A0A096NBV1_PAPAN Loading...

Ubl carboxyl-terminal hydrolase 18

Interferon-induced ISG15-specific protease that plays a crucial role for maintaining a proper balance of ISG15-conjugated proteins in cells. Regulates protein ISGylation by efficiently cleaving ISG15 conjugates linked via isopeptide bonds. Regulates T-cell activation and T-helper 17 (Th17) cell differentiation by deubiquitinating TAK1, likely to keep TAK1-TAB complexes in steady conditions. In turn, restricts activation of NF-kappa-B, NFAT, and JNK as well as expression of IL2 in T-cells after TCR activation. Acts as a molecular adapter with USP20 to promote innate antiviral response through deubiquitinating STING1. Involved also in the negative regulation of the inflammatory response triggered by type I interferon. Upon recruitment by STAT2 to the type I interferon receptor subunit IFNAR2 interferes with the assembly of the ternary interferon-IFNAR1-IFNAR2 complex and acts as a negative regulator of the type I interferon signaling pathway.

AlphaFold DB , UniProt , Accession A0A096NBV1, Species PAPAN (Papio anubis, Olive baboon), Gene USP18, Length 374 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	33.4	Very low	26.1	Very low	254 Å²	254	164.6 Å²	164.6	100%	1.251	85%	0.85	S	S	*	*				0	129.4	0	-66.8	154.8	164	0	0	107.6
2	G	27.7	Very low	25.8	Very low	71 Å²	71	162.3 Å²	162.3	73%	0.732	86%	0.856	S	S	*	*			cis	170.9	130.4	-12.2	0	0	0	0	0	112.7
3	K	27.2	Very low	25.7	Very low	200 Å²	200	165.1 Å²	165.1	87%	0.87	86%	0.856	S	S	*	*			trans	63.3	129	163.2	-58	178.7	179.1	179.1	0	117.2
4	V	24.2	Very low	25.9	Very low	130 Å²	130	160.4 Å²	160.4	79%	0.788	85%	0.845	S	S	*	*			cis	80.2	107.5	34	-177	0	0	0	0	115.2
5	F	26.5	Very low	25.7	Very low	207 Å²	207	161.3 Å²	161.3	91%	0.908	85%	0.85	S	S	*	*			trans	-161.5	144.9	136.3	-89.4	-76.5	0	0	0	105.4
6	G	24.4	Very low	25.7	Very low	65 Å²	65	161.8 Å²	161.8	67%	0.67	85%	0.853	S	S	*	*			cis	103.4	140.3	21	0	0	0	0	0	110.6
7	L	25.5	Very low	25.6	Very low	157 Å²	157	156.9 Å²	156.9	82%	0.822	84%	0.841	S	S	*	*			cis	-169	120.6	-3.2	-174.1	103.3	0	0	0	112.8
8	K	25.4	Very low	25.6	Very low	194 Å²	194	158.9 Å²	158.9	84%	0.843	85%	0.845	S	S	*	*			trans	167.7	156.4	150.9	-91.3	157.5	-162	-176.4	0	108.3
9	R	24.4	Very low	25.7	Very low	221 Å²	221	156.1 Å²	156.1	83%	0.834	84%	0.839	S	S	*	*			cis	93.2	111.6	8.8	-72.2	-168.2	174.3	-175.2	-0.4	118.9
10	Q	24.3	Very low	26.2	Very low	194 Å²	194	153.2 Å²	153.2	91%	0.907	83%	0.829	S	S	*	*				-145.6	141.1	119.5	-147.7	161	2.6	0	0	110.9
11	T	24.2	Very low	26.2	Very low	118 Å²	118	154.4 Å²	154.4	72%	0.724	83%	0.829	S	S	*	*			trans	-148.4	141	-175	45.1	0	0	0	0	108.5
12	C	22.6	Very low	25.8	Very low	136 Å²	136	147.5 Å²	147.5	92%	0.919	81%	0.805	S	S	*	*			trans	-129.6	136	162	-81.3	0	0	0	0	110.3
13	K	24.8	Very low	25.6	Very low	199 Å²	199	152.1 Å²	152.1	87%	0.865	81%	0.812	S	S	*	*			trans	-129.7	143.6	175.1	-106.3	-168	177.2	-171.8	0	107.9
14	S	28	Very low	25.5	Very low	100 Å²	100	146.6 Å²	146.6	70%	0.699	80%	0.804	S	S	*	*			trans	28.6	140.1	146.9	61.5	0	0	0	0	121.2
15	N	22.7	Very low	25.6	Very low	173 Å²	173	147.3 Å²	147.3	93%	0.925	80%	0.804	S	S	*	*			trans	-141.7	158.4	134.6	-93.4	-27.5	0	0	0	110.8
16	L	25.1	Very low	25.5	Very low	169 Å²	169	144.7 Å²	144.7	89%	0.885	80%	0.798	S	S	*	*			trans	-143.7	176.1	-171.7	-127.1	167.6	0	0	0	107.9
17	A	25.1	Very low	25.7	Very low	79 Å²	79	147.3 Å²	147.3	65%	0.653	80%	0.801	S	S	*	*			trans	78.1	147.5	-173.6	0	0	0	0	0	114.3
18	E	24.5	Very low	25.7	Very low	194 Å²	194	146.9 Å²	146.9	91%	0.907	80%	0.795	S	S	*	*			cis	-152.6	174.2	12.3	-140.5	150.4	-131.1	0	0	111.7
19	S	27.4	Very low	25.8	Very low	105 Å²	105	145.8 Å²	145.8	73%	0.734	79%	0.79	S	S	*	*			trans	-120.2	162.6	177.5	-167.1	0	0	0	0	109.8
20	P	36.8	Very low	25.9	Very low	98 Å²	98	142.9 Å²	142.9	64%	0.636	78%	0.784	S	S	*	*				-159.5	176.4	95.2	41.9	-22.3	0	0	0	118.1
21	Q	26	Very low	26.1	Very low	178 Å²	178	140.8 Å²	140.8	83%	0.832	77%	0.774	S	S	*	*			trans	69	147.5	152.1	-74.3	155.4	-5.4	0	0	119.6
22	S	24.7	Very low	26.2	Very low	109 Å²	109	143.9 Å²	143.9	76%	0.762	78%	0.78	S	S	*	*			cis	-162.1	163.6	-9.1	51	0	0	0	0	113
23	L	24.5	Very low	26.3	Very low	168 Å²	168	144.1 Å²	144.1	88%	0.88	77%	0.772	S	S	*	*			trans	-31.9	141.4	166.5	-102	62.8	0	0	0	117.7
24	A	23.6	Very low	26.6	Very low	84 Å²	84	139.5 Å²	139.5	69%	0.694	77%	0.765	S	S	*	*				-176.8	131.4	126.7	0	0	0	0	0	112.9
25	D	25.9	Very low	26.7	Very low	146 Å²	146	141.8 Å²	141.8	78%	0.781	77%	0.769	S	S	*	*			trans	41.2	116.9	144.5	-44.1	-32.5	0	0	0	120.8
26	L	26.1	Very low	26.9	Very low	151 Å²	151	142.2 Å²	142.2	79%	0.791	77%	0.768	S	S	*	*				62.3	112	62.9	-76.1	168.7	0	0	0	116.2
27	V	27.4	Very low	27.3	Very low	120 Å²	120	143.2 Å²	143.2	73%	0.727	77%	0.765	S	S	*	*			trans	73.9	128.9	147.5	-173.9	0	0	0	0	113.7
28	E	26.3	Very low	27.5	Very low	148 Å²	148	150.8 Å²	150.8	69%	0.692	78%	0.777	S	S	*	*			cis	-169.5	174	47.5	-149.9	169.4	-125.6	0	0	113.4
29	K	27.4	Very low	27.8	Very low	171 Å²	171	151.1 Å²	151.1	74%	0.743	78%	0.775	S	S	*	*			trans	74.3	110.1	164.7	-62.4	167.2	-174.5	164	0	117
30	K	27.1	Very low	27.8	Very low	161 Å²	161	152 Å²	152	70%	0.7	78%	0.777	S	S	*	*				82.3	117.3	59.5	-100.1	-171.8	158.5	-106.6	0	114.3
31	E	26.7	Very low	27.6	Very low	150 Å²	150	156 Å²	156	70%	0.701	79%	0.787	S	S	*	*			trans	57.7	130.5	150.1	-67.2	148.8	177.7	0	0	115.6
32	E	26.2	Very low	27.9	Very low	182 Å²	182	155.9 Å²	155.9	85%	0.85	79%	0.786	S	S	*	*			cis	-147.5	167.7	38.8	-68.9	175.5	135.2	0	0	114.6
33	D	26.3	Very low	28.1	Very low	142 Å²	142	155.9 Å²	155.9	76%	0.759	78%	0.783	S	S	*	*			trans	78.4	110.7	145.9	-110.6	-32.8	0	0	0	125.4
34	S	29.9	Very low	28.8	Very low	101 Å²	101	159 Å²	159	71%	0.706	78%	0.784	S	S	*	*			trans	36.5	137.5	139.5	62.9	0	0	0	0	125.6
35	N	30.2	Very low	29.1	Very low	149 Å²	149	163.1 Å²	163.1	80%	0.797	79%	0.788	S	S	*	*			trans	91.2	60.5	141.9	-144.4	1.7	0	0	0	119.4
36	M	28.3	Very low	29.7	Very low	182 Å²	182	163.9 Å²	163.9	90%	0.897	79%	0.787	S	S	*	*			trans	-99.8	114.5	160.7	-170.6	140.7	66.6	0	0	112	R38	M36-R38 PolarHBondContact O-N 3.36Å
37	K	32.9	Very low	29.9	Very low	190 Å²	190	161.8 Å²	161.8	83%	0.826	78%	0.782	S	S	*	*			trans	-59.8	102.9	176.3	-70.4	175.6	178.5	173.5	0	111.2	K39	K37-K39 PolarHBondContact O-N 3.01Å; K37-K39 VanDerWaalsContact O-N 3.17Å
38	R	28.6	Very low	30.2	Very low	237 Å²	237	164.9 Å²	164.9	89%	0.894	78%	0.781	S	S	*	*			trans	-67.7	110	164.6	-73	-176.7	177.7	174.2	-0	108.8	M36 T40	M36-R38 PolarHBondContact O-N 3.36Å; R38-T40 PolarHBondContact O-N 3.06Å
39	K	31.1	Very low	30.7	Very low	202 Å²	202	162.3 Å²	162.3	88%	0.878	79%	0.785	S	S	*	*			trans	-64.5	111	158.4	-80	-177.8	174.2	179.3	0	106.9	K37 E41	K37-K39 PolarHBondContact O-N 3.01Å; K37-K39 VanDerWaalsContact O-N 3.17Å; K39-E41 PolarHBondContact O-N 3.39Å; K39-E41 VanDerWaalsContact O-N 3.08Å
40	T	28.5	Very low	30.9	Very low	124 Å²	124	165.2 Å²	165.2	76%	0.761	79%	0.792	S	S	*	*			trans	-68.1	104.8	173.5	-42.7	0	0	0	0	108.3	R38 Q42	R38-T40 PolarHBondContact O-N 3.06Å; T40-Q42 PolarHBondContact O-N 3.49Å
41	E	32.5	Very low	31.5	Very low	182 Å²	182	162.7 Å²	162.7	85%	0.85	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-60.9	117.8	161.6	-69.5	-172.7	140.7	0	0	107.3	K39	K39-E41 PolarHBondContact O-N 3.39Å; K39-E41 VanDerWaalsContact O-N 3.08Å
42	Q	31	Very low	32.3	Very low	175 Å²	175	162.3 Å²	162.3	82%	0.818	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-64.6	130.3	173	-71.4	-174.3	-10.4	0	0	108.2	T40 R44	T40-Q42 PolarHBondContact O-N 3.49Å; Q42-R44 PolarHBondContact O-N 3.39Å
43	P	30.5	Very low	33	Very low	109 Å²	109	159 Å²	159	71%	0.708	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-56.8	129.6	171.1	-20.2	31.7	0	0	0	108.6	E45	P43-E45 VanDerWaalsContact C-N 3.35Å; P43-E45 PolarHBondContact O-N 2.94Å
44	R	38	Very low	34.4	Very low	234 Å²	234	161.6 Å²	161.6	88%	0.883	78%	0.78	S	S	*	*			trans	-61.8	102	168.2	-76	-176.6	177.8	175	-0.4	107.7	Q42 H46	Q42-R44 PolarHBondContact O-N 3.39Å; R44-H46 PolarHBondContact O-N 2.75Å; R44-H46 PolarHBondContact O-ND1 3.22Å; R44-H46 VanDerWaalsContact O-ND1 3.16Å
45	E	30.1	Very low	36.3	Very low	169 Å²	169	159.1 Å²	159.1	79%	0.79	77%	0.771	S	S	*	*			trans	-55.3	112.5	-179.1	-62.7	-164	129.2	0	0	108.8	P43 P47	P43-E45 VanDerWaalsContact C-N 3.35Å; P43-E45 PolarHBondContact O-N 2.94Å; E45-P47 WeakPolarHBondContact O-CD 3.39Å
46	H	38.9	Very low	39.2	Very low	162 Å²	162	154.1 Å²	154.1	75%	0.75	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-69.6	125.5	165.2	-76	39.8	0	0	0	106.1	R44 R48	R44-H46 PolarHBondContact O-N 2.75Å; R44-H46 PolarHBondContact O-ND1 3.22Å; R44-H46 VanDerWaalsContact O-ND1 3.16Å; H46-R48 PolarHBondContact O-N 2.94Å; H46-R48 VanDerWaalsContact O-N 3.15Å
47	P	31.1	Very low	42.4	Very low	107 Å²	107	146.4 Å²	146.4	70%	0.695	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-51.4	124.9	178.7	-27.5	35	0	0	0	109.6	E45 D51	E45-P47 WeakPolarHBondContact O-CD 3.39Å; P47-D51 VanDerWaalsContact CA-OD2 3.26Å; P47-D51 WeakPolarHBondContact CA-OD2 2.96Å; P47-D51 HydrophobicContact CB-CB 4.48Å; P47-D51 WeakPolarHBondContact CB-OD2 3.2Å
48	R	32.5	Very low	45.4	Very low	185 Å²	185	137.4 Å²	137.4	70%	0.698	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-76.3	161.2	-178.3	-61.7	-170	-167.7	-162.9	6.8	107.7	H46 W50 D51	H46-R48 PolarHBondContact O-N 2.94Å; H46-R48 VanDerWaalsContact O-N 3.15Å; R48-W50 PolarHBondContact O-N 2.89Å; R48-D51 PolarHBondContact N-OD2 2.92Å; R48-D51 PolarHBondContact O-N 3.37Å; R48-D51 VanDerWaalsContact O-N 3.12Å
49	A	36.6	Very low	48.7	Very low	95 Å²	95	126.1 Å²	126.1	79%	0.785	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	6.2	-177.2	0	0	0	0	0	115.5
50	W	31.9	Very low	51.9	Low	231 Å²	231	119.7 Å²	119.7	88%	0.875	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	-6.4	-179.2	-55.4	104.1	0	0	0	113.4	R48 Y52	R48-W50 PolarHBondContact O-N 2.89Å; W50-Y52 PolarHBondContact O-N 3.47Å
51	D	40.1	Very low	55	Low	108 Å²	108	116.8 Å²	116.8	58%	0.578	58%	0.578	S	S	*	*	S	Bend	trans	-79.3	-0.5	178.7	-60.5	-43.5	0	0	0	113.6	P47 R48	P47-D51 VanDerWaalsContact CA-OD2 3.26Å; P47-D51 WeakPolarHBondContact CA-OD2 2.96Å; P47-D51 HydrophobicContact CB-CB 4.48Å; P47-D51 WeakPolarHBondContact CB-OD2 3.2Å; R48-D51 PolarHBondContact N-OD2 2.92Å; R48-D51 PolarHBondContact O-N 3.37Å; R48-D51 VanDerWaalsContact O-N 3.12Å
52	Y	42.5	Very low	57.8	Low	142 Å²	142	110.1 Å²	110.1	56%	0.557	55%	0.548	S	S	*	.	S	Bend	trans	-100.8	110.9	172.4	-80.1	-95.3	0	0	0	109.8	W50 H54	W50-Y52 PolarHBondContact O-N 3.47Å; Y52-H54 PolarHBondContact O-N 3.17Å
53	P	42.7	Very low	60	Low	112 Å²	112	103 Å²	103	73%	0.727	52%	0.521	S	S	*	.			trans	-79.3	67.6	-176.9	33.5	-36.6	0	0	0	111.3	G55	P53-G55 VanDerWaalsContact O-CA 3.25Å; P53-G55 WeakPolarHBondContact O-CA 3.32Å; P53-G55 PolarHBondContact O-N 3.24Å
54	H	54.7	Low	62.7	Low	197 Å²	197	102.2 Å²	102.2	91%	0.912	51%	0.508	S	S	*	.	S	Bend	trans	50.7	22.5	175.9	-58.4	-76.5	0	0	0	115.4	Y52	Y52-H54 PolarHBondContact O-N 3.17Å
55	G	70.8	Confident	65.3	Low	50 Å²	50	91.3 Å²	91.3	52%	0.515	47%	0.468	S	S	.	.			trans	-82.5	-63.5	-141.6	0	0	0	0	0	117.9	P53	P53-G55 VanDerWaalsContact O-CA 3.25Å; P53-G55 WeakPolarHBondContact O-CA 3.32Å; P53-G55 PolarHBondContact O-N 3.24Å
56	L	89.3	Confident	68.4	Low	43 Å²	43	83.8 Å²	83.8	23%	0.225	43%	0.434	C	S	.	.			trans	-149.8	145.4	-173.2	-64.1	171.9	0	0	0	109.3	M77 F334 F336 I341	L56-M77 HydrophobicContact CD2-CE 3.52Å; L56-M77 HydrophobicContact CD2-SD 3.92Å; L56-F334 HydrophobicContact CD1-CB 4.06Å; L56-F334 HydrophobicContact CD1-CD1 3.74Å; L56-F334 HydrophobicContact CD1-CD2 3.71Å; L56-F334 HydrophobicContact CD1-CE1 4.05Å; L56-F334 HydrophobicContact CD1-CE2 4.03Å; L56-F334 HydrophobicContact CD1-CG 3.55Å; L56-F334 HydrophobicContact CD1-CZ 4.18Å; L56-F336 HydrophobicContact CB-CE1 4.39Å; L56-F336 HydrophobicContact CB-CZ 4.4Å; L56-F336 HydrophobicContact CD1-CE2 4.4Å; L56-F336 HydrophobicContact CD1-CZ 3.82Å; L56-F336 HydrophobicContact CD2-CZ 4.16Å; L56-F336 HydrophobicContact CG-CZ 4.36Å; L56-I341 HydrophobicContact CB-CD1 3.87Å; L56-I341 HydrophobicContact CB-CG2 4.47Å; L56-I341 HydrophobicContact CD1-CG2 4.26Å
57	V	95.6	Very high	71.1	Confident	21 Å²	21	76.2 Å²	76.2	13%	0.127	40%	0.399	C	S	.	.			trans	-124	129	-174.8	176.2	0	0	0	0	111.2	Q73 M112 V120 I341	V57-Q73 PolarHBondContact O-NE2 2.86Å; V57-M112 HydrophobicContact CB-CB 4.37Å; V57-M112 HydrophobicContact CG1-CB 4.46Å; V57-M112 HydrophobicContact CG1-CG 4.38Å; V57-M112 WeakPolarHBondContact CG2-O 3.33Å; V57-M112 WeakPolarHBondContact O-CE 3.24Å; V57-V120 HydrophobicContact CG1-CG1 3.96Å; V57-V120 HydrophobicContact CG1-CG2 4.43Å; V57-I341 VanDerWaalsContact C-CD1 3.44Å
58	G	97.2	Very high	74.3	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	178	180	0	0	0	0	0	113.8	K118 A119 V120 D338	G58-K118 PolarHBondContact N-O 2.76Å; G58-A119 CarbonylContact O-C 3.54Å; G58-A119 WeakPolarHBondContact O-CA 3.33Å; G58-A119 WeakPolarHBondContact O-CB 3.29Å; G58-V120 PolarHBondContact O-N 3.35Å; G58-D338 CarbonylContact C-O 3.53Å; G58-D338 WeakPolarHBondContact CA-O 3.35Å
59	L	98.3	Very high	77.4	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121.6	174.7	-66.8	175.2	0	0	0	109.8	N61 N69 I72 Q73 L108 M112 V120 P122 D338 S339	L59-N61 PolarHBondContact O-N 3.39Å; L59-N69 HydrophobicContact CB-CB 4.04Å; L59-N69 HydrophobicContact CD1-CB 4.1Å; L59-N69 PolarHBondContact O-ND2 2.81Å; L59-I72 HydrophobicContact CD1-CB 3.81Å; L59-I72 HydrophobicContact CD1-CD1 4.15Å; L59-I72 HydrophobicContact CD1-CG2 3.67Å; L59-Q73 HydrophobicContact CD1-CG 4.28Å; L59-L108 HydrophobicContact CD2-CD1 4.08Å; L59-L108 HydrophobicContact CD2-CD2 4.35Å; L59-M112 HydrophobicContact CD2-CE 4.29Å; L59-M112 HydrophobicContact CD2-SD 3.96Å; L59-M112 HydrophobicContact CG-CE 4.45Å; L59-V120 WeakPolarHBondContact CA-O 3.36Å; L59-V120 HydrophobicContact CD2-CG2 3.78Å; L59-P122 HydrophobicContact CD2-CB 4.34Å; L59-P122 HydrophobicContact CD2-CG 4.38Å; L59-D338 PolarHBondContact N-O 2.58Å; L59-D338 CarbonylContact O-C 3.54Å; L59-D338 WeakPolarHBondContact O-CA 3.49Å; L59-D338 WeakPolarHBondContact O-CB 3.1Å; L59-S339 PolarHBondContact O-N 2.88Å
60	H	97.5	Very high	80.4	Confident	66 Å²	66	58.4 Å²	58.4	31%	0.306	30%	0.299	S	S	.	.			trans	-60.5	133	174.8	-74	-67.6	0	0	0	110.9	I62 N69 V120 R121	H60-I62 PolarHBondContact O-N 2.85Å; H60-N69 PolarHBondContact O-ND2 2.8Å; H60-V120 PolarHBondContact N-O 3.14Å; H60-R121 HydrophobicContact CB-CG 4.03Å
61	N	93.3	Very high	83.5	Confident	63 Å²	63	47.4 Å²	47.4	34%	0.337	26%	0.257	S	S	.	.			trans	-68.2	117.1	167.2	-161.1	-44.1	0	0	0	108.6	L59 G63 Q64 T65 D338	L59-N61 PolarHBondContact O-N 3.39Å; N61-G63 PolarHBondContact OD1-N 2.87Å; N61-Q64 PolarHBondContact OD1-N 3.39Å; N61-T65 PolarHBondContact OD1-N 2.63Å; N61-T65 VanDerWaalsContact OD1-N 3.12Å; N61-D338 HydrophobicContact CB-CB 4.17Å; N61-D338 WeakPolarHBondContact CB-OD2 3.36Å; N61-D338 PolarHBondContact ND2-OD2 3.34Å
62	I	90.5	Very high	86.3	Confident	42 Å²	42	42.4 Å²	42.4	22%	0.215	23%	0.23	C	C	.	.	S	Bend	trans	-99.4	14	-179.3	61.1	174.1	0	0	0	112.4	H60 T65 L123 A126 F137	H60-I62 PolarHBondContact O-N 2.85Å; I62-T65 HydrophobicContact CD1-CG2 4.19Å; I62-T65 HydrophobicContact CG1-CG2 3.45Å; I62-T65 VanDerWaalsContact CG1-CG2 3.45Å; I62-T65 PolarHBondContact N-OG1 3.39Å; I62-T65 VanDerWaalsContact N-OG1 3.14Å; I62-L123 HydrophobicContact CD1-CD2 3.98Å; I62-L123 HydrophobicContact CG2-CD2 4.04Å; I62-A126 HydrophobicContact CD1-CB 3.63Å; I62-F137 WeakPolarHBondContact O-CE1 3.48Å
63	G	79.1	Confident	89	Confident	25 Å²	25	35.8 Å²	35.8	26%	0.258	21%	0.205	S	C	.	.	S	Bend	trans	121.8	87.5	178.7	0	0	0	0	0	111.6	N61 T65 F137	N61-G63 PolarHBondContact OD1-N 2.87Å; G63-T65 VanDerWaalsContact C-N 3.28Å; G63-T65 PolarHBondContact O-N 3.2Å; G63-F137 VanDerWaalsContact O-CA 3.31Å; G63-F137 WeakPolarHBondContact O-CA 3.24Å; G63-F137 WeakPolarHBondContact O-CD1 3.26Å; G63-F137 PolarHBondContact O-N 3.4Å
64	Q	85.3	Confident	91.6	Very high	93 Å²	93	30.7 Å²	30.7	44%	0.435	17%	0.171	S	C	.	.	S	Bend	trans	60.7	29.2	-177.3	-55	-178.2	68.8	0	0	114.4	N61 F137	N61-Q64 PolarHBondContact OD1-N 3.39Å; Q64-F137 PolarHBondContact NE2-O 2.99Å
65	T	92.6	Very high	93.7	Very high	5 Å²	5	21.4 Å²	21.4	3%	0.031	13%	0.128	C	C	.	.			trans	-90.1	10.3	179.6	60.4	0	0	0	0	114.3	N61 I62 G63 C67 L68 N69 M136	N61-T65 PolarHBondContact OD1-N 2.63Å; N61-T65 VanDerWaalsContact OD1-N 3.12Å; I62-T65 HydrophobicContact CD1-CG2 4.19Å; I62-T65 HydrophobicContact CG1-CG2 3.45Å; I62-T65 VanDerWaalsContact CG1-CG2 3.45Å; I62-T65 PolarHBondContact N-OG1 3.39Å; I62-T65 VanDerWaalsContact N-OG1 3.14Å; G63-T65 VanDerWaalsContact C-N 3.28Å; G63-T65 PolarHBondContact O-N 3.2Å; T65-C67 VanDerWaalsContact C-N 3.3Å; T65-C67 PolarHBondContact O-N 3.44Å; T65-L68 CarbonylContact O-C 3.57Å; T65-L68 WeakPolarHBondContact O-CA 3.38Å; T65-L68 WeakPolarHBondContact O-CB 3.45Å; T65-L68 PolarHBondContact O-N 2.87Å; T65-N69 WeakPolarHBondContact O-CB 3.49Å; T65-N69 VanDerWaalsContact O-CG 3.31Å; T65-N69 PolarHBondContact O-N 2.81Å; T65-N69 PolarHBondContact OG1-ND2 2.8Å; T65-M136 HydrophobicContact CG2-SD 4.13Å
66	C	95.7	Very high	94.9	Very high	11 Å²	11	19.6 Å²	19.6	7%	0.074	11%	0.107	C	C	.	.	H	α-helix	trans	-59.6	-35.9	-175.5	54.9	0	0	0	0	114	N69 S70 H320 Y321 D338	C66-N69 PolarHBondContact O-N 2.7Å; C66-S70 WeakPolarHBondContact O-CB 3.28Å; C66-S70 PolarHBondContact O-N 2.81Å; C66-S70 PolarHBondContact O-OG 2.87Å; C66-H320 WeakPolarHBondContact CB-CE1 3.33Å; C66-H320 WeakPolarHBondContact CB-ND1 3.25Å; C66-H320 PolarHBondContact SG-ND1 3.02Å; C66-Y321 WeakPolarHBondContact CB-O 3.42Å; C66-D338 WeakPolarHBondContact CA-OD1 3.36Å
67	C	96.9	Very high	95.2	Very high	4 Å²	4	19.5 Å²	19.5	3%	0.027	11%	0.106	C	C	.	.	H	α-helix	trans	-61.5	-48.8	171.7	-174.3	0	0	0	0	111.6	T65 S70 L71 H140 A142 Y321	T65-C67 VanDerWaalsContact C-N 3.3Å; T65-C67 PolarHBondContact O-N 3.44Å; C67-S70 PolarHBondContact O-N 2.85Å; C67-L71 WeakPolarHBondContact O-CG 3.39Å; C67-L71 PolarHBondContact O-N 2.95Å; C67-L71 VanDerWaalsContact O-N 3.11Å; C67-H140 HydrophobicContact CB-CB 4.11Å; C67-H140 PolarHBondContact SG-O 3.36Å; C67-H140 VanDerWaalsContact SG-O 3.39Å; C67-A142 VanDerWaalsContact SG-CA 3.56Å; C67-Y321 HydrophobicContact CB-CD2 3.51Å; C67-Y321 HydrophobicContact CB-CE2 3.92Å; C67-Y321 HydrophobicContact CB-CG 4.1Å
68	L	97.5	Very high	95.2	Very high	6 Å²	6	18.5 Å²	18.5	3%	0.031	10%	0.1	C	C	.	.	H	α-helix	trans	-63.7	-43.3	176.6	176.1	60.3	0	0	0	111.7	T65 L71 I72 L129 M136 L145 L149	T65-L68 CarbonylContact O-C 3.57Å; T65-L68 WeakPolarHBondContact O-CA 3.38Å; T65-L68 WeakPolarHBondContact O-CB 3.45Å; T65-L68 PolarHBondContact O-N 2.87Å; L68-L71 PolarHBondContact O-N 2.86Å; L68-I72 HydrophobicContact CD1-CD1 3.86Å; L68-I72 HydrophobicContact CD1-CG1 4.06Å; L68-I72 HydrophobicContact CD2-CD1 4.46Å; L68-I72 HydrophobicContact CG-CD1 3.73Å; L68-I72 HydrophobicContact CG-CG1 4.38Å; L68-I72 VanDerWaalsContact O-CG1 3.25Å; L68-I72 WeakPolarHBondContact O-CG1 3.44Å; L68-I72 PolarHBondContact O-N 3.08Å; L68-L129 HydrophobicContact CD1-CD1 3.75Å; L68-L129 HydrophobicContact CD2-CD1 3.96Å; L68-M136 HydrophobicContact CD2-CE 4.16Å; L68-M136 HydrophobicContact CD2-SD 4.13Å; L68-L145 HydrophobicContact CB-CD2 4.14Å; L68-L145 HydrophobicContact CD1-CD2 4.44Å; L68-L149 HydrophobicContact CD1-CD1 3.89Å; L68-L149 HydrophobicContact CD1-CD2 4.2Å
69	N	98	Very high	95.1	Very high	3 Å²	3	23.8 Å²	23.8	2%	0.016	13%	0.126	C	C	.	.	H	α-helix	trans	-61.5	-45.4	178.6	-72.9	-12.5	0	0	0	111	L59 H60 T65 C66 L71 I72 Q73 D338	L59-N69 HydrophobicContact CB-CB 4.04Å; L59-N69 HydrophobicContact CD1-CB 4.1Å; L59-N69 PolarHBondContact O-ND2 2.81Å; H60-N69 PolarHBondContact O-ND2 2.8Å; T65-N69 WeakPolarHBondContact O-CB 3.49Å; T65-N69 VanDerWaalsContact O-CG 3.31Å; T65-N69 PolarHBondContact O-N 2.81Å; T65-N69 PolarHBondContact OG1-ND2 2.8Å; C66-N69 PolarHBondContact O-N 2.7Å; N69-L71 PolarHBondContact O-N 3.49Å; N69-I72 PolarHBondContact O-N 3.21Å; N69-Q73 VanDerWaalsContact O-CG 3.31Å; N69-Q73 WeakPolarHBondContact O-CG 3.44Å; N69-Q73 PolarHBondContact O-N 3.11Å; N69-D338 WeakPolarHBondContact CB-OD1 3.42Å; N69-D338 PolarHBondContact ND2-OD1 2.78Å
70	S	98.4	Very high	95	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-59.2	-45.2	175.6	-62.8	0	0	0	0	112	C66 C67 Q73 V74	C66-S70 WeakPolarHBondContact O-CB 3.28Å; C66-S70 PolarHBondContact O-N 2.81Å; C66-S70 PolarHBondContact O-OG 2.87Å; C67-S70 PolarHBondContact O-N 2.85Å; S70-Q73 PolarHBondContact O-N 2.79Å; S70-V74 WeakPolarHBondContact O-CG2 3.49Å; S70-V74 PolarHBondContact O-N 2.83Å; S70-V74 VanDerWaalsContact O-N 3.15Å
