakPolarHBondContact CE1-OG1 3.46Å; F339-T394 HydrophobicContact CZ-CG2 3.69Å; F339-T394 VanDerWaalsContact CZ-OG1 3.26Å; F339-T394 WeakPolarHBondContact CZ-OG1 3.31Å; C389-T394 VanDerWaalsContact SG-CG2 3.53Å; T394-I397 PolarHBondContact O-N 3.24Å; T394-R423 VanDerWaalsContact O-CD 3.27Å; T394-R423 WeakPolarHBondContact O-CD 3.47Å; T394-R423 PolarHBondContact O-NE 3.2Å; T394-R423 VanDerWaalsContact O-NE 3.17Å; T394-R423 PolarHBondContact O-NH1 2.84Å
395	R	70.8	Confident	82.3	Confident	42 Å²	42	27 Å²	27	16%	0.158	13%	0.133	C	C	.	.	S	Bend	trans	-56.6	139.3	176.9	-67.1	-163.4	-177.7	138.4	2	111.3	T172 E246 I397 H419	T172-R395 HydrophobicContact CG2-CB 4.28Å; E246-R395 WeakPolarHBondContact OE2-CB 3.42Å; R395-I397 PolarHBondContact O-N 3.36Å; R395-H419 HydrophobicContact CG-CB 4.27Å; R395-H419 PolarHBondContact NE-CD2 3.36Å
396	G	61	Low	82.4	Confident	6 Å²	6	20.5 Å²	20.5	6%	0.062	11%	0.108	C	C	.	.	S	Bend	trans	70.2	-42.7	-168.5	0	0	0	0	0	117.2	Q178 E246 R423 R426	Q178-G396 PolarHBondContact NE2-O 3.42Å; Q178-G396 VanDerWaalsContact NE2-O 3.15Å; E246-G396 VanDerWaalsContact CD-N 3.31Å; E246-G396 PolarHBondContact OE1-N 3.19Å; E246-G396 PolarHBondContact OE2-N 2.97Å; E246-G396 VanDerWaalsContact OE2-N 3.14Å; G396-R423 VanDerWaalsContact C-NH1 3.28Å; G396-R426 PolarHBondContact O-NH2 2.85Å
397	I	69.3	Low	82.5	Confident	10 Å²	10	20.2 Å²	20.2	5%	0.051	11%	0.107	C	C	.	.			trans	-55.2	136.5	-169.4	-62.3	-170.2	0	0	0	114.3	E174 Q178 F376 F393 T394 R395 I399 R423 R426	E174-I397 HydrophobicContact CB-CD1 3.65Å; E174-I397 HydrophobicContact CB-CG1 4.15Å; E174-I397 HydrophobicContact CG-CD1 4.25Å; Q178-I397 VanDerWaalsContact OE1-CA 3.32Å; F376-I397 HydrophobicContact CD2-CD1 4.07Å; F376-I397 HydrophobicContact CD2-CG2 4.35Å; F376-I397 HydrophobicContact CE1-CD1 4.41Å; F376-I397 HydrophobicContact CE2-CD1 3.89Å; F376-I397 HydrophobicContact CE2-CG2 3.4Å; F376-I397 HydrophobicContact CG-CD1 4.44Å; F376-I397 HydrophobicContact CZ-CD1 4.06Å; F376-I397 HydrophobicContact CZ-CG1 4.5Å; F376-I397 HydrophobicContact CZ-CG2 3.69Å; F393-I397 WeakPolarHBondContact O-CD1 3.39Å; T394-I397 PolarHBondContact O-N 3.24Å; R395-I397 PolarHBondContact O-N 3.36Å; I397-I399 HydrophobicContact CG2-CD1 4.28Å; I397-I399 HydrophobicContact CG2-CG1 3.96Å; I397-R423 PolarHBondContact O-NH1 3.14Å; I397-R426 PolarHBondContact O-NE 3.02Å; I397-R426 PolarHBondContact O-NH2 3.07Å
398	D	71.8	Confident	82.7	Confident	39 Å²	39	20.5 Å²	20.5	21%	0.209	11%	0.108	C	C	.	.			trans	-108.8	131.7	172	-153.1	-51.7	0	0	0	112.2	R426	D398-R426 VanDerWaalsContact CB-NH1 3.28Å; D398-R426 IonicContact OD2-CZ 2.61Å; D398-R426 IonicContact OD2-NH1 3.67Å; D398-R426 PolarHBondContact OD2-NH1 3.28Å
399	I	80	Confident	82.7	Confident	14 Å²	14	20.8 Å²	20.8	7%	0.072	11%	0.11	C	C	.	.			trans	-145.8	96.4	170.3	-51.1	175.5	0	0	0	107.5	F376 F379 I397 A401 V402	F376-I399 HydrophobicContact CD2-CD1 4.45Å; F376-I399 HydrophobicContact CE2-CD1 4Å; F376-I399 HydrophobicContact CE2-CG1 4.19Å; F379-I399 HydrophobicContact CD1-CD1 3.48Å; F379-I399 VanDerWaalsContact CD1-CD1 3.48Å; F379-I399 HydrophobicContact CE1-CD1 3.42Å; F379-I399 VanDerWaalsContact CE1-CD1 3.42Å; I397-I399 HydrophobicContact CG2-CD1 4.28Å; I397-I399 HydrophobicContact CG2-CG1 3.96Å; I399-A401 PolarHBondContact O-N 2.99Å; I399-V402 HydrophobicContact CB-CG2 3.87Å; I399-V402 HydrophobicContact CD1-CG2 4.47Å; I399-V402 HydrophobicContact CG2-CG2 3.84Å; I399-V402 PolarHBondContact O-N 3.04Å
400	Q	77.8	Confident	82.9	Confident	115 Å²	115	20.9 Å²	20.9	54%	0.537	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-13.2	-172.9	-64	-171.3	3.7	0	0	115.9	R83	R83-Q400 PolarHBondContact NH1-O 3.07Å
401	A	86.4	Confident	83	Confident	31 Å²	31	20.3 Å²	20.3	26%	0.256	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-8.7	176.9	0	0	0	0	0	113.5	N334 Q335 I399 N403	N334-A401 WeakPolarHBondContact CB-O 3.41Å; Q335-A401 HydrophobicContact CG-CB 4.16Å; Q335-A401 PolarHBondContact N-O 3.3Å; Q335-A401 VanDerWaalsContact N-O 3.07Å; I399-A401 PolarHBondContact O-N 2.99Å; A401-N403 PolarHBondContact O-N 3.15Å; A401-N403 VanDerWaalsContact O-N 3.14Å
402	V	90.9	Very high	83.5	Confident	5 Å²	5	23.5 Å²	23.5	3%	0.03	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	98.5	176	175.6	0	0	0	0	109.5	Q335 I337 F379 I399 V405	Q335-V402 HydrophobicContact CB-CG2 3.96Å; Q335-V402 WeakPolarHBondContact O-CA 3.38Å; I337-V402 HydrophobicContact CD1-CG1 4.17Å; I337-V402 HydrophobicContact CD1-CG2 4.08Å; I337-V402 HydrophobicContact CG1-CG1 3.98Å; I337-V402 HydrophobicContact CG1-CG2 4.02Å; F379-V402 HydrophobicContact CE1-CG2 4.17Å; F379-V402 HydrophobicContact CZ-CG2 3.98Å; I399-V402 HydrophobicContact CB-CG2 3.87Å; I399-V402 HydrophobicContact CD1-CG2 4.47Å; I399-V402 HydrophobicContact CG2-CG2 3.84Å; I399-V402 PolarHBondContact O-N 3.04Å; V402-V405 HydrophobicContact CG1-CG2 4.33Å
403	N	92.2	Very high	84.6	Confident	19 Å²	19	24.7 Å²	24.7	10%	0.102	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-16.8	176	70.3	-31.8	0	0	0	113.5	Q332 N334 Q335 A401 G431 L432 Y468	Q332-N403 PolarHBondContact O-ND2 3.29Å; Q332-N403 VanDerWaalsContact O-ND2 3.1Å; N334-N403 PolarHBondContact N-OD1 3.42Å; Q335-N403 PolarHBondContact O-N 3.47Å; Q335-N403 PolarHBondContact O-OD1 2.92Å; A401-N403 PolarHBondContact O-N 3.15Å; A401-N403 VanDerWaalsContact O-N 3.14Å; N403-G431 WeakPolarHBondContact O-CA 3.49Å; N403-L432 PolarHBondContact O-N 2.72Å; N403-Y468 WeakPolarHBondContact CB-O 3.48Å; N403-Y468 WeakPolarHBondContact ND2-CD2 3.33Å; N403-Y468 PolarHBondContact ND2-O 3.08Å
404	V	94.9	Very high	85.8	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.3	179.7	-173.8	0	0	0	0	112.3	L331 I333 S336 I337 I406 L432 Y468	L331-V404 HydrophobicContact CD1-CG1 4.33Å; I333-V404 HydrophobicContact CG1-CB 4.33Å; I333-V404 HydrophobicContact CG1-CG2 3.93Å; S336-V404 WeakPolarHBondContact CA-O 3.46Å; S336-V404 WeakPolarHBondContact CB-O 3.47Å; I337-V404 PolarHBondContact N-O 3.1Å; I337-V404 VanDerWaalsContact N-O 3.15Å; V404-I406 HydrophobicContact CG1-CD1 4.42Å; V404-I406 HydrophobicContact CG1-CG1 4Å; V404-L432 CarbonylContact C-O 3.49Å; V404-L432 WeakPolarHBondContact CA-O 3.25Å; V404-L432 HydrophobicContact CG1-CB 4.44Å; V404-L432 HydrophobicContact CG1-CD2 4.48Å; V404-L432 HydrophobicContact CG2-CB 4.2Å; V404-L432 HydrophobicContact CG2-CD2 4.36Å; V404-Y468 HydrophobicContact CG2-CD2 3.75Å; V404-Y468 HydrophobicContact CG2-CE2 4.04Å
405	V	94.8	Very high	87	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135	168.9	170.8	0	0	0	0	109.5	I337 F339 V402 R423 S424 L432 A433 I434	I337-V405 WeakPolarHBondContact O-CA 3.4Å; F339-V405 HydrophobicContact CD2-CG1 3.82Å; F339-V405 HydrophobicContact CE2-CG1 3.72Å; V402-V405 HydrophobicContact CG1-CG2 4.33Å; V405-R423 HydrophobicContact CG2-CB 4.05Å; V405-S424 WeakPolarHBondContact CG2-OG 2.97Å; V405-L432 PolarHBondContact N-O 3.26Å; V405-A433 CarbonylContact O-C 3.57Å; V405-A433 WeakPolarHBondContact O-CA 3.4Å; V405-I434 PolarHBondContact O-N 3.44Å
406	I	97.6	Very high	87.7	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	114.4	178.4	-54.2	-179	0	0	0	109.9	L324 L327 F328 I337 I338 F339 V404 F408 I434	L324-I406 HydrophobicContact CD1-CD1 3.57Å; L324-I406 HydrophobicContact CD1-CG2 4.22Å; L327-I406 HydrophobicContact CD1-CD1 4.45Å; F328-I406 HydrophobicContact CD1-CD1 4.29Å; F328-I406 HydrophobicContact CE1-CD1 3.73Å; I337-I406 PolarHBondContact O-N 3.45Å; I338-I406 CarbonylContact C-O 3.59Å; I338-I406 WeakPolarHBondContact CA-O 3.48Å; I338-I406 HydrophobicContact CG2-CB 4.32Å; I338-I406 HydrophobicContact CG2-CG2 4.46Å; F339-I406 PolarHBondContact N-O 3.19Å; V404-I406 HydrophobicContact CG1-CD1 4.42Å; V404-I406 HydrophobicContact CG1-CG1 4Å; I406-F408 PolarHBondContact O-N 2.68Å; I406-F408 VanDerWaalsContact O-N 3.13Å; I406-I434 CarbonylContact C-O 3.47Å; I406-I434 WeakPolarHBondContact CA-O 3.2Å
407	N	97.9	Very high	89.1	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	88.5	165.3	-76.1	-55.9	0	0	0	108.6	D409 R420 I434 N435 L436	N407-D409 VanDerWaalsContact C-N 3.27Å; N407-R420 WeakPolarHBondContact OD1-CD 3.4Å; N407-R420 PolarHBondContact OD1-NH1 3.49Å; N407-I434 PolarHBondContact N-O 3Å; N407-N435 WeakPolarHBondContact CB-OD1 3.42Å; N407-N435 PolarHBondContact ND2-OD1 2.75Å; N407-L436 PolarHBondContact O-N 2.85Å
408	F	98.3	Very high	89.9	Confident	11 Å²	11	24.4 Å²	24.4	5%	0.048	13%	0.125	C	C	.	.	S	Bend	trans	-66.7	-34.9	173.2	-175.5	-85.4	0	0	0	110.9	K320 V321 L324 I338 F339 L349 I406 L436	K320-F408 HydrophobicContact CB-CD2 4.37Å; K320-F408 HydrophobicContact CB-CE1 4.19Å; K320-F408 HydrophobicContact CB-CE2 3.65Å; K320-F408 HydrophobicContact CB-CZ 3.54Å; K320-F408 HydrophobicContact CD-CD1 4.29Å; K320-F408 HydrophobicContact CD-CE1 4.03Å; K320-F408 HydrophobicContact CD-CZ 4.25Å; K320-F408 VanDerWaalsContact CD-O 3.31Å; K320-F408 WeakPolarHBondContact CD-O 3.35Å; K320-F408 WeakPolarHBondContact CE-O 3.34Å; K320-F408 PolarHBondContact NZ-O 3.48Å; V321-F408 HydrophobicContact CG2-CE2 4.21Å; V321-F408 HydrophobicContact CG2-CZ 3.94Å; L324-F408 HydrophobicContact CD2-CD2 4.05Å; L324-F408 HydrophobicContact CD2-CE2 4.18Å; I338-F408 HydrophobicContact CG2-CB 3.67Å; I338-F408 HydrophobicContact CG2-CG 4.5Å; F339-F408 WeakPolarHBondContact O-CB 3.48Å; F339-F408 PolarHBondContact O-N 2.58Å; L349-F408 HydrophobicContact CD1-CD2 4.11Å; L349-F408 HydrophobicContact CD1-CE1 4.36Å; L349-F408 HydrophobicContact CD1-CE2 3.54Å; L349-F408 HydrophobicContact CD1-CZ 3.69Å; L349-F408 HydrophobicContact CD2-CB 4.09Å; L349-F408 HydrophobicContact CD2-CD1 3.86Å; L349-F408 HydrophobicContact CD2-CD2 3.6Å; L349-F408 HydrophobicContact CD2-CE1 4.14Å; L349-F408 HydrophobicContact CD2-CE2 3.88Å; L349-F408 HydrophobicContact CD2-CG 3.58Å; L349-F408 HydrophobicContact CD2-CZ 4.15Å; L349-F408 HydrophobicContact CG-CE2 4.38Å; L349-F408 HydrophobicContact CG-CZ 4.48Å; I406-F408 PolarHBondContact O-N 2.68Å; I406-F408 VanDerWaalsContact O-N 3.13Å; F408-L436 HydrophobicContact CD2-CD1 3.7Å; F408-L436 HydrophobicContact CE2-CD1 4.24Å; F408-L436 HydrophobicContact CG-CD1 4.26Å
409	D	97.6	Very high	90.5	Very high	7 Å²	7	22.8 Å²	22.8	4%	0.037	12%	0.116	C	C	.	.	S	Bend	trans	-113.5	126.8	161.7	-59.5	-34.4	0	0	0	109.4	K320 F339 C340 N341 R345 N407 R420	K320-D409 IonicContact NZ-OD1 2.66Å; K320-D409 PolarHBondContact NZ-OD1 2.81Å; F339-D409 PolarHBondContact O-N 2.61Å; F339-D409 VanDerWaalsContact O-N 3.07Å; C340-D409 VanDerWaalsContact CA-OD2 3.29Å; C340-D409 WeakPolarHBondContact CA-OD2 3.22Å; C340-D409 WeakPolarHBondContact CB-OD2 3.45Å; N341-D409 HydrophobicContact CB-CB 3.88Å; N341-D409 PolarHBondContact N-OD2 3.18Å; N341-D409 WeakPolarHBondContact OD1-CB 3.21Å; N341-D409 PolarHBondContact OD1-O 2.81Å; R345-D409 WeakPolarHBondContact CD-OD2 3.37Å; R345-D409 IonicContact CZ-OD1 2.73Å; R345-D409 VanDerWaalsContact CZ-OD1 3.25Å; R345-D409 IonicContact CZ-OD2 3.32Å; R345-D409 VanDerWaalsContact NE-CG 3.31Å; R345-D409 IonicContact NE-OD1 2.71Å; R345-D409 PolarHBondContact NE-OD1 2.98Å; R345-D409 VanDerWaalsContact NE-OD1 3.1Å; R345-D409 IonicContact NE-OD2 3.19Å; R345-D409 PolarHBondContact NE-OD2 2.89Å; R345-D409 IonicContact NH2-OD1 3.23Å; R345-D409 PolarHBondContact NH2-OD1 2.89Å; R345-D409 IonicContact NH2-OD2 2.7Å; N407-D409 VanDerWaalsContact C-N 3.27Å; D409-R420 PolarHBondContact O-NH1 2.85Å
410	F	97.3	Very high	90.9	Very high	1 Å²	1	22.2 Å²	22.2	0%	0.004	11%	0.113	C	C	.	.			trans	-70.3	136.7	177.9	-161.4	-108.9	0	0	0	110.5	N341 Y417 N435 I437 D441 N444 L445 I448	N341-F410 PolarHBondContact ND2-O 3.42Å; F410-Y417 AromaticContact CE2-CD2 3.85Å; F410-Y417 HydrophobicContact CE2-CD2 3.85Å; F410-Y417 AromaticContact CE2-CE2 3.72Å; F410-Y417 HydrophobicContact CE2-CE2 3.72Å; F410-Y417 HydrophobicContact CZ-CD2 4.13Å; F410-Y417 HydrophobicContact CZ-CE2 4.24Å; F410-N435 HydrophobicContact CD2-CB 3.93Å; F410-N435 HydrophobicContact CE2-CB 4Å; F410-I437 HydrophobicContact CB-CD1 3.89Å; F410-I437 HydrophobicContact CD1-CD1 3.97Å; F410-I437 HydrophobicContact CD2-CD1 3.28Å; F410-I437 HydrophobicContact CE1-CD1 4.34Å; F410-I437 HydrophobicContact CE2-CD1 3.72Å; F410-I437 HydrophobicContact CG-CD1 3.43Å; F410-I437 VanDerWaalsContact CG-CD1 3.43Å; F410-I437 HydrophobicContact CZ-CD1 4.23Å; F410-D441 HydrophobicContact CB-CB 4.16Å; F410-D441 HydrophobicContact CD1-CB 4.36Å; F410-N444 HydrophobicContact CD1-CB 4.07Å; F410-N444 HydrophobicContact CE1-CB 4.1Å; F410-L445 HydrophobicContact CE1-CB 4.23Å; F410-L445 HydrophobicContact CE2-CD1 4.16Å; F410-L445 HydrophobicContact CZ-CB 4.36Å; F410-L445 HydrophobicContact CZ-CD1 3.84Å; F410-I448 HydrophobicContact CE1-CD1 3.81Å; F410-I448 HydrophobicContact CZ-CB 4.48Å; F410-I448 HydrophobicContact CZ-CD1 4.16Å; F410-I448 HydrophobicContact CZ-CG2 4.5Å
411	P	94.9	Very high	91.4	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.013	9%	0.088	C	C	.	.			trans	-72.1	162.4	176.3	31.6	-35.2	0	0	0	111.3	T416 Y417 I448	P411-T416 HydrophobicContact CB-CG2 3.88Å; P411-Y417 HydrophobicContact CG-CD2 3.87Å; P411-Y417 HydrophobicContact CG-CG 4.28Å; P411-I448 HydrophobicContact CG-CD1 4.39Å
412	K	92.6	Very high	91.2	Very high	102 Å²	102	15.4 Å²	15.4	44%	0.443	8%	0.076	S	C	.	.	S	Bend	trans	-102.9	4.4	-179.6	-55.1	-59.4	-174.1	-177	0	114	D441 N444	K412-D441 IonicContact NZ-OD1 3.14Å; K412-D441 PolarHBondContact NZ-OD1 3.42Å; K412-N444 HydrophobicContact CD-CB 4.34Å; K412-N444 VanDerWaalsContact CD-OD1 3.28Å; K412-N444 WeakPolarHBondContact CD-OD1 3.36Å; K412-N444 PolarHBondContact NZ-ND2 3.36Å
413	L	89.5	Confident	90.7	Very high	104 Å²	104	15.5 Å²	15.5	55%	0.545	8%	0.076	S	C	.	.	S	Bend	trans	-142	132.7	-177.2	-62.8	173.3	0	0	0	110	E415 T416 Y417	L413-E415 VanDerWaalsContact C-N 3.34Å; L413-E415 PolarHBondContact O-N 3.29Å; L413-T416 WeakPolarHBondContact O-CB 3.49Å; L413-T416 PolarHBondContact O-N 3.23Å; L413-T416 VanDerWaalsContact O-N 3.08Å; L413-Y417 PolarHBondContact O-N 2.88Å
414	G	88	Confident	89.9	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-64.8	-34.9	-176.9	0	0	0	0	0	113.6	T416 Y417 L418 Q451	G414-T416 VanDerWaalsContact C-N 3.32Å; G414-T416 PolarHBondContact O-N 2.9Å; G414-Y417 WeakPolarHBondContact O-CB 3.39Å; G414-Y417 PolarHBondContact O-N 3.39Å; G414-L418 WeakPolarHBondContact O-CB 3.45Å; G414-L418 PolarHBondContact O-N 3.13Å; G414-Q451 VanDerWaalsContact CA-OE1 3.31Å; G414-Q451 VanDerWaalsContact N-OE1 3.12Å