71	L	98.6	Very high	95	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-67.4	-40.6	178	-68.1	174.1	0	0	0	112.8	C67 L68 N69 Q73 V74 F75 L145 Y146 L149 I310 L366	C67-L71 WeakPolarHBondContact O-CG 3.39Å; C67-L71 PolarHBondContact O-N 2.95Å; C67-L71 VanDerWaalsContact O-N 3.11Å; L68-L71 PolarHBondContact O-N 2.86Å; N69-L71 PolarHBondContact O-N 3.49Å; L71-Q73 VanDerWaalsContact C-N 3.35Å; L71-V74 PolarHBondContact O-N 3.03Å; L71-F75 WeakPolarHBondContact O-CD2 3.46Å; L71-F75 PolarHBondContact O-N 3.35Å; L71-F75 VanDerWaalsContact O-N 3.12Å; L71-L145 HydrophobicContact CD1-CB 3.77Å; L71-L145 HydrophobicContact CD1-CD2 3.83Å; L71-L145 HydrophobicContact CD1-CG 3.64Å; L71-Y146 HydrophobicContact CD2-CD2 4.17Å; L71-L149 HydrophobicContact CB-CD1 4.07Å; L71-L149 HydrophobicContact CD1-CD1 4.06Å; L71-I310 HydrophobicContact CD2-CD1 3.78Å; L71-L366 HydrophobicContact CD2-CD1 4.15Å
72	I	98.4	Very high	95.2	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-59.3	-47.9	174.5	-69	162.8	0	0	0	109.8	L59 L68 N69 V74 F75 V76 L108 L125	L59-I72 HydrophobicContact CD1-CB 3.81Å; L59-I72 HydrophobicContact CD1-CD1 4.15Å; L59-I72 HydrophobicContact CD1-CG2 3.67Å; L68-I72 HydrophobicContact CD1-CD1 3.86Å; L68-I72 HydrophobicContact CD1-CG1 4.06Å; L68-I72 HydrophobicContact CD2-CD1 4.46Å; L68-I72 HydrophobicContact CG-CD1 3.73Å; L68-I72 HydrophobicContact CG-CG1 4.38Å; L68-I72 VanDerWaalsContact O-CG1 3.25Å; L68-I72 WeakPolarHBondContact O-CG1 3.44Å; L68-I72 PolarHBondContact O-N 3.08Å; N69-I72 PolarHBondContact O-N 3.21Å; I72-V74 VanDerWaalsContact C-N 3.34Å; I72-V74 PolarHBondContact O-N 2.92Å; I72-F75 PolarHBondContact O-N 2.97Å; I72-F75 VanDerWaalsContact O-N 3.1Å; I72-V76 HydrophobicContact CG2-CG1 4.03Å; I72-V76 WeakPolarHBondContact O-CG2 3.4Å; I72-V76 PolarHBondContact O-N 3.44Å; I72-L108 HydrophobicContact CD1-CD2 4.19Å; I72-L108 HydrophobicContact CG2-CD2 3.83Å; I72-L125 HydrophobicContact CD1-CD2 3.67Å; I72-L125 HydrophobicContact CG1-CD2 4.09Å
73	Q	98.2	Very high	95.5	Very high	4 Å²	4	23.2 Å²	23.2	2%	0.019	12%	0.119	C	C	.	.	H	α-helix	trans	-57.3	-44.7	179.5	-69.9	-70.1	9.6	0	0	111.7	V57 L59 N69 S70 L71 F75 V76 M77 V323 I325 F336	V57-Q73 PolarHBondContact O-NE2 2.86Å; L59-Q73 HydrophobicContact CD1-CG 4.28Å; N69-Q73 VanDerWaalsContact O-CG 3.31Å; N69-Q73 WeakPolarHBondContact O-CG 3.44Å; N69-Q73 PolarHBondContact O-N 3.11Å; S70-Q73 PolarHBondContact O-N 2.79Å; L71-Q73 VanDerWaalsContact C-N 3.35Å; Q73-F75 VanDerWaalsContact C-N 3.34Å; Q73-F75 PolarHBondContact O-N 3.01Å; Q73-V76 PolarHBondContact O-N 3.27Å; Q73-M77 VanDerWaalsContact O-CB 3.23Å; Q73-M77 WeakPolarHBondContact O-CB 3.47Å; Q73-M77 WeakPolarHBondContact O-CG 3.34Å; Q73-M77 PolarHBondContact O-N 2.89Å; Q73-V323 HydrophobicContact CB-CG1 4.02Å; Q73-I325 HydrophobicContact CB-CD1 3.83Å; Q73-F336 HydrophobicContact CB-CD1 4.38Å; Q73-F336 HydrophobicContact CG-CB 4.29Å; Q73-F336 HydrophobicContact CG-CD1 3.85Å; Q73-F336 HydrophobicContact CG-CE1 4.48Å; Q73-F336 HydrophobicContact CG-CG 4.29Å
74	V	98.1	Very high	96.4	Very high	5 Å²	5	22.3 Å²	22.3	3%	0.03	11%	0.108	C	C	.	.	H	α-helix	trans	-58.7	-42.4	174.7	171.1	0	0	0	0	112.7	S70 L71 I72 N78 F307 A308 I310 V323 I325 V368	S70-V74 WeakPolarHBondContact O-CG2 3.49Å; S70-V74 PolarHBondContact O-N 2.83Å; S70-V74 VanDerWaalsContact O-N 3.15Å; L71-V74 PolarHBondContact O-N 3.03Å; I72-V74 VanDerWaalsContact C-N 3.34Å; I72-V74 PolarHBondContact O-N 2.92Å; V74-N78 PolarHBondContact O-N 2.89Å; V74-F307 HydrophobicContact CG1-CE1 4.29Å; V74-A308 HydrophobicContact CG2-CB 3.91Å; V74-I310 HydrophobicContact CG2-CD1 3.83Å; V74-I310 HydrophobicContact CG2-CG1 3.88Å; V74-V323 HydrophobicContact CG2-CG2 3.64Å; V74-I325 HydrophobicContact CG2-CD1 4.31Å; V74-V368 HydrophobicContact CG1-CG2 3.97Å
75	F	98.3	Very high	97	Very high	1 Å²	1	18 Å²	18	0%	0.004	9%	0.088	C	C	.	.	H	α-helix	trans	-68.8	-48.7	177.5	-77.7	-61.8	0	0	0	112.2	L71 I72 Q73 M77 N78 F81 M105 Y146 L149 W150 Y170	L71-F75 WeakPolarHBondContact O-CD2 3.46Å; L71-F75 PolarHBondContact O-N 3.35Å; L71-F75 VanDerWaalsContact O-N 3.12Å; I72-F75 PolarHBondContact O-N 2.97Å; I72-F75 VanDerWaalsContact O-N 3.1Å; Q73-F75 VanDerWaalsContact C-N 3.34Å; Q73-F75 PolarHBondContact O-N 3.01Å; F75-M77 PolarHBondContact O-N 2.88Å; F75-N78 WeakPolarHBondContact O-CB 3.49Å; F75-N78 PolarHBondContact O-N 3.4Å; F75-F81 HydrophobicContact CB-CD1 3.97Å; F75-F81 HydrophobicContact CB-CE1 3.8Å; F75-F81 HydrophobicContact CB-CZ 4.23Å; F75-F81 HydrophobicContact CD1-CD1 4.43Å; F75-F81 AromaticContact CD1-CD2 3.96Å; F75-F81 HydrophobicContact CD1-CD2 3.96Å; F75-F81 HydrophobicContact CD1-CE1 4.41Å; F75-F81 AromaticContact CD1-CE2 3.94Å; F75-F81 HydrophobicContact CD1-CE2 3.94Å; F75-F81 HydrophobicContact CD1-CG 4.2Å; F75-F81 HydrophobicContact CD1-CZ 4.18Å; F75-F81 HydrophobicContact CE1-CE2 4.47Å; F75-F81 HydrophobicContact CG-CE1 4.42Å; F75-F81 HydrophobicContact CG-CZ 4.38Å; F75-F81 WeakPolarHBondContact O-CD1 3.26Å; F75-M105 HydrophobicContact CB-CE 3.85Å; F75-M105 HydrophobicContact CD2-CE 4.3Å; F75-M105 HydrophobicContact CG-CE 4.23Å; F75-Y146 AromaticContact CE1-CE2 3.89Å; F75-Y146 HydrophobicContact CE1-CE2 3.89Å; F75-Y146 AromaticContact CE2-CD2 3.91Å; F75-Y146 HydrophobicContact CE2-CD2 3.91Å; F75-Y146 HydrophobicContact CE2-CE2 4.09Å; F75-Y146 AromaticContact CZ-CD2 3.58Å; F75-Y146 HydrophobicContact CZ-CD2 3.58Å; F75-Y146 AromaticContact CZ-CE2 3.35Å; F75-Y146 HydrophobicContact CZ-CE2 3.35Å; F75-L149 HydrophobicContact CE2-CB 4.39Å; F75-W150 HydrophobicContact CZ-CB 4.38Å; F75-Y170 HydrophobicContact CE1-CE1 4.32Å; F75-Y170 HydrophobicContact CE1-CE2 4.5Å; F75-Y170 AromaticContact CE1-CZ 3.97Å
76	V	96.1	Very high	97.2	Very high	12 Å²	12	23 Å²	23	7%	0.073	11%	0.109	C	C	.	.	H	α-helix	trans	-75.4	-22	-174.8	-56.9	0	0	0	0	113.8	I72 Q73 N78 T82 L109 M112	I72-V76 HydrophobicContact CG2-CG1 4.03Å; I72-V76 WeakPolarHBondContact O-CG2 3.4Å; I72-V76 PolarHBondContact O-N 3.44Å; Q73-V76 PolarHBondContact O-N 3.27Å; V76-N78 VanDerWaalsContact C-N 3.35Å; V76-T82 WeakPolarHBondContact O-CG2 3.25Å; V76-L109 HydrophobicContact CB-CD1 3.97Å; V76-L109 HydrophobicContact CG1-CD1 4.44Å; V76-M112 HydrophobicContact CG2-CE 3.96Å; V76-M112 HydrophobicContact CG2-SD 4.22Å
77	M	95.8	Very high	97.3	Very high	41 Å²	41	29.8 Å²	29.8	20%	0.202	13%	0.133	C	C	.	.	H	α-helix	trans	-80.9	-14.8	171.5	-67.2	-58.6	-61.5	0	0	113	L56 Q73 F75 M79 F307 I325 F336	L56-M77 HydrophobicContact CD2-CE 3.52Å; L56-M77 HydrophobicContact CD2-SD 3.92Å; Q73-M77 VanDerWaalsContact O-CB 3.23Å; Q73-M77 WeakPolarHBondContact O-CB 3.47Å; Q73-M77 WeakPolarHBondContact O-CG 3.34Å; Q73-M77 PolarHBondContact O-N 2.89Å; F75-M77 PolarHBondContact O-N 2.88Å; M77-M79 PolarHBondContact O-N 2.87Å; M77-F307 HydrophobicContact CB-CE2 4.49Å; M77-F307 HydrophobicContact CB-CZ 3.9Å; M77-I325 HydrophobicContact CB-CD1 4.17Å; M77-I325 HydrophobicContact CB-CG2 4.02Å; M77-I325 HydrophobicContact CG-CD1 3.88Å; M77-I325 HydrophobicContact CG-CG2 4.36Å; M77-F336 HydrophobicContact CE-CZ 4.46Å; M77-F336 HydrophobicContact CG-CZ 4.26Å; M77-F336 HydrophobicContact SD-CZ 4.23Å
78	N	96.4	Very high	97.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.136	C	C	.	.			trans	-78.8	112.3	175	-178.5	-48.6	0	0	0	109.9	V74 F75 V76 D80 F81 T82 T253 F307 M370	V74-N78 PolarHBondContact O-N 2.89Å; F75-N78 WeakPolarHBondContact O-CB 3.49Å; F75-N78 PolarHBondContact O-N 3.4Å; V76-N78 VanDerWaalsContact C-N 3.35Å; N78-D80 VanDerWaalsContact C-N 3.3Å; N78-D80 PolarHBondContact O-N 3.16Å; N78-D80 PolarHBondContact OD1-N 2.94Å; N78-F81 HydrophobicContact CB-CB 4Å; N78-F81 PolarHBondContact O-N 2.96Å; N78-F81 PolarHBondContact OD1-N 2.84Å; N78-T82 PolarHBondContact O-N 3.05Å; N78-T82 PolarHBondContact O-OG1 3.44Å; N78-T253 PolarHBondContact ND2-OG1 3.19Å; N78-F307 HydrophobicContact CB-CE1 4.32Å; N78-F307 HydrophobicContact CB-CZ 4.24Å; N78-M370 HydrophobicContact CB-CE 4.01Å; N78-M370 VanDerWaalsContact ND2-CE 3.27Å; N78-M370 WeakPolarHBondContact ND2-CE 3.01Å
79	M	94.1	Very high	97.3	Very high	111 Å²	111	34.4 Å²	34.4	55%	0.547	16%	0.161	S	C	.	.	H	α-helix	trans	-65.5	-30.5	-175.7	-68.5	-173.1	70.9	0	0	113.3	M77 T82 R83 A328	M77-M79 PolarHBondContact O-N 2.87Å; M79-T82 WeakPolarHBondContact CA-OG1 3.36Å; M79-T82 PolarHBondContact O-OG1 2.98Å; M79-T82 VanDerWaalsContact O-OG1 3.13Å; M79-R83 VanDerWaalsContact O-CB 3.31Å; M79-R83 WeakPolarHBondContact O-CB 3.44Å; M79-R83 PolarHBondContact O-N 3.33Å; M79-A328 HydrophobicContact SD-CB 4.35Å
80	D	95.8	Very high	97.2	Very high	35 Å²	35	37.7 Å²	37.7	19%	0.187	18%	0.181	C	C	.	.	H	α-helix	trans	-74.5	-41.5	178.5	-61.1	-40	0	0	0	111.5	N78 R83 I84 L169	N78-D80 VanDerWaalsContact C-N 3.3Å; N78-D80 PolarHBondContact O-N 3.16Å; N78-D80 PolarHBondContact OD1-N 2.94Å; D80-R83 PolarHBondContact O-N 2.89Å; D80-R83 IonicContact OD1-CZ 2.97Å; D80-R83 IonicContact OD1-NH1 3.93Å; D80-R83 PolarHBondContact OD1-NH1 3.37Å; D80-R83 IonicContact OD1-NH2 3.32Å; D80-R83 PolarHBondContact OD1-NH2 2.88Å; D80-R83 VanDerWaalsContact OD1-NH2 3.12Å; D80-I84 WeakPolarHBondContact O-CG1 3.46Å; D80-I84 PolarHBondContact O-N 2.83Å; D80-I84 VanDerWaalsContact O-N 3.1Å; D80-L169 HydrophobicContact CB-CD1 3.64Å; D80-L169 HydrophobicContact CB-CD2 3.75Å; D80-L169 HydrophobicContact CB-CG 4.37Å
81	F	97.9	Very high	97.1	Very high	1 Å²	1	38.8 Å²	38.8	0%	0.004	19%	0.188	C	C	.	.	H	α-helix	trans	-60.8	-48.7	172.8	176.7	-95.3	0	0	0	111.3	F75 N78 R83 I84 L85 M105 I153 L166 L169 Y170	F75-F81 HydrophobicContact CB-CD1 3.97Å; F75-F81 HydrophobicContact CB-CE1 3.8Å; F75-F81 HydrophobicContact CB-CZ 4.23Å; F75-F81 HydrophobicContact CD1-CD1 4.43Å; F75-F81 AromaticContact CD1-CD2 3.96Å; F75-F81 HydrophobicContact CD1-CD2 3.96Å; F75-F81 HydrophobicContact CD1-CE1 4.41Å; F75-F81 AromaticContact CD1-CE2 3.94Å; F75-F81 HydrophobicContact CD1-CE2 3.94Å; F75-F81 HydrophobicContact CD1-CG 4.2Å; F75-F81 HydrophobicContact CD1-CZ 4.18Å; F75-F81 HydrophobicContact CE1-CE2 4.47Å; F75-F81 HydrophobicContact CG-CE1 4.42Å; F75-F81 HydrophobicContact CG-CZ 4.38Å; F75-F81 WeakPolarHBondContact O-CD1 3.26Å; N78-F81 HydrophobicContact CB-CB 4Å; N78-F81 PolarHBondContact O-N 2.96Å; N78-F81 PolarHBondContact OD1-N 2.84Å; F81-R83 VanDerWaalsContact C-N 3.27Å; F81-R83 PolarHBondContact O-N 2.74Å; F81-I84 WeakPolarHBondContact O-CB 3.45Å; F81-I84 PolarHBondContact O-N 3.12Å; F81-I84 VanDerWaalsContact O-N 3.08Å; F81-L85 HydrophobicContact CE1-CB 4.38Å; F81-L85 HydrophobicContact CE1-CD1 4.26Å; F81-L85 HydrophobicContact CE1-CD2 3.94Å; F81-L85 HydrophobicContact CE1-CG 4.44Å; F81-L85 HydrophobicContact CZ-CD1 4.11Å; F81-L85 WeakPolarHBondContact O-CB 3.38Å; F81-L85 PolarHBondContact O-N 3.22Å; F81-M105 HydrophobicContact CE1-CE 3.81Å; F81-M105 HydrophobicContact CZ-CE 3.74Å; F81-M105 HydrophobicContact CZ-SD 4.37Å; F81-I153 HydrophobicContact CE2-CD1 4.16Å; F81-I153 HydrophobicContact CE2-CG2 4.22Å; F81-I153 HydrophobicContact CZ-CD1 4.01Å; F81-I153 HydrophobicContact CZ-CG2 4.49Å; F81-L166 HydrophobicContact CD2-CD1 3.93Å; F81-L166 HydrophobicContact CE2-CD1 4.14Å; F81-L169 HydrophobicContact CB-CD2 4.19Å; F81-Y170 WeakPolarHBondContact CB-OH 3.23Å; F81-Y170 HydrophobicContact CD2-CE2 4.05Å
82	T	96.9	Very high	96.8	Very high	20 Å²	20	50.2 Å²	50.2	12%	0.123	23%	0.231	C	C	.	.	H	α-helix	trans	-64.9	-30.7	178.4	55.1	0	0	0	0	112.7	V76 N78 M79 I84 L85 K86 L109	V76-T82 WeakPolarHBondContact O-CG2 3.25Å; N78-T82 PolarHBondContact O-N 3.05Å; N78-T82 PolarHBondContact O-OG1 3.44Å; M79-T82 WeakPolarHBondContact CA-OG1 3.36Å; M79-T82 PolarHBondContact O-OG1 2.98Å; M79-T82 VanDerWaalsContact O-OG1 3.13Å; T82-I84 VanDerWaalsContact C-N 3.33Å; T82-I84 PolarHBondContact O-N 3.4Å; T82-L85 PolarHBondContact O-N 3.48Å; T82-K86 WeakPolarHBondContact O-CB 3.38Å; T82-K86 WeakPolarHBondContact O-CG 3.27Å; T82-K86 PolarHBondContact O-N 3.02Å; T82-L109 HydrophobicContact CG2-CD1 4Å; T82-L109 HydrophobicContact CG2-CD2 3.69Å
83	R	97.3	Very high	96.7	Very high	105 Å²	105	51.4 Å²	51.4	40%	0.396	24%	0.244	S	C	.	.	H	α-helix	trans	-67.9	-29.7	172.7	-159.6	-174.4	-52.4	106.9	-3.8	113.1	M79 D80 F81 R87	M79-R83 VanDerWaalsContact O-CB 3.31Å; M79-R83 WeakPolarHBondContact O-CB 3.44Å; M79-R83 PolarHBondContact O-N 3.33Å; D80-R83 PolarHBondContact O-N 2.89Å; D80-R83 IonicContact OD1-CZ 2.97Å; D80-R83 IonicContact OD1-NH1 3.93Å; D80-R83 PolarHBondContact OD1-NH1 3.37Å; D80-R83 IonicContact OD1-NH2 3.32Å; D80-R83 PolarHBondContact OD1-NH2 2.88Å; D80-R83 VanDerWaalsContact OD1-NH2 3.12Å; F81-R83 VanDerWaalsContact C-N 3.27Å; F81-R83 PolarHBondContact O-N 2.74Å; R83-R87 WeakPolarHBondContact O-CG 3.26Å
84	I	98.1	Very high	96.6	Very high	6 Å²	6	53.8 Å²	53.8	3%	0.031	26%	0.264	C	S	.	.	H	α-helix	trans	-74.2	-47.9	169.6	-65.7	165.7	0	0	0	109.6	D80 F81 T82 K86 R87 L162 R165 L166 L169	D80-I84 WeakPolarHBondContact O-CG1 3.46Å; D80-I84 PolarHBondContact O-N 2.83Å; D80-I84 VanDerWaalsContact O-N 3.1Å; F81-I84 WeakPolarHBondContact O-CB 3.45Å; F81-I84 PolarHBondContact O-N 3.12Å; F81-I84 VanDerWaalsContact O-N 3.08Å; T82-I84 VanDerWaalsContact C-N 3.33Å; T82-I84 PolarHBondContact O-N 3.4Å; I84-K86 VanDerWaalsContact C-N 3.35Å; I84-K86 PolarHBondContact O-N 3Å; I84-R87 PolarHBondContact O-N 3.03Å; I84-L162 HydrophobicContact CG2-CB 4.29Å; I84-L162 HydrophobicContact CG2-CD2 4.39Å; I84-R165 HydrophobicContact CD1-CB 4.15Å; I84-R165 HydrophobicContact CG1-CB 4.44Å; I84-L166 HydrophobicContact CD1-CB 4.31Å; I84-L166 HydrophobicContact CD1-CD1 4.44Å; I84-L169 HydrophobicContact CD1-CD2 3.88Å
85	L	97.6	Very high	96.5	Very high	3 Å²	3	58.4 Å²	58.4	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-59	-41.7	-177.3	-163.8	71.5	0	0	0	112.7	F81 T82 R87 I88 P102 M105 L106 L109	F81-L85 HydrophobicContact CE1-CB 4.38Å; F81-L85 HydrophobicContact CE1-CD1 4.26Å; F81-L85 HydrophobicContact CE1-CD2 3.94Å; F81-L85 HydrophobicContact CE1-CG 4.44Å; F81-L85 HydrophobicContact CZ-CD1 4.11Å; F81-L85 WeakPolarHBondContact O-CB 3.38Å; F81-L85 PolarHBondContact O-N 3.22Å; T82-L85 PolarHBondContact O-N 3.48Å; L85-R87 PolarHBondContact O-N 3.45Å; L85-R87 VanDerWaalsContact O-N 3.17Å; L85-I88 WeakPolarHBondContact O-CG1 3.18Å; L85-I88 WeakPolarHBondContact O-CG2 3.32Å; L85-I88 PolarHBondContact O-N 3.44Å; L85-P102 HydrophobicContact CD1-CB 4.12Å; L85-P102 WeakPolarHBondContact CD1-O 3.26Å; L85-M105 HydrophobicContact CD1-CB 4.22Å; L85-M105 HydrophobicContact CD2-CB 4.07Å; L85-L106 HydrophobicContact CD2-CB 4.33Å; L85-L106 HydrophobicContact CG-CB 4.13Å; L85-L106 HydrophobicContact CG-CD1 4.44Å; L85-L109 HydrophobicContact CD2-CD2 4.26Å
86	K	97.8	Very high	96.3	Very high	109 Å²	109	63.8 Å²	63.8	47%	0.474	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-4.1	176.3	-72.2	-174.9	176.5	-163.6	0	114.4	T82 I84 L106 L109	T82-K86 WeakPolarHBondContact O-CB 3.38Å; T82-K86 WeakPolarHBondContact O-CG 3.27Å; T82-K86 PolarHBondContact O-N 3.02Å; I84-K86 VanDerWaalsContact C-N 3.35Å; I84-K86 PolarHBondContact O-N 3Å; K86-L106 HydrophobicContact CG-CD1 3.84Å; K86-L109 HydrophobicContact CG-CD2 4.39Å
87	R	98	Very high	96.4	Very high	154 Å²	154	66 Å²	66	58%	0.581	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	-3.3	179.2	-68.5	-178.3	178.9	-150.6	1.1	114	R83 I84 L85 L162	R83-R87 WeakPolarHBondContact O-CG 3.26Å; I84-R87 PolarHBondContact O-N 3.03Å; L85-R87 PolarHBondContact O-N 3.45Å; L85-R87 VanDerWaalsContact O-N 3.17Å; R87-L162 HydrophobicContact CB-CD1 3.93Å; R87-L162 HydrophobicContact CB-CD2 3.97Å; R87-L162 VanDerWaalsContact O-CD1 3.32Å; R87-L162 WeakPolarHBondContact O-CD1 3.36Å
88	I	97.4	Very high	96.4	Very high	15 Å²	15	70.7 Å²	70.7	8%	0.077	34%	0.339	C	S	.	.	S	Bend	trans	-59.3	149	-179.7	68.7	-174.4	0	0	0	111.4	L85 V90 P102 F103 L106 I157 L162	L85-I88 WeakPolarHBondContact O-CG1 3.18Å; L85-I88 WeakPolarHBondContact O-CG2 3.32Å; L85-I88 PolarHBondContact O-N 3.44Å; I88-V90 PolarHBondContact O-N 3.03Å; I88-P102 HydrophobicContact CD1-CB 3.9Å; I88-P102 HydrophobicContact CG2-CB 4.48Å; I88-F103 HydrophobicContact CD1-CB 4.38Å; I88-L106 HydrophobicContact CD1-CB 4.33Å; I88-L106 HydrophobicContact CD1-CD2 4.13Å; I88-L106 HydrophobicContact CG1-CD2 4.24Å; I88-I157 HydrophobicContact CG2-CD1 4.13Å; I88-I157 HydrophobicContact CG2-CG1 3.99Å; I88-L162 HydrophobicContact CG2-CD1 4.47Å
89	T	96.6	Very high	96.5	Very high	92 Å²	92	77 Å²	77	56%	0.564	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-70.1	121.7	168.8	-60.8	0	0	0	0	109.4	P91	T89-P91 WeakPolarHBondContact O-CD 3.37Å
90	V	95.9	Very high	96.7	Very high	71 Å²	71	72.3 Å²	72.3	43%	0.43	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-70.1	125	175.9	176.2	0	0	0	0	109.7	I88 F103	I88-V90 PolarHBondContact O-N 3.03Å; V90-F103 HydrophobicContact CB-CE2 4.33Å; V90-F103 HydrophobicContact CG1-CD2 4.13Å; V90-F103 HydrophobicContact CG1-CE2 3.61Å; V90-F103 HydrophobicContact CG1-CZ 3.95Å; V90-F103 HydrophobicContact CG2-CD2 4.19Å; V90-F103 HydrophobicContact CG2-CE2 3.92Å
91	P	95.1	Very high	96.8	Very high	26 Å²	26	70.7 Å²	70.7	17%	0.169	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-61.7	145.5	175.8	-20.3	31.4	0	0	0	111.7	T89 E96 Q97	T89-P91 WeakPolarHBondContact O-CD 3.37Å; P91-E96 HydrophobicContact CB-CB 3.63Å; P91-Q97 HydrophobicContact CB-CG 4.05Å; P91-Q97 HydrophobicContact CG-CG 4.47Å; P91-Q97 VanDerWaalsContact O-CG 3.3Å; P91-Q97 WeakPolarHBondContact O-CG 3.46Å; P91-Q97 PolarHBondContact O-NE2 3.35Å
92	R	94	Very high	96.8	Very high	242 Å²	242	70.7 Å²	70.7	91%	0.913	33%	0.332	S	S	*	.	S	Bend	trans	-85.4	-35.4	-175.5	-65.8	-175.7	-177.5	-176.8	1.2	112.5	E96	R92-E96 PolarHBondContact N-OE2 3.04Å
93	G	95.9	Very high	96.9	Very high	27 Å²	27	70.8 Å²	70.8	28%	0.278	33%	0.331	S	S	.	.	S	Bend	trans	-78.9	135	178.9	0	0	0	0	0	112.4	D95 E96 Q97	G93-D95 PolarHBondContact O-N 3.26Å; G93-E96 PolarHBondContact N-OE2 2.86Å; G93-E96 WeakPolarHBondContact O-CB 3.42Å; G93-E96 PolarHBondContact O-N 2.91Å; G93-Q97 WeakPolarHBondContact O-CG 3.41Å; G93-Q97 PolarHBondContact O-N 2.88Å
94	A	95.4	Very high	97	Very high	53 Å²	53	66.4 Å²	66.4	44%	0.438	32%	0.315	S	S	.	.	H	α-helix	trans	-57.4	-32.7	177.1	0	0	0	0	0	113.1	R98	A94-R98 WeakPolarHBondContact O-CB 3.5Å; A94-R98 WeakPolarHBondContact O-CG 3.34Å; A94-R98 PolarHBondContact O-N 3.24Å
95	D	95.5	Very high	97	Very high	102 Å²	102	66.3 Å²	66.3	55%	0.545	31%	0.314	S	S	.	.	H	α-helix	trans	-82.6	-25	177.2	-67	-29	0	0	0	113.5	G93 R98 R99	G93-D95 PolarHBondContact O-N 3.26Å; D95-R98 IonicContact OD1-CZ 3.34Å; D95-R98 VanDerWaalsContact OD1-CZ 3.32Å; D95-R98 IonicContact OD1-NE 3.12Å; D95-R98 PolarHBondContact OD1-NE 3.48Å; D95-R98 IonicContact OD1-NH2 2.65Å; D95-R98 PolarHBondContact OD1-NH2 3.45Å; D95-R99 WeakPolarHBondContact O-CB 3.27Å; D95-R99 VanDerWaalsContact O-CG 3.24Å; D95-R99 WeakPolarHBondContact O-CG 3.14Å; D95-R99 PolarHBondContact O-N 3.26Å
96	E	95.3	Very high	97	Very high	114 Å²	114	66.8 Å²	66.8	53%	0.533	32%	0.317	S	S	.	.	H	α-helix	trans	-67.9	-45.6	167.8	-54.7	177.4	143	0	0	109.8	P91 R92 G93 R98 R99 S100	P91-E96 HydrophobicContact CB-CB 3.63Å; R92-E96 PolarHBondContact N-OE2 3.04Å; G93-E96 PolarHBondContact N-OE2 2.86Å; G93-E96 WeakPolarHBondContact O-CB 3.42Å; G93-E96 PolarHBondContact O-N 2.91Å; E96-R98 VanDerWaalsContact C-N 3.35Å; E96-R98 PolarHBondContact O-N 3.29Å; E96-R99 CarbonylContact O-C 3.58Å; E96-R99 WeakPolarHBondContact O-CA 3.34Å; E96-R99 PolarHBondContact O-N 2.99Å; E96-S100 WeakPolarHBondContact O-CB 3.39Å; E96-S100 PolarHBondContact O-N 3.37Å
97	Q	96.9	Very high	97.1	Very high	59 Å²	59	64.8 Å²	64.8	28%	0.276	31%	0.311	S	S	.	.	H	α-helix	trans	-56.6	-46.5	173	-71.9	177.9	3.6	0	0	111.5	P91 G93 R99 S100 F103 Q104	P91-Q97 HydrophobicContact CB-CG 4.05Å; P91-Q97 HydrophobicContact CG-CG 4.47Å; P91-Q97 VanDerWaalsContact O-CG 3.3Å; P91-Q97 WeakPolarHBondContact O-CG 3.46Å; P91-Q97 PolarHBondContact O-NE2 3.35Å; G93-Q97 WeakPolarHBondContact O-CG 3.41Å; G93-Q97 PolarHBondContact O-N 2.88Å; Q97-R99 PolarHBondContact O-N 2.81Å; Q97-R99 VanDerWaalsContact O-N 3.14Å; Q97-S100 PolarHBondContact O-N 3.3Å; Q97-F103 HydrophobicContact CB-CD1 3.71Å; Q97-F103 HydrophobicContact CB-CE1 3.64Å; Q97-F103 HydrophobicContact CG-CD1 3.89Å; Q97-F103 HydrophobicContact CG-CE1 3.61Å; Q97-F103 HydrophobicContact CG-CZ 4.34Å; Q97-Q104 PolarHBondContact O-NE2 3.41Å
98	R	97.1	Very high	97.1	Very high	140 Å²	140	57.7 Å²	57.7	53%	0.528	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-0.4	174.4	-75.9	-170.9	-81.6	-118.8	4.5	114.9	A94 D95 E96 K131	A94-R98 WeakPolarHBondContact O-CB 3.5Å; A94-R98 WeakPolarHBondContact O-CG 3.34Å; A94-R98 PolarHBondContact O-N 3.24Å; D95-R98 IonicContact OD1-CZ 3.34Å; D95-R98 VanDerWaalsContact OD1-CZ 3.32Å; D95-R98 IonicContact OD1-NE 3.12Å; D95-R98 PolarHBondContact OD1-NE 3.48Å; D95-R98 IonicContact OD1-NH2 2.65Å; D95-R98 PolarHBondContact OD1-NH2 3.45Å; E96-R98 VanDerWaalsContact C-N 3.35Å; E96-R98 PolarHBondContact O-N 3.29Å; R98-K131 PolarHBondContact O-NZ 3.23Å