415	E	82.4	Confident	88.6	Confident	37 Å²	37	15.2 Å²	15.2	17%	0.173	8%	0.077	C	C	.	.	H	α-helix	trans	-59.6	-41.1	171.6	178.2	-129.3	-127.7	0	0	112	K249 T278 L413 L418 H419	K249-E415 WeakPolarHBondContact CE-OE1 3.47Å; K249-E415 IonicContact NZ-OE1 3.5Å; K249-E415 PolarHBondContact NZ-OE1 2.86Å; K249-E415 IonicContact NZ-OE2 3.39Å; K249-E415 PolarHBondContact NZ-OE2 2.62Å; T278-E415 HydrophobicContact CG2-CB 4.35Å; T278-E415 HydrophobicContact CG2-CG 3.95Å; L413-E415 VanDerWaalsContact C-N 3.34Å; L413-E415 PolarHBondContact O-N 3.29Å; E415-L418 PolarHBondContact O-N 3.19Å; E415-H419 PolarHBondContact O-CD2 3.32Å; E415-H419 PolarHBondContact O-N 3.08Å; E415-H419 VanDerWaalsContact O-N 3.08Å
416	T	87.5	Confident	87.6	Confident	17 Å²	17	16.1 Å²	16.1	10%	0.104	8%	0.081	C	C	.	.	H	α-helix	trans	-69	-39.4	174.9	-67.9	0	0	0	0	111.8	D391 P411 L413 G414 H419 R420	D391-T416 WeakPolarHBondContact OD1-CG2 3.45Å; P411-T416 HydrophobicContact CB-CG2 3.88Å; L413-T416 WeakPolarHBondContact O-CB 3.49Å; L413-T416 PolarHBondContact O-N 3.23Å; L413-T416 VanDerWaalsContact O-N 3.08Å; G414-T416 VanDerWaalsContact C-N 3.32Å; G414-T416 PolarHBondContact O-N 2.9Å; T416-H419 PolarHBondContact O-N 3.1Å; T416-R420 WeakPolarHBondContact O-CG 3.4Å; T416-R420 PolarHBondContact O-N 3.02Å; T416-R420 VanDerWaalsContact O-N 3.16Å
417	Y	90.3	Very high	86.4	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-57.3	-51.4	171.9	179.9	-94.4	0	0	0	112.1	Q310 F410 P411 L413 G414 H419 R420 I421 N435 I448 L452 I456	Q310-Y417 PolarHBondContact OE1-OH 3.12Å; F410-Y417 AromaticContact CE2-CD2 3.85Å; F410-Y417 HydrophobicContact CE2-CD2 3.85Å; F410-Y417 AromaticContact CE2-CE2 3.72Å; F410-Y417 HydrophobicContact CE2-CE2 3.72Å; F410-Y417 HydrophobicContact CZ-CD2 4.13Å; F410-Y417 HydrophobicContact CZ-CE2 4.24Å; P411-Y417 HydrophobicContact CG-CD2 3.87Å; P411-Y417 HydrophobicContact CG-CG 4.28Å; L413-Y417 PolarHBondContact O-N 2.88Å; G414-Y417 WeakPolarHBondContact O-CB 3.39Å; G414-Y417 PolarHBondContact O-N 3.39Å; Y417-H419 VanDerWaalsContact C-N 3.34Å; Y417-H419 PolarHBondContact O-N 3.04Å; Y417-R420 WeakPolarHBondContact O-CB 3.39Å; Y417-R420 PolarHBondContact O-N 2.86Å; Y417-I421 HydrophobicContact CD1-CD1 4.17Å; Y417-I421 HydrophobicContact CD1-CG1 4.24Å; Y417-I421 HydrophobicContact CE1-CD1 3.62Å; Y417-I421 HydrophobicContact CE1-CG1 4.06Å; Y417-I421 HydrophobicContact CE1-CG2 4.08Å; Y417-I421 HydrophobicContact CE2-CG2 4.1Å; Y417-I421 WeakPolarHBondContact O-CG1 3.11Å; Y417-I421 PolarHBondContact O-N 3.47Å; Y417-N435 WeakPolarHBondContact CE2-OD1 3.49Å; Y417-N435 PolarHBondContact OH-ND2 3.28Å; Y417-I448 HydrophobicContact CD1-CG2 3.81Å; Y417-I448 HydrophobicContact CD2-CG2 4.32Å; Y417-I448 HydrophobicContact CE1-CG2 4.41Å; Y417-I448 HydrophobicContact CG-CG2 3.76Å; Y417-L452 HydrophobicContact CD1-CD1 3.56Å; Y417-L452 HydrophobicContact CE1-CD1 4.2Å; Y417-L452 HydrophobicContact CG-CD1 4.49Å; Y417-I456 HydrophobicContact CE1-CD1 4.14Å; Y417-I456 HydrophobicContact CE2-CD1 4.12Å; Y417-I456 VanDerWaalsContact OH-CD1 3.31Å; Y417-I456 WeakPolarHBondContact OH-CD1 3.17Å
418	L	85.8	Confident	85.2	Confident	9 Å²	9	18.8 Å²	18.8	5%	0.047	9%	0.093	C	C	.	.	H	α-helix	trans	-55.9	-45.4	178.6	179.5	59.6	0	0	0	112.1	A277 L303 L305 G414 E415 R420 G422 L452	A277-L418 HydrophobicContact CB-CD2 4.46Å; L303-L418 HydrophobicContact CD2-CD2 4.33Å; L303-L418 WeakPolarHBondContact O-CD1 3.29Å; L303-L418 WeakPolarHBondContact O-CD2 3.33Å; L305-L418 HydrophobicContact CD1-CD1 4.41Å; L305-L418 HydrophobicContact CD2-CD1 3.69Å; L305-L418 HydrophobicContact CG-CD1 3.76Å; G414-L418 WeakPolarHBondContact O-CB 3.45Å; G414-L418 PolarHBondContact O-N 3.13Å; E415-L418 PolarHBondContact O-N 3.19Å; L418-R420 VanDerWaalsContact C-N 3.3Å; L418-R420 PolarHBondContact O-N 3.45Å; L418-G422 PolarHBondContact O-N 2.89Å; L418-L452 HydrophobicContact CB-CD2 4.45Å
419	H	83.9	Confident	84.4	Confident	4 Å²	4	18.9 Å²	18.9	2%	0.019	9%	0.093	C	C	.	.	H	α-helix	trans	-63.9	-31.5	176.1	-67.2	-58.8	0	0	0	113.4	K249 R395 E415 T416 Y417 R423	K249-H419 VanDerWaalsContact CE-NE2 3.27Å; K249-H419 WeakPolarHBondContact CE-NE2 3.42Å; R395-H419 HydrophobicContact CG-CB 4.27Å; R395-H419 PolarHBondContact NE-CD2 3.36Å; E415-H419 PolarHBondContact O-CD2 3.32Å; E415-H419 PolarHBondContact O-N 3.08Å; E415-H419 VanDerWaalsContact O-N 3.08Å; T416-H419 PolarHBondContact O-N 3.1Å; Y417-H419 VanDerWaalsContact C-N 3.34Å; Y417-H419 PolarHBondContact O-N 3.04Å; H419-R423 VanDerWaalsContact O-CZ 3.29Å; H419-R423 PolarHBondContact O-NE 3.07Å; H419-R423 PolarHBondContact O-NH2 2.76Å
420	R	89	Confident	83.9	Confident	2 Å²	2	20.5 Å²	20.5	1%	0.008	10%	0.102	C	C	.	.	H	α-helix	trans	-75.2	-50.6	178.1	-73.2	-177	-175.7	-173.4	1.1	112.2	F339 N341 D391 N407 D409 T416 Y417 L418 G422 R423	F339-R420 HydrophobicContact CD1-CG 3.92Å; F339-R420 HydrophobicContact CD2-CB 3.78Å; F339-R420 HydrophobicContact CD2-CG 3.79Å; F339-R420 HydrophobicContact CE1-CG 3.99Å; F339-R420 HydrophobicContact CE2-CB 3.62Å; F339-R420 HydrophobicContact CE2-CG 3.85Å; F339-R420 HydrophobicContact CG-CB 4.33Å; F339-R420 HydrophobicContact CG-CG 3.82Å; F339-R420 HydrophobicContact CZ-CB 4.06Å; F339-R420 HydrophobicContact CZ-CG 3.95Å; N341-R420 PolarHBondContact OD1-NH2 2.78Å; D391-R420 IonicContact OD1-CZ 3.59Å; D391-R420 IonicContact OD1-NE 3.7Å; D391-R420 PolarHBondContact OD1-NE 2.92Å; D391-R420 IonicContact OD1-NH2 2.66Å; D391-R420 PolarHBondContact OD1-NH2 2.6Å; D391-R420 IonicContact OD2-CZ 3.08Å; D391-R420 IonicContact OD2-NE 3.9Å; D391-R420 IonicContact OD2-NH2 3.91Å; D391-R420 PolarHBondContact OD2-NH2 2.65Å; N407-R420 WeakPolarHBondContact OD1-CD 3.4Å; N407-R420 PolarHBondContact OD1-NH1 3.49Å; D409-R420 PolarHBondContact O-NH1 2.85Å; T416-R420 WeakPolarHBondContact O-CG 3.4Å; T416-R420 PolarHBondContact O-N 3.02Å; T416-R420 VanDerWaalsContact O-N 3.16Å; Y417-R420 WeakPolarHBondContact O-CB 3.39Å; Y417-R420 PolarHBondContact O-N 2.86Å; L418-R420 VanDerWaalsContact C-N 3.3Å; L418-R420 PolarHBondContact O-N 3.45Å; R420-G422 PolarHBondContact O-N 3.48Å; R420-R423 WeakPolarHBondContact O-CG 3.31Å; R420-R423 PolarHBondContact O-N 3.01Å
421	I	87.9	Confident	83.6	Confident	2 Å²	2	20.5 Å²	20.5	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-66.6	-23.5	179.2	61.3	155.3	0	0	0	111.7	L305 Q310 Y417 R423 S424 A433	L305-I421 HydrophobicContact CB-CD1 4.47Å; L305-I421 VanDerWaalsContact CD1-C 3.45Å; L305-I421 HydrophobicContact CD1-CB 4.23Å; L305-I421 HydrophobicContact CD1-CD1 3.82Å; L305-I421 HydrophobicContact CD1-CG1 3.64Å; L305-I421 HydrophobicContact CG-CD1 4.07Å; L305-I421 HydrophobicContact CG-CG1 4.33Å; Q310-I421 HydrophobicContact CG-CD1 4.5Å; Y417-I421 HydrophobicContact CD1-CD1 4.17Å; Y417-I421 HydrophobicContact CD1-CG1 4.24Å; Y417-I421 HydrophobicContact CE1-CD1 3.62Å; Y417-I421 HydrophobicContact CE1-CG1 4.06Å; Y417-I421 HydrophobicContact CE1-CG2 4.08Å; Y417-I421 HydrophobicContact CE2-CG2 4.1Å; Y417-I421 WeakPolarHBondContact O-CG1 3.11Å; Y417-I421 PolarHBondContact O-N 3.47Å; I421-R423 PolarHBondContact O-N 2.85Å; I421-S424 PolarHBondContact O-N 2.85Å; I421-S424 PolarHBondContact O-OG 3.49Å; I421-S424 VanDerWaalsContact O-OG 3.07Å; I421-A433 HydrophobicContact CB-CB 4.17Å; I421-A433 HydrophobicContact CG2-CB 3.56Å
422	G	81.1	Confident	83.6	Confident	2 Å²	2	20.4 Å²	20.4	2%	0.021	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	24.2	171.4	0	0	0	0	0	116.5	L418 R420 R426	L418-G422 PolarHBondContact O-N 2.89Å; R420-G422 PolarHBondContact O-N 3.48Å; G422-R426 PolarHBondContact O-NE 3.2Å