99	R	97.3	Very high	97.1	Very high	133 Å²	133	57.2 Å²	57.2	50%	0.502	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-15.1	174.4	-72.1	-178.3	73.5	-179.5	4.3	112.9	D95 E96 Q97 V101 C128 K131 Y132 Q156	D95-R99 WeakPolarHBondContact O-CB 3.27Å; D95-R99 VanDerWaalsContact O-CG 3.24Å; D95-R99 WeakPolarHBondContact O-CG 3.14Å; D95-R99 PolarHBondContact O-N 3.26Å; E96-R99 CarbonylContact O-C 3.58Å; E96-R99 WeakPolarHBondContact O-CA 3.34Å; E96-R99 PolarHBondContact O-N 2.99Å; Q97-R99 PolarHBondContact O-N 2.81Å; Q97-R99 VanDerWaalsContact O-N 3.14Å; R99-V101 PolarHBondContact O-N 3.43Å; R99-C128 PolarHBondContact O-SG 3.35Å; R99-K131 HydrophobicContact CG-CD 3.88Å; R99-Y132 WeakPolarHBondContact O-CE2 3.45Å; R99-Y132 PolarHBondContact O-OH 2.86Å; R99-Q156 PolarHBondContact O-OE1 3.48Å
100	S	98.4	Very high	97.1	Very high	12 Å²	12	56.6 Å²	56.6	8%	0.084	27%	0.273	C	S	.	.			trans	-79.3	103.5	179.7	176.5	0	0	0	0	110.6	E96 Q97 F103 Q104	E96-S100 WeakPolarHBondContact O-CB 3.39Å; E96-S100 PolarHBondContact O-N 3.37Å; Q97-S100 PolarHBondContact O-N 3.3Å; S100-F103 PolarHBondContact O-N 3.42Å; S100-F103 WeakPolarHBondContact OG-CB 3.46Å; S100-F103 PolarHBondContact OG-N 2.88Å; S100-Q104 WeakPolarHBondContact O-CG 3.34Å; S100-Q104 PolarHBondContact O-N 3.25Å
101	V	98.6	Very high	97.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-53.7	-49.2	172.6	176.9	0	0	0	0	112.1	R99 F103 Q104 M105 L125 L129 Y132 L152 I153	R99-V101 PolarHBondContact O-N 3.43Å; V101-F103 VanDerWaalsContact C-N 3.32Å; V101-F103 PolarHBondContact O-N 3.07Å; V101-Q104 PolarHBondContact O-N 3.24Å; V101-M105 HydrophobicContact CG1-SD 4.3Å; V101-M105 WeakPolarHBondContact O-CG 3.39Å; V101-M105 PolarHBondContact O-N 2.93Å; V101-L125 HydrophobicContact CG1-CD1 4.35Å; V101-L129 HydrophobicContact CG1-CD2 4.06Å; V101-L129 HydrophobicContact CG2-CD2 3.98Å; V101-Y132 HydrophobicContact CG2-CD2 3.96Å; V101-Y132 HydrophobicContact CG2-CE2 3.99Å; V101-L152 HydrophobicContact CB-CB 4.48Å; V101-L152 HydrophobicContact CG1-CB 4.42Å; V101-L152 HydrophobicContact CG2-CB 4.24Å; V101-I153 HydrophobicContact CG1-CG1 4Å
102	P	98.4	Very high	97.1	Very high	2 Å²	2	56.2 Å²	56.2	1%	0.013	26%	0.263	C	S	.	.	H	α-helix	trans	-62.8	-36.8	177.4	22.8	-31.6	0	0	0	112.5	L85 I88 M105 L106 I153 Q156 I157	L85-P102 HydrophobicContact CD1-CB 4.12Å; L85-P102 WeakPolarHBondContact CD1-O 3.26Å; I88-P102 HydrophobicContact CD1-CB 3.9Å; I88-P102 HydrophobicContact CG2-CB 4.48Å; P102-M105 PolarHBondContact O-N 2.88Å; P102-L106 PolarHBondContact O-N 3.39Å; P102-I153 HydrophobicContact CB-CG2 4.36Å; P102-Q156 HydrophobicContact CG-CB 3.99Å; P102-I157 HydrophobicContact CB-CG1 4.19Å; P102-I157 HydrophobicContact CG-CG1 4.15Å
103	F	98.6	Very high	97	Very high	21 Å²	21	50.1 Å²	50.1	9%	0.092	25%	0.245	C	C	.	.	H	α-helix	trans	-68.6	-40.6	175.7	-174.5	-115.8	0	0	0	112.7	I88 V90 Q97 S100 V101 M105 L106 L107	I88-F103 HydrophobicContact CD1-CB 4.38Å; V90-F103 HydrophobicContact CB-CE2 4.33Å; V90-F103 HydrophobicContact CG1-CD2 4.13Å; V90-F103 HydrophobicContact CG1-CE2 3.61Å; V90-F103 HydrophobicContact CG1-CZ 3.95Å; V90-F103 HydrophobicContact CG2-CD2 4.19Å; V90-F103 HydrophobicContact CG2-CE2 3.92Å; Q97-F103 HydrophobicContact CB-CD1 3.71Å; Q97-F103 HydrophobicContact CB-CE1 3.64Å; Q97-F103 HydrophobicContact CG-CD1 3.89Å; Q97-F103 HydrophobicContact CG-CE1 3.61Å; Q97-F103 HydrophobicContact CG-CZ 4.34Å; S100-F103 PolarHBondContact O-N 3.42Å; S100-F103 WeakPolarHBondContact OG-CB 3.46Å; S100-F103 PolarHBondContact OG-N 2.88Å; V101-F103 VanDerWaalsContact C-N 3.32Å; V101-F103 PolarHBondContact O-N 3.07Å; F103-M105 VanDerWaalsContact C-N 3.3Å; F103-M105 PolarHBondContact O-N 3.41Å; F103-L106 HydrophobicContact CD2-CD2 4.49Å; F103-L106 WeakPolarHBondContact O-CB 3.16Å; F103-L106 PolarHBondContact O-N 2.9Å; F103-L106 VanDerWaalsContact O-N 3.16Å; F103-L107 HydrophobicContact CD1-CD1 4.04Å; F103-L107 HydrophobicContact CD1-CG 4.45Å; F103-L107 HydrophobicContact CE1-CD1 3.59Å; F103-L107 HydrophobicContact CE1-CD2 4.46Å; F103-L107 HydrophobicContact CE1-CG 4.08Å; F103-L107 HydrophobicContact CE2-CD2 4.33Å; F103-L107 HydrophobicContact CE2-CG 4.33Å; F103-L107 HydrophobicContact CZ-CD1 3.97Å; F103-L107 HydrophobicContact CZ-CD2 3.98Å; F103-L107 HydrophobicContact CZ-CG 4.02Å; F103-L107 WeakPolarHBondContact O-CG 3.29Å; F103-L107 PolarHBondContact O-N 3.31Å
104	Q	98.6	Very high	96.9	Very high	13 Å²	13	55.5 Å²	55.5	6%	0.061	27%	0.267	C	S	.	.	H	α-helix	trans	-67.2	-30.4	175.2	-65.9	-56.8	-45.3	0	0	112.6	Q97 S100 V101 L108 E124 L125 C128	Q97-Q104 PolarHBondContact O-NE2 3.41Å; S100-Q104 WeakPolarHBondContact O-CG 3.34Å; S100-Q104 PolarHBondContact O-N 3.25Å; V101-Q104 PolarHBondContact O-N 3.24Å; Q104-L108 WeakPolarHBondContact O-CB 3.22Å; Q104-L108 PolarHBondContact O-N 2.84Å; Q104-L108 VanDerWaalsContact O-N 3.07Å; Q104-E124 VanDerWaalsContact OE1-CB 3.27Å; Q104-L125 HydrophobicContact CB-CB 4.22Å; Q104-L125 HydrophobicContact CB-CD1 3.81Å; Q104-C128 HydrophobicContact CB-CB 4.38Å; Q104-C128 HydrophobicContact CG-CB 3.84Å
105	M	98.4	Very high	96.8	Very high	5 Å²	5	54.3 Å²	54.3	3%	0.025	26%	0.256	C	S	.	.	H	α-helix	trans	-70	-36.9	169.6	-72.4	-176.6	73.7	0	0	112.4	F75 F81 L85 V101 P102 F103 L108 L109 L125 I153	F75-M105 HydrophobicContact CB-CE 3.85Å; F75-M105 HydrophobicContact CD2-CE 4.3Å; F75-M105 HydrophobicContact CG-CE 4.23Å; F81-M105 HydrophobicContact CE1-CE 3.81Å; F81-M105 HydrophobicContact CZ-CE 3.74Å; F81-M105 HydrophobicContact CZ-SD 4.37Å; L85-M105 HydrophobicContact CD1-CB 4.22Å; L85-M105 HydrophobicContact CD2-CB 4.07Å; V101-M105 HydrophobicContact CG1-SD 4.3Å; V101-M105 WeakPolarHBondContact O-CG 3.39Å; V101-M105 PolarHBondContact O-N 2.93Å; P102-M105 PolarHBondContact O-N 2.88Å; F103-M105 VanDerWaalsContact C-N 3.3Å; F103-M105 PolarHBondContact O-N 3.41Å; M105-L108 PolarHBondContact O-N 3.32Å; M105-L109 WeakPolarHBondContact O-CB 3.26Å; M105-L109 PolarHBondContact O-N 3.33Å; M105-L125 HydrophobicContact CG-CD1 3.82Å; M105-L125 HydrophobicContact CG-CD2 3.81Å; M105-I153 HydrophobicContact CE-CD1 4.1Å; M105-I153 HydrophobicContact SD-CD1 3.46Å; M105-I153 WeakPolarHBondContact SD-CD1 3.33Å; M105-I153 HydrophobicContact SD-CG1 3.77Å
106	L	98.4	Very high	96.6	Very high	13 Å²	13	61.1 Å²	61.1	7%	0.068	27%	0.274	C	S	.	.	H	α-helix	trans	-63.5	-48.8	175	179.7	59.2	0	0	0	111.2	L85 K86 I88 P102 F103 L108 L109 E110	L85-L106 HydrophobicContact CD2-CB 4.33Å; L85-L106 HydrophobicContact CG-CB 4.13Å; L85-L106 HydrophobicContact CG-CD1 4.44Å; K86-L106 HydrophobicContact CG-CD1 3.84Å; I88-L106 HydrophobicContact CD1-CB 4.33Å; I88-L106 HydrophobicContact CD1-CD2 4.13Å; I88-L106 HydrophobicContact CG1-CD2 4.24Å; P102-L106 PolarHBondContact O-N 3.39Å; F103-L106 HydrophobicContact CD2-CD2 4.49Å; F103-L106 WeakPolarHBondContact O-CB 3.16Å; F103-L106 PolarHBondContact O-N 2.9Å; F103-L106 VanDerWaalsContact O-N 3.16Å; L106-L108 VanDerWaalsContact C-N 3.27Å; L106-L108 PolarHBondContact O-N 3.19Å; L106-L109 WeakPolarHBondContact O-CB 3.47Å; L106-L109 PolarHBondContact O-N 2.81Å; L106-L109 VanDerWaalsContact O-N 3.13Å; L106-E110 WeakPolarHBondContact O-CG 3.38Å; L106-E110 PolarHBondContact O-N 3.17Å
107	L	98.3	Very high	96.5	Very high	66 Å²	66	62.3 Å²	62.3	35%	0.346	28%	0.279	S	S	.	.	H	α-helix	trans	-60.1	-37.1	175.3	-68.2	178.4	0	0	0	112.3	F103 K111	F103-L107 HydrophobicContact CD1-CD1 4.04Å; F103-L107 HydrophobicContact CD1-CG 4.45Å; F103-L107 HydrophobicContact CE1-CD1 3.59Å; F103-L107 HydrophobicContact CE1-CD2 4.46Å; F103-L107 HydrophobicContact CE1-CG 4.08Å; F103-L107 HydrophobicContact CE2-CD2 4.33Å; F103-L107 HydrophobicContact CE2-CG 4.33Å; F103-L107 HydrophobicContact CZ-CD1 3.97Å; F103-L107 HydrophobicContact CZ-CD2 3.98Å; F103-L107 HydrophobicContact CZ-CG 4.02Å; F103-L107 WeakPolarHBondContact O-CG 3.29Å; F103-L107 PolarHBondContact O-N 3.31Å; L107-K111 WeakPolarHBondContact O-CB 3.33Å; L107-K111 PolarHBondContact O-N 3.11Å
108	L	98.4	Very high	96.4	Very high	5 Å²	5	66.1 Å²	66.1	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-67.6	-41	175.2	-178.5	59	0	0	0	111.8	L59 I72 Q104 M105 L106 K111 M112 V120 P122 L125	L59-L108 HydrophobicContact CD2-CD1 4.08Å; L59-L108 HydrophobicContact CD2-CD2 4.35Å; I72-L108 HydrophobicContact CD1-CD2 4.19Å; I72-L108 HydrophobicContact CG2-CD2 3.83Å; Q104-L108 WeakPolarHBondContact O-CB 3.22Å; Q104-L108 PolarHBondContact O-N 2.84Å; Q104-L108 VanDerWaalsContact O-N 3.07Å; M105-L108 PolarHBondContact O-N 3.32Å; L106-L108 VanDerWaalsContact C-N 3.27Å; L106-L108 PolarHBondContact O-N 3.19Å; L108-K111 PolarHBondContact O-N 3.2Å; L108-M112 HydrophobicContact CD1-CG 4.35Å; L108-M112 HydrophobicContact CD1-SD 4.33Å; L108-M112 HydrophobicContact CG-SD 4.04Å; L108-M112 WeakPolarHBondContact O-CB 3.36Å; L108-M112 WeakPolarHBondContact O-CG 3.47Å; L108-M112 PolarHBondContact O-N 2.83Å; L108-V120 HydrophobicContact CD1-CG2 3.85Å; L108-P122 HydrophobicContact CD1-CB 3.97Å; L108-P122 HydrophobicContact CD2-CB 3.67Å; L108-P122 HydrophobicContact CG-CB 4.5Å; L108-L125 HydrophobicContact CD2-CD2 3.67Å
109	L	97.4	Very high	96.3	Very high	5 Å²	5	59.7 Å²	59.7	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-60.3	-47.1	175.2	173.4	69.5	0	0	0	111.3	V76 T82 L85 K86 M105 L106 M112 Q113	V76-L109 HydrophobicContact CB-CD1 3.97Å; V76-L109 HydrophobicContact CG1-CD1 4.44Å; T82-L109 HydrophobicContact CG2-CD1 4Å; T82-L109 HydrophobicContact CG2-CD2 3.69Å; L85-L109 HydrophobicContact CD2-CD2 4.26Å; K86-L109 HydrophobicContact CG-CD2 4.39Å; M105-L109 WeakPolarHBondContact O-CB 3.26Å; M105-L109 PolarHBondContact O-N 3.33Å; L106-L109 WeakPolarHBondContact O-CB 3.47Å; L106-L109 PolarHBondContact O-N 2.81Å; L106-L109 VanDerWaalsContact O-N 3.13Å; L109-M112 PolarHBondContact O-N 2.92Å; L109-Q113 HydrophobicContact CD1-CG 4.36Å; L109-Q113 WeakPolarHBondContact O-CG 3.39Å; L109-Q113 PolarHBondContact O-N 2.95Å
110	E	96.3	Very high	96.4	Very high	80 Å²	80	54 Å²	54	37%	0.374	25%	0.252	S	S	.	.	H	α-helix	trans	-61.5	-48.2	176.1	-69.3	169.9	171.7	0	0	111.1	L106 M112 Q113 D114	L106-E110 WeakPolarHBondContact O-CG 3.38Å; L106-E110 PolarHBondContact O-N 3.17Å; E110-M112 PolarHBondContact O-N 3.05Å; E110-Q113 PolarHBondContact O-N 2.89Å; E110-D114 PolarHBondContact O-N 3.39Å
111	K	96.8	Very high	96.3	Very high	72 Å²	72	60.7 Å²	60.7	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-57.3	-33	175.1	-172.3	-179.3	-170.3	178.4	0	112.9	L107 L108 S115 V120 R121 E124	L107-K111 WeakPolarHBondContact O-CB 3.33Å; L107-K111 PolarHBondContact O-N 3.11Å; L108-K111 PolarHBondContact O-N 3.2Å; K111-S115 WeakPolarHBondContact O-CB 3.5Å; K111-S115 PolarHBondContact O-N 2.95Å; K111-V120 HydrophobicContact CG-CB 4.37Å; K111-V120 HydrophobicContact CG-CG1 4.25Å; K111-R121 PolarHBondContact NZ-O 2.82Å; K111-E124 IonicContact NZ-OE1 2.73Å; K111-E124 PolarHBondContact NZ-OE1 2.97Å; K111-E124 IonicContact NZ-OE2 2.92Å; K111-E124 PolarHBondContact NZ-OE2 3.27Å
112	M	95.6	Very high	96.2	Very high	16 Å²	16	60.8 Å²	60.8	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-74.9	-41.3	173.1	-71.3	169	77.2	0	0	111.9	V57 L59 V76 L108 L109 E110 S115 V120	V57-M112 HydrophobicContact CB-CB 4.37Å; V57-M112 HydrophobicContact CG1-CB 4.46Å; V57-M112 HydrophobicContact CG1-CG 4.38Å; V57-M112 WeakPolarHBondContact CG2-O 3.33Å; V57-M112 WeakPolarHBondContact O-CE 3.24Å; L59-M112 HydrophobicContact CD2-CE 4.29Å; L59-M112 HydrophobicContact CD2-SD 3.96Å; L59-M112 HydrophobicContact CG-CE 4.45Å; V76-M112 HydrophobicContact CG2-CE 3.96Å; V76-M112 HydrophobicContact CG2-SD 4.22Å; L108-M112 HydrophobicContact CD1-CG 4.35Å; L108-M112 HydrophobicContact CD1-SD 4.33Å; L108-M112 HydrophobicContact CG-SD 4.04Å; L108-M112 WeakPolarHBondContact O-CB 3.36Å; L108-M112 WeakPolarHBondContact O-CG 3.47Å; L108-M112 PolarHBondContact O-N 2.83Å; L109-M112 PolarHBondContact O-N 2.92Å; E110-M112 PolarHBondContact O-N 3.05Å; M112-S115 PolarHBondContact O-N 3.23Å; M112-V120 HydrophobicContact CG-CG2 3.51Å
113	Q	92.3	Very high	96.1	Very high	115 Å²	115	63.3 Å²	63.3	54%	0.537	29%	0.289	S	S	.	.	H	α-helix	trans	-68.7	-36	-179.5	-72.8	-177.2	-23.5	0	0	112.8	L109 E110	L109-Q113 HydrophobicContact CD1-CG 4.36Å; L109-Q113 WeakPolarHBondContact O-CG 3.39Å; L109-Q113 PolarHBondContact O-N 2.95Å; E110-Q113 PolarHBondContact O-N 2.89Å
114	D	93.1	Very high	96.1	Very high	139 Å²	139	66.5 Å²	66.5	74%	0.743	30%	0.304	S	S	*	.	S	Bend	trans	-87.3	-10.9	179.1	-66.6	-24.7	0	0	0	113.7	E110 R116	E110-D114 PolarHBondContact O-N 3.39Å; D114-R116 PolarHBondContact O-N 2.9Å
115	S	93.5	Very high	96	Very high	28 Å²	28	66 Å²	66	20%	0.196	30%	0.302	C	S	.	.			trans	-71.9	127.8	-174.8	169.3	0	0	0	0	112.7	K111 M112 Q117	K111-S115 WeakPolarHBondContact O-CB 3.5Å; K111-S115 PolarHBondContact O-N 2.95Å; M112-S115 PolarHBondContact O-N 3.23Å; S115-Q117 VanDerWaalsContact C-N 3.34Å; S115-Q117 PolarHBondContact OG-N 3.44Å; S115-Q117 PolarHBondContact OG-O 3.11Å; S115-Q117 VanDerWaalsContact OG-O 3.11Å
116	R	91.7	Very high	95.9	Very high	246 Å²	246	66 Å²	66	93%	0.928	30%	0.302	S	S	*	.			trans	-90.7	4.3	166.5	-55	-177.2	-171.9	-179.3	1.5	113.3	D114	D114-R116 PolarHBondContact O-N 2.9Å
117	Q	92.8	Very high	95.8	Very high	139 Å²	139	72.1 Å²	72.1	65%	0.65	33%	0.326	S	S	*	.	S	Bend	trans	-95.8	151.1	178.1	-59.6	-60.1	-32.7	0	0	110.7	S115 A119	S115-Q117 VanDerWaalsContact C-N 3.34Å; S115-Q117 PolarHBondContact OG-N 3.44Å; S115-Q117 PolarHBondContact OG-O 3.11Å; S115-Q117 VanDerWaalsContact OG-O 3.11Å; Q117-A119 PolarHBondContact O-N 3.01Å; Q117-A119 VanDerWaalsContact O-N 3.13Å
118	K	93.7	Very high	95.8	Very high	138 Å²	138	69 Å²	69	60%	0.6	31%	0.309	S	S	*	.	S	Bend	trans	-56.3	-29.3	176.8	-66.6	-169.3	176.6	-167.8	0	113.4	G58	G58-K118 PolarHBondContact N-O 2.76Å
119	A	96.9	Very high	95.8	Very high	6 Å²	6	68.8 Å²	68.8	5%	0.05	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	158.1	179.4	0	0	0	0	0	111.7	G58 Q117 S339	G58-A119 CarbonylContact O-C 3.54Å; G58-A119 WeakPolarHBondContact O-CA 3.33Å; G58-A119 WeakPolarHBondContact O-CB 3.29Å; Q117-A119 PolarHBondContact O-N 3.01Å; Q117-A119 VanDerWaalsContact O-N 3.13Å; A119-S339 VanDerWaalsContact CB-CB 3.49Å
120	V	97.8	Very high	95.7	Very high	12 Å²	12	72.3 Å²	72.3	7%	0.073	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	163	172.4	-61.1	0	0	0	0	111.2	V57 G58 L59 H60 L108 K111 M112	V57-V120 HydrophobicContact CG1-CG1 3.96Å; V57-V120 HydrophobicContact CG1-CG2 4.43Å; G58-V120 PolarHBondContact O-N 3.35Å; L59-V120 WeakPolarHBondContact CA-O 3.36Å; L59-V120 HydrophobicContact CD2-CG2 3.78Å; H60-V120 PolarHBondContact N-O 3.14Å; L108-V120 HydrophobicContact CD1-CG2 3.85Å; K111-V120 HydrophobicContact CG-CB 4.37Å; K111-V120 HydrophobicContact CG-CG1 4.25Å; M112-V120 HydrophobicContact CG-CG2 3.51Å
121	R	97.4	Very high	95.7	Very high	153 Å²	153	73.6 Å²	73.6	58%	0.577	33%	0.329	S	S	*	.			trans	-97.9	120.9	175.2	-60	-175.4	173	177.9	-3.2	109.9	H60 K111 L123	H60-R121 HydrophobicContact CB-CG 4.03Å; K111-R121 PolarHBondContact NZ-O 2.82Å; R121-L123 HydrophobicContact CB-CD1 4.33Å; R121-L123 HydrophobicContact CB-CG 4Å; R121-L123 PolarHBondContact O-N 2.93Å; R121-L123 VanDerWaalsContact O-N 3.14Å
122	P	96.8	Very high	95.7	Very high	2 Å²	2	72.4 Å²	72.4	1%	0.013	32%	0.323	C	S	.	.			trans	-86.7	44.4	179.5	36.7	-36.8	0	0	0	112.2	L59 L108 E124 A126	L59-P122 HydrophobicContact CD2-CB 4.34Å; L59-P122 HydrophobicContact CD2-CG 4.38Å; L108-P122 HydrophobicContact CD1-CB 3.97Å; L108-P122 HydrophobicContact CD2-CB 3.67Å; L108-P122 HydrophobicContact CG-CB 4.5Å; P122-E124 PolarHBondContact O-N 3.01Å; P122-A126 WeakPolarHBondContact O-CB 3.21Å; P122-A126 PolarHBondContact O-N 3.33Å
123	L	96.4	Very high	95.6	Very high	56 Å²	56	78.6 Å²	78.6	29%	0.293	36%	0.356	S	S	.	.	H	α-helix	trans	-63.2	-43.3	-172.2	-67.4	174	0	0	0	111.9	I62 R121 A126 Y127	I62-L123 HydrophobicContact CD1-CD2 3.98Å; I62-L123 HydrophobicContact CG2-CD2 4.04Å; R121-L123 HydrophobicContact CB-CD1 4.33Å; R121-L123 HydrophobicContact CB-CG 4Å; R121-L123 PolarHBondContact O-N 2.93Å; R121-L123 VanDerWaalsContact O-N 3.14Å; L123-A126 PolarHBondContact O-N 2.96Å; L123-Y127 HydrophobicContact CB-CD2 4.32Å; L123-Y127 HydrophobicContact CB-CE2 3.95Å; L123-Y127 WeakPolarHBondContact O-CD2 3.39Å; L123-Y127 PolarHBondContact O-N 3.18Å
124	E	97.3	Very high	95.7	Very high	87 Å²	87	73.3 Å²	73.3	41%	0.407	33%	0.332	S	S	.	.	H	α-helix	trans	-66.6	-40.8	-174	-53.7	87.1	159.6	0	0	110.9	Q104 K111 P122 C128	Q104-E124 VanDerWaalsContact OE1-CB 3.27Å; K111-E124 IonicContact NZ-OE1 2.73Å; K111-E124 PolarHBondContact NZ-OE1 2.97Å; K111-E124 IonicContact NZ-OE2 2.92Å; K111-E124 PolarHBondContact NZ-OE2 3.27Å; P122-E124 PolarHBondContact O-N 3.01Å; E124-C128 WeakPolarHBondContact O-CB 3.19Å; E124-C128 PolarHBondContact O-N 2.74Å; E124-C128 VanDerWaalsContact O-N 3.08Å
125	L	97.8	Very high	95.6	Very high	4 Å²	4	69.8 Å²	69.8	2%	0.021	32%	0.317	C	S	.	.	H	α-helix	trans	-68.2	-41.9	170.8	-179.5	59.8	0	0	0	112.1	I72 V101 Q104 M105 L108 C128 L129	I72-L125 HydrophobicContact CD1-CD2 3.67Å; I72-L125 HydrophobicContact CG1-CD2 4.09Å; V101-L125 HydrophobicContact CG1-CD1 4.35Å; Q104-L125 HydrophobicContact CB-CB 4.22Å; Q104-L125 HydrophobicContact CB-CD1 3.81Å; M105-L125 HydrophobicContact CG-CD1 3.82Å; M105-L125 HydrophobicContact CG-CD2 3.81Å; L108-L125 HydrophobicContact CD2-CD2 3.67Å; L125-C128 WeakPolarHBondContact O-CB 3.45Å; L125-C128 PolarHBondContact O-N 3.47Å; L125-L129 HydrophobicContact CD1-CD1 4.16Å; L125-L129 HydrophobicContact CD1-CG 4.11Å; L125-L129 HydrophobicContact CG-CD1 4Å; L125-L129 HydrophobicContact CG-CG 4.39Å; L125-L129 WeakPolarHBondContact O-CB 3.28Å; L125-L129 VanDerWaalsContact O-CG 3.3Å; L125-L129 WeakPolarHBondContact O-CG 3.43Å; L125-L129 PolarHBondContact O-N 3.27Å
126	A	96.3	Very high	95.4	Very high	4 Å²	4	69.4 Å²	69.4	3%	0.033	31%	0.312	C	S	.	.	H	α-helix	trans	-61.6	-46.5	177.5	0	0	0	0	0	112.4	I62 P122 L123 C128 L129 Q130 M136	I62-A126 HydrophobicContact CD1-CB 3.63Å; P122-A126 WeakPolarHBondContact O-CB 3.21Å; P122-A126 PolarHBondContact O-N 3.33Å; L123-A126 PolarHBondContact O-N 2.96Å; A126-C128 VanDerWaalsContact C-N 3.28Å; A126-C128 PolarHBondContact O-N 3.12Å; A126-L129 PolarHBondContact O-N 2.86Å; A126-Q130 WeakPolarHBondContact O-CG 3.44Å; A126-Q130 PolarHBondContact O-N 3Å; A126-M136 HydrophobicContact CB-CG 4.49Å; A126-M136 HydrophobicContact CB-SD 3.92Å
127	Y	96.1	Very high	95.2	Very high	141 Å²	141	63.7 Å²	63.7	55%	0.553	29%	0.294	S	S	*	.	H	α-helix	trans	-64.1	-31.4	174.3	-65.6	-49	0	0	0	112.8	L123	L123-Y127 HydrophobicContact CB-CD2 4.32Å; L123-Y127 HydrophobicContact CB-CE2 3.95Å; L123-Y127 WeakPolarHBondContact O-CD2 3.39Å; L123-Y127 PolarHBondContact O-N 3.18Å
128	C	98	Very high	94.9	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.007	28%	0.28	C	S	.	.	H	α-helix	trans	-66.4	-50.3	172.3	-174.3	0	0	0	0	111.1	R99 Q104 E124 L125 A126 Q130 K131 Y132	R99-C128 PolarHBondContact O-SG 3.35Å; Q104-C128 HydrophobicContact CB-CB 4.38Å; Q104-C128 HydrophobicContact CG-CB 3.84Å; E124-C128 WeakPolarHBondContact O-CB 3.19Å; E124-C128 PolarHBondContact O-N 2.74Å; E124-C128 VanDerWaalsContact O-N 3.08Å; L125-C128 WeakPolarHBondContact O-CB 3.45Å; L125-C128 PolarHBondContact O-N 3.47Å; A126-C128 VanDerWaalsContact C-N 3.28Å; A126-C128 PolarHBondContact O-N 3.12Å; C128-Q130 VanDerWaalsContact C-N 3.33Å; C128-Q130 PolarHBondContact O-N 3.29Å; C128-K131 WeakPolarHBondContact O-CB 3.47Å; C128-K131 PolarHBondContact O-N 3.15Å; C128-K131 VanDerWaalsContact O-N 3.07Å; C128-Y132 WeakPolarHBondContact O-CD2 3.49Å
129	L	97.5	Very high	94.5	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-34.5	-179	-70.9	172.8	0	0	0	113.3	L68 V101 L125 A126 K131 Y132 V134 M136 L149 L152	L68-L129 HydrophobicContact CD1-CD1 3.75Å; L68-L129 HydrophobicContact CD2-CD1 3.96Å; V101-L129 HydrophobicContact CG1-CD2 4.06Å; V101-L129 HydrophobicContact CG2-CD2 3.98Å; L125-L129 HydrophobicContact CD1-CD1 4.16Å; L125-L129 HydrophobicContact CD1-CG 4.11Å; L125-L129 HydrophobicContact CG-CD1 4Å; L125-L129 HydrophobicContact CG-CG 4.39Å; L125-L129 WeakPolarHBondContact O-CB 3.28Å; L125-L129 VanDerWaalsContact O-CG 3.3Å; L125-L129 WeakPolarHBondContact O-CG 3.43Å; L125-L129 PolarHBondContact O-N 3.27Å; A126-L129 PolarHBondContact O-N 2.86Å; L129-K131 PolarHBondContact O-N 3.05Å; L129-Y132 PolarHBondContact O-N 3.2Å; L129-V134 HydrophobicContact CB-CB 4.04Å; L129-V134 HydrophobicContact CB-CG1 4.44Å; L129-V134 HydrophobicContact CB-CG2 4.38Å; L129-V134 HydrophobicContact CD2-CG2 4.48Å; L129-V134 WeakPolarHBondContact O-CB 3.26Å; L129-V134 PolarHBondContact O-N 2.87Å; L129-M136 HydrophobicContact CB-CE 4.24Å; L129-L149 HydrophobicContact CD1-CD2 3.76Å; L129-L149 HydrophobicContact CD2-CD2 3.48Å; L129-L149 VanDerWaalsContact CD2-CD2 3.48Å; L129-L149 HydrophobicContact CG-CD2 4.29Å; L129-L152 HydrophobicContact CD2-CD1 4.08Å