423	R	80.9	Confident	83.7	Confident	7 Å²	7	15.5 Å²	15.5	3%	0.026	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-26.3	166.8	-51.1	-49.5	125.3	-179.5	3.7	113.4	N141 E246 I337 F339 T394 G396 I397 V405 H419 R420 I421	N141-R423 PolarHBondContact ND2-NH2 3.06Å; N141-R423 VanDerWaalsContact ND2-NH2 3.12Å; E246-R423 IonicContact OE1-NH2 2.73Å; I337-R423 HydrophobicContact CD1-CB 3.9Å; I337-R423 HydrophobicContact CD1-CG 4.16Å; F339-R423 HydrophobicContact CZ-CG 4.26Å; T394-R423 VanDerWaalsContact O-CD 3.27Å; T394-R423 WeakPolarHBondContact O-CD 3.47Å; T394-R423 PolarHBondContact O-NE 3.2Å; T394-R423 VanDerWaalsContact O-NE 3.17Å; T394-R423 PolarHBondContact O-NH1 2.84Å; G396-R423 VanDerWaalsContact C-NH1 3.28Å; I397-R423 PolarHBondContact O-NH1 3.14Å; V405-R423 HydrophobicContact CG2-CB 4.05Å; H419-R423 VanDerWaalsContact O-CZ 3.29Å; H419-R423 PolarHBondContact O-NE 3.07Å; H419-R423 PolarHBondContact O-NH2 2.76Å; R420-R423 WeakPolarHBondContact O-CG 3.31Å; R420-R423 PolarHBondContact O-N 3.01Å; I421-R423 PolarHBondContact O-N 2.85Å
424	S	75.5	Confident	84.1	Confident	1 Å²	1	10.6 Å²	10.6	1%	0.007	5%	0.054	C	C	.	.	S	Bend	trans	-87.1	159.8	161.4	46.7	0	0	0	0	110.3	V405 I421 R426	V405-S424 WeakPolarHBondContact CG2-OG 2.97Å; I421-S424 PolarHBondContact O-N 2.85Å; I421-S424 PolarHBondContact O-OG 3.49Å; I421-S424 VanDerWaalsContact O-OG 3.07Å; S424-R426 VanDerWaalsContact C-N 3.34Å; S424-R426 PolarHBondContact O-N 2.7Å
425	G	67.6	Low	84.6	Confident	11 Å²	11	10.6 Å²	10.6	11%	0.113	5%	0.054	C	C	.	.	S	Bend	trans	62.6	32.7	173.8	0	0	0	0	0	115.6	H429	G425-H429 CarbonylContact C-O 3.6Å; G425-H429 WeakPolarHBondContact CA-O 3.47Å
426	R	74.3	Confident	85.3	Confident	19 Å²	19	8.8 Å²	8.8	7%	0.072	5%	0.046	C	C	.	.	G	3₁₀ helix	trans	-73.4	155.3	177.1	-71.2	-171.4	139.2	-116.8	6.4	111.6	G396 I397 D398 G422 S424 G428 H429	G396-R426 PolarHBondContact O-NH2 2.85Å; I397-R426 PolarHBondContact O-NE 3.02Å; I397-R426 PolarHBondContact O-NH2 3.07Å; D398-R426 VanDerWaalsContact CB-NH1 3.28Å; D398-R426 IonicContact OD2-CZ 2.61Å; D398-R426 IonicContact OD2-NH1 3.67Å; D398-R426 PolarHBondContact OD2-NH1 3.28Å; G422-R426 PolarHBondContact O-NE 3.2Å; S424-R426 VanDerWaalsContact C-N 3.34Å; S424-R426 PolarHBondContact O-N 2.7Å; R426-G428 PolarHBondContact O-N 3.39Å; R426-G428 VanDerWaalsContact O-N 3.16Å; R426-H429 WeakPolarHBondContact O-CB 3.42Å; R426-H429 PolarHBondContact O-CD2 2.66Å; R426-H429 PolarHBondContact O-N 3.16Å
427	F	72.4	Confident	85.8	Confident	56 Å²	56	8 Å²	8	25%	0.246	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	45.4	40.7	-170.7	-147	-98.5	0	0	0	113.5	K85 G142 H429	K85-F427 HydrophobicContact CD-CD1 4.26Å; G142-F427 WeakPolarHBondContact O-CA 3.37Å; G142-F427 PolarHBondContact O-N 3.42Å; F427-H429 VanDerWaalsContact C-N 3.27Å; F427-H429 PolarHBondContact O-N 3.08Å
428	G	73	Confident	86.2	Confident	1 Å²	1	8.7 Å²	8.7	1%	0.01	5%	0.045	C	C	.	.	G	3₁₀ helix	trans	72.8	5.2	178.4	0	0	0	0	0	116.1	K85 T86 R426	K85-G428 CarbonylContact C-O 3.57Å; K85-G428 VanDerWaalsContact CA-O 3.3Å; K85-G428 WeakPolarHBondContact CA-O 3.26Å; T86-G428 WeakPolarHBondContact CG2-O 3.49Å; T86-G428 PolarHBondContact N-O 2.95Å; T86-G428 WeakPolarHBondContact OG1-CA 3.44Å; T86-G428 PolarHBondContact OG1-O 2.74Å; R426-G428 PolarHBondContact O-N 3.39Å; R426-G428 VanDerWaalsContact O-N 3.16Å
429	H	80.1	Confident	86.7	Confident	12 Å²	12	15.6 Å²	15.6	6%	0.056	7%	0.071	C	C	.	.			trans	-63.5	161	175.6	-62.2	-46.1	0	0	0	112.3	D81 R83 I84 K85 G425 R426 F427	D81-H429 IonicContact OD1-CE1 2.75Å; D81-H429 IonicContact OD2-CE1 2.68Å; D81-H429 PolarHBondContact OD2-CE1 3.09Å; D81-H429 IonicContact OD2-NE2 2.7Å; D81-H429 PolarHBondContact OD2-NE2 2.86Å; D81-H429 VanDerWaalsContact OD2-NE2 3.14Å; R83-H429 PolarHBondContact NE-CE1 3.26Å; R83-H429 PolarHBondContact NE-NE2 3.1Å; R83-H429 PolarHBondContact NH2-NE2 3.32Å; I84-H429 PolarHBondContact O-ND1 2.82Å; K85-H429 VanDerWaalsContact CE-CE1 3.46Å; K85-H429 WeakPolarHBondContact CE-CE1 3.5Å; G425-H429 CarbonylContact C-O 3.6Å; G425-H429 WeakPolarHBondContact CA-O 3.47Å; R426-H429 WeakPolarHBondContact O-CB 3.42Å; R426-H429 PolarHBondContact O-CD2 2.66Å; R426-H429 PolarHBondContact O-N 3.16Å; F427-H429 VanDerWaalsContact C-N 3.27Å; F427-H429 PolarHBondContact O-N 3.08Å
430	L	87.1	Confident	87.2	Confident	42 Å²	42	20.9 Å²	20.9	22%	0.22	10%	0.1	C	C	.	.			trans	-76.7	153.7	170.8	-53.1	-175.6	0	0	0	110.8	I84 T86 G307 S466	I84-L430 HydrophobicContact CG2-CD1 4.38Å; I84-L430 HydrophobicContact CG2-CG 4.29Å; T86-L430 HydrophobicContact CG2-CD2 4.38Å; G307-L430 WeakPolarHBondContact O-CA 3.31Å; L430-S466 VanDerWaalsContact CD1-O 3.32Å; L430-S466 WeakPolarHBondContact CD1-O 3.41Å
431	G	91.6	Very high	87.6	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	166.8	-178.5	0	0	0	0	0	113.2	G307 V308 T309 N403 L467	G307-G431 PolarHBondContact O-N 2.76Å; G307-G431 VanDerWaalsContact O-N 3.14Å; V308-G431 CarbonylContact C-O 3.49Å; V308-G431 WeakPolarHBondContact CA-O 3.4Å; T309-G431 PolarHBondContact N-O 2.89Å; N403-G431 WeakPolarHBondContact O-CA 3.49Å; G431-L467 PolarHBondContact N-O 3.37Å
432	L	94.3	Very high	87.9	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	132.5	-171.5	-166.3	62.7	0	0	0	111.6	T309 Y311 L331 N403 V404 V405 I434 I463 Y468	T309-L432 HydrophobicContact CG2-CD1 3.96Å; Y311-L432 HydrophobicContact CD2-CD1 3.75Å; Y311-L432 HydrophobicContact CE2-CD1 3.8Å; L331-L432 HydrophobicContact CD1-CD2 4.16Å; L331-L432 HydrophobicContact CD2-CD2 3.67Å; N403-L432 PolarHBondContact O-N 2.72Å; V404-L432 CarbonylContact C-O 3.49Å; V404-L432 WeakPolarHBondContact CA-O 3.25Å; V404-L432 HydrophobicContact CG1-CB 4.44Å; V404-L432 HydrophobicContact CG1-CD2 4.48Å; V404-L432 HydrophobicContact CG2-CB 4.2Å; V404-L432 HydrophobicContact CG2-CD2 4.36Å; V405-L432 PolarHBondContact N-O 3.26Å; L432-I434 HydrophobicContact CD2-CD1 3.94Å; L432-I434 HydrophobicContact CD2-CG1 4.29Å; L432-I434 HydrophobicContact CG-CD1 4.26Å; L432-I434 HydrophobicContact CG-CG1 4.05Å; L432-I463 HydrophobicContact CD1-CG2 4.14Å; L432-I463 HydrophobicContact CD2-CD1 4.34Å; L432-I463 HydrophobicContact CD2-CG2 4.24Å; L432-Y468 HydrophobicContact CB-CD2 4.3Å; L432-Y468 HydrophobicContact CB-CG 3.97Å; L432-Y468 HydrophobicContact CD2-CD1 4.08Å; L432-Y468 HydrophobicContact CD2-CD2 4.19Å; L432-Y468 HydrophobicContact CD2-CE1 4.2Å; L432-Y468 HydrophobicContact CD2-CE2 4.32Å; L432-Y468 HydrophobicContact CD2-CG 4.11Å
433	A	95.4	Very high	88.6	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123	171.6	0	0	0	0	0	110.2	V308 T309 Q310 Y311 V405 I421	V308-A433 HydrophobicContact CG1-CB 3.78Å; T309-A433 PolarHBondContact O-N 3.17Å; Q310-A433 WeakPolarHBondContact CA-O 3.49Å; Q310-A433 HydrophobicContact CG-CB 4.21Å; Y311-A433 PolarHBondContact N-O 2.93Å; V405-A433 CarbonylContact O-C 3.57Å; V405-A433 WeakPolarHBondContact O-CA 3.4Å; I421-A433 HydrophobicContact CB-CB 4.17Å; I421-A433 HydrophobicContact CG2-CB 3.56Å