130	Q	95.5	Very high	94.2	Very high	80 Å²	80	58.3 Å²	58.3	37%	0.374	27%	0.274	S	S	.	.	H	α-helix	trans	-55.8	-35.4	172.7	-77.3	179.4	-33.6	0	0	112.9	A126 C128 Y132 N133 M136	A126-Q130 WeakPolarHBondContact O-CG 3.44Å; A126-Q130 PolarHBondContact O-N 3Å; C128-Q130 VanDerWaalsContact C-N 3.33Å; C128-Q130 PolarHBondContact O-N 3.29Å; Q130-Y132 PolarHBondContact O-N 3.38Å; Q130-N133 PolarHBondContact O-N 3.31Å; Q130-M136 HydrophobicContact CG-CE 4.44Å; Q130-M136 HydrophobicContact CG-CG 3.66Å
131	K	96.2	Very high	94	Very high	106 Å²	106	59.4 Å²	59.4	46%	0.461	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-10.9	177.1	-58.6	173.8	-173.2	173.1	0	113.7	R98 R99 C128 L129	R98-K131 PolarHBondContact O-NZ 3.23Å; R99-K131 HydrophobicContact CG-CD 3.88Å; C128-K131 WeakPolarHBondContact O-CB 3.47Å; C128-K131 PolarHBondContact O-N 3.15Å; C128-K131 VanDerWaalsContact O-N 3.07Å; L129-K131 PolarHBondContact O-N 3.05Å
132	Y	96.9	Very high	94	Very high	48 Å²	48	52.1 Å²	52.1	19%	0.188	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	21.8	179.1	-66.1	-76.6	0	0	0	113.3	R99 V101 C128 L129 Q130 V134 K148 L152 Q156	R99-Y132 WeakPolarHBondContact O-CE2 3.45Å; R99-Y132 PolarHBondContact O-OH 2.86Å; V101-Y132 HydrophobicContact CG2-CD2 3.96Å; V101-Y132 HydrophobicContact CG2-CE2 3.99Å; C128-Y132 WeakPolarHBondContact O-CD2 3.49Å; L129-Y132 PolarHBondContact O-N 3.2Å; Q130-Y132 PolarHBondContact O-N 3.38Å; Y132-V134 VanDerWaalsContact C-N 3.3Å; Y132-V134 PolarHBondContact O-N 3.08Å; Y132-K148 VanDerWaalsContact O-CE 3.28Å; Y132-K148 WeakPolarHBondContact O-CE 3.32Å; Y132-K148 PolarHBondContact O-NZ 2.66Å; Y132-L152 HydrophobicContact CD1-CD2 3.53Å; Y132-L152 HydrophobicContact CD2-CD2 4.45Å; Y132-L152 HydrophobicContact CE1-CD2 4.28Å; Y132-L152 HydrophobicContact CG-CD1 4.17Å; Y132-L152 HydrophobicContact CG-CD2 3.64Å; Y132-Q156 VanDerWaalsContact CZ-NE2 3.31Å
133	N	94.6	Very high	94	Very high	145 Å²	145	52.5 Å²	52.5	78%	0.775	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	37.1	-177.4	-56	-32.7	0	0	0	113	Q130 P135	Q130-N133 PolarHBondContact O-N 3.31Å; N133-P135 WeakPolarHBondContact O-CD 3.45Å
134	V	94.1	Very high	94	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.024	27%	0.271	C	S	.	.			trans	-97.3	95.5	163.6	-174.4	0	0	0	0	107.4	L129 Y132 M136 L145 K148 L152	L129-V134 HydrophobicContact CB-CB 4.04Å; L129-V134 HydrophobicContact CB-CG1 4.44Å; L129-V134 HydrophobicContact CB-CG2 4.38Å; L129-V134 HydrophobicContact CD2-CG2 4.48Å; L129-V134 WeakPolarHBondContact O-CB 3.26Å; L129-V134 PolarHBondContact O-N 2.87Å; Y132-V134 VanDerWaalsContact C-N 3.3Å; Y132-V134 PolarHBondContact O-N 3.08Å; V134-M136 HydrophobicContact CB-CE 4.35Å; V134-M136 HydrophobicContact CG1-CE 3.83Å; V134-M136 VanDerWaalsContact O-CE 3.28Å; V134-M136 WeakPolarHBondContact O-CE 3.36Å; V134-L145 HydrophobicContact CG1-CD1 3.67Å; V134-K148 HydrophobicContact CG2-CG 3.98Å; V134-L152 HydrophobicContact CG2-CD1 4.28Å
135	P	90.1	Very high	94	Very high	66 Å²	66	52.3 Å²	52.3	43%	0.429	25%	0.253	S	S	.	.			trans	-62.2	141.2	178.9	24.1	-34.6	0	0	0	111.5	N133 V138 H140	N133-P135 WeakPolarHBondContact O-CD 3.45Å; P135-V138 HydrophobicContact CB-CG1 4.24Å; P135-V138 HydrophobicContact CB-CG2 3.91Å; P135-V138 HydrophobicContact CG-CG2 3.62Å; P135-H140 PolarHBondContact O-CE1 3.23Å; P135-H140 PolarHBondContact O-NE2 2.79Å
136	M	90.3	Very high	94	Very high	19 Å²	19	52.2 Å²	52.2	9%	0.094	25%	0.252	C	S	.	.	S	Bend	trans	-92.5	167.3	166.8	-60	-63.2	115.6	0	0	109.2	T65 L68 A126 L129 Q130 V134 V138	T65-M136 HydrophobicContact CG2-SD 4.13Å; L68-M136 HydrophobicContact CD2-CE 4.16Å; L68-M136 HydrophobicContact CD2-SD 4.13Å; A126-M136 HydrophobicContact CB-CG 4.49Å; A126-M136 HydrophobicContact CB-SD 3.92Å; L129-M136 HydrophobicContact CB-CE 4.24Å; Q130-M136 HydrophobicContact CG-CE 4.44Å; Q130-M136 HydrophobicContact CG-CG 3.66Å; V134-M136 HydrophobicContact CB-CE 4.35Å; V134-M136 HydrophobicContact CG1-CE 3.83Å; V134-M136 VanDerWaalsContact O-CE 3.28Å; V134-M136 WeakPolarHBondContact O-CE 3.36Å; M136-V138 PolarHBondContact O-N 3.33Å
137	F	86.3	Confident	94.1	Very high	126 Å²	126	56 Å²	56	55%	0.553	27%	0.271	S	S	*	.	S	Bend	trans	62.8	22.5	179.5	-43.3	-82.5	0	0	0	114.9	I62 G63 Q64	I62-F137 WeakPolarHBondContact O-CE1 3.48Å; G63-F137 VanDerWaalsContact O-CA 3.31Å; G63-F137 WeakPolarHBondContact O-CA 3.24Å; G63-F137 WeakPolarHBondContact O-CD1 3.26Å; G63-F137 PolarHBondContact O-N 3.4Å; Q64-F137 PolarHBondContact NE2-O 2.99Å
138	V	86.5	Confident	94.2	Very high	58 Å²	58	53.4 Å²	53.4	35%	0.352	26%	0.263	S	S	.	.	S	Bend	trans	-126.1	155.5	173.4	-53.9	0	0	0	0	110.8	P135 M136 H140	P135-V138 HydrophobicContact CB-CG1 4.24Å; P135-V138 HydrophobicContact CB-CG2 3.91Å; P135-V138 HydrophobicContact CG-CG2 3.62Å; M136-V138 PolarHBondContact O-N 3.33Å; V138-H140 WeakPolarHBondContact CG2-NE2 3.39Å; V138-H140 PolarHBondContact O-CD2 2.84Å
139	Q	86	Confident	94.2	Very high	76 Å²	76	53.6 Å²	53.6	36%	0.355	26%	0.264	S	S	.	.			trans	-70.3	130.7	170	-57.1	-107.9	-47.1	0	0	108.8	S318 G319	Q139-S318 VanDerWaalsContact OE1-CA 3.24Å; Q139-G319 PolarHBondContact NE2-O 2.94Å; Q139-G319 VanDerWaalsContact NE2-O 3.12Å
140	H	90.1	Very high	94.3	Very high	36 Å²	36	53.6 Å²	53.6	17%	0.167	26%	0.264	C	S	.	.			trans	-113.5	137.2	177.6	-76.6	-86.1	0	0	0	110.8	C67 P135 V138 A142 L145 Y321	C67-H140 HydrophobicContact CB-CB 4.11Å; C67-H140 PolarHBondContact SG-O 3.36Å; C67-H140 VanDerWaalsContact SG-O 3.39Å; P135-H140 PolarHBondContact O-CE1 3.23Å; P135-H140 PolarHBondContact O-NE2 2.79Å; V138-H140 WeakPolarHBondContact CG2-NE2 3.39Å; V138-H140 PolarHBondContact O-CD2 2.84Å; H140-A142 PolarHBondContact O-N 3.4Å; H140-L145 HydrophobicContact CB-CB 4.31Å; H140-L145 HydrophobicContact CB-CD2 3.9Å; H140-Y321 VanDerWaalsContact O-CE2 3.31Å; H140-Y321 WeakPolarHBondContact O-CE2 3.25Å; H140-Y321 PolarHBondContact O-OH 2.89Å
141	D	94.7	Very high	94.4	Very high	35 Å²	35	52.3 Å²	52.3	19%	0.187	26%	0.26	C	S	.	.			trans	-67.8	118.1	160.4	175.3	-57.7	0	0	0	108.7	A143 Q144 L145 Y365	D141-A143 VanDerWaalsContact C-N 3.28Å; D141-A143 PolarHBondContact O-N 3.13Å; D141-A143 WeakPolarHBondContact OD1-CA 3.45Å; D141-A143 WeakPolarHBondContact OD1-CB 3.42Å; D141-A143 PolarHBondContact OD1-N 3.04Å; D141-Q144 HydrophobicContact CB-CB 4.11Å; D141-Q144 HydrophobicContact CB-CG 4.05Å; D141-Q144 VanDerWaalsContact CG-NE2 3.27Å; D141-Q144 PolarHBondContact O-N 2.85Å; D141-Q144 WeakPolarHBondContact OD1-CG 3.49Å; D141-Q144 PolarHBondContact OD1-N 3.15Å; D141-Q144 PolarHBondContact OD2-NE2 3.36Å; D141-Q144 VanDerWaalsContact OD2-NE2 3.12Å; D141-L145 WeakPolarHBondContact O-CB 3.3Å; D141-L145 PolarHBondContact O-N 3.01Å; D141-Y365 PolarHBondContact OD1-OH 2.83Å; D141-Y365 PolarHBondContact OD2-OH 2.75Å
142	A	96.5	Very high	94.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.2	-27.7	-174.3	0	0	0	0	0	113.6	C67 H140 Y146 Y321 Y365 L366	C67-A142 VanDerWaalsContact SG-CA 3.56Å; H140-A142 PolarHBondContact O-N 3.4Å; A142-Y146 WeakPolarHBondContact O-CB 3.25Å; A142-Y146 PolarHBondContact O-N 3.35Å; A142-Y321 HydrophobicContact CB-CD1 4.29Å; A142-Y321 HydrophobicContact CB-CE1 3.6Å; A142-Y321 PolarHBondContact N-OH 2.84Å; A142-Y365 HydrophobicContact CB-CD1 3.88Å; A142-Y365 HydrophobicContact CB-CE1 3.82Å; A142-L366 HydrophobicContact CB-CD1 4.43Å
143	A	96.9	Very high	94.6	Very high	10 Å²	10	45.7 Å²	45.7	8%	0.083	23%	0.232	C	C	.	.	H	α-helix	trans	-74.5	-40.6	178.7	0	0	0	0	0	110.8	D141 L147 H257 Y365 L366	D141-A143 VanDerWaalsContact C-N 3.28Å; D141-A143 PolarHBondContact O-N 3.13Å; D141-A143 WeakPolarHBondContact OD1-CA 3.45Å; D141-A143 WeakPolarHBondContact OD1-CB 3.42Å; D141-A143 PolarHBondContact OD1-N 3.04Å; A143-L147 WeakPolarHBondContact O-CB 3.25Å; A143-L147 PolarHBondContact O-N 3.04Å; A143-L147 VanDerWaalsContact O-N 3.11Å; A143-H257 HydrophobicContact CB-CB 4.48Å; A143-Y365 HydrophobicContact CB-CE1 4.02Å; A143-L366 HydrophobicContact CB-CD2 4Å
144	Q	96.2	Very high	94.8	Very high	134 Å²	134	40.6 Å²	40.6	63%	0.626	20%	0.203	S	C	*	.	H	α-helix	trans	-66.6	-44.3	174.2	-65.7	178	52.6	0	0	111.5	D141 L147 K148	D141-Q144 HydrophobicContact CB-CB 4.11Å; D141-Q144 HydrophobicContact CB-CG 4.05Å; D141-Q144 VanDerWaalsContact CG-NE2 3.27Å; D141-Q144 PolarHBondContact O-N 2.85Å; D141-Q144 WeakPolarHBondContact OD1-CG 3.49Å; D141-Q144 PolarHBondContact OD1-N 3.15Å; D141-Q144 PolarHBondContact OD2-NE2 3.36Å; D141-Q144 VanDerWaalsContact OD2-NE2 3.12Å; Q144-L147 PolarHBondContact O-N 2.9Å; Q144-K148 WeakPolarHBondContact O-CB 3.47Å; Q144-K148 PolarHBondContact O-N 2.84Å
145	L	97.6	Very high	95	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-67.1	-40	177.9	-176.3	58.4	0	0	0	111.6	L68 L71 V134 H140 D141 K148 L149	L68-L145 HydrophobicContact CB-CD2 4.14Å; L68-L145 HydrophobicContact CD1-CD2 4.44Å; L71-L145 HydrophobicContact CD1-CB 3.77Å; L71-L145 HydrophobicContact CD1-CD2 3.83Å; L71-L145 HydrophobicContact CD1-CG 3.64Å; V134-L145 HydrophobicContact CG1-CD1 3.67Å; H140-L145 HydrophobicContact CB-CB 4.31Å; H140-L145 HydrophobicContact CB-CD2 3.9Å; D141-L145 WeakPolarHBondContact O-CB 3.3Å; D141-L145 PolarHBondContact O-N 3.01Å; L145-K148 PolarHBondContact O-N 3.14Å; L145-L149 HydrophobicContact CD1-CD1 4.33Å; L145-L149 HydrophobicContact CD1-CG 4.06Å; L145-L149 HydrophobicContact CG-CD1 4.05Å; L145-L149 HydrophobicContact CG-CG 4.26Å; L145-L149 WeakPolarHBondContact O-CB 3.42Å; L145-L149 VanDerWaalsContact O-CG 3.28Å; L145-L149 WeakPolarHBondContact O-CG 3.37Å; L145-L149 PolarHBondContact O-N 3.3Å
146	Y	98.6	Very high	95.4	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-55.9	-51.4	172.8	173.2	-101.9	0	0	0	111.8	L71 F75 A142 K148 L149 W150 Y170 L194 T195 T255 L366	L71-Y146 HydrophobicContact CD2-CD2 4.17Å; F75-Y146 AromaticContact CE1-CE2 3.89Å; F75-Y146 HydrophobicContact CE1-CE2 3.89Å; F75-Y146 AromaticContact CE2-CD2 3.91Å; F75-Y146 HydrophobicContact CE2-CD2 3.91Å; F75-Y146 HydrophobicContact CE2-CE2 4.09Å; F75-Y146 AromaticContact CZ-CD2 3.58Å; F75-Y146 HydrophobicContact CZ-CD2 3.58Å; F75-Y146 AromaticContact CZ-CE2 3.35Å; F75-Y146 HydrophobicContact CZ-CE2 3.35Å; A142-Y146 WeakPolarHBondContact O-CB 3.25Å; A142-Y146 PolarHBondContact O-N 3.35Å; Y146-K148 VanDerWaalsContact C-N 3.32Å; Y146-K148 PolarHBondContact O-N 3.26Å; Y146-L149 PolarHBondContact O-N 3.18Å; Y146-W150 WeakPolarHBondContact O-CB 3.48Å; Y146-W150 PolarHBondContact O-N 3.43Å; Y146-Y170 VanDerWaalsContact OH-CD1 3.25Å; Y146-Y170 WeakPolarHBondContact OH-CD1 3.28Å; Y146-L194 HydrophobicContact CE1-CB 3.97Å; Y146-T195 HydrophobicContact CD1-CG2 3.71Å; Y146-T195 HydrophobicContact CE1-CG2 3.6Å; Y146-T255 HydrophobicContact CE1-CG2 4.15Å; Y146-T255 PolarHBondContact OH-OG1 2.86Å; Y146-T255 VanDerWaalsContact OH-OG1 3.13Å; Y146-L366 HydrophobicContact CG-CD1 4.39Å
147	L	98.1	Very high	95.7	Very high	84 Å²	84	44.3 Å²	44.3	44%	0.44	22%	0.218	S	C	.	.	H	α-helix	trans	-60	-40.9	176.5	176.4	63.3	0	0	0	112.1	A143 Q144 N151 L194	A143-L147 WeakPolarHBondContact O-CB 3.25Å; A143-L147 PolarHBondContact O-N 3.04Å; A143-L147 VanDerWaalsContact O-N 3.11Å; Q144-L147 PolarHBondContact O-N 2.9Å; L147-N151 WeakPolarHBondContact CD1-ND2 3.45Å; L147-N151 WeakPolarHBondContact O-CB 3.41Å; L147-N151 PolarHBondContact O-N 2.97Å; L147-N151 VanDerWaalsContact O-N 3.11Å; L147-N151 PolarHBondContact O-ND2 3.28Å; L147-L194 HydrophobicContact CD1-CD1 3.58Å; L147-L194 HydrophobicContact CD1-CG 4.28Å
148	K	98.3	Very high	96.2	Very high	87 Å²	87	43.5 Å²	43.5	38%	0.378	22%	0.224	S	C	.	.	H	α-helix	trans	-67	-45.6	179.2	-178.3	60.9	172	179.6	0	111.8	Y132 V134 Q144 L145 Y146 L152	Y132-K148 VanDerWaalsContact O-CE 3.28Å; Y132-K148 WeakPolarHBondContact O-CE 3.32Å; Y132-K148 PolarHBondContact O-NZ 2.66Å; V134-K148 HydrophobicContact CG2-CG 3.98Å; Q144-K148 WeakPolarHBondContact O-CB 3.47Å; Q144-K148 PolarHBondContact O-N 2.84Å; L145-K148 PolarHBondContact O-N 3.14Å; Y146-K148 VanDerWaalsContact C-N 3.32Å; Y146-K148 PolarHBondContact O-N 3.26Å; K148-L152 HydrophobicContact CD-CD1 4.32Å; K148-L152 HydrophobicContact CD-CG 4.44Å; K148-L152 HydrophobicContact CG-CD1 4.24Å; K148-L152 WeakPolarHBondContact O-CB 3.46Å; K148-L152 VanDerWaalsContact O-CG 3.26Å; K148-L152 WeakPolarHBondContact O-CG 3.44Å; K148-L152 PolarHBondContact O-N 3.24Å
149	L	98.4	Very high	96.7	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-50.5	176.6	-71.5	173.3	0	0	0	111.1	L68 L71 F75 L129 L145 Y146 N151 L152 I153	L68-L149 HydrophobicContact CD1-CD1 3.89Å; L68-L149 HydrophobicContact CD1-CD2 4.2Å; L71-L149 HydrophobicContact CB-CD1 4.07Å; L71-L149 HydrophobicContact CD1-CD1 4.06Å; F75-L149 HydrophobicContact CE2-CB 4.39Å; L129-L149 HydrophobicContact CD1-CD2 3.76Å; L129-L149 HydrophobicContact CD2-CD2 3.48Å; L129-L149 VanDerWaalsContact CD2-CD2 3.48Å; L129-L149 HydrophobicContact CG-CD2 4.29Å; L145-L149 HydrophobicContact CD1-CD1 4.33Å; L145-L149 HydrophobicContact CD1-CG 4.06Å; L145-L149 HydrophobicContact CG-CD1 4.05Å; L145-L149 HydrophobicContact CG-CG 4.26Å; L145-L149 WeakPolarHBondContact O-CB 3.42Å; L145-L149 VanDerWaalsContact O-CG 3.28Å; L145-L149 WeakPolarHBondContact O-CG 3.37Å; L145-L149 PolarHBondContact O-N 3.3Å; Y146-L149 PolarHBondContact O-N 3.18Å; L149-N151 PolarHBondContact O-N 2.79Å; L149-L152 PolarHBondContact O-N 3.38Å; L149-L152 VanDerWaalsContact O-N 3.17Å; L149-I153 WeakPolarHBondContact O-CD1 3.42Å; L149-I153 VanDerWaalsContact O-CG1 3.25Å; L149-I153 WeakPolarHBondContact O-CG1 3.33Å; L149-I153 PolarHBondContact O-N 2.88Å
150	W	98.6	Very high	97.3	Very high	1 Å²	1	44.4 Å²	44.4	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-60.2	-43	-178.5	-170.2	99.4	0	0	0	112.5	F75 Y146 I153 K154 L166 Q167 Y170 M171 L194	F75-W150 HydrophobicContact CZ-CB 4.38Å; Y146-W150 WeakPolarHBondContact O-CB 3.48Å; Y146-W150 PolarHBondContact O-N 3.43Å; W150-I153 PolarHBondContact O-N 2.92Å; W150-K154 HydrophobicContact CE3-CB 4.26Å; W150-K154 HydrophobicContact CH2-CB 4.43Å; W150-K154 HydrophobicContact CH2-CD 3.64Å; W150-K154 HydrophobicContact CH2-CG 4.34Å; W150-K154 HydrophobicContact CZ3-CB 4.08Å; W150-K154 HydrophobicContact CZ3-CD 3.57Å; W150-K154 HydrophobicContact CZ3-CG 4.3Å; W150-K154 WeakPolarHBondContact O-CB 3.39Å; W150-K154 PolarHBondContact O-N 3.38Å; W150-L166 HydrophobicContact CZ2-CG 4.06Å; W150-Q167 HydrophobicContact CH2-CG 3.95Å; W150-Q167 HydrophobicContact CZ2-CG 4.44Å; W150-Y170 AromaticContact CD1-CD2 3.96Å; W150-Y170 AromaticContact NE1-CD2 3.23Å; W150-Y170 AromaticContact NE1-CE2 3.97Å; W150-Y170 AromaticContact NE1-CG 3.48Å; W150-M171 HydrophobicContact CH2-CE 3.48Å; W150-M171 VanDerWaalsContact CH2-CE 3.48Å; W150-M171 HydrophobicContact CZ2-CE 4.28Å; W150-M171 HydrophobicContact CZ3-CE 3.96Å; W150-L194 HydrophobicContact CB-CD1 3.79Å; W150-L194 HydrophobicContact CD2-CD1 3.46Å; W150-L194 VanDerWaalsContact CD2-CD1 3.46Å; W150-L194 HydrophobicContact CD2-CD2 3.75Å; W150-L194 HydrophobicContact CD2-CG 4.26Å; W150-L194 HydrophobicContact CE3-CD1 3.41Å; W150-L194 VanDerWaalsContact CE3-CD1 3.41Å; W150-L194 HydrophobicContact CE3-CD2 3.83Å; W150-L194 HydrophobicContact CE3-CG 4.2Å; W150-L194 HydrophobicContact CG-CD1 3.64Å; W150-L194 HydrophobicContact CG-CD2 4.44Å; W150-L194 HydrophobicContact CH2-CD2 3.72Å; W150-L194 HydrophobicContact CZ2-CD2 3.66Å; W150-L194 HydrophobicContact CZ3-CD1 4.1Å; W150-L194 HydrophobicContact CZ3-CD2 3.8Å; W150-L194 HydrophobicContact CZ3-CG 4.45Å
151	N	98.4	Very high	97.6	Very high	53 Å²	53	48.8 Å²	48.8	28%	0.283	25%	0.253	S	S	.	.	H	α-helix	trans	-64.7	-44	175.1	-75	-48.3	0	0	0	111.9	L147 L149 I153 K154 D155	L147-N151 WeakPolarHBondContact CD1-ND2 3.45Å; L147-N151 WeakPolarHBondContact O-CB 3.41Å; L147-N151 PolarHBondContact O-N 2.97Å; L147-N151 VanDerWaalsContact O-N 3.11Å; L147-N151 PolarHBondContact O-ND2 3.28Å; L149-N151 PolarHBondContact O-N 2.79Å; N151-I153 VanDerWaalsContact C-N 3.26Å; N151-I153 PolarHBondContact O-N 3.28Å; N151-K154 PolarHBondContact O-N 2.89Å; N151-D155 VanDerWaalsContact O-CB 3.27Å; N151-D155 WeakPolarHBondContact O-CB 3.46Å; N151-D155 PolarHBondContact O-N 3.33Å
152	L	98.6	Very high	97.8	Very high	13 Å²	13	47.5 Å²	47.5	7%	0.068	25%	0.246	C	C	.	.	H	α-helix	trans	-60.5	-35.1	176	-73.2	173.2	0	0	0	112.9	V101 L129 Y132 V134 K148 L149 Q156	V101-L152 HydrophobicContact CB-CB 4.48Å; V101-L152 HydrophobicContact CG1-CB 4.42Å; V101-L152 HydrophobicContact CG2-CB 4.24Å; L129-L152 HydrophobicContact CD2-CD1 4.08Å; Y132-L152 HydrophobicContact CD1-CD2 3.53Å; Y132-L152 HydrophobicContact CD2-CD2 4.45Å; Y132-L152 HydrophobicContact CE1-CD2 4.28Å; Y132-L152 HydrophobicContact CG-CD1 4.17Å; Y132-L152 HydrophobicContact CG-CD2 3.64Å; V134-L152 HydrophobicContact CG2-CD1 4.28Å; K148-L152 HydrophobicContact CD-CD1 4.32Å; K148-L152 HydrophobicContact CD-CG 4.44Å; K148-L152 HydrophobicContact CG-CD1 4.24Å; K148-L152 WeakPolarHBondContact O-CB 3.46Å; K148-L152 VanDerWaalsContact O-CG 3.26Å; K148-L152 WeakPolarHBondContact O-CG 3.44Å; K148-L152 PolarHBondContact O-N 3.24Å; L149-L152 PolarHBondContact O-N 3.38Å; L149-L152 VanDerWaalsContact O-N 3.17Å; L152-Q156 WeakPolarHBondContact O-CB 3.25Å; L152-Q156 VanDerWaalsContact O-CD 3.22Å; L152-Q156 WeakPolarHBondContact O-CG 3.35Å; L152-Q156 PolarHBondContact O-NE2 3.21Å
153	I	98.4	Very high	97.9	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-66.5	-55.4	173.5	-65.5	156.8	0	0	0	109.6	F81 V101 P102 M105 L149 W150 N151 D155 Q156 I157 L166	F81-I153 HydrophobicContact CE2-CD1 4.16Å; F81-I153 HydrophobicContact CE2-CG2 4.22Å; F81-I153 HydrophobicContact CZ-CD1 4.01Å; F81-I153 HydrophobicContact CZ-CG2 4.49Å; V101-I153 HydrophobicContact CG1-CG1 4Å; P102-I153 HydrophobicContact CB-CG2 4.36Å; M105-I153 HydrophobicContact CE-CD1 4.1Å; M105-I153 HydrophobicContact SD-CD1 3.46Å; M105-I153 WeakPolarHBondContact SD-CD1 3.33Å; M105-I153 HydrophobicContact SD-CG1 3.77Å; L149-I153 WeakPolarHBondContact O-CD1 3.42Å; L149-I153 VanDerWaalsContact O-CG1 3.25Å; L149-I153 WeakPolarHBondContact O-CG1 3.33Å; L149-I153 PolarHBondContact O-N 2.88Å; W150-I153 PolarHBondContact O-N 2.92Å; N151-I153 VanDerWaalsContact C-N 3.26Å; N151-I153 PolarHBondContact O-N 3.28Å; I153-D155 PolarHBondContact O-N 2.95Å; I153-Q156 PolarHBondContact O-N 3.4Å; I153-I157 HydrophobicContact CG2-CD1 3.93Å; I153-I157 WeakPolarHBondContact O-CG1 3.42Å; I153-I157 PolarHBondContact O-N 3.45Å; I153-L166 HydrophobicContact CG2-CD2 3.89Å
154	K	98.3	Very high	97.9	Very high	39 Å²	39	53 Å²	53	17%	0.17	27%	0.271	C	S	.	.	H	α-helix	trans	-58.4	-47	-178.2	-172.2	-164.3	56.2	62	0	112.4	W150 N151 Q156 I157 V163 L166 Q167	W150-K154 HydrophobicContact CE3-CB 4.26Å; W150-K154 HydrophobicContact CH2-CB 4.43Å; W150-K154 HydrophobicContact CH2-CD 3.64Å; W150-K154 HydrophobicContact CH2-CG 4.34Å; W150-K154 HydrophobicContact CZ3-CB 4.08Å; W150-K154 HydrophobicContact CZ3-CD 3.57Å; W150-K154 HydrophobicContact CZ3-CG 4.3Å; W150-K154 WeakPolarHBondContact O-CB 3.39Å; W150-K154 PolarHBondContact O-N 3.38Å; N151-K154 PolarHBondContact O-N 2.89Å; K154-Q156 PolarHBondContact O-N 2.81Å; K154-I157 PolarHBondContact O-N 2.75Å; K154-V163 HydrophobicContact CD-CG1 4.18Å; K154-V163 HydrophobicContact CG-CG1 3.83Å; K154-V163 HydrophobicContact CG-CG2 4.47Å; K154-L166 HydrophobicContact CB-CD2 3.98Å; K154-L166 HydrophobicContact CG-CD2 4.43Å; K154-Q167 HydrophobicContact CD-CG 4.11Å
155	D	98.2	Very high	98	Very high	108 Å²	108	51.1 Å²	51.1	58%	0.578	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-13.4	-175.7	-65	-23.2	0	0	0	113.2	N151 I153	N151-D155 VanDerWaalsContact O-CB 3.27Å; N151-D155 WeakPolarHBondContact O-CB 3.46Å; N151-D155 PolarHBondContact O-N 3.33Å; I153-D155 PolarHBondContact O-N 2.95Å
156	Q	98.2	Very high	98	Very high	42 Å²	42	50.9 Å²	50.9	20%	0.196	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-5.7	-178.7	-64.3	176.6	32.5	0	0	113.6	R99 P102 Y132 L152 I153 K154	R99-Q156 PolarHBondContact O-OE1 3.48Å; P102-Q156 HydrophobicContact CG-CB 3.99Å; Y132-Q156 VanDerWaalsContact CZ-NE2 3.31Å; L152-Q156 WeakPolarHBondContact O-CB 3.25Å; L152-Q156 VanDerWaalsContact O-CD 3.22Å; L152-Q156 WeakPolarHBondContact O-CG 3.35Å; L152-Q156 PolarHBondContact O-NE2 3.21Å; I153-Q156 PolarHBondContact O-N 3.4Å; K154-Q156 PolarHBondContact O-N 2.81Å
157	I	97.8	Very high	97.9	Very high	16 Å²	16	54.1 Å²	54.1	8%	0.082	27%	0.272	C	S	.	.			trans	-82.6	120	168.9	-67.4	169.1	0	0	0	108	I88 P102 I153 K154 D159 L162 V163 L166	I88-I157 HydrophobicContact CG2-CD1 4.13Å; I88-I157 HydrophobicContact CG2-CG1 3.99Å; P102-I157 HydrophobicContact CB-CG1 4.19Å; P102-I157 HydrophobicContact CG-CG1 4.15Å; I153-I157 HydrophobicContact CG2-CD1 3.93Å; I153-I157 WeakPolarHBondContact O-CG1 3.42Å; I153-I157 PolarHBondContact O-N 3.45Å; K154-I157 PolarHBondContact O-N 2.75Å; I157-D159 HydrophobicContact CG2-CB 4.39Å; I157-L162 HydrophobicContact CG2-CB 3.76Å; I157-L162 HydrophobicContact CG2-CD1 4.49Å; I157-V163 HydrophobicContact CB-CG2 3.94Å; I157-V163 HydrophobicContact CG2-CG2 3.88Å; I157-V163 WeakPolarHBondContact O-CG2 3.46Å; I157-L166 HydrophobicContact CD1-CD2 4.13Å