434	I	97.7	Very high	89.3	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	130.8	-179.8	-53.6	-175.6	0	0	0	110.9	L327 L331 V405 I406 N407 L432 I459 I463	L327-I434 HydrophobicContact CD1-CD1 4.26Å; L327-I434 HydrophobicContact CD1-CG2 3.84Å; L327-I434 HydrophobicContact CD2-CD1 3.83Å; L327-I434 HydrophobicContact CD2-CG2 4.45Å; L331-I434 HydrophobicContact CD1-CD1 3.62Å; V405-I434 PolarHBondContact O-N 3.44Å; I406-I434 CarbonylContact C-O 3.47Å; I406-I434 WeakPolarHBondContact CA-O 3.2Å; N407-I434 PolarHBondContact N-O 3Å; L432-I434 HydrophobicContact CD2-CD1 3.94Å; L432-I434 HydrophobicContact CD2-CG1 4.29Å; L432-I434 HydrophobicContact CG-CD1 4.26Å; L432-I434 HydrophobicContact CG-CG1 4.05Å; I434-I459 HydrophobicContact CD1-CD1 4.38Å; I434-I459 HydrophobicContact CG2-CD1 4.25Å; I434-I463 HydrophobicContact CD1-CD1 4.14Å
435	N	98.3	Very high	90.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121	-173.4	-61.7	-61.8	0	0	0	111.8	Y311 Y312 A313 N407 F410 Y417 I437	Y311-N435 WeakPolarHBondContact O-CB 3.42Å; Y311-N435 PolarHBondContact O-N 2.83Å; Y311-N435 PolarHBondContact O-ND2 2.77Å; Y312-N435 CarbonylContact C-O 3.41Å; Y312-N435 WeakPolarHBondContact CA-O 3.32Å; A313-N435 PolarHBondContact N-O 3.01Å; N407-N435 WeakPolarHBondContact CB-OD1 3.42Å; N407-N435 PolarHBondContact ND2-OD1 2.75Å; F410-N435 HydrophobicContact CD2-CB 3.93Å; F410-N435 HydrophobicContact CE2-CB 4Å; Y417-N435 WeakPolarHBondContact CE2-OD1 3.49Å; Y417-N435 PolarHBondContact OH-ND2 3.28Å; N435-I437 HydrophobicContact CB-CD1 4Å; N435-I437 HydrophobicContact CB-CG1 4.19Å; N435-I437 PolarHBondContact O-N 3.39Å
436	L	98.4	Very high	91.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	97.3	175.1	-60.4	-166	0	0	0	110.2	A313 V315 K320 C323 L327 N407 F408	A313-L436 HydrophobicContact CB-CD2 4.23Å; V315-L436 HydrophobicContact CG2-CB 3.82Å; V315-L436 HydrophobicContact CG2-CD2 4.39Å; K320-L436 HydrophobicContact CB-CD1 3.99Å; K320-L436 HydrophobicContact CD-CB 4.37Å; K320-L436 HydrophobicContact CD-CD1 4.47Å; K320-L436 HydrophobicContact CG-CB 4.26Å; K320-L436 HydrophobicContact CG-CD1 3.99Å; C323-L436 HydrophobicContact CB-CD2 4.45Å; L327-L436 HydrophobicContact CD1-CD2 4.36Å; N407-L436 PolarHBondContact O-N 2.85Å; F408-L436 HydrophobicContact CD2-CD1 3.7Å; F408-L436 HydrophobicContact CE2-CD1 4.24Å; F408-L436 HydrophobicContact CG-CD1 4.26Å
437	I	98.3	Very high	92.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	119.4	-169.8	-60	-59.7	0	0	0	110.6	Y312 A313 Y314 V315 F410 N435 D441 L445	Y312-I437 HydrophobicContact CD2-CG1 4.46Å; Y312-I437 HydrophobicContact CG-CG1 4.36Å; A313-I437 PolarHBondContact O-N 3.08Å; Y314-I437 WeakPolarHBondContact CA-O 3.26Å; Y314-I437 HydrophobicContact CD1-CB 4.15Å; Y314-I437 HydrophobicContact CD1-CG2 3.75Å; Y314-I437 HydrophobicContact CE1-CB 4.34Å; Y314-I437 HydrophobicContact CE1-CG2 3.52Å; V315-I437 PolarHBondContact N-O 2.79Å; F410-I437 HydrophobicContact CB-CD1 3.89Å; F410-I437 HydrophobicContact CD1-CD1 3.97Å; F410-I437 HydrophobicContact CD2-CD1 3.28Å; F410-I437 HydrophobicContact CE1-CD1 4.34Å; F410-I437 HydrophobicContact CE2-CD1 3.72Å; F410-I437 HydrophobicContact CG-CD1 3.43Å; F410-I437 VanDerWaalsContact CG-CD1 3.43Å; F410-I437 HydrophobicContact CZ-CD1 4.23Å; N435-I437 HydrophobicContact CB-CD1 4Å; N435-I437 HydrophobicContact CB-CG1 4.19Å; N435-I437 PolarHBondContact O-N 3.39Å; I437-D441 HydrophobicContact CD1-CB 4.25Å; I437-D441 HydrophobicContact CG2-CB 3.91Å; I437-L445 HydrophobicContact CD1-CB 4.39Å; I437-L445 HydrophobicContact CD1-CD1 4.1Å; I437-L445 HydrophobicContact CG1-CD1 4.47Å; I437-L445 HydrophobicContact CG1-CD2 4.29Å; I437-L445 HydrophobicContact CG2-CD2 4.39Å
438	T	97.9	Very high	93.4	Very high	14 Å²	14	39.9 Å²	39.9	9%	0.086	19%	0.189	C	C	.	.			trans	-83.8	179.1	169.2	70.3	0	0	0	0	111.5	V315 E317 D440 D441	V315-T438 WeakPolarHBondContact O-CA 3.2Å; E317-T438 HydrophobicContact CG-CG2 4.31Å; T438-D440 VanDerWaalsContact C-N 3.31Å; T438-D440 PolarHBondContact O-N 2.8Å; T438-D440 PolarHBondContact OG1-N 2.98Å; T438-D441 WeakPolarHBondContact CB-OD2 3.41Å; T438-D441 WeakPolarHBondContact CG2-OD2 3.17Å; T438-D441 PolarHBondContact N-OD2 2.57Å; T438-D441 PolarHBondContact O-N 2.98Å; T438-D441 VanDerWaalsContact OG1-CG 3.27Å; T438-D441 PolarHBondContact OG1-N 2.89Å; T438-D441 PolarHBondContact OG1-OD2 3.22Å
439	Y	95.8	Very high	94.3	Very high	155 Å²	155	40.6 Å²	40.6	61%	0.608	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-43.9	173.3	-171.9	-86.4	0	0	0	111.7	D441 R442	Y439-D441 PolarHBondContact O-N 2.66Å; Y439-R442 WeakPolarHBondContact O-CB 3.34Å; Y439-R442 WeakPolarHBondContact O-CD 3.42Å; Y439-R442 WeakPolarHBondContact O-CG 3.2Å; Y439-R442 PolarHBondContact O-N 3.41Å
440	D	95.4	Very high	94.7	Very high	115 Å²	115	48 Å²	48	62%	0.615	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-14.1	-175.3	-46.2	-41.9	0	0	0	112.8	T438 N444	T438-D440 VanDerWaalsContact C-N 3.31Å; T438-D440 PolarHBondContact O-N 2.8Å; T438-D440 PolarHBondContact OG1-N 2.98Å; D440-N444 PolarHBondContact O-ND2 2.88Å; D440-N444 VanDerWaalsContact O-ND2 3.1Å
441	D	96.8	Very high	94.7	Very high	9 Å²	9	51.2 Å²	51.2	5%	0.048	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-13.7	174.7	-64.7	-48.2	0	0	0	112.8	F410 K412 I437 T438 Y439 F443 N444 L445	F410-D441 HydrophobicContact CB-CB 4.16Å; F410-D441 HydrophobicContact CD1-CB 4.36Å; K412-D441 IonicContact NZ-OD1 3.14Å; K412-D441 PolarHBondContact NZ-OD1 3.42Å; I437-D441 HydrophobicContact CD1-CB 4.25Å; I437-D441 HydrophobicContact CG2-CB 3.91Å; T438-D441 WeakPolarHBondContact CB-OD2 3.41Å; T438-D441 WeakPolarHBondContact CG2-OD2 3.17Å; T438-D441 PolarHBondContact N-OD2 2.57Å; T438-D441 PolarHBondContact O-N 2.98Å; T438-D441 VanDerWaalsContact OG1-CG 3.27Å; T438-D441 PolarHBondContact OG1-N 2.89Å; T438-D441 PolarHBondContact OG1-OD2 3.22Å; Y439-D441 PolarHBondContact O-N 2.66Å; D441-F443 PolarHBondContact O-N 2.9Å; D441-N444 CarbonylContact O-C 3.49Å; D441-N444 WeakPolarHBondContact O-CA 3.39Å; D441-N444 WeakPolarHBondContact O-CB 3.35Å; D441-N444 PolarHBondContact O-N 2.93Å; D441-L445 PolarHBondContact O-N 2.84Å
442	R	94.8	Very high	94.4	Very high	102 Å²	102	51.6 Å²	51.6	39%	0.385	24%	0.243	S	C	.	.	H	α-helix	trans	-54.2	-47.9	-176.5	-73	171.6	179.2	-164.3	-0.9	114.4	Y314 Y439 N444 L445 K446	Y314-R442 HydrophobicContact CE1-CG 3.75Å; Y439-R442 WeakPolarHBondContact O-CB 3.34Å; Y439-R442 WeakPolarHBondContact O-CD 3.42Å; Y439-R442 WeakPolarHBondContact O-CG 3.2Å; Y439-R442 PolarHBondContact O-N 3.41Å; R442-N444 VanDerWaalsContact C-N 3.32Å; R442-L445 PolarHBondContact O-N 3.15Å; R442-K446 PolarHBondContact O-N 2.62Å
443	F	94.6	Very high	93.9	Very high	168 Å²	168	54.1 Å²	54.1	74%	0.737	27%	0.268	S	S	*	.	H	α-helix	trans	-65.7	-37.8	177.6	-63.1	-76.2	0	0	0	111.8	D441 A447	D441-F443 PolarHBondContact O-N 2.9Å; F443-A447 VanDerWaalsContact O-CB 3.28Å; F443-A447 WeakPolarHBondContact O-CB 3.36Å; F443-A447 PolarHBondContact O-N 2.87Å
444	N	95.4	Very high	93.5	Very high	38 Å²	38	55 Å²	55	20%	0.203	27%	0.274	C	S	.	.	H	α-helix	trans	-68.3	-38.9	177.8	-62.7	-83.9	0	0	0	111.2	F410 K412 D440 D441 R442 I448	F410-N444 HydrophobicContact CD1-CB 4.07Å; F410-N444 HydrophobicContact CE1-CB 4.1Å; K412-N444 HydrophobicContact CD-CB 4.34Å; K412-N444 VanDerWaalsContact CD-OD1 3.28Å; K412-N444 WeakPolarHBondContact CD-OD1 3.36Å; K412-N444 PolarHBondContact NZ-ND2 3.36Å; D440-N444 PolarHBondContact O-ND2 2.88Å; D440-N444 VanDerWaalsContact O-ND2 3.1Å; D441-N444 CarbonylContact O-C 3.49Å; D441-N444 WeakPolarHBondContact O-CA 3.39Å; D441-N444 WeakPolarHBondContact O-CB 3.35Å; D441-N444 PolarHBondContact O-N 2.93Å; R442-N444 VanDerWaalsContact C-N 3.32Å; N444-I448 VanDerWaalsContact O-CB 3.3Å; N444-I448 WeakPolarHBondContact O-CB 3.31Å; N444-I448 WeakPolarHBondContact O-CG1 3.32Å; N444-I448 PolarHBondContact O-N 3.16Å
445	L	95.4	Very high	92.9	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-57.9	-55.4	175.8	177.8	67.7	0	0	0	110.4	Y312 F410 I437 D441 R442 A447 I448 E449 I456	Y312-L445 HydrophobicContact CD1-CD2 3.97Å; Y312-L445 HydrophobicContact CD2-CD2 4.42Å; Y312-L445 HydrophobicContact CE1-CD2 4.23Å; Y312-L445 HydrophobicContact CG-CD2 4.08Å; F410-L445 HydrophobicContact CE1-CB 4.23Å; F410-L445 HydrophobicContact CE2-CD1 4.16Å; F410-L445 HydrophobicContact CZ-CB 4.36Å; F410-L445 HydrophobicContact CZ-CD1 3.84Å; I437-L445 HydrophobicContact CD1-CB 4.39Å; I437-L445 HydrophobicContact CD1-CD1 4.1Å; I437-L445 HydrophobicContact CG1-CD1 4.47Å; I437-L445 HydrophobicContact CG1-CD2 4.29Å; I437-L445 HydrophobicContact CG2-CD2 4.39Å; D441-L445 PolarHBondContact O-N 2.84Å; R442-L445 PolarHBondContact O-N 3.15Å; L445-A447 PolarHBondContact O-N 2.73Å; L445-I448 PolarHBondContact O-N 2.71Å; L445-E449 WeakPolarHBondContact O-CG 3.36Å; L445-E449 PolarHBondContact O-N 3.45Å; L445-I456 HydrophobicContact CD1-CB 4.18Å; L445-I456 HydrophobicContact CD1-CD1 3.76Å; L445-I456 HydrophobicContact CD1-CG2 4.19Å
446	K	94.4	Very high	92.7	Very high	123 Å²	123	61 Å²	61	54%	0.535	30%	0.302	S	S	.	.	H	α-helix	trans	-66	-40.3	-178.1	-75.5	-73.1	158.2	-146.2	0	113	R442 I448 E449 E450	R442-K446 PolarHBondContact O-N 2.62Å; K446-I448 VanDerWaalsContact C-N 3.28Å; K446-I448 PolarHBondContact O-N 2.66Å; K446-E449 VanDerWaalsContact CD-OE2 3.28Å; K446-E449 WeakPolarHBondContact CD-OE2 3.31Å; K446-E449 WeakPolarHBondContact CE-OE2 3.49Å; K446-E449 IonicContact NZ-OE1 2.67Å; K446-E449 PolarHBondContact NZ-OE1 3.14Å; K446-E449 VanDerWaalsContact NZ-OE1 3.14Å; K446-E449 IonicContact NZ-OE2 3.98Å; K446-E449 PolarHBondContact NZ-OE2 2.93Å; K446-E449 PolarHBondContact O-N 3.12Å; K446-E450 WeakPolarHBondContact O-CB 3.34Å; K446-E450 PolarHBondContact O-N 2.93Å
447	A	93.8	Very high	92.6	Very high	53 Å²	53	65.5 Å²	65.5	44%	0.438	32%	0.321	S	S	.	.	H	α-helix	trans	-63.3	-32.3	174.7	0	0	0	0	0	113	F443 L445 Q451	F443-A447 VanDerWaalsContact O-CB 3.28Å; F443-A447 WeakPolarHBondContact O-CB 3.36Å; F443-A447 PolarHBondContact O-N 2.87Å; L445-A447 PolarHBondContact O-N 2.73Å; A447-Q451 WeakPolarHBondContact O-CB 3.31Å; A447-Q451 PolarHBondContact O-N 2.99Å
448	I	93.1	Very high	92.5	Very high	3 Å²	3	69.4 Å²	69.4	2%	0.015	35%	0.347	C	S	.	.	H	α-helix	trans	-79.9	-36.6	177.5	-71.3	-178.9	0	0	0	111.9	F410 P411 Y417 N444 L445 K446 L452	F410-I448 HydrophobicContact CE1-CD1 3.81Å; F410-I448 HydrophobicContact CZ-CB 4.48Å; F410-I448 HydrophobicContact CZ-CD1 4.16Å; F410-I448 HydrophobicContact CZ-CG2 4.5Å; P411-I448 HydrophobicContact CG-CD1 4.39Å; Y417-I448 HydrophobicContact CD1-CG2 3.81Å; Y417-I448 HydrophobicContact CD2-CG2 4.32Å; Y417-I448 HydrophobicContact CE1-CG2 4.41Å; Y417-I448 HydrophobicContact CG-CG2 3.76Å; N444-I448 VanDerWaalsContact O-CB 3.3Å; N444-I448 WeakPolarHBondContact O-CB 3.31Å; N444-I448 WeakPolarHBondContact O-CG1 3.32Å; N444-I448 PolarHBondContact O-N 3.16Å; L445-I448 PolarHBondContact O-N 2.71Å; K446-I448 VanDerWaalsContact C-N 3.28Å; K446-I448 PolarHBondContact O-N 2.66Å; I448-L452 HydrophobicContact CG2-CD1 3.76Å; I448-L452 HydrophobicContact CG2-CG 4.4Å; I448-L452 WeakPolarHBondContact O-CB 3.17Å; I448-L452 VanDerWaalsContact O-CG 3.32Å; I448-L452 WeakPolarHBondContact O-CG 3.3Å; I448-L452 PolarHBondContact O-N 3.25Å; I448-L452 VanDerWaalsContact O-N 3.13Å
449	E	91.2	Very high	92.5	Very high	16 Å²	16	71.3 Å²	71.3	8%	0.075	36%	0.356	C	S	.	.	H	α-helix	trans	-57.4	-51.3	169.1	-75.4	176.7	105.3	0	0	111	L445 K446 G453 T454 I456	L445-E449 WeakPolarHBondContact O-CG 3.36Å; L445-E449 PolarHBondContact O-N 3.45Å; K446-E449 VanDerWaalsContact CD-OE2 3.28Å; K446-E449 WeakPolarHBondContact CD-OE2 3.31Å; K446-E449 WeakPolarHBondContact CE-OE2 3.49Å; K446-E449 IonicContact NZ-OE1 2.67Å; K446-E449 PolarHBondContact NZ-OE1 3.14Å; K446-E449 VanDerWaalsContact NZ-OE1 3.14Å; K446-E449 IonicContact NZ-OE2 3.98Å; K446-E449 PolarHBondContact NZ-OE2 2.93Å; K446-E449 PolarHBondContact O-N 3.12Å; E449-G453 WeakPolarHBondContact O-CA 3.48Å; E449-G453 PolarHBondContact O-N 3.42Å; E449-T454 WeakPolarHBondContact CA-O 3.38Å; E449-T454 VanDerWaalsContact CB-O 3.24Å; E449-T454 WeakPolarHBondContact CB-O 3.28Å; E449-T454 WeakPolarHBondContact CG-O 2.79Å; E449-T454 PolarHBondContact O-N 3.38Å; E449-I456 HydrophobicContact CG-CB 4.12Å; E449-I456 HydrophobicContact CG-CD1 3.86Å; E449-I456 HydrophobicContact CG-CG1 3.82Å; E449-I456 PolarHBondContact OE1-N 3.22Å; E449-I456 VanDerWaalsContact OE1-N 3.12Å
450	E	89.8	Confident	92.4	Very high	167 Å²	167	66.4 Å²	66.4	78%	0.78	34%	0.343	S	S	*	.	H	α-helix	trans	-64.1	-49.9	178.6	-173.5	178.9	-178.3	0	0	112.2	K446 L452 G453	K446-E450 WeakPolarHBondContact O-CB 3.34Å; K446-E450 PolarHBondContact O-N 2.93Å; E450-L452 VanDerWaalsContact C-N 3.26Å; E450-L452 PolarHBondContact O-N 2.92Å; E450-G453 PolarHBondContact O-N 2.92Å
451	Q	86.4	Confident	92.2	Very high	111 Å²	111	63.8 Å²	63.8	52%	0.519	34%	0.343	S	S	.	.	H	α-helix	trans	-59.7	-34.7	-178.9	179.6	177.4	35.1	0	0	113.1	L303 G414 A447	L303-Q451 VanDerWaalsContact CD1-O 3.31Å; L303-Q451 WeakPolarHBondContact CD1-O 3.48Å; G414-Q451 VanDerWaalsContact CA-OE1 3.31Å; G414-Q451 VanDerWaalsContact N-OE1 3.12Å; A447-Q451 WeakPolarHBondContact O-CB 3.31Å; A447-Q451 PolarHBondContact O-N 2.99Å
452	L	84.7	Confident	91.9	Very high	8 Å²	8	70.7 Å²	70.7	4%	0.042	38%	0.378	C	S	.	.	H	α-helix	trans	-95.2	-12.3	-177.3	-60.1	178.1	0	0	0	113.3	L303 T304 Y417 L418 I448 E450 T454	L303-L452 HydrophobicContact CB-CB 4.26Å; L303-L452 HydrophobicContact CB-CD2 3.91Å; L303-L452 WeakPolarHBondContact CB-O 3.2Å; L303-L452 HydrophobicContact CD1-CD2 4.39Å; T304-L452 WeakPolarHBondContact CG2-O 3.5Å; Y417-L452 HydrophobicContact CD1-CD1 3.56Å; Y417-L452 HydrophobicContact CE1-CD1 4.2Å; Y417-L452 HydrophobicContact CG-CD1 4.49Å; L418-L452 HydrophobicContact CB-CD2 4.45Å; I448-L452 HydrophobicContact CG2-CD1 3.76Å; I448-L452 HydrophobicContact CG2-CG 4.4Å; I448-L452 WeakPolarHBondContact O-CB 3.17Å; I448-L452 VanDerWaalsContact O-CG 3.32Å; I448-L452 WeakPolarHBondContact O-CG 3.3Å; I448-L452 PolarHBondContact O-N 3.25Å; I448-L452 VanDerWaalsContact O-N 3.13Å; E450-L452 VanDerWaalsContact C-N 3.26Å; E450-L452 PolarHBondContact O-N 2.92Å; L452-T454 HydrophobicContact CB-CG2 4.26Å
453	G	85	Confident	91.9	Very high	52 Å²	52	66.8 Å²	66.8	54%	0.536	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	40.4	-169.8	0	0	0	0	0	112.2	E449 E450	E449-G453 WeakPolarHBondContact O-CA 3.48Å; E449-G453 PolarHBondContact O-N 3.42Å; E450-G453 PolarHBondContact O-N 2.92Å
454	T	86.4	Confident	91.7	Very high	19 Å²	19	63.1 Å²	63.1	12%	0.117	35%	0.353	C	S	.	.			trans	-123.5	145.8	-173.4	-145.3	0	0	0	0	112.7	T304 Q310 E449 L452 I456	T304-T454 VanDerWaalsContact CG2-CB 3.43Å; T304-T454 WeakPolarHBondContact CG2-OG1 2.95Å; Q310-T454 PolarHBondContact NE2-OG1 2.95Å; E449-T454 WeakPolarHBondContact CA-O 3.38Å; E449-T454 VanDerWaalsContact CB-O 3.24Å; E449-T454 WeakPolarHBondContact CB-O 3.28Å; E449-T454 WeakPolarHBondContact CG-O 2.79Å; E449-T454 PolarHBondContact O-N 3.38Å; L452-T454 HydrophobicContact CB-CG2 4.26Å; T454-I456 HydrophobicContact CG2-CD1 4.33Å; T454-I456 HydrophobicContact CG2-CG1 3.97Å