158	T	95.8	Very high	97.8	Very high	109 Å²	109	52.7 Å²	52.7	67%	0.669	27%	0.273	S	S	*	.			trans	-85.5	-20.4	-178	52.7	0	0	0	0	113.9	V160	T158-V160 PolarHBondContact O-N 3.02Å
159	D	97.5	Very high	97.8	Very high	58 Å²	58	49 Å²	49	31%	0.31	26%	0.258	S	S	.	.			trans	-78.7	114.5	177.2	-177.6	-40.5	0	0	0	109.7	I157 H161 L162 V163	I157-D159 HydrophobicContact CG2-CB 4.39Å; D159-H161 VanDerWaalsContact C-N 3.32Å; D159-H161 PolarHBondContact O-N 3.31Å; D159-H161 WeakPolarHBondContact OD1-CA 3.24Å; D159-H161 WeakPolarHBondContact OD1-CB 3.44Å; D159-H161 PolarHBondContact OD1-N 2.83Å; D159-L162 HydrophobicContact CB-CB 4.05Å; D159-L162 HydrophobicContact CB-CD1 3.9Å; D159-L162 HydrophobicContact CB-CG 3.92Å; D159-L162 PolarHBondContact O-N 2.91Å; D159-L162 PolarHBondContact OD1-N 2.87Å; D159-V163 PolarHBondContact O-N 2.93Å
160	V	97.4	Very high	97.8	Very high	96 Å²	96	49 Å²	49	58%	0.582	26%	0.257	S	S	*	.	H	α-helix	trans	-60.4	-40.1	-177.3	-179.9	0	0	0	0	111.6	T158 L162 V163 E164	T158-V160 PolarHBondContact O-N 3.02Å; V160-L162 PolarHBondContact O-N 3.32Å; V160-V163 WeakPolarHBondContact O-CB 3.37Å; V160-V163 PolarHBondContact O-N 3.03Å; V160-E164 HydrophobicContact CG1-CG 4.43Å; V160-E164 WeakPolarHBondContact O-CG 3.3Å; V160-E164 PolarHBondContact O-N 3.23Å
161	H	97.6	Very high	97.7	Very high	128 Å²	128	50.3 Å²	50.3	59%	0.593	26%	0.264	S	S	*	.	H	α-helix	trans	-71	-31.7	180	-63.7	-46	0	0	0	112.2	D159 E164 R165	D159-H161 VanDerWaalsContact C-N 3.32Å; D159-H161 PolarHBondContact O-N 3.31Å; D159-H161 WeakPolarHBondContact OD1-CA 3.24Å; D159-H161 WeakPolarHBondContact OD1-CB 3.44Å; D159-H161 PolarHBondContact OD1-N 2.83Å; H161-E164 IonicContact CE1-OE2 2.8Å; H161-E164 IonicContact CG-OE2 3.91Å; H161-E164 IonicContact ND1-OE2 3.96Å; H161-E164 PolarHBondContact ND1-OE2 2.85Å; H161-R165 WeakPolarHBondContact O-CB 3.28Å; H161-R165 WeakPolarHBondContact O-CG 3.11Å; H161-R165 PolarHBondContact O-N 3.29Å
162	L	98	Very high	97.6	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.037	25%	0.25	C	S	.	.	H	α-helix	trans	-70	-35.4	170.8	-64.3	-176.9	0	0	0	112	I84 R87 I88 I157 D159 V160 L166	I84-L162 HydrophobicContact CG2-CB 4.29Å; I84-L162 HydrophobicContact CG2-CD2 4.39Å; R87-L162 HydrophobicContact CB-CD1 3.93Å; R87-L162 HydrophobicContact CB-CD2 3.97Å; R87-L162 VanDerWaalsContact O-CD1 3.32Å; R87-L162 WeakPolarHBondContact O-CD1 3.36Å; I88-L162 HydrophobicContact CG2-CD1 4.47Å; I157-L162 HydrophobicContact CG2-CB 3.76Å; I157-L162 HydrophobicContact CG2-CD1 4.49Å; D159-L162 HydrophobicContact CB-CB 4.05Å; D159-L162 HydrophobicContact CB-CD1 3.9Å; D159-L162 HydrophobicContact CB-CG 3.92Å; D159-L162 PolarHBondContact O-N 2.91Å; D159-L162 PolarHBondContact OD1-N 2.87Å; V160-L162 PolarHBondContact O-N 3.32Å; L162-L166 WeakPolarHBondContact O-CB 3.41Å; L162-L166 PolarHBondContact O-N 2.7Å
163	V	98.2	Very high	97.5	Very high	25 Å²	25	53.4 Å²	53.4	15%	0.152	27%	0.271	C	S	.	.	H	α-helix	trans	-64.6	-46.5	172.5	169.2	0	0	0	0	111.5	K154 I157 D159 V160 R165 L166 Q167	K154-V163 HydrophobicContact CD-CG1 4.18Å; K154-V163 HydrophobicContact CG-CG1 3.83Å; K154-V163 HydrophobicContact CG-CG2 4.47Å; I157-V163 HydrophobicContact CB-CG2 3.94Å; I157-V163 HydrophobicContact CG2-CG2 3.88Å; I157-V163 WeakPolarHBondContact O-CG2 3.46Å; D159-V163 PolarHBondContact O-N 2.93Å; V160-V163 WeakPolarHBondContact O-CB 3.37Å; V160-V163 PolarHBondContact O-N 3.03Å; V163-R165 VanDerWaalsContact C-N 3.34Å; V163-R165 PolarHBondContact O-N 3.35Å; V163-L166 PolarHBondContact O-N 2.94Å; V163-Q167 WeakPolarHBondContact O-CB 3.46Å; V163-Q167 WeakPolarHBondContact O-CG 3.43Å; V163-Q167 PolarHBondContact O-N 3.31Å
164	E	97.6	Very high	97.2	Very high	101 Å²	101	53.4 Å²	53.4	47%	0.472	27%	0.271	S	S	.	.	H	α-helix	trans	-58.7	-44.6	175.9	-73	170.6	156.5	0	0	111.4	V160 H161 Q167 A168	V160-E164 HydrophobicContact CG1-CG 4.43Å; V160-E164 WeakPolarHBondContact O-CG 3.3Å; V160-E164 PolarHBondContact O-N 3.23Å; H161-E164 IonicContact CE1-OE2 2.8Å; H161-E164 IonicContact CG-OE2 3.91Å; H161-E164 IonicContact ND1-OE2 3.96Å; H161-E164 PolarHBondContact ND1-OE2 2.85Å; E164-Q167 WeakPolarHBondContact O-CB 3.47Å; E164-Q167 PolarHBondContact O-N 2.98Å; E164-A168 PolarHBondContact O-N 3.44Å
165	R	97.8	Very high	97.1	Very high	94 Å²	94	55 Å²	55	36%	0.355	28%	0.277	S	S	.	.	H	α-helix	trans	-66.2	-39.4	176.4	-72.4	175.9	67.8	-172.2	4.2	113	I84 H161 V163 Q167 A168 L169	I84-R165 HydrophobicContact CD1-CB 4.15Å; I84-R165 HydrophobicContact CG1-CB 4.44Å; H161-R165 WeakPolarHBondContact O-CB 3.28Å; H161-R165 WeakPolarHBondContact O-CG 3.11Å; H161-R165 PolarHBondContact O-N 3.29Å; V163-R165 VanDerWaalsContact C-N 3.34Å; V163-R165 PolarHBondContact O-N 3.35Å; R165-Q167 VanDerWaalsContact C-N 3.3Å; R165-A168 PolarHBondContact O-N 2.93Å; R165-L169 WeakPolarHBondContact O-CB 3.42Å; R165-L169 PolarHBondContact O-N 3.15Å
166	L	98.2	Very high	96.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-65.2	-37	174.7	-177.5	66	0	0	0	111.3	F81 I84 W150 I153 K154 I157 L162 V163 Y170	F81-L166 HydrophobicContact CD2-CD1 3.93Å; F81-L166 HydrophobicContact CE2-CD1 4.14Å; I84-L166 HydrophobicContact CD1-CB 4.31Å; I84-L166 HydrophobicContact CD1-CD1 4.44Å; W150-L166 HydrophobicContact CZ2-CG 4.06Å; I153-L166 HydrophobicContact CG2-CD2 3.89Å; K154-L166 HydrophobicContact CB-CD2 3.98Å; K154-L166 HydrophobicContact CG-CD2 4.43Å; I157-L166 HydrophobicContact CD1-CD2 4.13Å; L162-L166 WeakPolarHBondContact O-CB 3.41Å; L162-L166 PolarHBondContact O-N 2.7Å; V163-L166 PolarHBondContact O-N 2.94Å; L166-Y170 HydrophobicContact CD1-CD2 3.88Å; L166-Y170 HydrophobicContact CD1-CE2 3.84Å; L166-Y170 PolarHBondContact O-N 3.07Å
167	Q	97.7	Very high	96.7	Very high	70 Å²	70	49 Å²	49	33%	0.327	25%	0.247	S	C	.	.	H	α-helix	trans	-65.2	-48.6	172.1	-76.4	176.8	-36	0	0	111.5	W150 K154 V163 E164 R165 L169 Y170 M171	W150-Q167 HydrophobicContact CH2-CG 3.95Å; W150-Q167 HydrophobicContact CZ2-CG 4.44Å; K154-Q167 HydrophobicContact CD-CG 4.11Å; V163-Q167 WeakPolarHBondContact O-CB 3.46Å; V163-Q167 WeakPolarHBondContact O-CG 3.43Å; V163-Q167 PolarHBondContact O-N 3.31Å; E164-Q167 WeakPolarHBondContact O-CB 3.47Å; E164-Q167 PolarHBondContact O-N 2.98Å; R165-Q167 VanDerWaalsContact C-N 3.3Å; Q167-L169 PolarHBondContact O-N 3.25Å; Q167-Y170 PolarHBondContact O-N 3.36Å; Q167-M171 HydrophobicContact CG-CE 4.49Å; Q167-M171 WeakPolarHBondContact O-CA 3.35Å; Q167-M171 WeakPolarHBondContact O-CB 3.4Å; Q167-M171 PolarHBondContact O-N 3.37Å
168	A	95.7	Very high	96.5	Very high	55 Å²	55	50.4 Å²	50.4	46%	0.455	26%	0.255	S	S	.	.	H	α-helix	trans	-59.1	-35.8	177.6	0	0	0	0	0	112.8	E164 R165 Y170	E164-A168 PolarHBondContact O-N 3.44Å; R165-A168 PolarHBondContact O-N 2.93Å; A168-Y170 PolarHBondContact O-N 3.02Å
169	L	97.3	Very high	96.4	Very high	10 Å²	10	47.2 Å²	47.2	5%	0.052	23%	0.233	C	C	.	.	H	α-helix	trans	-67.1	-29.5	179.9	-178.9	57.3	0	0	0	114.1	D80 F81 I84 R165 Q167 Q252 T253	D80-L169 HydrophobicContact CB-CD1 3.64Å; D80-L169 HydrophobicContact CB-CD2 3.75Å; D80-L169 HydrophobicContact CB-CG 4.37Å; F81-L169 HydrophobicContact CB-CD2 4.19Å; I84-L169 HydrophobicContact CD1-CD2 3.88Å; R165-L169 WeakPolarHBondContact O-CB 3.42Å; R165-L169 PolarHBondContact O-N 3.15Å; Q167-L169 PolarHBondContact O-N 3.25Å; L169-Q252 HydrophobicContact CD1-CB 3.94Å; L169-Q252 HydrophobicContact CD1-CG 4.07Å; L169-T253 WeakPolarHBondContact CD1-OG1 3.47Å; L169-T253 WeakPolarHBondContact O-CA 2.97Å; L169-T253 WeakPolarHBondContact O-CB 3.22Å; L169-T253 PolarHBondContact O-N 3.35Å
170	Y	98.1	Very high	96.2	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-130.1	-14.7	-170.7	-70.2	-77.9	0	0	0	116.2	F75 F81 Y146 W150 L166 Q167 A168 I172 P251 T253	F75-Y170 HydrophobicContact CE1-CE1 4.32Å; F75-Y170 HydrophobicContact CE1-CE2 4.5Å; F75-Y170 AromaticContact CE1-CZ 3.97Å; F81-Y170 WeakPolarHBondContact CB-OH 3.23Å; F81-Y170 HydrophobicContact CD2-CE2 4.05Å; Y146-Y170 VanDerWaalsContact OH-CD1 3.25Å; Y146-Y170 WeakPolarHBondContact OH-CD1 3.28Å; W150-Y170 AromaticContact CD1-CD2 3.96Å; W150-Y170 AromaticContact NE1-CD2 3.23Å; W150-Y170 AromaticContact NE1-CE2 3.97Å; W150-Y170 AromaticContact NE1-CG 3.48Å; L166-Y170 HydrophobicContact CD1-CD2 3.88Å; L166-Y170 HydrophobicContact CD1-CE2 3.84Å; L166-Y170 PolarHBondContact O-N 3.07Å; Q167-Y170 PolarHBondContact O-N 3.36Å; A168-Y170 PolarHBondContact O-N 3.02Å; Y170-I172 PolarHBondContact O-N 3.24Å; Y170-P251 VanDerWaalsContact C-CB 3.47Å; Y170-T253 HydrophobicContact CD1-CG2 4Å; Y170-T253 HydrophobicContact CE1-CG2 3.56Å
171	M	97.6	Very high	96	Very high	29 Å²	29	43.6 Å²	43.6	14%	0.143	21%	0.211	C	C	.	.			trans	-88.1	111.2	-169.6	-163.7	68.3	66.9	0	0	112.3	W150 Q167 S192 L194 H249	W150-M171 HydrophobicContact CH2-CE 3.48Å; W150-M171 VanDerWaalsContact CH2-CE 3.48Å; W150-M171 HydrophobicContact CZ2-CE 4.28Å; W150-M171 HydrophobicContact CZ3-CE 3.96Å; Q167-M171 HydrophobicContact CG-CE 4.49Å; Q167-M171 WeakPolarHBondContact O-CA 3.35Å; Q167-M171 WeakPolarHBondContact O-CB 3.4Å; Q167-M171 PolarHBondContact O-N 3.37Å; M171-S192 VanDerWaalsContact SD-CB 3.59Å; M171-L194 HydrophobicContact CE-CD2 3.59Å; M171-L194 HydrophobicContact SD-CD2 3.86Å; M171-H249 PolarHBondContact O-ND1 2.96Å
172	I	96.3	Very high	95.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	133.2	167.5	-52.1	149.1	0	0	0	107.9	Y170 V174 S192 M193 L196 L247 P251 L254	Y170-I172 PolarHBondContact O-N 3.24Å; I172-V174 HydrophobicContact CG2-CG1 4.32Å; I172-S192 CarbonylContact O-C 3.5Å; I172-S192 VanDerWaalsContact O-CA 3.23Å; I172-S192 WeakPolarHBondContact O-CA 3.44Å; I172-M193 HydrophobicContact CB-CG 3.86Å; I172-M193 WeakPolarHBondContact CB-O 3.49Å; I172-M193 HydrophobicContact CD1-CG 3.93Å; I172-M193 HydrophobicContact CG2-CG 4.25Å; I172-M193 PolarHBondContact N-O 3.31Å; I172-M193 PolarHBondContact O-N 3.34Å; I172-L196 HydrophobicContact CD1-CD2 4Å; I172-L196 HydrophobicContact CD1-CG 3.87Å; I172-L196 HydrophobicContact CG2-CD2 4.16Å; I172-L247 HydrophobicContact CG2-CD1 3.61Å; I172-P251 HydrophobicContact CG1-CG 3.88Å; I172-L254 HydrophobicContact CD1-CD1 3.78Å; I172-L254 HydrophobicContact CG1-CD1 3.83Å
173	R	95.3	Very high	95.5	Very high	132 Å²	132	43.2 Å²	43.2	50%	0.498	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	137.9	173.5	-51.2	179.3	175.1	175.8	-1.7	110.3	T248 H249	R173-T248 VanDerWaalsContact C-OG1 3.23Å; R173-T248 WeakPolarHBondContact CB-OG1 3.49Å; R173-T248 PolarHBondContact O-N 3.27Å; R173-T248 PolarHBondContact O-OG1 3.37Å; R173-T248 VanDerWaalsContact O-OG1 3.11Å; R173-H249 HydrophobicContact CB-CB 3.87Å; R173-H249 HydrophobicContact CG-CB 4Å; R173-H249 PolarHBondContact N-O 2.95Å; R173-H249 PolarHBondContact O-N 2.76Å; R173-H249 VanDerWaalsContact O-N 3.16Å
174	V	93.6	Very high	95.3	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	151.4	177.8	-55.6	0	0	0	0	110.6	I172 S191 M193 K246 L247	I172-V174 HydrophobicContact CG2-CG1 4.32Å; V174-S191 PolarHBondContact N-O 2.92Å; V174-S191 PolarHBondContact O-N 3.1Å; V174-M193 HydrophobicContact CB-CE 4.47Å; V174-M193 HydrophobicContact CG1-CE 3.94Å; V174-M193 HydrophobicContact CG2-CE 3.62Å; V174-K246 CarbonylContact C-O 3.57Å; V174-K246 VanDerWaalsContact CA-O 3.28Å; V174-K246 WeakPolarHBondContact CA-O 3.34Å; V174-L247 HydrophobicContact CG1-CD1 4.03Å
175	K	94.6	Very high	95.1	Very high	72 Å²	72	46.2 Å²	46.2	31%	0.313	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	115.6	163.6	-174.3	-179.9	177	-172.4	0	108	E186 S188 K246 T248	K175-E186 IonicContact NZ-OE1 2.75Å; K175-S188 WeakPolarHBondContact CE-OG 3.35Å; K175-K246 HydrophobicContact CB-CB 4.45Å; K175-K246 PolarHBondContact N-O 3.4Å; K175-K246 PolarHBondContact O-N 2.58Å; K175-T248 HydrophobicContact CB-CG2 3.98Å
176	D	94.1	Very high	94.8	Very high	15 Å²	15	45.5 Å²	45.5	8%	0.08	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	106.7	176.9	175.9	27.8	0	0	0	108.6	S188 R189 Q243 L245	D176-S188 WeakPolarHBondContact O-CA 3.31Å; D176-R189 HydrophobicContact CB-CG 3.99Å; D176-R189 PolarHBondContact N-O 2.84Å; D176-R189 PolarHBondContact O-N 3.33Å; D176-R189 IonicContact OD2-CZ 3.84Å; D176-R189 IonicContact OD2-NE 2.7Å; D176-R189 PolarHBondContact OD2-NE 3.5Å; D176-R189 IonicContact OD2-NH2 3.17Å; D176-R189 PolarHBondContact OD2-NH2 3.08Å; D176-Q243 PolarHBondContact OD1-NE2 3.37Å; D176-L245 HydrophobicContact CB-CD2 3.86Å
177	S	94.2	Very high	94.6	Very high	8 Å²	8	49 Å²	49	6%	0.056	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	129.8	-174.7	-71.9	0	0	0	0	110.8	E186 S188 Q243 V244	S177-E186 VanDerWaalsContact CB-OE1 3.26Å; S177-E186 WeakPolarHBondContact CB-OE1 3.31Å; S177-E186 PolarHBondContact OG-OE1 2.91Å; S177-S188 VanDerWaalsContact OG-CB 3.24Å; S177-S188 WeakPolarHBondContact OG-CB 3.41Å; S177-Q243 CarbonylContact O-C 3.54Å; S177-Q243 WeakPolarHBondContact O-CA 3.44Å; S177-V244 PolarHBondContact N-O 2.99Å; S177-V244 PolarHBondContact O-N 2.72Å
178	L	93.3	Very high	94.4	Very high	47 Å²	47	48.8 Å²	48.8	25%	0.246	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	115.2	174.5	177.2	66	0	0	0	109.1	S187 L224 C230	L178-S187 PolarHBondContact N-O 3.17Å; L178-S187 PolarHBondContact O-N 2.84Å; L178-S187 PolarHBondContact O-OG 2.9Å; L178-L224 HydrophobicContact CD1-CD1 3.61Å; L178-C230 HydrophobicContact CD2-CB 3.8Å
179	I	94.1	Very high	94.3	Very high	42 Å²	42	54 Å²	54	22%	0.215	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.2	-177.7	-56.3	169.5	0	0	0	109.1	E186 G241 K242 V244	I179-E186 HydrophobicContact CG1-CB 4.28Å; I179-E186 HydrophobicContact CG1-CG 4.09Å; I179-G241 CarbonylContact O-C 3.5Å; I179-G241 VanDerWaalsContact O-CA 3.25Å; I179-G241 WeakPolarHBondContact O-CA 3.43Å; I179-K242 HydrophobicContact CB-CB 4.49Å; I179-K242 PolarHBondContact N-O 2.98Å; I179-K242 PolarHBondContact O-N 2.75Å; I179-V244 HydrophobicContact CD1-CG2 3.88Å
180	C	93.6	Very high	94.2	Very high	7 Å²	7	60 Å²	60	5%	0.047	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	125.7	174.2	-179.7	0	0	0	0	111.1	D182 A184 M185 C232 T239	C180-D182 VanDerWaalsContact C-N 3.33Å; C180-D182 PolarHBondContact O-N 3.4Å; C180-A184 WeakPolarHBondContact O-CA 3.42Å; C180-A184 PolarHBondContact O-N 2.65Å; C180-M185 PolarHBondContact N-O 2.88Å; C180-C232 HydrophobicContact CB-CB 4.4Å; C180-C232 VanDerWaalsContact SG-SG 3.67Å; C180-T239 PolarHBondContact SG-OG1 2.96Å
181	L	92.6	Very high	94	Very high	70 Å²	70	62.1 Å²	62.1	37%	0.366	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-16	179.1	-63.4	-173.2	0	0	0	114.1	E223 R240 K242	L181-E223 HydrophobicContact CD1-CG 4.34Å; L181-R240 HydrophobicContact CB-CB 4.24Å; L181-R240 HydrophobicContact CD1-CB 3.89Å; L181-R240 HydrophobicContact CG-CB 4.32Å; L181-R240 PolarHBondContact N-O 3.41Å; L181-K242 HydrophobicContact CD2-CB 3.9Å
182	D	92.8	Very high	93.9	Very high	83 Å²	83	63.9 Å²	63.9	44%	0.444	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-30.6	178.9	-70.7	42.7	0	0	0	112.7	C180 K237 T239	C180-D182 VanDerWaalsContact C-N 3.33Å; C180-D182 PolarHBondContact O-N 3.4Å; D182-K237 WeakPolarHBondContact OD2-CE 3.43Å; D182-K237 IonicContact OD2-NZ 2.75Å; D182-K237 PolarHBondContact OD2-NZ 3.28Å; D182-T239 HydrophobicContact CB-CG2 3.96Å; D182-T239 WeakPolarHBondContact OD1-CB 3.45Å
183	C	93.6	Very high	93.9	Very high	45 Å²	45	65.8 Å²	65.8	30%	0.304	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.6	9.6	-173.5	71.7	0	0	0	0	115.4	M185 C235	C183-M185 PolarHBondContact O-N 3.12Å; C183-C235 PolarHBondContact SG-SG 3.47Å
184	A	93.5	Very high	94.1	Very high	79 Å²	79	60 Å²	60	65%	0.653	33%	0.333	S	S	*	.			trans	58.1	-1.4	-177.1	0	0	0	0	0	117.1	C180 E186	C180-A184 WeakPolarHBondContact O-CA 3.42Å; C180-A184 PolarHBondContact O-N 2.65Å; A184-E186 PolarHBondContact O-N 2.9Å
185	M	92.8	Very high	94.3	Very high	110 Å²	110	61.1 Å²	61.1	54%	0.542	34%	0.34	S	S	.	.			trans	-59	123.6	179.2	-173.1	67.8	-168	0	0	111.4	C180 C183 N234	C180-M185 PolarHBondContact N-O 2.88Å; C183-M185 PolarHBondContact O-N 3.12Å; M185-N234 HydrophobicContact CB-CB 4.42Å; M185-N234 HydrophobicContact CG-CB 4.44Å
186	E	93.1	Very high	94.4	Very high	79 Å²	79	57.7 Å²	57.7	37%	0.369	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	137	172.2	-174	-176.3	149.8	0	0	110.9	K175 S177 I179 A184 S188	K175-E186 IonicContact NZ-OE1 2.75Å; S177-E186 VanDerWaalsContact CB-OE1 3.26Å; S177-E186 WeakPolarHBondContact CB-OE1 3.31Å; S177-E186 PolarHBondContact OG-OE1 2.91Å; I179-E186 HydrophobicContact CG1-CB 4.28Å; I179-E186 HydrophobicContact CG1-CG 4.09Å; A184-E186 PolarHBondContact O-N 2.9Å; E186-S188 WeakPolarHBondContact OE1-CB 3.32Å
187	S	92.3	Very high	94.6	Very high	74 Å²	74	59.1 Å²	59.1	52%	0.517	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.9	161.1	58.4	0	0	0	0	108.8	L178	L178-S187 PolarHBondContact N-O 3.17Å; L178-S187 PolarHBondContact O-N 2.84Å; L178-S187 PolarHBondContact O-OG 2.9Å
188	S	93.8	Very high	94.7	Very high	65 Å²	65	58.8 Å²	58.8	46%	0.455	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	152.1	-176.4	59	0	0	0	0	112.7	K175 D176 S177 E186	K175-S188 WeakPolarHBondContact CE-OG 3.35Å; D176-S188 WeakPolarHBondContact O-CA 3.31Å; S177-S188 VanDerWaalsContact OG-CB 3.24Å; S177-S188 WeakPolarHBondContact OG-CB 3.41Å; E186-S188 WeakPolarHBondContact OE1-CB 3.32Å
189	R	94.8	Very high	94.9	Very high	163 Å²	163	58.6 Å²	58.6	62%	0.615	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.7	145	174.4	62.9	-178.7	176.2	170.7	0	110.3	D176	D176-R189 HydrophobicContact CB-CG 3.99Å; D176-R189 PolarHBondContact N-O 2.84Å; D176-R189 PolarHBondContact O-N 3.33Å; D176-R189 IonicContact OD2-CZ 3.84Å; D176-R189 IonicContact OD2-NE 2.7Å; D176-R189 PolarHBondContact OD2-NE 3.5Å; D176-R189 IonicContact OD2-NH2 3.17Å; D176-R189 PolarHBondContact OD2-NH2 3.08Å
190	N	95.3	Very high	95	Very high	138 Å²	138	56.7 Å²	56.7	74%	0.738	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	138.3	166.7	-65.9	-23.5	0	0	0	108.9
191	S	94.2	Very high	95.1	Very high	45 Å²	45	58.7 Å²	58.7	32%	0.315	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	162.8	179	-171	0	0	0	0	109.6	V174	V174-S191 PolarHBondContact N-O 2.92Å; V174-S191 PolarHBondContact O-N 3.1Å
192	S	95.3	Very high	95.1	Very high	66 Å²	66	57.1 Å²	57.1	46%	0.462	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	147.7	-179.4	-54.9	0	0	0	0	111.1	M171 I172	M171-S192 VanDerWaalsContact SD-CB 3.59Å; I172-S192 CarbonylContact O-C 3.5Å; I172-S192 VanDerWaalsContact O-CA 3.23Å; I172-S192 WeakPolarHBondContact O-CA 3.44Å
193	M	96.3	Very high	94.9	Very high	40 Å²	40	57.7 Å²	57.7	20%	0.197	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	151.6	-176.7	62.6	-169.1	78.6	0	0	110.9	I172 V174 T195 L196 F218	I172-M193 HydrophobicContact CB-CG 3.86Å; I172-M193 WeakPolarHBondContact CB-O 3.49Å; I172-M193 HydrophobicContact CD1-CG 3.93Å; I172-M193 HydrophobicContact CG2-CG 4.25Å; I172-M193 PolarHBondContact N-O 3.31Å; I172-M193 PolarHBondContact O-N 3.34Å; V174-M193 HydrophobicContact CB-CE 4.47Å; V174-M193 HydrophobicContact CG1-CE 3.94Å; V174-M193 HydrophobicContact CG2-CE 3.62Å; M193-T195 WeakPolarHBondContact CG-O 3.27Å; M193-T195 VanDerWaalsContact SD-O 3.38Å; M193-L196 HydrophobicContact SD-CD2 3.89Å; M193-F218 HydrophobicContact SD-CZ 4.47Å
194	L	97.6	Very high	94.8	Very high	10 Å²	10	60.7 Å²	60.7	5%	0.052	35%	0.345	C	S	.	.	S	Bend	trans	-89.7	-18.5	175.7	-59	179.8	0	0	0	113.3	Y146 L147 W150 M171	Y146-L194 HydrophobicContact CE1-CB 3.97Å; L147-L194 HydrophobicContact CD1-CD1 3.58Å; L147-L194 HydrophobicContact CD1-CG 4.28Å; W150-L194 HydrophobicContact CB-CD1 3.79Å; W150-L194 HydrophobicContact CD2-CD1 3.46Å; W150-L194 VanDerWaalsContact CD2-CD1 3.46Å; W150-L194 HydrophobicContact CD2-CD2 3.75Å; W150-L194 HydrophobicContact CD2-CG 4.26Å; W150-L194 HydrophobicContact CE3-CD1 3.41Å; W150-L194 VanDerWaalsContact CE3-CD1 3.41Å; W150-L194 HydrophobicContact CE3-CD2 3.83Å; W150-L194 HydrophobicContact CE3-CG 4.2Å; W150-L194 HydrophobicContact CG-CD1 3.64Å; W150-L194 HydrophobicContact CG-CD2 4.44Å; W150-L194 HydrophobicContact CH2-CD2 3.72Å; W150-L194 HydrophobicContact CZ2-CD2 3.66Å; W150-L194 HydrophobicContact CZ3-CD1 4.1Å; W150-L194 HydrophobicContact CZ3-CD2 3.8Å; W150-L194 HydrophobicContact CZ3-CG 4.45Å; M171-L194 HydrophobicContact CE-CD2 3.59Å; M171-L194 HydrophobicContact SD-CD2 3.86Å
195	T	98.1	Very high	94.7	Very high	25 Å²	25	61.4 Å²	61.4	15%	0.153	35%	0.345	C	S	.	.	S	Bend	trans	-136.6	147.3	-179.7	65.4	0	0	0	0	110	Y146 M193 P197 T255	Y146-T195 HydrophobicContact CD1-CG2 3.71Å; Y146-T195 HydrophobicContact CE1-CG2 3.6Å; M193-T195 WeakPolarHBondContact CG-O 3.27Å; M193-T195 VanDerWaalsContact SD-O 3.38Å; T195-P197 VanDerWaalsContact O-CD 3.26Å; T195-P197 WeakPolarHBondContact O-CD 3.48Å; T195-T255 CarbonylContact C-O 3.58Å; T195-T255 VanDerWaalsContact CA-O 3.25Å; T195-T255 WeakPolarHBondContact CA-O 3.35Å; T195-T255 HydrophobicContact CG2-CG2 3.69Å