455	E	85.4	Confident	91.5	Very high	122 Å²	122	64.8 Å²	64.8	57%	0.57	36%	0.358	S	S	*	.			trans	-97.7	120.5	172.6	-166	-170.5	172.9	0	0	109.5	K457	E455-K457 HydrophobicContact CG-CG 4.18Å; E455-K457 WeakPolarHBondContact OE1-CE 3.42Å; E455-K457 IonicContact OE1-NZ 2.73Å; E455-K457 WeakPolarHBondContact OE2-CE 3.24Å; E455-K457 IonicContact OE2-NZ 2.69Å; E455-K457 PolarHBondContact OE2-NZ 3.5Å
456	I	94.3	Very high	91.2	Very high	3 Å²	3	66.2 Å²	66.2	2%	0.015	37%	0.369	C	S	.	.			trans	-105.8	107.6	172.9	-55.6	172.5	0	0	0	106.8	Q310 Y312 Y417 L445 E449 T454	Q310-I456 HydrophobicContact CB-CG1 4.24Å; Q310-I456 HydrophobicContact CB-CG2 4.31Å; Y312-I456 HydrophobicContact CD1-CG2 4.03Å; Y312-I456 WeakPolarHBondContact CD1-O 3.34Å; Y312-I456 WeakPolarHBondContact CE1-O 3.22Å; Y417-I456 HydrophobicContact CE1-CD1 4.14Å; Y417-I456 HydrophobicContact CE2-CD1 4.12Å; Y417-I456 VanDerWaalsContact OH-CD1 3.31Å; Y417-I456 WeakPolarHBondContact OH-CD1 3.17Å; L445-I456 HydrophobicContact CD1-CB 4.18Å; L445-I456 HydrophobicContact CD1-CD1 3.76Å; L445-I456 HydrophobicContact CD1-CG2 4.19Å; E449-I456 HydrophobicContact CG-CB 4.12Å; E449-I456 HydrophobicContact CG-CD1 3.86Å; E449-I456 HydrophobicContact CG-CG1 3.82Å; E449-I456 PolarHBondContact OE1-N 3.22Å; E449-I456 VanDerWaalsContact OE1-N 3.12Å; T454-I456 HydrophobicContact CG2-CD1 4.33Å; T454-I456 HydrophobicContact CG2-CG1 3.97Å
457	K	95.4	Very high	91	Very high	95 Å²	95	62.7 Å²	62.7	41%	0.413	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	150.4	-169.7	-74.6	175.3	177.7	169	0	112.1	Q310 Y311 Y312 E455 I459	Q310-K457 PolarHBondContact O-N 3Å; Y311-K457 CarbonylContact C-O 3.56Å; Y311-K457 WeakPolarHBondContact CA-O 3.49Å; Y311-K457 HydrophobicContact CD1-CB 3.69Å; Y311-K457 HydrophobicContact CE1-CB 3.85Å; Y312-K457 WeakPolarHBondContact CD1-O 3.36Å; Y312-K457 PolarHBondContact N-O 2.76Å; E455-K457 HydrophobicContact CG-CG 4.18Å; E455-K457 WeakPolarHBondContact OE1-CE 3.42Å; E455-K457 IonicContact OE1-NZ 2.73Å; E455-K457 WeakPolarHBondContact OE2-CE 3.24Å; E455-K457 IonicContact OE2-NZ 2.69Å; E455-K457 PolarHBondContact OE2-NZ 3.5Å; K457-I459 PolarHBondContact O-N 3.13Å
458	P	97.1	Very high	90.7	Very high	82 Å²	82	60.4 Å²	60.4	53%	0.532	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	138.4	164.7	27.3	-33.8	0	0	0	109.2	Y312 P460	Y312-P458 HydrophobicContact CE1-CB 4.26Å; Y312-P458 HydrophobicContact CE2-CB 4.33Å; P458-P460 WeakPolarHBondContact O-CD 3.12Å
459	I	96.5	Very high	90.4	Very high	55 Å²	55	60.6 Å²	60.6	28%	0.282	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-63.2	125.3	-177.9	-166.7	170.8	0	0	0	111.1	Y311 Y312 A313 L327 I434 K457 I463	Y311-I459 HydrophobicContact CG-CG1 4.49Å; Y312-I459 WeakPolarHBondContact O-CB 3.48Å; Y312-I459 WeakPolarHBondContact O-CG2 3.44Å; Y312-I459 PolarHBondContact O-N 3.19Å; A313-I459 HydrophobicContact CB-CG2 3.91Å; L327-I459 HydrophobicContact CD2-CD1 3.67Å; I434-I459 HydrophobicContact CD1-CD1 4.38Å; I434-I459 HydrophobicContact CG2-CD1 4.25Å; K457-I459 PolarHBondContact O-N 3.13Å; I459-I463 HydrophobicContact CD1-CD1 3.98Å; I459-I463 HydrophobicContact CG1-CD1 3.92Å; I459-I463 HydrophobicContact CG1-CG1 4.45Å
460	P	95.2	Very high	90	Very high	51 Å²	51	62 Å²	62	33%	0.331	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-74	162.9	176.9	30.9	-36.3	0	0	0	111.4	Y311 P458 I462 I463	Y311-P460 HydrophobicContact CE1-CG 4.02Å; Y311-P460 HydrophobicContact CE2-CG 4.49Å; P458-P460 WeakPolarHBondContact O-CD 3.12Å; P460-I462 WeakPolarHBondContact CB-O 3.28Å; P460-I462 VanDerWaalsContact CG-O 3.25Å; P460-I462 WeakPolarHBondContact CG-O 3.46Å; P460-I462 PolarHBondContact O-N 3.25Å; P460-I463 HydrophobicContact CG-CG1 3.78Å
461	G	89.8	Confident	89.7	Confident	60 Å²	60	60.1 Å²	60.1	62%	0.619	34%	0.342	S	S	*	.	S	Bend	trans	-61.7	-30.5	178.5	0	0	0	0	0	113.8	R330	R330-G461 PolarHBondContact NH1-O 3.11Å
462	I	91.3	Very high	89.4	Confident	154 Å²	154	58.3 Å²	58.3	79%	0.79	33%	0.331	S	S	*	.	S	Bend	trans	-133.5	136.3	172.6	-58.2	175.9	0	0	0	106.7	P460	P460-I462 WeakPolarHBondContact CB-O 3.28Å; P460-I462 VanDerWaalsContact CG-O 3.25Å; P460-I462 WeakPolarHBondContact CG-O 3.46Å; P460-I462 PolarHBondContact O-N 3.25Å
463	I	93.9	Very high	89	Confident	21 Å²	21	58.8 Å²	58.8	11%	0.108	33%	0.333	C	S	.	.			trans	-102.7	129.6	173.4	-66.6	166.1	0	0	0	107.8	Y311 L331 L432 I434 I459 P460 Y468	Y311-I463 HydrophobicContact CD2-CD1 3.88Å; Y311-I463 HydrophobicContact CD2-CG1 4.19Å; Y311-I463 HydrophobicContact CE2-CD1 4.01Å; Y311-I463 HydrophobicContact CE2-CG1 3.83Å; Y311-I463 HydrophobicContact CE2-CG2 3.92Å; L331-I463 HydrophobicContact CD2-CB 4.44Å; L331-I463 HydrophobicContact CD2-CD1 4.02Å; L432-I463 HydrophobicContact CD1-CG2 4.14Å; L432-I463 HydrophobicContact CD2-CD1 4.34Å; L432-I463 HydrophobicContact CD2-CG2 4.24Å; I434-I463 HydrophobicContact CD1-CD1 4.14Å; I459-I463 HydrophobicContact CD1-CD1 3.98Å; I459-I463 HydrophobicContact CG1-CD1 3.92Å; I459-I463 HydrophobicContact CG1-CG1 4.45Å; P460-I463 HydrophobicContact CG-CG1 3.78Å; I463-Y468 HydrophobicContact CG2-CD1 4.39Å; I463-Y468 HydrophobicContact CG2-CE1 4Å
464	D	91.9	Very high	87.8	Confident	90 Å²	90	60.4 Å²	60.4	48%	0.481	34%	0.337	S	S	.	.			trans	-63.8	136.1	175.5	-179.4	9.2	0	0	0	111.2	S466 L467 Y468	D464-S466 PolarHBondContact OD1-N 3.46Å; D464-S466 PolarHBondContact OD1-OG 2.92Å; D464-S466 WeakPolarHBondContact OD2-CB 3.47Å; D464-S466 PolarHBondContact OD2-OG 2.96Å; D464-L467 HydrophobicContact CB-CD1 4.04Å; D464-L467 HydrophobicContact CB-CG 4.13Å; D464-Y468 WeakPolarHBondContact O-CD1 3.37Å; D464-Y468 VanDerWaalsContact O-CE1 3.31Å; D464-Y468 WeakPolarHBondContact O-CE1 3.41Å
465	K	90.9	Very high	85.9	Confident	73 Å²	73	65.9 Å²	65.9	32%	0.317	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-71.7	-29.9	178	-63.4	-171.2	-177.5	-169.2	0	112.7	L467 Y468 V469 Y472	K465-L467 PolarHBondContact O-N 3.37Å; K465-Y468 PolarHBondContact O-N 2.71Å; K465-Y468 VanDerWaalsContact O-N 3.08Å; K465-V469 HydrophobicContact CB-CB 4.2Å; K465-V469 HydrophobicContact CB-CG2 3.94Å; K465-V469 HydrophobicContact CG-CG2 4.39Å; K465-V469 WeakPolarHBondContact O-CB 3.28Å; K465-V469 WeakPolarHBondContact O-CG2 3.34Å; K465-V469 PolarHBondContact O-N 2.95Å; K465-Y472 HydrophobicContact CB-CD1 4.39Å; K465-Y472 HydrophobicContact CB-CD2 3.74Å; K465-Y472 HydrophobicContact CB-CE2 4.13Å; K465-Y472 HydrophobicContact CB-CG 3.88Å; K465-Y472 HydrophobicContact CD-CD1 4.48Å; K465-Y472 HydrophobicContact CD-CD2 3.79Å; K465-Y472 HydrophobicContact CD-CE1 4.05Å; K465-Y472 HydrophobicContact CD-CE2 3.27Å; K465-Y472 HydrophobicContact CD-CG 4.36Å; K465-Y472 VanDerWaalsContact CD-CZ 3.42Å; K465-Y472 HydrophobicContact CG-CD2 4.47Å; K465-Y472 HydrophobicContact CG-CE2 4.38Å; K465-Y472 PolarHBondContact NZ-OH 3.39Å
466	S	89.4	Confident	83.9	Confident	33 Å²	33	65.2 Å²	65.2	23%	0.231	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-55.2	-25.9	178.8	79.4	0	0	0	0	112.7	L430 D464 Y468 H473	L430-S466 VanDerWaalsContact CD1-O 3.32Å; L430-S466 WeakPolarHBondContact CD1-O 3.41Å; D464-S466 PolarHBondContact OD1-N 3.46Å; D464-S466 PolarHBondContact OD1-OG 2.92Å; D464-S466 WeakPolarHBondContact OD2-CB 3.47Å; D464-S466 PolarHBondContact OD2-OG 2.96Å; S466-Y468 VanDerWaalsContact C-N 3.34Å; S466-Y468 PolarHBondContact O-N 3.06Å; S466-H473 PolarHBondContact O-CD2 3.48Å; S466-H473 PolarHBondContact O-NE2 3.1Å
467	L	88.7	Confident	81.2	Confident	49 Å²	49	68.2 Å²	68.2	26%	0.257	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-78.3	-10.4	-176.6	-56.3	177.8	0	0	0	114.5	T309 G431 D464 K465	T309-L467 HydrophobicContact CG2-CD1 4.09Å; G431-L467 PolarHBondContact N-O 3.37Å; D464-L467 HydrophobicContact CB-CD1 4.04Å; D464-L467 HydrophobicContact CB-CG 4.13Å; K465-L467 PolarHBondContact O-N 3.37Å
468	Y	88.9	Confident	78.2	Confident	5 Å²	5	72.1 Å²	72.1	2%	0.02	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-160.6	3.1	-175	73.4	-74.3	0	0	0	116.3	L331 Q332 N403 V404 L432 I463 D464 K465 S466	L331-Y468 WeakPolarHBondContact CA-OH 3.47Å; L331-Y468 HydrophobicContact CB-CE2 4.44Å; L331-Y468 HydrophobicContact CD2-CE1 4.44Å; L331-Y468 HydrophobicContact CD2-CE2 4.38Å; L331-Y468 WeakPolarHBondContact CD2-OH 3.09Å; Q332-Y468 PolarHBondContact N-OH 3.25Å; N403-Y468 WeakPolarHBondContact CB-O 3.48Å; N403-Y468 WeakPolarHBondContact ND2-CD2 3.33Å; N403-Y468 PolarHBondContact ND2-O 3.08Å; V404-Y468 HydrophobicContact CG2-CD2 3.75Å; V404-Y468 HydrophobicContact CG2-CE2 4.04Å; L432-Y468 HydrophobicContact CB-CD2 4.3Å; L432-Y468 HydrophobicContact CB-CG 3.97Å; L432-Y468 HydrophobicContact CD2-CD1 4.08Å; L432-Y468 HydrophobicContact CD2-CD2 4.19Å; L432-Y468 HydrophobicContact CD2-CE1 4.2Å; L432-Y468 HydrophobicContact CD2-CE2 4.32Å; L432-Y468 HydrophobicContact CD2-CG 4.11Å; I463-Y468 HydrophobicContact CG2-CD1 4.39Å; I463-Y468 HydrophobicContact CG2-CE1 4Å; D464-Y468 WeakPolarHBondContact O-CD1 3.37Å; D464-Y468 VanDerWaalsContact O-CE1 3.31Å; D464-Y468 WeakPolarHBondContact O-CE1 3.41Å; K465-Y468 PolarHBondContact O-N 2.71Å; K465-Y468 VanDerWaalsContact O-N 3.08Å; S466-Y468 VanDerWaalsContact C-N 3.34Å; S466-Y468 PolarHBondContact O-N 3.06Å
469	V	87	Confident	75.2	Confident	6 Å²	6	77.1 Å²	77.1	4%	0.036	43%	0.433	C	S	.	.			trans	-123.1	107.7	-175.4	-171.5	0	0	0	0	110.1	Q332 K465 E471 Y472 H473	Q332-V469 HydrophobicContact CB-CG2 3.94Å; Q332-V469 HydrophobicContact CG-CG1 4.14Å; Q332-V469 HydrophobicContact CG-CG2 4.36Å; K465-V469 HydrophobicContact CB-CB 4.2Å; K465-V469 HydrophobicContact CB-CG2 3.94Å; K465-V469 HydrophobicContact CG-CG2 4.39Å; K465-V469 WeakPolarHBondContact O-CB 3.28Å; K465-V469 WeakPolarHBondContact O-CG2 3.34Å; K465-V469 PolarHBondContact O-N 2.95Å; V469-E471 HydrophobicContact CG1-CB 4.44Å; V469-E471 PolarHBondContact O-N 2.81Å; V469-Y472 HydrophobicContact CB-CD2 3.85Å; V469-Y472 HydrophobicContact CG1-CD2 3.65Å; V469-Y472 HydrophobicContact CG1-CE2 4.06Å; V469-Y472 PolarHBondContact O-N 3.01Å; V469-H473 PolarHBondContact O-CD2 3.46Å; V469-H473 PolarHBondContact O-NE2 3.34Å
470	A	82	Confident	72.3	Confident	46 Å²	46	80.8 Å²	80.8	38%	0.38	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-49.3	-33.4	-174.2	0	0	0	0	0	115.8	R83 H473	R83-A470 HydrophobicContact CG-CB 3.83Å; A470-H473 WeakPolarHBondContact O-CB 3.2Å; A470-H473 PolarHBondContact O-N 2.99Å
471	E	82.8	Confident	69.5	Low	127 Å²	127	87.7 Å²	87.7	59%	0.593	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-63.1	-40.3	179.1	-66	151.9	-167.6	0	0	111.9	Q332 V469 H473	Q332-E471 PolarHBondContact NE2-OE2 3.42Å; V469-E471 HydrophobicContact CG1-CB 4.44Å; V469-E471 PolarHBondContact O-N 2.81Å; E471-H473 PolarHBondContact O-N 3.04Å
472	Y	80.4	Confident	66.7	Low	73 Å²	73	98 Å²	98	29%	0.286	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-81.4	3.6	-179	-65.9	-88.2	0	0	0	113.1	K465 V469 S474 E475	K465-Y472 HydrophobicContact CB-CD1 4.39Å; K465-Y472 HydrophobicContact CB-CD2 3.74Å; K465-Y472 HydrophobicContact CB-CE2 4.13Å; K465-Y472 HydrophobicContact CB-CG 3.88Å; K465-Y472 HydrophobicContact CD-CD1 4.48Å; K465-Y472 HydrophobicContact CD-CD2 3.79Å; K465-Y472 HydrophobicContact CD-CE1 4.05Å; K465-Y472 HydrophobicContact CD-CE2 3.27Å; K465-Y472 HydrophobicContact CD-CG 4.36Å; K465-Y472 VanDerWaalsContact CD-CZ 3.42Å; K465-Y472 HydrophobicContact CG-CD2 4.47Å; K465-Y472 HydrophobicContact CG-CE2 4.38Å; K465-Y472 PolarHBondContact NZ-OH 3.39Å; V469-Y472 HydrophobicContact CB-CD2 3.85Å; V469-Y472 HydrophobicContact CG1-CD2 3.65Å; V469-Y472 HydrophobicContact CG1-CE2 4.06Å; V469-Y472 PolarHBondContact O-N 3.01Å; Y472-S474 VanDerWaalsContact C-N 3.32Å; Y472-E475 VanDerWaalsContact CD1-OE2 3.29Å; Y472-E475 WeakPolarHBondContact CD1-OE2 3.34Å
473	H	77.8	Confident	65.5	Low	19 Å²	19	95.2 Å²	95.2	9%	0.088	50%	0.5	C	S	.	.	G	3₁₀ helix	trans	-82.4	-11.7	174.3	-62.4	-175.2	0	0	0	112.5	I84 S466 V469 A470 E471	I84-H473 HydrophobicContact CB-CB 4.44Å; I84-H473 HydrophobicContact CD1-CB 3.72Å; I84-H473 HydrophobicContact CG1-CB 3.94Å; S466-H473 PolarHBondContact O-CD2 3.48Å; S466-H473 PolarHBondContact O-NE2 3.1Å; V469-H473 PolarHBondContact O-CD2 3.46Å; V469-H473 PolarHBondContact O-NE2 3.34Å; A470-H473 WeakPolarHBondContact O-CB 3.2Å; A470-H473 PolarHBondContact O-N 2.99Å; E471-H473 PolarHBondContact O-N 3.04Å
474	S	58.1	Low	64	Low	86 Å²	86	99.1 Å²	99.1	60%	0.601	52%	0.521	S	S	*	.	S	Bend	trans	-95.1	-28.4	-175.6	-57.5	0	0	0	0	113.8	Y472 T476	Y472-S474 VanDerWaalsContact C-N 3.32Å; S474-T476 PolarHBondContact O-N 3.24Å
475	E	48.1	Very low	62.5	Low	133 Å²	133	99.6 Å²	99.6	62%	0.621	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-72.2	-28.6	-170.9	-62.5	177.8	145.3	0	0	112.8	Y472 G477	Y472-E475 VanDerWaalsContact CD1-OE2 3.29Å; Y472-E475 WeakPolarHBondContact CD1-OE2 3.34Å; E475-G477 PolarHBondContact O-N 3.33Å
476	T	43.3	Very low	60.8	Low	109 Å²	109	101.2 Å²	101.2	67%	0.669	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-78.1	5.5	-178.5	49.5	0	0	0	0	114.6	S474	S474-T476 PolarHBondContact O-N 3.24Å
477	G	36.3	Very low	59	Low	65 Å²	65	105.4 Å²	105.4	67%	0.67	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-90.4	-22.3	-177.1	0	0	0	0	0	116.2	E475	E475-G477 PolarHBondContact O-N 3.33Å
478	E	33.7	Very low	57	Low	178 Å²	178	109.2 Å²	109.2	83%	0.832	57%	0.574	S	S	*	*	S	Bend	trans	-109.6	-18.3	-165.4	-61.1	-164	141.2	0	0	115.3	V480	E478-V480 VanDerWaalsContact C-N 3.28Å; E478-V480 PolarHBondContact O-N 2.67Å; E478-V480 VanDerWaalsContact O-N 3.16Å
479	E	33.8	Very low	54.7	Low	187 Å²	187	116.6 Å²	116.6	87%	0.874	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	9.8	-173.4	-66.3	-161.3	135.1	0	0	116.2
480	V	35.9	Very low	52.3	Low	132 Å²	132	125.2 Å²	125.2	80%	0.8	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	41.6	-179.6	-158.2	0	0	0	0	112.9	E478	E478-V480 VanDerWaalsContact C-N 3.28Å; E478-V480 PolarHBondContact O-N 2.67Å; E478-V480 VanDerWaalsContact O-N 3.16Å
481	K	35.3	Very low	49.8	Very low	195 Å²	195	131.8 Å²	131.8	85%	0.848	68%	0.681	S	S	*	*			trans	-147.3	78.9	161.8	-76.4	-163.5	178.2	175	0	113.4
482	Q	31.9	Very low	46.8	Very low	277 Å²	277	132.2 Å²	132.2	100%	1.294	69%	0.689	S	S	*	*			trans	-135	0	147.8	-70.5	-164.8	0.4	0	0	108.7

Retrieved 482 of 482 residues in 339.9 ms (Link to these results)

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