196	L	97.5	Very high	94.8	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	108.6	162.9	-65.5	179.7	0	0	0	109	I172 M193 L198 L215 F218 F219 L254 T255 H257 F283	I172-L196 HydrophobicContact CD1-CD2 4Å; I172-L196 HydrophobicContact CD1-CG 3.87Å; I172-L196 HydrophobicContact CG2-CD2 4.16Å; M193-L196 HydrophobicContact SD-CD2 3.89Å; L196-L198 HydrophobicContact CB-CD2 4.11Å; L196-L198 HydrophobicContact CB-CG 4.46Å; L196-L198 PolarHBondContact O-N 2.99Å; L196-L215 HydrophobicContact CD1-CD2 3.61Å; L196-F218 HydrophobicContact CD2-CE1 3.97Å; L196-F218 HydrophobicContact CD2-CZ 4.4Å; L196-F219 HydrophobicContact CD1-CE2 4.41Å; L196-F219 HydrophobicContact CD1-CZ 4.31Å; L196-F219 HydrophobicContact CD2-CZ 4.02Å; L196-L254 HydrophobicContact CD1-CD1 4.18Å; L196-L254 HydrophobicContact CG-CD1 4.32Å; L196-T255 PolarHBondContact N-O 3.38Å; L196-H257 PolarHBondContact O-N 3.03Å; L196-F283 HydrophobicContact CD1-CZ 4.39Å
197	P	97.6	Very high	94.9	Very high	46 Å²	46	61.3 Å²	61.3	30%	0.299	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	94.7	179.3	32.9	-32.7	0	0	0	110.3	T195 F218 M259	T195-P197 VanDerWaalsContact O-CD 3.26Å; T195-P197 WeakPolarHBondContact O-CD 3.48Å; P197-F218 HydrophobicContact CG-CE2 4.03Å; P197-F218 HydrophobicContact CG-CZ 4.5Å; P197-F218 WeakPolarHBondContact O-CD2 3.44Å; P197-F218 WeakPolarHBondContact O-CE2 3.49Å; P197-M259 HydrophobicContact CB-CG 4.2Å; P197-M259 HydrophobicContact CB-SD 3.91Å
198	L	97.4	Very high	95.2	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	121.6	-176	-55.9	-173	0	0	0	111.5	L196 L211 A214 L215 F218 I256 H257 L258 M259	L196-L198 HydrophobicContact CB-CD2 4.11Å; L196-L198 HydrophobicContact CB-CG 4.46Å; L196-L198 PolarHBondContact O-N 2.99Å; L198-L211 HydrophobicContact CD1-CD1 3.47Å; L198-L211 VanDerWaalsContact CD1-CD1 3.47Å; L198-A214 HydrophobicContact CB-CB 4.27Å; L198-A214 HydrophobicContact CD1-CB 4.08Å; L198-L215 HydrophobicContact CD1-CD2 3.82Å; L198-L215 HydrophobicContact CD1-CG 3.86Å; L198-L215 HydrophobicContact CD2-CD2 4Å; L198-F218 HydrophobicContact CD2-CB 3.62Å; L198-F218 HydrophobicContact CD2-CD1 4.34Å; L198-F218 HydrophobicContact CD2-CD2 3.84Å; L198-F218 HydrophobicContact CD2-CG 3.68Å; L198-I256 HydrophobicContact CD1-CG2 3.39Å; L198-I256 HydrophobicContact CG-CG2 3.77Å; L198-H257 PolarHBondContact N-O 3.13Å; L198-L258 HydrophobicContact CB-CD2 4.49Å; L198-L258 HydrophobicContact CD1-CD2 4.42Å; L198-M259 WeakPolarHBondContact O-CB 3.39Å; L198-M259 WeakPolarHBondContact O-CG 3.42Å; L198-M259 PolarHBondContact O-N 2.93Å
199	S	96	Very high	95.3	Very high	44 Å²	44	60.8 Å²	60.8	31%	0.308	33%	0.327	S	S	.	.			trans	-61.3	137.5	163	177.8	0	0	0	0	109.4	F201 L208	S199-F201 VanDerWaalsContact C-N 3.26Å; S199-F201 PolarHBondContact OG-N 3.38Å; S199-F201 VanDerWaalsContact OG-N 3.14Å; S199-F201 PolarHBondContact OG-O 3.05Å; S199-L208 WeakPolarHBondContact O-CD1 3.33Å
200	L	96.4	Very high	95.4	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	31%	0.309	C	S	.	.	S	Bend	trans	-89.5	5.4	173.4	-53.3	-175.5	0	0	0	112.8	L208 L258 R260 I271 H273 L275	L200-L208 PolarHBondContact O-N 3.22Å; L200-L258 HydrophobicContact CD2-CB 4.14Å; L200-L258 HydrophobicContact CD2-CD2 4.15Å; L200-R260 HydrophobicContact CD1-CB 4.48Å; L200-R260 HydrophobicContact CD1-CG 3.45Å; L200-R260 VanDerWaalsContact CD1-CG 3.45Å; L200-I271 HydrophobicContact CB-CG2 4.46Å; L200-I271 HydrophobicContact CD1-CB 4.45Å; L200-I271 HydrophobicContact CD1-CG2 4Å; L200-H273 PolarHBondContact O-CE1 3.36Å; L200-H273 PolarHBondContact O-NE2 2.93Å; L200-L275 HydrophobicContact CD2-CD1 4.2Å; L200-L275 HydrophobicContact CD2-CD2 3.88Å
201	F	95.6	Very high	95.5	Very high	50 Å²	50	48.3 Å²	48.3	22%	0.219	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-126.9	144.1	177.7	-62.4	-86.9	0	0	0	111	S199 S205 K206 P207 I271	S199-F201 VanDerWaalsContact C-N 3.26Å; S199-F201 PolarHBondContact OG-N 3.38Å; S199-F201 VanDerWaalsContact OG-N 3.14Å; S199-F201 PolarHBondContact OG-O 3.05Å; F201-S205 WeakPolarHBondContact CD1-O 3.28Å; F201-K206 CarbonylContact C-O 3.55Å; F201-K206 VanDerWaalsContact CA-O 3.24Å; F201-K206 WeakPolarHBondContact CA-O 3.37Å; F201-P207 HydrophobicContact CD1-CB 4.2Å; F201-P207 HydrophobicContact CE1-CB 3.95Å; F201-I271 HydrophobicContact CE2-CD1 3.84Å; F201-I271 HydrophobicContact CE2-CG1 4.09Å; F201-I271 HydrophobicContact CE2-CG2 3.86Å; F201-I271 HydrophobicContact CZ-CG2 4.03Å
202	D	93.6	Very high	95.6	Very high	37 Å²	37	49.5 Å²	49.5	20%	0.198	28%	0.275	C	S	.	.			trans	-71.6	178.1	173.2	85.8	-20.5	0	0	0	112.1	N204 S205 K206 L208	D202-N204 PolarHBondContact O-N 2.84Å; D202-N204 VanDerWaalsContact O-N 3.12Å; D202-N204 WeakPolarHBondContact OD1-CA 3.38Å; D202-N204 WeakPolarHBondContact OD1-CB 3.29Å; D202-N204 PolarHBondContact OD1-N 3.26Å; D202-N204 PolarHBondContact OD2-ND2 2.79Å; D202-S205 PolarHBondContact O-N 2.95Å; D202-S205 PolarHBondContact OD1-N 3.17Å; D202-K206 PolarHBondContact N-O 3.16Å; D202-K206 WeakPolarHBondContact OD1-CB 3.45Å; D202-K206 PolarHBondContact OD1-N 2.88Å; D202-L208 HydrophobicContact CB-CD2 3.77Å; D202-L208 HydrophobicContact CB-CG 4.49Å
203	V	88.1	Confident	95.6	Very high	95 Å²	95	49.8 Å²	49.8	58%	0.576	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-18.9	175.9	-61.1	0	0	0	0	114
204	N	90.8	Very high	95.6	Very high	108 Å²	108	47.9 Å²	47.9	58%	0.578	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	10.6	177.8	-50.3	-70.5	0	0	0	112.6	D202 K206	D202-N204 PolarHBondContact O-N 2.84Å; D202-N204 VanDerWaalsContact O-N 3.12Å; D202-N204 WeakPolarHBondContact OD1-CA 3.38Å; D202-N204 WeakPolarHBondContact OD1-CB 3.29Å; D202-N204 PolarHBondContact OD1-N 3.26Å; D202-N204 PolarHBondContact OD2-ND2 2.79Å; N204-K206 VanDerWaalsContact C-N 3.26Å; N204-K206 HydrophobicContact CB-CG 4.33Å; N204-K206 PolarHBondContact O-N 2.95Å
205	S	91.7	Very high	95.5	Very high	93 Å²	93	47.4 Å²	47.4	65%	0.65	26%	0.259	S	S	*	.	S	Bend	trans	61.6	22.9	-174.6	-54.5	0	0	0	0	115.5	F201 D202	F201-S205 WeakPolarHBondContact CD1-O 3.28Å; D202-S205 PolarHBondContact O-N 2.95Å; D202-S205 PolarHBondContact OD1-N 3.17Å
206	K	94.9	Very high	95.3	Very high	135 Å²	135	51.1 Å²	51.1	59%	0.587	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-83.2	138.5	171.7	-62.1	178.2	178.9	177.2	0	110.5	F201 D202 N204 L208	F201-K206 CarbonylContact C-O 3.55Å; F201-K206 VanDerWaalsContact CA-O 3.24Å; F201-K206 WeakPolarHBondContact CA-O 3.37Å; D202-K206 PolarHBondContact N-O 3.16Å; D202-K206 WeakPolarHBondContact OD1-CB 3.45Å; D202-K206 PolarHBondContact OD1-N 2.88Å; N204-K206 VanDerWaalsContact C-N 3.26Å; N204-K206 HydrophobicContact CB-CG 4.33Å; N204-K206 PolarHBondContact O-N 2.95Å; K206-L208 PolarHBondContact O-N 3.39Å
207	P	96.1	Very high	95.1	Very high	53 Å²	53	51.5 Å²	51.5	34%	0.344	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-70.7	120.2	-179.5	27.6	-33.5	0	0	0	111.3	F201 K209	F201-P207 HydrophobicContact CD1-CB 4.2Å; F201-P207 HydrophobicContact CE1-CB 3.95Å; P207-K209 WeakPolarHBondContact O-CE 3.12Å
208	L	97.1	Very high	94.9	Very high	20 Å²	20	50.4 Å²	50.4	11%	0.105	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-67.9	152.1	174.9	-59.7	171.9	0	0	0	110.4	S199 L200 D202 K206 D213 A214 C217 H273 L275	S199-L208 WeakPolarHBondContact O-CD1 3.33Å; L200-L208 PolarHBondContact O-N 3.22Å; D202-L208 HydrophobicContact CB-CD2 3.77Å; D202-L208 HydrophobicContact CB-CG 4.49Å; K206-L208 PolarHBondContact O-N 3.39Å; L208-D213 HydrophobicContact CB-CB 4.39Å; L208-D213 HydrophobicContact CD2-CB 4.19Å; L208-A214 HydrophobicContact CD1-CB 3.98Å; L208-C217 HydrophobicContact CD1-CB 4.19Å; L208-H273 PolarHBondContact O-CD2 3.47Å; L208-H273 PolarHBondContact O-NE2 3.47Å; L208-L275 HydrophobicContact CB-CD1 4.23Å
209	K	96.4	Very high	94.6	Very high	107 Å²	107	51 Å²	51	47%	0.465	27%	0.27	S	S	.	.			trans	-113.5	-26	-169.1	-60.3	-57	179.4	-176.8	0	114.4	P207 D213 H276	P207-K209 WeakPolarHBondContact O-CE 3.12Å; K209-D213 PolarHBondContact N-OD2 3.07Å; K209-H276 PolarHBondContact O-N 3.17Å; K209-H276 PolarHBondContact O-ND1 3.44Å
210	T	97.4	Very high	94.4	Very high	40 Å²	40	53.1 Å²	53.1	25%	0.245	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-126.7	161.4	-180	69.4	0	0	0	0	110.9	E212 D213 A214 L275 H276	T210-E212 VanDerWaalsContact C-N 3.27Å; T210-E212 VanDerWaalsContact CB-OE2 3.29Å; T210-E212 WeakPolarHBondContact CB-OE2 3.29Å; T210-D213 PolarHBondContact N-OD2 3.12Å; T210-D213 WeakPolarHBondContact OG1-CB 3.49Å; T210-D213 PolarHBondContact OG1-N 2.69Å; T210-D213 PolarHBondContact OG1-OD1 3.43Å; T210-D213 PolarHBondContact OG1-OD2 3.01Å; T210-A214 PolarHBondContact O-N 3.1Å; T210-L275 WeakPolarHBondContact O-CD1 3.49Å; T210-H276 CarbonylContact C-O 3.6Å; T210-H276 WeakPolarHBondContact CA-O 3.5Å
211	L	97.8	Very high	94.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.6	-36.9	174.3	174.8	59.4	0	0	0	110.9	L198 A214 L215 I256 L258 H276 F277 L281 L367 Y369	L198-L211 HydrophobicContact CD1-CD1 3.47Å; L198-L211 VanDerWaalsContact CD1-CD1 3.47Å; L211-A214 CarbonylContact O-C 3.51Å; L211-A214 WeakPolarHBondContact O-CB 3.45Å; L211-A214 PolarHBondContact O-N 2.82Å; L211-A214 VanDerWaalsContact O-N 3.15Å; L211-L215 HydrophobicContact CD1-CD1 4.23Å; L211-L215 HydrophobicContact CD1-CG 4.28Å; L211-L215 HydrophobicContact CG-CD1 3.92Å; L211-L215 HydrophobicContact CG-CG 4.44Å; L211-L215 WeakPolarHBondContact O-CG 3.38Å; L211-L215 PolarHBondContact O-N 3.36Å; L211-I256 HydrophobicContact CD1-CD1 4.11Å; L211-I256 HydrophobicContact CD1-CG2 4.03Å; L211-I256 HydrophobicContact CD2-CD1 4.08Å; L211-L258 HydrophobicContact CD1-CD2 4.27Å; L211-H276 PolarHBondContact N-O 2.88Å; L211-F277 HydrophobicContact CB-CB 3.92Å; L211-F277 HydrophobicContact CD2-CB 3.89Å; L211-F277 HydrophobicContact CG-CB 4.5Å; L211-L281 HydrophobicContact CD2-CD2 3.92Å; L211-L367 HydrophobicContact CD1-CD1 4.29Å; L211-L367 HydrophobicContact CD2-CD1 3.92Å; L211-Y369 HydrophobicContact CD2-CE2 3.81Å; L211-Y369 WeakPolarHBondContact CD2-OH 3.49Å
212	E	95.8	Very high	93.9	Very high	69 Å²	69	57.9 Å²	57.9	32%	0.322	30%	0.3	S	S	.	.	H	α-helix	trans	-62.4	-45.7	178.2	-60	88.1	155.3	0	0	110.8	T210 A214 L215 H216 P278 L281 V286	T210-E212 VanDerWaalsContact C-N 3.27Å; T210-E212 VanDerWaalsContact CB-OE2 3.29Å; T210-E212 WeakPolarHBondContact CB-OE2 3.29Å; E212-A214 VanDerWaalsContact C-N 3.26Å; E212-A214 PolarHBondContact O-N 2.81Å; E212-L215 PolarHBondContact O-N 2.87Å; E212-H216 WeakPolarHBondContact O-CB 3.17Å; E212-H216 PolarHBondContact O-N 2.84Å; E212-P278 WeakPolarHBondContact OE1-CG 3.44Å; E212-L281 HydrophobicContact CG-CD1 4.38Å; E212-V286 HydrophobicContact CB-CG2 4.44Å; E212-V286 HydrophobicContact CG-CG2 4.32Å
213	D	95.1	Very high	93.7	Very high	72 Å²	72	61.4 Å²	61.4	39%	0.385	32%	0.315	S	S	.	.	H	α-helix	trans	-57.4	-41.2	172.1	-69.7	-21.3	0	0	0	111.2	L208 K209 T210 C217	L208-D213 HydrophobicContact CB-CB 4.39Å; L208-D213 HydrophobicContact CD2-CB 4.19Å; K209-D213 PolarHBondContact N-OD2 3.07Å; T210-D213 PolarHBondContact N-OD2 3.12Å; T210-D213 WeakPolarHBondContact OG1-CB 3.49Å; T210-D213 PolarHBondContact OG1-N 2.69Å; T210-D213 PolarHBondContact OG1-OD1 3.43Å; T210-D213 PolarHBondContact OG1-OD2 3.01Å; D213-C217 VanDerWaalsContact O-CB 3.22Å; D213-C217 WeakPolarHBondContact O-CB 3.37Å; D213-C217 PolarHBondContact O-N 2.9Å
214	A	96.9	Very high	93.6	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.008	30%	0.297	C	S	.	.	H	α-helix	trans	-73.4	-37.9	-177.2	0	0	0	0	0	112.9	L198 L208 T210 L211 E212 F218	L198-A214 HydrophobicContact CB-CB 4.27Å; L198-A214 HydrophobicContact CD1-CB 4.08Å; L208-A214 HydrophobicContact CD1-CB 3.98Å; T210-A214 PolarHBondContact O-N 3.1Å; L211-A214 CarbonylContact O-C 3.51Å; L211-A214 WeakPolarHBondContact O-CB 3.45Å; L211-A214 PolarHBondContact O-N 2.82Å; L211-A214 VanDerWaalsContact O-N 3.15Å; E212-A214 VanDerWaalsContact C-N 3.26Å; E212-A214 PolarHBondContact O-N 2.81Å; A214-F218 VanDerWaalsContact O-CB 3.29Å; A214-F218 WeakPolarHBondContact O-CB 3.35Å; A214-F218 PolarHBondContact O-N 3.08Å
215	L	95.5	Very high	92.9	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-66.7	-47.3	171.4	-70.5	162.8	0	0	0	111	L196 L198 L211 E212 C217 F218 F219 I256 L281 F283 V286	L196-L215 HydrophobicContact CD1-CD2 3.61Å; L198-L215 HydrophobicContact CD1-CD2 3.82Å; L198-L215 HydrophobicContact CD1-CG 3.86Å; L198-L215 HydrophobicContact CD2-CD2 4Å; L211-L215 HydrophobicContact CD1-CD1 4.23Å; L211-L215 HydrophobicContact CD1-CG 4.28Å; L211-L215 HydrophobicContact CG-CD1 3.92Å; L211-L215 HydrophobicContact CG-CG 4.44Å; L211-L215 WeakPolarHBondContact O-CG 3.38Å; L211-L215 PolarHBondContact O-N 3.36Å; E212-L215 PolarHBondContact O-N 2.87Å; L215-C217 VanDerWaalsContact C-N 3.34Å; L215-C217 PolarHBondContact O-N 3.37Å; L215-F218 WeakPolarHBondContact O-CB 3.46Å; L215-F218 PolarHBondContact O-N 2.9Å; L215-F218 VanDerWaalsContact O-N 3.07Å; L215-F219 HydrophobicContact CD2-CE2 4.31Å; L215-F219 VanDerWaalsContact O-CD2 3.27Å; L215-F219 WeakPolarHBondContact O-CD2 3.35Å; L215-F219 PolarHBondContact O-N 2.89Å; L215-I256 HydrophobicContact CD2-CD1 4.49Å; L215-L281 HydrophobicContact CD1-CD1 4.23Å; L215-L281 HydrophobicContact CD1-CD2 4.13Å; L215-F283 HydrophobicContact CD1-CE1 4.42Å; L215-F283 HydrophobicContact CD1-CZ 4.15Å; L215-F283 HydrophobicContact CD2-CE1 4.26Å; L215-F283 HydrophobicContact CD2-CZ 4.21Å; L215-V286 HydrophobicContact CB-CG1 3.32Å; L215-V286 HydrophobicContact CD1-CG1 4.04Å; L215-V286 HydrophobicContact CD1-CG2 4.31Å; L215-V286 HydrophobicContact CG-CG1 4.26Å
216	H	92.9	Very high	91.8	Very high	103 Å²	103	56.7 Å²	56.7	48%	0.477	29%	0.291	S	S	.	.	H	α-helix	trans	-56.8	-47.7	175	177.3	-92.4	0	0	0	110.9	E212 F218 F219 Q220	E212-H216 WeakPolarHBondContact O-CB 3.17Å; E212-H216 PolarHBondContact O-N 2.84Å; H216-F218 VanDerWaalsContact C-N 3.28Å; H216-F218 PolarHBondContact O-N 2.91Å; H216-F219 PolarHBondContact O-N 3.2Å; H216-Q220 VanDerWaalsContact O-CB 3.26Å; H216-Q220 WeakPolarHBondContact O-CB 3.36Å; H216-Q220 PolarHBondContact O-N 3.11Å
217	C	93.8	Very high	90.8	Very high	7 Å²	7	59.7 Å²	59.7	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-64.5	-29.7	176.8	-168	0	0	0	0	113.4	L208 D213 L215 R222	L208-C217 HydrophobicContact CD1-CB 4.19Å; D213-C217 VanDerWaalsContact O-CB 3.22Å; D213-C217 WeakPolarHBondContact O-CB 3.37Å; D213-C217 PolarHBondContact O-N 2.9Å; L215-C217 VanDerWaalsContact C-N 3.34Å; L215-C217 PolarHBondContact O-N 3.37Å; C217-R222 PolarHBondContact O-NE 3.29Å; C217-R222 PolarHBondContact O-NH2 2.82Å
218	F	93.7	Very high	89.8	Confident	23 Å²	23	60.1 Å²	60.1	10%	0.101	31%	0.309	C	S	.	.	H	α-helix	trans	-70.3	-44	177.3	179.5	-92.7	0	0	0	112.4	M193 L196 P197 L198 A214 L215 H216 L245	M193-F218 HydrophobicContact SD-CZ 4.47Å; L196-F218 HydrophobicContact CD2-CE1 3.97Å; L196-F218 HydrophobicContact CD2-CZ 4.4Å; P197-F218 HydrophobicContact CG-CE2 4.03Å; P197-F218 HydrophobicContact CG-CZ 4.5Å; P197-F218 WeakPolarHBondContact O-CD2 3.44Å; P197-F218 WeakPolarHBondContact O-CE2 3.49Å; L198-F218 HydrophobicContact CD2-CB 3.62Å; L198-F218 HydrophobicContact CD2-CD1 4.34Å; L198-F218 HydrophobicContact CD2-CD2 3.84Å; L198-F218 HydrophobicContact CD2-CG 3.68Å; A214-F218 VanDerWaalsContact O-CB 3.29Å; A214-F218 WeakPolarHBondContact O-CB 3.35Å; A214-F218 PolarHBondContact O-N 3.08Å; L215-F218 WeakPolarHBondContact O-CB 3.46Å; L215-F218 PolarHBondContact O-N 2.9Å; L215-F218 VanDerWaalsContact O-N 3.07Å; H216-F218 VanDerWaalsContact C-N 3.28Å; H216-F218 PolarHBondContact O-N 2.91Å; F218-L245 HydrophobicContact CE1-CD1 3.99Å; F218-L245 HydrophobicContact CZ-CD1 4.04Å
219	F	91.9	Very high	89.1	Confident	13 Å²	13	64.4 Å²	64.4	6%	0.057	33%	0.326	C	S	.	.	H	α-helix	trans	-87	-17.1	179.3	-65.6	-70.5	0	0	0	114	L196 L215 H216 L245 L247 L287	L196-F219 HydrophobicContact CD1-CE2 4.41Å; L196-F219 HydrophobicContact CD1-CZ 4.31Å; L196-F219 HydrophobicContact CD2-CZ 4.02Å; L215-F219 HydrophobicContact CD2-CE2 4.31Å; L215-F219 VanDerWaalsContact O-CD2 3.27Å; L215-F219 WeakPolarHBondContact O-CD2 3.35Å; L215-F219 PolarHBondContact O-N 2.89Å; H216-F219 PolarHBondContact O-N 3.2Å; F219-L245 HydrophobicContact CD1-CB 4.17Å; F219-L245 WeakPolarHBondContact CD1-O 3.41Å; F219-L247 HydrophobicContact CE1-CB 4.07Å; F219-L247 HydrophobicContact CE1-CD1 4.43Å; F219-L247 HydrophobicContact CZ-CB 4.35Å; F219-L247 HydrophobicContact CZ-CD1 4.26Å; F219-L247 HydrophobicContact CZ-CD2 4.24Å; F219-L287 HydrophobicContact CB-CD2 3.69Å; F219-L287 HydrophobicContact CD1-CD2 4.5Å; F219-L287 HydrophobicContact CD2-CD1 4.21Å; F219-L287 HydrophobicContact CD2-CD2 3.72Å; F219-L287 HydrophobicContact CD2-CG 4.28Å; F219-L287 HydrophobicContact CE2-CD1 4.17Å; F219-L287 HydrophobicContact CE2-CD2 4.48Å; F219-L287 HydrophobicContact CG-CD2 3.73Å
220	Q	91.2	Very high	88.4	Confident	88 Å²	88	60.9 Å²	60.9	41%	0.411	32%	0.315	S	S	.	.	S	Bend	trans	-53.6	131	174.3	-174.6	177.1	25.7	0	0	110.7	H216 R222	H216-Q220 VanDerWaalsContact O-CB 3.26Å; H216-Q220 WeakPolarHBondContact O-CB 3.36Å; H216-Q220 PolarHBondContact O-N 3.11Å; Q220-R222 WeakPolarHBondContact O-CG 3.25Å; Q220-R222 PolarHBondContact O-N 3.45Å
221	P	91.8	Very high	87.9	Confident	59 Å²	59	65.1 Å²	65.1	38%	0.383	33%	0.33	S	S	.	.			trans	-55.4	129.1	176.5	-30.7	37.5	0	0	0	113.7	K242 Q243 V244	P221-K242 HydrophobicContact CB-CD 4.33Å; P221-K242 HydrophobicContact CB-CG 4.21Å; P221-Q243 CarbonylContact C-O 3.57Å; P221-Q243 WeakPolarHBondContact CA-O 3.49Å; P221-V244 HydrophobicContact CB-CG2 4.03Å; P221-V244 HydrophobicContact CG-CG1 4.39Å; P221-V244 HydrophobicContact CG-CG2 4.16Å
222	R	89.8	Confident	87.6	Confident	93 Å²	93	65.7 Å²	65.7	35%	0.351	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.5	-176.4	-66.6	176.7	-177.9	-162.7	-5.1	111	C217 Q220 K242 Q243	C217-R222 PolarHBondContact O-NE 3.29Å; C217-R222 PolarHBondContact O-NH2 2.82Å; Q220-R222 WeakPolarHBondContact O-CG 3.25Å; Q220-R222 PolarHBondContact O-N 3.45Å; R222-K242 CarbonylContact O-C 3.47Å; R222-K242 WeakPolarHBondContact O-CA 3.43Å; R222-Q243 PolarHBondContact N-O 3.03Å; R222-Q243 PolarHBondContact O-N 3.23Å
223	E	89.9	Confident	87.4	Confident	110 Å²	110	71.7 Å²	71.7	51%	0.514	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	131.8	165.6	-69.6	-164	-167.9	0	0	110.6	L181 R240	L181-E223 HydrophobicContact CD1-CG 4.34Å; E223-R240 IonicContact OE1-NH2 3.02Å; E223-R240 IonicContact OE2-CZ 3.82Å; E223-R240 IonicContact OE2-NE 2.63Å; E223-R240 IonicContact OE2-NH2 3.6Å; E223-R240 PolarHBondContact OE2-NH2 3.5Å
224	L	84.8	Confident	87.2	Confident	39 Å²	39	73.6 Å²	73.6	20%	0.204	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-72.8	138.4	175.9	-61.1	179.1	0	0	0	110	L178 C230 G241 Q243	L178-L224 HydrophobicContact CD1-CD1 3.61Å; L224-C230 WeakPolarHBondContact CD1-SG 3.49Å; L224-G241 WeakPolarHBondContact CB-O 2.92Å; L224-G241 PolarHBondContact N-O 3.11Å; L224-Q243 HydrophobicContact CD2-CB 4.27Å
225	S	76.6	Confident	87	Confident	63 Å²	63	75.5 Å²	75.5	44%	0.441	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-56.7	155.7	-176.3	86.1	0	0	0	0	112.2	K227 S228	S225-K227 PolarHBondContact O-N 3.38Å; S225-K227 PolarHBondContact OG-N 2.74Å; S225-S228 CarbonylContact O-C 3.54Å; S225-S228 WeakPolarHBondContact O-CA 3.37Å; S225-S228 PolarHBondContact O-N 3.01Å; S225-S228 PolarHBondContact OG-N 3.38Å; S225-S228 PolarHBondContact OG-OG 2.86Å
226	S	69.2	Low	86.8	Confident	96 Å²	96	78 Å²	78	67%	0.671	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.7	178.2	58.4	0	0	0	0	114.3
227	K	72.4	Confident	86.8	Confident	197 Å²	197	78.2 Å²	78.2	86%	0.857	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-20	173.3	-61.1	-178.5	-179.8	179.8	0	112.9	S225	S225-K227 PolarHBondContact O-N 3.38Å; S225-K227 PolarHBondContact OG-N 2.74Å
228	S	76.4	Confident	86.6	Confident	62 Å²	62	85 Å²	85	43%	0.434	44%	0.436	S	S	.	.	S	Bend	trans	-104.1	39.5	-174.4	-50.4	0	0	0	0	112.4	S225 C230	S225-S228 CarbonylContact O-C 3.54Å; S225-S228 WeakPolarHBondContact O-CA 3.37Å; S225-S228 PolarHBondContact O-N 3.01Å; S225-S228 PolarHBondContact OG-N 3.38Å; S225-S228 PolarHBondContact OG-OG 2.86Å; S228-C230 PolarHBondContact O-N 3.4Å
229	K	82.2	Confident	86.3	Confident	110 Å²	110	84.1 Å²	84.1	48%	0.478	43%	0.432	S	S	.	.			trans	-64.3	127.4	179.9	-65	-176.5	-177	-178.6	0	111.6	K238 T239	K229-K238 HydrophobicContact CB-CB 3.95Å; K229-K238 HydrophobicContact CD-CB 4.5Å; K229-T239 WeakPolarHBondContact CA-O 3.31Å; K229-T239 WeakPolarHBondContact CB-O 3.41Å
230	C	81.3	Confident	86.3	Confident	33 Å²	33	89.7 Å²	89.7	22%	0.223	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	145.7	177.1	-64.6	0	0	0	0	111.3	L178 L224 S228 C232 K238 T239	L178-C230 HydrophobicContact CD2-CB 3.8Å; L224-C230 WeakPolarHBondContact CD1-SG 3.49Å; S228-C230 PolarHBondContact O-N 3.4Å; C230-C232 PolarHBondContact O-N 2.87Å; C230-K238 CarbonylContact O-C 3.18Å; C230-K238 VanDerWaalsContact O-CA 3.29Å; C230-K238 WeakPolarHBondContact O-CA 3.28Å; C230-T239 PolarHBondContact N-O 3.37Å; C230-T239 PolarHBondContact O-N 2.77Å
231	F	87.4	Confident	86.3	Confident	129 Å²	129	85.6 Å²	85.6	57%	0.566	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	113.4	172.1	-177.2	-95.4	0	0	0	109.9	K233 G236	F231-K233 HydrophobicContact CD1-CG 4.49Å; F231-K233 HydrophobicContact CE1-CG 4.36Å; F231-G236 WeakPolarHBondContact CE2-O 3.34Å
232	C	91	Very high	86.3	Confident	13 Å²	13	86.5 Å²	86.5	9%	0.088	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	118.2	173.2	-179.5	0	0	0	0	109.2	C180 C230 N234 C235 G236 K237 T239	C180-C232 HydrophobicContact CB-CB 4.4Å; C180-C232 VanDerWaalsContact SG-SG 3.67Å; C230-C232 PolarHBondContact O-N 2.87Å; C232-N234 VanDerWaalsContact C-N 3.27Å; C232-N234 PolarHBondContact O-N 3.2Å; C232-C235 HydrophobicContact CB-CB 4.04Å; C232-C235 PolarHBondContact O-N 3.04Å; C232-C235 PolarHBondContact SG-N 3.5Å; C232-G236 PolarHBondContact O-N 2.94Å; C232-K237 PolarHBondContact N-O 3Å; C232-T239 HydrophobicContact CB-CG2 3.92Å
233	K	90.6	Very high	86.5	Confident	194 Å²	194	85.1 Å²	85.1	84%	0.843	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-37.3	176.8	-66.2	-175.6	-179.6	-178.7	0	112.3	F231	F231-K233 HydrophobicContact CD1-CG 4.49Å; F231-K233 HydrophobicContact CE1-CG 4.36Å
234	N	91.8	Very high	86.6	Confident	113 Å²	113	81.5 Å²	81.5	60%	0.604	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-42.6	180	-168.1	50.5	0	0	0	112.5	M185 C232 G236	M185-N234 HydrophobicContact CB-CB 4.42Å; M185-N234 HydrophobicContact CG-CB 4.44Å; C232-N234 VanDerWaalsContact C-N 3.27Å; C232-N234 PolarHBondContact O-N 3.2Å; N234-G236 VanDerWaalsContact C-N 3.34Å
235	C	92.3	Very high	87	Confident	40 Å²	40	81.4 Å²	81.4	27%	0.27	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-6.6	177.4	-57.7	0	0	0	0	114.5	C183 C232 K237 T239	C183-C235 PolarHBondContact SG-SG 3.47Å; C232-C235 HydrophobicContact CB-CB 4.04Å; C232-C235 PolarHBondContact O-N 3.04Å; C232-C235 PolarHBondContact SG-N 3.5Å; C235-K237 HydrophobicContact CB-CD 4.35Å; C235-K237 HydrophobicContact CB-CG 3.86Å; C235-K237 PolarHBondContact O-N 3.39Å; C235-T239 HydrophobicContact CB-CG2 4.02Å
236	G	92	Very high	87.6	Confident	52 Å²	52	83.9 Å²	83.9	54%	0.536	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	12.8	-174.6	0	0	0	0	0	115.6	F231 C232 N234	F231-G236 WeakPolarHBondContact CE2-O 3.34Å; C232-G236 PolarHBondContact O-N 2.94Å; N234-G236 VanDerWaalsContact C-N 3.34Å
237	K	92.1	Very high	88.7	Confident	108 Å²	108	79.6 Å²	79.6	47%	0.47	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	166.3	-169.3	75	-172.1	-176.5	176.4	0	112.8	D182 C232 C235 T239	D182-K237 WeakPolarHBondContact OD2-CE 3.43Å; D182-K237 IonicContact OD2-NZ 2.75Å; D182-K237 PolarHBondContact OD2-NZ 3.28Å; C232-K237 PolarHBondContact N-O 3Å; C235-K237 HydrophobicContact CB-CD 4.35Å; C235-K237 HydrophobicContact CB-CG 3.86Å; C235-K237 PolarHBondContact O-N 3.39Å; K237-T239 HydrophobicContact CG-CG2 3.87Å; K237-T239 PolarHBondContact O-N 3.35Å
238	K	90.2	Very high	89.5	Confident	149 Å²	149	72.9 Å²	72.9	65%	0.648	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	109.7	171.6	-70.5	-172.1	-179.9	-179.2	0	111	K229 C230	K229-K238 HydrophobicContact CB-CB 3.95Å; K229-K238 HydrophobicContact CD-CB 4.5Å; C230-K238 CarbonylContact O-C 3.18Å; C230-K238 VanDerWaalsContact O-CA 3.29Å; C230-K238 WeakPolarHBondContact O-CA 3.28Å
239	T	87.9	Confident	90.2	Very high	5 Å²	5	72.5 Å²	72.5	3%	0.031	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	170.6	-178.8	65.7	0	0	0	0	111.4	C180 D182 K229 C230 C232 C235 K237	C180-T239 PolarHBondContact SG-OG1 2.96Å; D182-T239 HydrophobicContact CB-CG2 3.96Å; D182-T239 WeakPolarHBondContact OD1-CB 3.45Å; K229-T239 WeakPolarHBondContact CA-O 3.31Å; K229-T239 WeakPolarHBondContact CB-O 3.41Å; C230-T239 PolarHBondContact N-O 3.37Å; C230-T239 PolarHBondContact O-N 2.77Å; C232-T239 HydrophobicContact CB-CG2 3.92Å; C235-T239 HydrophobicContact CB-CG2 4.02Å; K237-T239 HydrophobicContact CG-CG2 3.87Å; K237-T239 PolarHBondContact O-N 3.35Å
240	R	91.4	Very high	90.7	Very high	131 Å²	131	67.7 Å²	67.7	49%	0.494	33%	0.333	S	S	.	.			trans	-68.7	152.9	157.7	-73.1	167	66.8	-173.8	1.9	108.8	L181 E223	L181-R240 HydrophobicContact CB-CB 4.24Å; L181-R240 HydrophobicContact CD1-CB 3.89Å; L181-R240 HydrophobicContact CG-CB 4.32Å; L181-R240 PolarHBondContact N-O 3.41Å; E223-R240 IonicContact OE1-NH2 3.02Å; E223-R240 IonicContact OE2-CZ 3.82Å; E223-R240 IonicContact OE2-NE 2.63Å; E223-R240 IonicContact OE2-NH2 3.6Å; E223-R240 PolarHBondContact OE2-NH2 3.5Å
241	G	90.9	Very high	91.4	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.01	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	152.3	177.6	0	0	0	0	0	110.9	I179 L224	I179-G241 CarbonylContact O-C 3.5Å; I179-G241 VanDerWaalsContact O-CA 3.25Å; I179-G241 WeakPolarHBondContact O-CA 3.43Å; L224-G241 WeakPolarHBondContact CB-O 2.92Å; L224-G241 PolarHBondContact N-O 3.11Å
242	K	92.9	Very high	91.8	Very high	78 Å²	78	62.5 Å²	62.5	34%	0.339	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	120.5	173.8	177.5	176.9	177.7	-179.9	0	107.8	I179 L181 P221 R222	I179-K242 HydrophobicContact CB-CB 4.49Å; I179-K242 PolarHBondContact N-O 2.98Å; I179-K242 PolarHBondContact O-N 2.75Å; L181-K242 HydrophobicContact CD2-CB 3.9Å; P221-K242 HydrophobicContact CB-CD 4.33Å; P221-K242 HydrophobicContact CB-CG 4.21Å; R222-K242 CarbonylContact O-C 3.47Å; R222-K242 WeakPolarHBondContact O-CA 3.43Å
243	Q	92.4	Very high	92.1	Very high	65 Å²	65	61.9 Å²	61.9	30%	0.304	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	136.7	175.2	-170.7	175.9	18	0	0	109.4	D176 S177 P221 R222 L224	D176-Q243 PolarHBondContact OD1-NE2 3.37Å; S177-Q243 CarbonylContact O-C 3.54Å; S177-Q243 WeakPolarHBondContact O-CA 3.44Å; P221-Q243 CarbonylContact C-O 3.57Å; P221-Q243 WeakPolarHBondContact CA-O 3.49Å; R222-Q243 PolarHBondContact N-O 3.03Å; R222-Q243 PolarHBondContact O-N 3.23Å; L224-Q243 HydrophobicContact CD2-CB 4.27Å
244	V	92.7	Very high	92.4	Very high	34 Å²	34	52.7 Å²	52.7	21%	0.206	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	127.8	176.8	-175.1	0	0	0	0	107.7	S177 I179 P221	S177-V244 PolarHBondContact N-O 2.99Å; S177-V244 PolarHBondContact O-N 2.72Å; I179-V244 HydrophobicContact CD1-CG2 3.88Å; P221-V244 HydrophobicContact CB-CG2 4.03Å; P221-V244 HydrophobicContact CG-CG1 4.39Å; P221-V244 HydrophobicContact CG-CG2 4.16Å
245	L	92.4	Very high	92.7	Very high	37 Å²	37	47.3 Å²	47.3	19%	0.194	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	110.4	170.8	-65	175.7	0	0	0	107.5	D176 F218 F219	D176-L245 HydrophobicContact CB-CD2 3.86Å; F218-L245 HydrophobicContact CE1-CD1 3.99Å; F218-L245 HydrophobicContact CZ-CD1 4.04Å; F219-L245 HydrophobicContact CD1-CB 4.17Å; F219-L245 WeakPolarHBondContact CD1-O 3.41Å
246	K	90.9	Very high	93	Very high	114 Å²	114	45.4 Å²	45.4	50%	0.496	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.1	170.5	-172.6	174.7	-178.1	179.5	0	108.7	V174 K175	V174-K246 CarbonylContact C-O 3.57Å; V174-K246 VanDerWaalsContact CA-O 3.28Å; V174-K246 WeakPolarHBondContact CA-O 3.34Å; K175-K246 HydrophobicContact CB-CB 4.45Å; K175-K246 PolarHBondContact N-O 3.4Å; K175-K246 PolarHBondContact O-N 2.58Å
247	L	90.8	Very high	93.4	Very high	7 Å²	7	44.1 Å²	44.1	4%	0.037	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	130.4	172.5	-171.4	61.2	0	0	0	109.4	I172 V174 F219 L250 F283 L287 P300	I172-L247 HydrophobicContact CG2-CD1 3.61Å; V174-L247 HydrophobicContact CG1-CD1 4.03Å; F219-L247 HydrophobicContact CE1-CB 4.07Å; F219-L247 HydrophobicContact CE1-CD1 4.43Å; F219-L247 HydrophobicContact CZ-CB 4.35Å; F219-L247 HydrophobicContact CZ-CD1 4.26Å; F219-L247 HydrophobicContact CZ-CD2 4.24Å; L247-L250 HydrophobicContact CD1-CD2 4.05Å; L247-L250 HydrophobicContact CD1-CG 4.32Å; L247-L250 HydrophobicContact CD2-CD1 3.92Å; L247-L250 HydrophobicContact CD2-CD2 3.77Å; L247-L250 HydrophobicContact CD2-CG 3.65Å; L247-L250 HydrophobicContact CG-CD2 4.39Å; L247-L250 HydrophobicContact CG-CG 4.23Å; L247-F283 HydrophobicContact CD2-CD1 4.25Å; L247-F283 HydrophobicContact CD2-CE1 4.44Å; L247-L287 HydrophobicContact CB-CD1 3.78Å; L247-L287 HydrophobicContact CD2-CD1 3.28Å; L247-L287 HydrophobicContact CG-CD1 4.21Å; L247-P300 HydrophobicContact CD2-CB 4.29Å; L247-P300 HydrophobicContact CG-CB 4.23Å
248	T	90.6	Very high	93.7	Very high	55 Å²	55	39 Å²	39	34%	0.337	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-27.3	-179.8	56.6	0	0	0	0	113.1	R173 K175	R173-T248 VanDerWaalsContact C-OG1 3.23Å; R173-T248 WeakPolarHBondContact CB-OG1 3.49Å; R173-T248 PolarHBondContact O-N 3.27Å; R173-T248 PolarHBondContact O-OG1 3.37Å; R173-T248 VanDerWaalsContact O-OG1 3.11Å; K175-T248 HydrophobicContact CB-CG2 3.98Å
249	H	91	Very high	94	Very high	54 Å²	54	35.5 Å²	35.5	25%	0.25	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	134.9	173.7	177.7	-90.2	0	0	0	110.7	M171 R173	M171-H249 PolarHBondContact O-ND1 2.96Å; R173-H249 HydrophobicContact CB-CB 3.87Å; R173-H249 HydrophobicContact CG-CB 4Å; R173-H249 PolarHBondContact N-O 2.95Å; R173-H249 PolarHBondContact O-N 2.76Å; R173-H249 VanDerWaalsContact O-N 3.16Å
250	L	92.8	Very high	94.4	Very high	10 Å²	10	35.3 Å²	35.3	5%	0.052	17%	0.165	C	C	.	.			trans	-105.6	133.9	168.6	-77.3	172.2	0	0	0	110.7	L247 L254 F283 P300 Y304	L247-L250 HydrophobicContact CD1-CD2 4.05Å; L247-L250 HydrophobicContact CD1-CG 4.32Å; L247-L250 HydrophobicContact CD2-CD1 3.92Å; L247-L250 HydrophobicContact CD2-CD2 3.77Å; L247-L250 HydrophobicContact CD2-CG 3.65Å; L247-L250 HydrophobicContact CG-CD2 4.39Å; L247-L250 HydrophobicContact CG-CG 4.23Å; L250-L254 HydrophobicContact CD2-CD1 4.04Å; L250-L254 HydrophobicContact CD2-CD2 4.37Å; L250-F283 HydrophobicContact CD1-CB 3.92Å; L250-F283 HydrophobicContact CD1-CD1 3.68Å; L250-F283 HydrophobicContact CD1-CD2 3.9Å; L250-F283 HydrophobicContact CD1-CE1 4.19Å; L250-F283 HydrophobicContact CD1-CE2 4.38Å; L250-F283 HydrophobicContact CD1-CG 3.52Å; L250-F283 HydrophobicContact CD2-CE1 4.3Å; L250-F283 HydrophobicContact CD2-CZ 4.43Å; L250-P300 WeakPolarHBondContact CD1-O 3.23Å; L250-Y304 VanDerWaalsContact CB-OH 3.26Å; L250-Y304 WeakPolarHBondContact CB-OH 3.01Å; L250-Y304 HydrophobicContact CD1-CE2 3.92Å
251	P	95.4	Very high	94.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.149	C	C	.	.			trans	-81.7	158.9	-178.1	36.2	-37.2	0	0	0	112.6	Y170 I172 T253 Y304	Y170-P251 VanDerWaalsContact C-CB 3.47Å; I172-P251 HydrophobicContact CG1-CG 3.88Å; P251-T253 PolarHBondContact O-N 2.86Å; P251-Y304 PolarHBondContact O-OH 3.12Å; P251-Y304 VanDerWaalsContact O-OH 3.05Å
252	Q	95.2	Very high	94.3	Very high	52 Å²	52	32.6 Å²	32.6	24%	0.243	16%	0.161	C	C	.	.	S	Bend	trans	-56.7	-35.9	177.7	-179.5	58.8	26	0	0	113.1	L169 M370 K371	L169-Q252 HydrophobicContact CD1-CB 3.94Å; L169-Q252 HydrophobicContact CD1-CG 4.07Å; Q252-M370 WeakPolarHBondContact O-CA 3.47Å; Q252-K371 PolarHBondContact NE2-O 3.13Å; Q252-K371 PolarHBondContact O-N 3.18Å
253	T	97.3	Very high	93.9	Very high	1 Å²	1	35 Å²	35	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	101	169	-58.6	0	0	0	0	109.9	N78 L169 Y170 P251 V368 Y369	N78-T253 PolarHBondContact ND2-OG1 3.19Å; L169-T253 WeakPolarHBondContact CD1-OG1 3.47Å; L169-T253 WeakPolarHBondContact O-CA 2.97Å; L169-T253 WeakPolarHBondContact O-CB 3.22Å; L169-T253 PolarHBondContact O-N 3.35Å; Y170-T253 HydrophobicContact CD1-CG2 4Å; Y170-T253 HydrophobicContact CE1-CG2 3.56Å; P251-T253 PolarHBondContact O-N 2.86Å; T253-V368 HydrophobicContact CG2-CG1 3.48Å; T253-V368 VanDerWaalsContact CG2-CG1 3.48Å; T253-Y369 CarbonylContact C-O 3.38Å
254	L	97.6	Very high	93.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	127.3	176.4	173.9	65.6	0	0	0	110.5	I172 L196 L250 I256 F283 Y304 V368 Y369	I172-L254 HydrophobicContact CD1-CD1 3.78Å; I172-L254 HydrophobicContact CG1-CD1 3.83Å; L196-L254 HydrophobicContact CD1-CD1 4.18Å; L196-L254 HydrophobicContact CG-CD1 4.32Å; L250-L254 HydrophobicContact CD2-CD1 4.04Å; L250-L254 HydrophobicContact CD2-CD2 4.37Å; L254-I256 HydrophobicContact CD2-CD1 4.11Å; L254-I256 HydrophobicContact CD2-CG1 4.18Å; L254-I256 HydrophobicContact CG-CG1 4.13Å; L254-F283 HydrophobicContact CD2-CD2 4.44Å; L254-F283 HydrophobicContact CD2-CE2 3.3Å; L254-F283 HydrophobicContact CD2-CZ 3.4Å; L254-Y304 HydrophobicContact CB-CD1 4.1Å; L254-Y304 HydrophobicContact CB-CE1 3.75Å; L254-V368 WeakPolarHBondContact O-CA 3.43Å; L254-Y369 PolarHBondContact N-O 3.4Å; L254-Y369 PolarHBondContact O-N 2.93Å
255	T	98.6	Very high	92.6	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	133.7	169.8	-54.5	0	0	0	0	110.6	Y146 T195 L196 L367 V368	Y146-T255 HydrophobicContact CE1-CG2 4.15Å; Y146-T255 PolarHBondContact OH-OG1 2.86Å; Y146-T255 VanDerWaalsContact OH-OG1 3.13Å; T195-T255 CarbonylContact C-O 3.58Å; T195-T255 VanDerWaalsContact CA-O 3.25Å; T195-T255 WeakPolarHBondContact CA-O 3.35Å; T195-T255 HydrophobicContact CG2-CG2 3.69Å; L196-T255 PolarHBondContact N-O 3.38Å; T255-L367 WeakPolarHBondContact CA-O 3.15Å; T255-V368 HydrophobicContact CG2-CG2 4.33Å
256	I	98.7	Very high	92.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	127.4	177.5	-58.4	179.1	0	0	0	108	L198 L211 L215 L254 L258 L281 L366 L367 Y369	L198-I256 HydrophobicContact CD1-CG2 3.39Å; L198-I256 HydrophobicContact CG-CG2 3.77Å; L211-I256 HydrophobicContact CD1-CD1 4.11Å; L211-I256 HydrophobicContact CD1-CG2 4.03Å; L211-I256 HydrophobicContact CD2-CD1 4.08Å; L215-I256 HydrophobicContact CD2-CD1 4.49Å; L254-I256 HydrophobicContact CD2-CD1 4.11Å; L254-I256 HydrophobicContact CD2-CG1 4.18Å; L254-I256 HydrophobicContact CG-CG1 4.13Å; I256-L258 HydrophobicContact CG2-CD2 4.17Å; I256-L281 HydrophobicContact CD1-CD2 4.16Å; I256-L366 CarbonylContact O-C 3.58Å; I256-L366 WeakPolarHBondContact O-CA 3.48Å; I256-L367 HydrophobicContact CB-CB 4.3Å; I256-L367 PolarHBondContact N-O 3.2Å; I256-L367 PolarHBondContact O-N 2.92Å; I256-Y369 HydrophobicContact CD1-CD2 4.02Å; I256-Y369 HydrophobicContact CD1-CE2 4.1Å
257	H	98.7	Very high	91.8	Very high	24 Å²	24	49.9 Å²	49.9	11%	0.111	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	111.1	176.5	168.2	-154.5	0	0	0	109.5	A143 L196 L198 M259 Y365 L366	A143-H257 HydrophobicContact CB-CB 4.48Å; L196-H257 PolarHBondContact O-N 3.03Å; L198-H257 PolarHBondContact N-O 3.13Å; H257-M259 PolarHBondContact O-N 3.41Å; H257-Y365 AromaticContact CD2-CZ 3.96Å; H257-Y365 AromaticContact NE2-CZ 3.58Å; H257-Y365 PolarHBondContact NE2-OH 3.37Å; H257-L366 HydrophobicContact CB-CD2 3.57Å
258	L	98.6	Very high	91.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	107.5	171.6	-59.9	-172.6	0	0	0	108	L198 L200 L211 I256 R260 L275 A364 Y365 L367	L198-L258 HydrophobicContact CB-CD2 4.49Å; L198-L258 HydrophobicContact CD1-CD2 4.42Å; L200-L258 HydrophobicContact CD2-CB 4.14Å; L200-L258 HydrophobicContact CD2-CD2 4.15Å; L211-L258 HydrophobicContact CD1-CD2 4.27Å; I256-L258 HydrophobicContact CG2-CD2 4.17Å; L258-R260 PolarHBondContact O-N 3.15Å; L258-L275 HydrophobicContact CD1-CD2 3.76Å; L258-L275 HydrophobicContact CD2-CD2 3.61Å; L258-L275 HydrophobicContact CG-CD2 4.31Å; L258-A364 HydrophobicContact CD1-CB 4.25Å; L258-Y365 PolarHBondContact N-O 3.39Å; L258-L367 HydrophobicContact CD1-CD1 4.15Å; L258-L367 HydrophobicContact CD1-CG 4.25Å; L258-L367 HydrophobicContact CD2-CD1 4.47Å; L258-L367 HydrophobicContact CG-CD1 4.43Å; L258-L367 HydrophobicContact CG-CG 4.45Å
259	M	97.1	Very high	91.7	Very high	77 Å²	77	56.6 Å²	56.6	38%	0.379	28%	0.282	S	S	.	.			trans	-70.9	69.6	-172.1	-64.4	-176.3	71.8	0	0	112.5	P197 L198 H257 I271	P197-M259 HydrophobicContact CB-CG 4.2Å; P197-M259 HydrophobicContact CB-SD 3.91Å; L198-M259 WeakPolarHBondContact O-CB 3.39Å; L198-M259 WeakPolarHBondContact O-CG 3.42Å; L198-M259 PolarHBondContact O-N 2.93Å; H257-M259 PolarHBondContact O-N 3.41Å; M259-I271 WeakPolarHBondContact O-CD1 3.47Å
260	R	95.8	Very high	91.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.275	C	S	.	.			trans	-79.8	-14.5	-176.7	-72.8	-170.3	-174.6	-93.7	11.3	113.7	L200 L258 K270 I271 H273 Y353 T363 A364 Y365	L200-R260 HydrophobicContact CD1-CB 4.48Å; L200-R260 HydrophobicContact CD1-CG 3.45Å; L200-R260 VanDerWaalsContact CD1-CG 3.45Å; L258-R260 PolarHBondContact O-N 3.15Å; R260-K270 CarbonylContact O-C 3.57Å; R260-K270 VanDerWaalsContact O-CA 3.28Å; R260-K270 WeakPolarHBondContact O-CA 3.46Å; R260-I271 WeakPolarHBondContact CD-O 3.41Å; R260-I271 PolarHBondContact NH1-O 3.47Å; R260-I271 PolarHBondContact O-N 2.98Å; R260-H273 PolarHBondContact NH1-O 3.3Å; R260-Y353 PolarHBondContact NH2-O 2.84Å; R260-T363 WeakPolarHBondContact CD-OG1 3.23Å; R260-A364 WeakPolarHBondContact CD-O 3.25Å; R260-A364 PolarHBondContact NE-O 2.88Å; R260-Y365 HydrophobicContact CB-CD2 4.16Å
261	F	93.4	Very high	91.8	Very high	38 Å²	38	56.1 Å²	56.1	17%	0.167	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	124.9	175.3	-59.5	-24.9	0	0	0	110.3	T268 K270 H312 A316 Y365	F261-T268 HydrophobicContact CB-CG2 4.06Å; F261-K270 HydrophobicContact CD1-CB 4.29Å; F261-K270 HydrophobicContact CD1-CG 4.31Å; F261-K270 HydrophobicContact CE1-CB 4.27Å; F261-K270 HydrophobicContact CE1-CD 4.46Å; F261-K270 HydrophobicContact CE1-CG 4.03Å; F261-H312 AromaticContact CE1-ND1 3.92Å; F261-H312 AromaticContact CZ-CE1 3.77Å; F261-H312 AromaticContact CZ-ND1 3.72Å; F261-A316 HydrophobicContact CD1-CB 4.04Å; F261-A316 HydrophobicContact CE1-CB 4.2Å; F261-Y365 HydrophobicContact CD1-CE2 4.39Å; F261-Y365 AromaticContact CD2-CE2 3.64Å; F261-Y365 HydrophobicContact CD2-CE2 3.64Å; F261-Y365 HydrophobicContact CE1-CE2 4.37Å; F261-Y365 HydrophobicContact CE2-CD2 4.31Å; F261-Y365 AromaticContact CE2-CE2 3.62Å; F261-Y365 HydrophobicContact CE2-CE2 3.62Å; F261-Y365 HydrophobicContact CG-CE2 4.04Å; F261-Y365 HydrophobicContact CZ-CD2 4.27Å; F261-Y365 HydrophobicContact CZ-CE2 4Å
262	S	87.6	Confident	91.8	Very high	37 Å²	37	56.6 Å²	56.6	26%	0.259	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	127.4	-178.3	179.2	0	0	0	0	110	R269	S262-R269 PolarHBondContact N-O 2.97Å; S262-R269 PolarHBondContact O-N 2.9Å
263	I	84.4	Confident	91.7	Very high	128 Å²	128	55 Å²	55	66%	0.656	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	122.6	175.1	-57.8	173.3	0	0	0	108.7	Q267	I263-Q267 WeakPolarHBondContact CA-O 3.2Å
264	R	77.1	Confident	91.7	Very high	144 Å²	144	56.2 Å²	56.2	54%	0.543	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	129.9	172.4	-63.9	-170.3	179.7	-156.7	0.7	109	S266 Q267	R264-S266 VanDerWaalsContact C-N 3.28Å; R264-S266 PolarHBondContact O-N 3.48Å; R264-Q267 PolarHBondContact N-O 3.44Å; R264-Q267 PolarHBondContact O-N 2.92Å; R264-Q267 VanDerWaalsContact O-O 3.05Å
265	N	81.1	Confident	91.7	Very high	161 Å²	161	56.2 Å²	56.2	86%	0.861	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	45.2	-179.3	-56.1	-9.8	0	0	0	113.1	Q267	N265-Q267 PolarHBondContact O-N 2.73Å; N265-Q267 VanDerWaalsContact O-N 3.15Å
266	S	82.4	Confident	91.7	Very high	124 Å²	124	60.4 Å²	60.4	87%	0.867	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	15.4	-176.8	-51	0	0	0	0	115.9	R264	R264-S266 VanDerWaalsContact C-N 3.28Å; R264-S266 PolarHBondContact O-N 3.48Å
267	Q	84.2	Confident	91.6	Very high	134 Å²	134	60.5 Å²	60.5	63%	0.626	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	139.2	173.2	-65.1	178.8	-1.9	0	0	110.4	I263 R264 N265	I263-Q267 WeakPolarHBondContact CA-O 3.2Å; R264-Q267 PolarHBondContact N-O 3.44Å; R264-Q267 PolarHBondContact O-N 2.92Å; R264-Q267 VanDerWaalsContact O-O 3.05Å; N265-Q267 PolarHBondContact O-N 2.73Å; N265-Q267 VanDerWaalsContact O-N 3.15Å
268	T	88.4	Confident	91.6	Very high	49 Å²	49	60.7 Å²	60.7	30%	0.301	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	127.7	173.3	-46.8	0	0	0	0	109.2	F261 A316	F261-T268 HydrophobicContact CB-CG2 4.06Å; T268-A316 HydrophobicContact CG2-CB 3.62Å
269	R	89.9	Confident	91.5	Very high	155 Å²	155	63.4 Å²	63.4	59%	0.585	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	138	176.7	-66.7	-168.8	64.3	170.6	-0.3	111.2	S262	S262-R269 PolarHBondContact N-O 2.97Å; S262-R269 PolarHBondContact O-N 2.9Å
270	K	93.3	Very high	91.4	Very high	28 Å²	28	62.7 Å²	62.7	12%	0.122	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	136.8	172.5	-172.2	-176.5	176.8	-170.2	0	110.7	R260 F261 H312 G314 Q361 T363	R260-K270 CarbonylContact O-C 3.57Å; R260-K270 VanDerWaalsContact O-CA 3.28Å; R260-K270 WeakPolarHBondContact O-CA 3.46Å; F261-K270 HydrophobicContact CD1-CB 4.29Å; F261-K270 HydrophobicContact CD1-CG 4.31Å; F261-K270 HydrophobicContact CE1-CB 4.27Å; F261-K270 HydrophobicContact CE1-CD 4.46Å; F261-K270 HydrophobicContact CE1-CG 4.03Å; K270-H312 PolarHBondContact NZ-O 3.03Å; K270-G314 WeakPolarHBondContact CD-O 3.45Å; K270-G314 WeakPolarHBondContact CE-O 3.13Å; K270-G314 PolarHBondContact NZ-O 3.19Å; K270-Q361 PolarHBondContact NZ-O 2.85Å; K270-T363 WeakPolarHBondContact CE-OG1 3.43Å; K270-T363 PolarHBondContact NZ-OG1 2.97Å
271	I	93.9	Very high	91.3	Very high	25 Å²	25	62.8 Å²	62.8	13%	0.128	32%	0.324	C	S	.	.			trans	-99.4	105	175.7	-62.3	153.9	0	0	0	108.1	L200 F201 M259 R260 H273	L200-I271 HydrophobicContact CB-CG2 4.46Å; L200-I271 HydrophobicContact CD1-CB 4.45Å; L200-I271 HydrophobicContact CD1-CG2 4Å; F201-I271 HydrophobicContact CE2-CD1 3.84Å; F201-I271 HydrophobicContact CE2-CG1 4.09Å; F201-I271 HydrophobicContact CE2-CG2 3.86Å; F201-I271 HydrophobicContact CZ-CG2 4.03Å; M259-I271 WeakPolarHBondContact O-CD1 3.47Å; R260-I271 WeakPolarHBondContact CD-O 3.41Å; R260-I271 PolarHBondContact NH1-O 3.47Å; R260-I271 PolarHBondContact O-N 2.98Å; I271-H273 VanDerWaalsContact CG2-ND1 3.34Å; I271-H273 WeakPolarHBondContact CG2-ND1 3.14Å
272	C	94	Very high	91.2	Very high	11 Å²	11	63.3 Å²	63.3	7%	0.074	33%	0.328	C	S	.	.			trans	-100.6	7.7	-173.2	-53.1	0	0	0	0	114.5	G354 N355 T363	C272-G354 CarbonylContact O-C 2.87Å; C272-N355 CarbonylContact O-C 3.43Å; C272-N355 WeakPolarHBondContact O-CA 3.49Å; C272-N355 PolarHBondContact O-N 3.23Å; C272-T363 HydrophobicContact CB-CG2 4.37Å
273	H	94.4	Very high	91.2	Very high	18 Å²	18	61.6 Å²	61.6	8%	0.083	32%	0.316	C	S	.	.			trans	-68.2	153.8	179.8	79.6	-100.6	0	0	0	111.9	L200 L208 R260 I271 L275 P356	L200-H273 PolarHBondContact O-CE1 3.36Å; L200-H273 PolarHBondContact O-NE2 2.93Å; L208-H273 PolarHBondContact O-CD2 3.47Å; L208-H273 PolarHBondContact O-NE2 3.47Å; R260-H273 PolarHBondContact NH1-O 3.3Å; I271-H273 VanDerWaalsContact CG2-ND1 3.34Å; I271-H273 WeakPolarHBondContact CG2-ND1 3.14Å; H273-L275 PolarHBondContact O-N 2.78Å; H273-P356 HydrophobicContact CB-CB 4.39Å
274	A	96.3	Very high	91	Very high	26 Å²	26	58.7 Å²	58.7	22%	0.215	31%	0.307	C	S	.	.			trans	-65	121	-179.4	0	0	0	0	0	111.6	Y353 G354	A274-Y353 WeakPolarHBondContact CA-O 3.27Å; A274-G354 VanDerWaalsContact CA-O 3.24Å; A274-G354 WeakPolarHBondContact CA-O 3.13Å; A274-G354 VanDerWaalsContact CB-O 3.23Å; A274-G354 WeakPolarHBondContact CB-O 3.32Å
275	L	97.8	Very high	91	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.315	C	S	.	.			trans	-124.6	115.4	167	-170.4	95.8	0	0	0	107.9	L200 L208 T210 L258 H273 Y353	L200-L275 HydrophobicContact CD2-CD1 4.2Å; L200-L275 HydrophobicContact CD2-CD2 3.88Å; L208-L275 HydrophobicContact CB-CD1 4.23Å; T210-L275 WeakPolarHBondContact O-CD1 3.49Å; L258-L275 HydrophobicContact CD1-CD2 3.76Å; L258-L275 HydrophobicContact CD2-CD2 3.61Å; L258-L275 HydrophobicContact CG-CD2 4.31Å; H273-L275 PolarHBondContact O-N 2.78Å; L275-Y353 PolarHBondContact N-O 2.95Å; L275-Y353 WeakPolarHBondContact O-CA 3.46Å; L275-Y353 WeakPolarHBondContact O-CB 3.4Å; L275-Y353 WeakPolarHBondContact O-CD1 3.45Å
276	H	98.1	Very high	90.7	Very high	89 Å²	89	51.7 Å²	51.7	41%	0.412	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-79.8	144.5	178	-52.9	79.4	0	0	0	109.6	K209 T210 L211 Y353	K209-H276 PolarHBondContact O-N 3.17Å; K209-H276 PolarHBondContact O-ND1 3.44Å; T210-H276 CarbonylContact C-O 3.6Å; T210-H276 WeakPolarHBondContact CA-O 3.5Å; L211-H276 PolarHBondContact N-O 2.88Å; H276-Y353 HydrophobicContact CB-CD2 4.47Å; H276-Y353 HydrophobicContact CB-CE2 4.31Å; H276-Y353 AromaticContact CD2-CD2 3.44Å; H276-Y353 VanDerWaalsContact CD2-CD2 3.44Å; H276-Y353 WeakPolarHBondContact CD2-CD2 3.24Å; H276-Y353 AromaticContact CD2-CE2 3.5Å; H276-Y353 VanDerWaalsContact CD2-CE2 3.5Å; H276-Y353 WeakPolarHBondContact CD2-CE2 3.48Å
277	F	98.3	Very high	90.2	Very high	3 Å²	3	47.4 Å²	47.4	1%	0.013	24%	0.243	C	C	.	.			trans	-139.9	140.2	172.9	52.9	-97.7	0	0	0	108.8	L211 L306 V309 W346 I349 T352 Y353 A364 L367	L211-F277 HydrophobicContact CB-CB 3.92Å; L211-F277 HydrophobicContact CD2-CB 3.89Å; L211-F277 HydrophobicContact CG-CB 4.5Å; F277-L306 HydrophobicContact CD2-CD2 3.98Å; F277-L306 HydrophobicContact CE2-CD2 3.78Å; F277-V309 HydrophobicContact CE2-CG2 3.77Å; F277-V309 HydrophobicContact CZ-CG1 4.03Å; F277-V309 HydrophobicContact CZ-CG2 3.96Å; F277-W346 HydrophobicContact CD2-CH2 4.15Å; F277-W346 AromaticContact CE2-CH2 3.95Å; F277-W346 HydrophobicContact CE2-CH2 3.95Å; F277-W346 HydrophobicContact CE2-CZ3 4.26Å; F277-I349 HydrophobicContact CE2-CG2 4.21Å; F277-I349 HydrophobicContact CZ-CG2 4.27Å; F277-T352 WeakPolarHBondContact CZ-OG1 3.24Å; F277-Y353 AromaticContact CD1-CD1 3.68Å; F277-Y353 HydrophobicContact CD1-CD1 3.68Å; F277-Y353 AromaticContact CD1-CE1 3.75Å; F277-Y353 HydrophobicContact CD1-CE1 3.75Å; F277-Y353 HydrophobicContact CD2-CE1 4.11Å; F277-Y353 AromaticContact CE1-CD1 3.44Å; F277-Y353 HydrophobicContact CE1-CD1 3.44Å; F277-Y353 VanDerWaalsContact CE1-CD1 3.44Å; F277-Y353 AromaticContact CE1-CE1 3.7Å; F277-Y353 HydrophobicContact CE1-CE1 3.7Å; F277-Y353 HydrophobicContact CE2-CE1 4.04Å; F277-Y353 HydrophobicContact CG-CD1 4.36Å; F277-Y353 AromaticContact CG-CE1 3.96Å; F277-Y353 HydrophobicContact CG-CE1 3.96Å; F277-Y353 AromaticContact CZ-CD1 3.93Å; F277-Y353 HydrophobicContact CZ-CD1 3.93Å; F277-Y353 AromaticContact CZ-CE1 3.84Å; F277-Y353 HydrophobicContact CZ-CE1 3.84Å; F277-Y353 PolarHBondContact O-OH 2.79Å; F277-A364 HydrophobicContact CD1-CB 4.44Å; F277-A364 HydrophobicContact CE1-CB 3.49Å; F277-A364 VanDerWaalsContact CE1-CB 3.49Å; F277-A364 HydrophobicContact CZ-CB 3.97Å; F277-L367 HydrophobicContact CB-CD1 3.73Å; F277-L367 HydrophobicContact CD1-CD1 3.92Å; F277-L367 HydrophobicContact CD1-CD2 3.9Å; F277-L367 HydrophobicContact CD2-CD1 4.24Å; F277-L367 HydrophobicContact CD2-CD2 3.98Å; F277-L367 HydrophobicContact CE1-CD2 3.79Å; F277-L367 HydrophobicContact CE2-CD2 3.9Å; F277-L367 HydrophobicContact CG-CD1 3.7Å; F277-L367 HydrophobicContact CG-CD2 3.99Å; F277-L367 HydrophobicContact CZ-CD2 3.81Å
278	P	97.1	Very high	89	Confident	28 Å²	28	46 Å²	46	18%	0.182	25%	0.246	C	C	.	.			trans	-83.1	160.8	-175.9	35.3	-38.3	0	0	0	112.4	E212 S280 L281 Y369	E212-P278 WeakPolarHBondContact OE1-CG 3.44Å; P278-S280 VanDerWaalsContact CB-O 3.29Å; P278-S280 WeakPolarHBondContact CB-O 3.49Å; P278-S280 VanDerWaalsContact CG-O 3.28Å; P278-S280 WeakPolarHBondContact CG-O 3.45Å; P278-L281 HydrophobicContact CG-CB 4.23Å; P278-L281 HydrophobicContact CG-CD1 4.31Å; P278-Y369 PolarHBondContact O-OH 3.25Å
279	E	96.1	Very high	87.4	Confident	56 Å²	56	46.6 Å²	46.6	26%	0.262	25%	0.25	S	C	.	.	S	Bend	trans	-65.9	-43.5	164.4	-68	-170.6	-86.6	0	0	110.8	E305 L306 W333 W346	E279-E305 CarbonylContact O-C 3.55Å; E279-E305 WeakPolarHBondContact O-CA 3.36Å; E279-L306 WeakPolarHBondContact O-CB 3.38Å; E279-L306 PolarHBondContact O-N 2.93Å; E279-W333 PolarHBondContact OE2-NE1 2.91Å; E279-W346 HydrophobicContact CG-CD2 3.54Å; E279-W346 VanDerWaalsContact CG-CE2 3.5Å; E279-W346 HydrophobicContact CG-CE3 3.54Å; E279-W346 HydrophobicContact CG-CG 4.3Å; E279-W346 HydrophobicContact CG-CH2 3.61Å; E279-W346 HydrophobicContact CG-CZ2 3.56Å; E279-W346 HydrophobicContact CG-CZ3 3.58Å
280	S	95.5	Very high	85.4	Confident	62 Å²	62	47.9 Å²	47.9	43%	0.434	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	119.9	177.1	-50.8	0	0	0	0	110.8	P278 Y304 E305	P278-S280 VanDerWaalsContact CB-O 3.29Å; P278-S280 WeakPolarHBondContact CB-O 3.49Å; P278-S280 VanDerWaalsContact CG-O 3.28Å; P278-S280 WeakPolarHBondContact CG-O 3.45Å; S280-Y304 CarbonylContact C-O 3.6Å; S280-Y304 WeakPolarHBondContact CA-O 3.47Å; S280-E305 VanDerWaalsContact CB-OE1 3.22Å; S280-E305 WeakPolarHBondContact CB-OE1 3.43Å; S280-E305 PolarHBondContact OG-OE1 3.04Å
281	L	94.9	Very high	83.1	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119.3	179.1	177.8	62	0	0	0	110.5	L211 E212 L215 I256 P278 F283 V286 Y304 Y369	L211-L281 HydrophobicContact CD2-CD2 3.92Å; E212-L281 HydrophobicContact CG-CD1 4.38Å; L215-L281 HydrophobicContact CD1-CD1 4.23Å; L215-L281 HydrophobicContact CD1-CD2 4.13Å; I256-L281 HydrophobicContact CD1-CD2 4.16Å; P278-L281 HydrophobicContact CG-CB 4.23Å; P278-L281 HydrophobicContact CG-CD1 4.31Å; L281-F283 HydrophobicContact CD2-CD2 4.25Å; L281-F283 HydrophobicContact CD2-CE2 3.5Å; L281-F283 VanDerWaalsContact CD2-CE2 3.5Å; L281-F283 HydrophobicContact CD2-CZ 4.1Å; L281-F283 HydrophobicContact CG-CD2 4.19Å; L281-F283 HydrophobicContact CG-CE2 3.94Å; L281-V286 HydrophobicContact CD1-CG2 4.33Å; L281-Y304 PolarHBondContact N-O 3.04Å; L281-Y304 PolarHBondContact O-N 3.39Å; L281-Y369 HydrophobicContact CB-CD1 4.03Å; L281-Y369 HydrophobicContact CB-CE1 3.66Å; L281-Y369 HydrophobicContact CD2-CD1 4.46Å; L281-Y369 HydrophobicContact CD2-CD2 4.31Å; L281-Y369 HydrophobicContact CD2-CE1 4.29Å; L281-Y369 HydrophobicContact CD2-CE2 4.1Å; L281-Y369 HydrophobicContact CD2-CG 4.49Å
282	D	91.4	Very high	80.6	Confident	49 Å²	49	63.7 Å²	63.7	26%	0.262	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	109.2	176.8	179.3	-0.5	0	0	0	110.8	S284 Q285	D282-S284 PolarHBondContact O-N 3.27Å; D282-S284 VanDerWaalsContact OD1-CB 3.26Å; D282-S284 WeakPolarHBondContact OD1-CB 3.3Å; D282-S284 PolarHBondContact OD1-N 3.31Å; D282-S284 PolarHBondContact OD1-OG 2.84Å; D282-S284 PolarHBondContact OD2-OG 3.46Å; D282-S284 VanDerWaalsContact OD2-OG 3.08Å; D282-Q285 HydrophobicContact CB-CG 4.29Å; D282-Q285 PolarHBondContact O-N 3.35Å; D282-Q285 WeakPolarHBondContact OD2-CG 3.37Å; D282-Q285 PolarHBondContact OD2-NE2 3.13Å
283	F	86.4	Confident	77.9	Confident	2 Å²	2	69 Å²	69	1%	0.009	36%	0.36	C	S	.	.	H	α-helix	trans	-68.7	-19.1	179.9	-94.7	-91.2	0	0	0	114.2	L196 L215 L247 L250 L254 L281 Q285 V286 L287 G302 Y304	L196-F283 HydrophobicContact CD1-CZ 4.39Å; L215-F283 HydrophobicContact CD1-CE1 4.42Å; L215-F283 HydrophobicContact CD1-CZ 4.15Å; L215-F283 HydrophobicContact CD2-CE1 4.26Å; L215-F283 HydrophobicContact CD2-CZ 4.21Å; L247-F283 HydrophobicContact CD2-CD1 4.25Å; L247-F283 HydrophobicContact CD2-CE1 4.44Å; L250-F283 HydrophobicContact CD1-CB 3.92Å; L250-F283 HydrophobicContact CD1-CD1 3.68Å; L250-F283 HydrophobicContact CD1-CD2 3.9Å; L250-F283 HydrophobicContact CD1-CE1 4.19Å; L250-F283 HydrophobicContact CD1-CE2 4.38Å; L250-F283 HydrophobicContact CD1-CG 3.52Å; L250-F283 HydrophobicContact CD2-CE1 4.3Å; L250-F283 HydrophobicContact CD2-CZ 4.43Å; L254-F283 HydrophobicContact CD2-CD2 4.44Å; L254-F283 HydrophobicContact CD2-CE2 3.3Å; L254-F283 HydrophobicContact CD2-CZ 3.4Å; L281-F283 HydrophobicContact CD2-CD2 4.25Å; L281-F283 HydrophobicContact CD2-CE2 3.5Å; L281-F283 VanDerWaalsContact CD2-CE2 3.5Å; L281-F283 HydrophobicContact CD2-CZ 4.1Å; L281-F283 HydrophobicContact CG-CD2 4.19Å; L281-F283 HydrophobicContact CG-CE2 3.94Å; F283-Q285 VanDerWaalsContact C-N 3.28Å; F283-Q285 PolarHBondContact O-N 3.09Å; F283-V286 PolarHBondContact O-N 3.38Å; F283-L287 HydrophobicContact CD1-CD1 4.32Å; F283-L287 PolarHBondContact O-N 3.14Å; F283-G302 PolarHBondContact N-O 2.95Å; F283-Y304 AromaticContact CD2-CD2 3.67Å; F283-Y304 HydrophobicContact CD2-CD2 3.67Å; F283-Y304 AromaticContact CD2-CE2 3.95Å; F283-Y304 HydrophobicContact CD2-CE2 3.95Å; F283-Y304 HydrophobicContact CE2-CD2 4.15Å; F283-Y304 HydrophobicContact CE2-CE2 4.46Å
284	S	81.5	Confident	75.2	Confident	66 Å²	66	73.3 Å²	73.3	46%	0.462	39%	0.391	S	S	.	.	H	α-helix	trans	-68.4	-29.4	178.1	75.6	0	0	0	0	112.6	D282	D282-S284 PolarHBondContact O-N 3.27Å; D282-S284 VanDerWaalsContact OD1-CB 3.26Å; D282-S284 WeakPolarHBondContact OD1-CB 3.3Å; D282-S284 PolarHBondContact OD1-N 3.31Å; D282-S284 PolarHBondContact OD1-OG 2.84Å; D282-S284 PolarHBondContact OD2-OG 3.46Å; D282-S284 VanDerWaalsContact OD2-OG 3.08Å
285	Q	75.4	Confident	72.5	Confident	150 Å²	150	78 Å²	78	70%	0.701	41%	0.412	S	S	*	.	H	α-helix	trans	-79.1	-31	177.2	-61.6	177	39.9	0	0	112	D282 F283	D282-Q285 HydrophobicContact CB-CG 4.29Å; D282-Q285 PolarHBondContact O-N 3.35Å; D282-Q285 WeakPolarHBondContact OD2-CG 3.37Å; D282-Q285 PolarHBondContact OD2-NE2 3.13Å; F283-Q285 VanDerWaalsContact C-N 3.28Å; F283-Q285 PolarHBondContact O-N 3.09Å
286	V	74.8	Confident	69.6	Low	9 Å²	9	82.3 Å²	82.3	6%	0.055	45%	0.448	C	S	.	.	H	α-helix	trans	-80.5	-31.4	-179	176.3	0	0	0	0	112.2	E212 L215 L281 F283	E212-V286 HydrophobicContact CB-CG2 4.44Å; E212-V286 HydrophobicContact CG-CG2 4.32Å; L215-V286 HydrophobicContact CB-CG1 3.32Å; L215-V286 HydrophobicContact CD1-CG1 4.04Å; L215-V286 HydrophobicContact CD1-CG2 4.31Å; L215-V286 HydrophobicContact CG-CG1 4.26Å; L281-V286 HydrophobicContact CD1-CG2 4.33Å; F283-V286 PolarHBondContact O-N 3.38Å
287	L	72.4	Confident	67.1	Low	34 Å²	34	87.2 Å²	87.2	18%	0.178	47%	0.471	C	S	.	.	S	Bend	trans	-125.8	80.6	-179.6	-70.6	174.7	0	0	0	111.6	F219 L247 F283 T289	F219-L287 HydrophobicContact CB-CD2 3.69Å; F219-L287 HydrophobicContact CD1-CD2 4.5Å; F219-L287 HydrophobicContact CD2-CD1 4.21Å; F219-L287 HydrophobicContact CD2-CD2 3.72Å; F219-L287 HydrophobicContact CD2-CG 4.28Å; F219-L287 HydrophobicContact CE2-CD1 4.17Å; F219-L287 HydrophobicContact CE2-CD2 4.48Å; F219-L287 HydrophobicContact CG-CD2 3.73Å; L247-L287 HydrophobicContact CB-CD1 3.78Å; L247-L287 HydrophobicContact CD2-CD1 3.28Å; L247-L287 HydrophobicContact CG-CD1 4.21Å; F283-L287 HydrophobicContact CD1-CD1 4.32Å; F283-L287 PolarHBondContact O-N 3.14Å; L287-T289 PolarHBondContact O-N 3.39Å
288	P	59.1	Low	64.8	Low	105 Å²	105	94.3 Å²	94.3	68%	0.682	51%	0.505	S	S	*	.			trans	-59.9	103.2	170.2	-18.8	31.6	0	0	0	109.3	E290	P288-E290 PolarHBondContact O-N 3.1Å
289	T	55.6	Low	62.7	Low	61 Å²	61	98.7 Å²	98.7	37%	0.374	52%	0.522	S	S	.	.			trans	-77	111.4	176.4	-64.4	0	0	0	0	108.2	L287 R291	L287-T289 PolarHBondContact O-N 3.39Å; T289-R291 PolarHBondContact O-N 3.47Å
290	E	47.1	Very low	60.8	Low	182 Å²	182	97.3 Å²	97.3	85%	0.85	52%	0.519	S	S	*	.			trans	-56.9	121.9	164.8	-69.3	-174.8	162	0	0	108	P288 E292	P288-E290 PolarHBondContact O-N 3.1Å; E290-E292 PolarHBondContact O-N 2.81Å; E290-E292 VanDerWaalsContact O-N 3.08Å
291	R	44.9	Very low	59.2	Low	238 Å²	238	95.9 Å²	95.9	90%	0.898	51%	0.513	S	S	*	.			trans	-77.4	96	-165.5	-63.4	177.1	-178.5	173.1	-1.2	111.1	T289	T289-R291 PolarHBondContact O-N 3.47Å
292	E	41.2	Very low	58.3	Low	147 Å²	147	96.4 Å²	96.4	69%	0.687	52%	0.519	S	S	*	.			trans	-76.9	123.2	158.8	-77.2	-66.3	147	0	0	108.8	E290 C294	E290-E292 PolarHBondContact O-N 2.81Å; E290-E292 VanDerWaalsContact O-N 3.08Å; E292-C294 PolarHBondContact O-N 3.21Å
293	P	37.8	Very low	58.3	Low	123 Å²	123	98.4 Å²	98.4	80%	0.799	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-3.3	-169.3	-23.5	34.6	0	0	0	117.2
294	C	37.4	Very low	58.7	Low	108 Å²	108	98.3 Å²	98.3	73%	0.73	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	-18.3	-160	-58.7	0	0	0	0	115.4	E292 A296	E292-C294 PolarHBondContact O-N 3.21Å; C294-A296 PolarHBondContact O-N 3.16Å
295	D	38.8	Very low	59.4	Low	123 Å²	123	96.8 Å²	96.8	66%	0.658	51%	0.512	S	S	*	.			trans	-101.3	81.8	-175.2	-68.5	-26	0	0	0	110.9
296	A	38.8	Very low	60.5	Low	91 Å²	91	89.7 Å²	89.7	75%	0.752	48%	0.479	S	S	*	.			trans	-88.4	-14.6	-170.1	0	0	0	0	0	116.2	C294	C294-A296 PolarHBondContact O-N 3.16Å
297	E	44.2	Very low	61.6	Low	192 Å²	192	89.8 Å²	89.8	90%	0.897	48%	0.479	S	S	*	.	S	Bend	trans	-99.9	-25.7	-161.5	-70.6	-170	140.2	0	0	117.2
298	E	50	Low	62.9	Low	153 Å²	153	88.1 Å²	88.1	72%	0.715	47%	0.47	S	S	*	.			trans	-136.1	82.2	178	-70.1	-167.6	168.6	0	0	112.7
299	Q	53.2	Low	64.8	Low	119 Å²	119	83.1 Å²	83.1	56%	0.556	44%	0.438	S	S	*	.			trans	-72.2	132.1	170.7	-72.7	-75.7	-24.4	0	0	110.7	G301	Q299-G301 PolarHBondContact O-N 2.91Å
300	P	57.4	Low	66.8	Low	28 Å²	28	80.3 Å²	80.3	18%	0.182	42%	0.42	C	S	.	.			trans	-74.5	18.5	170.6	32.8	-35.5	0	0	0	113	L247 L250	L247-P300 HydrophobicContact CD2-CB 4.29Å; L247-P300 HydrophobicContact CG-CB 4.23Å; L250-P300 WeakPolarHBondContact CD1-O 3.23Å
301	G	60.3	Low	69.3	Low	31 Å²	31	71.7 Å²	71.7	32%	0.32	38%	0.38	S	S	.	.			trans	-71.5	144.1	170	0	0	0	0	0	111.4	Q299	Q299-G301 PolarHBondContact O-N 2.91Å
302	G	76.8	Confident	71.7	Confident	13 Å²	13	60.4 Å²	60.4	13%	0.134	34%	0.337	C	S	.	.			trans	-179.7	135.3	175.8	0	0	0	0	0	111	F283 Y304	F283-G302 PolarHBondContact N-O 2.95Å; G302-Y304 WeakPolarHBondContact O-CD2 3.24Å
303	Q	91.3	Very high	74.3	Confident	92 Å²	92	55.4 Å²	55.4	43%	0.43	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	133.8	163.7	-173.7	174	-6.4	0	0	108.4	M372	Q303-M372 HydrophobicContact CB-CB 4.47Å; Q303-M372 HydrophobicContact CB-CG 4.45Å; Q303-M372 HydrophobicContact CG-CG 4.25Å; Q303-M372 PolarHBondContact O-N 3.17Å
304	Y	95.2	Very high	76.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	137.9	-179.7	-81.5	-95.5	0	0	0	110.2	L250 P251 L254 S280 L281 F283 G302 M370 K371	L250-Y304 VanDerWaalsContact CB-OH 3.26Å; L250-Y304 WeakPolarHBondContact CB-OH 3.01Å; L250-Y304 HydrophobicContact CD1-CE2 3.92Å; P251-Y304 PolarHBondContact O-OH 3.12Å; P251-Y304 VanDerWaalsContact O-OH 3.05Å; L254-Y304 HydrophobicContact CB-CD1 4.1Å; L254-Y304 HydrophobicContact CB-CE1 3.75Å; S280-Y304 CarbonylContact C-O 3.6Å; S280-Y304 WeakPolarHBondContact CA-O 3.47Å; L281-Y304 PolarHBondContact N-O 3.04Å; L281-Y304 PolarHBondContact O-N 3.39Å; F283-Y304 AromaticContact CD2-CD2 3.67Å; F283-Y304 HydrophobicContact CD2-CD2 3.67Å; F283-Y304 AromaticContact CD2-CE2 3.95Å; F283-Y304 HydrophobicContact CD2-CE2 3.95Å; F283-Y304 HydrophobicContact CE2-CD2 4.15Å; F283-Y304 HydrophobicContact CE2-CE2 4.46Å; G302-Y304 WeakPolarHBondContact O-CD2 3.24Å; Y304-M370 CarbonylContact C-O 3.58Å; Y304-M370 VanDerWaalsContact CA-O 3.31Å; Y304-M370 WeakPolarHBondContact CA-O 3.36Å; Y304-M370 VanDerWaalsContact CD1-C 3.43Å; Y304-K371 HydrophobicContact CD1-CB 4.09Å; Y304-K371 HydrophobicContact CE1-CB 3.52Å; Y304-K371 HydrophobicContact CE1-CG 4.12Å; Y304-K371 HydrophobicContact CE2-CB 4.32Å; Y304-K371 HydrophobicContact CE2-CG 4Å
305	E	96.2	Very high	79.3	Confident	34 Å²	34	47.4 Å²	47.4	16%	0.159	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	138.4	171.2	-71	-69.3	119.2	0	0	109.8	E279 S280 F307 R326 Y369 M370 M372	E279-E305 CarbonylContact O-C 3.55Å; E279-E305 WeakPolarHBondContact O-CA 3.36Å; S280-E305 VanDerWaalsContact CB-OE1 3.22Å; S280-E305 WeakPolarHBondContact CB-OE1 3.43Å; S280-E305 PolarHBondContact OG-OE1 3.04Å; E305-F307 PolarHBondContact O-N 2.93Å; E305-R326 IonicContact OE2-CZ 3.72Å; E305-R326 IonicContact OE2-NH1 2.72Å; E305-R326 PolarHBondContact OE2-NH1 3.12Å; E305-R326 IonicContact OE2-NH2 3.81Å; E305-Y369 CarbonylContact O-C 3.04Å; E305-Y369 WeakPolarHBondContact O-CA 3.26Å; E305-M370 PolarHBondContact N-O 3.08Å; E305-M370 PolarHBondContact O-N 3.18Å; E305-M372 HydrophobicContact CG-CG 3.77Å; E305-M372 HydrophobicContact CG-SD 3.52Å; E305-M372 VanDerWaalsContact CG-SD 3.52Å
306	L	98.2	Very high	81.5	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	120.2	177.3	-171.9	72.4	0	0	0	108.9	F277 E279 V309 W333 W346 L367 Y369	F277-L306 HydrophobicContact CD2-CD2 3.98Å; F277-L306 HydrophobicContact CE2-CD2 3.78Å; E279-L306 WeakPolarHBondContact O-CB 3.38Å; E279-L306 PolarHBondContact O-N 2.93Å; L306-V309 HydrophobicContact CD1-CG2 4.13Å; L306-V309 HydrophobicContact CD2-CG2 3.68Å; L306-V309 HydrophobicContact CG-CG2 4.18Å; L306-W333 HydrophobicContact CB-CH2 4.19Å; L306-W333 HydrophobicContact CB-CZ2 4.28Å; L306-W333 HydrophobicContact CD2-CH2 3.8Å; L306-W333 HydrophobicContact CD2-CZ2 4.02Å; L306-W333 HydrophobicContact CG-CH2 3.79Å; L306-W333 HydrophobicContact CG-CZ2 4.25Å; L306-W333 WeakPolarHBondContact O-CH2 3.47Å; L306-W346 HydrophobicContact CD2-CH2 4.08Å; L306-W346 HydrophobicContact CD2-CZ3 3.72Å; L306-L367 HydrophobicContact CD1-CB 4.26Å; L306-L367 HydrophobicContact CD1-CD2 4.46Å; L306-Y369 HydrophobicContact CB-CD1 4.03Å; L306-Y369 HydrophobicContact CB-CE1 3.67Å; L306-Y369 HydrophobicContact CD1-CD1 4.17Å; L306-Y369 HydrophobicContact CD1-CD2 3.98Å; L306-Y369 HydrophobicContact CD1-CE1 3.76Å; L306-Y369 HydrophobicContact CD1-CE2 3.57Å; L306-Y369 HydrophobicContact CD1-CG 4.26Å; L306-Y369 VanDerWaalsContact CD1-CZ 3.43Å; L306-Y369 HydrophobicContact CG-CE1 4.28Å
307	F	98.2	Very high	83.6	Confident	10 Å²	10	43.3 Å²	43.3	4%	0.044	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-43.1	-179.6	165.6	-108.6	0	0	0	111.6	V74 M77 N78 E305 I325 R326 V368 M370	V74-F307 HydrophobicContact CG1-CE1 4.29Å; M77-F307 HydrophobicContact CB-CE2 4.49Å; M77-F307 HydrophobicContact CB-CZ 3.9Å; N78-F307 HydrophobicContact CB-CE1 4.32Å; N78-F307 HydrophobicContact CB-CZ 4.24Å; E305-F307 PolarHBondContact O-N 2.93Å; F307-I325 HydrophobicContact CD2-CG2 4.31Å; F307-I325 HydrophobicContact CE1-CG2 4.42Å; F307-I325 HydrophobicContact CE2-CG2 3.72Å; F307-I325 HydrophobicContact CZ-CG2 3.79Å; F307-I325 WeakPolarHBondContact O-CA 3.38Å; F307-R326 PolarHBondContact O-N 3.08Å; F307-V368 WeakPolarHBondContact CA-O 3.47Å; F307-V368 HydrophobicContact CD1-CB 4.2Å; F307-V368 HydrophobicContact CD1-CG1 3.85Å; F307-V368 PolarHBondContact N-O 2.98Å; F307-M370 HydrophobicContact CB-CB 4.44Å; F307-M370 HydrophobicContact CB-CE 4.29Å; F307-M370 HydrophobicContact CB-CG 3.79Å; F307-M370 HydrophobicContact CB-SD 3.84Å; F307-M370 HydrophobicContact CD1-CE 3.68Å; F307-M370 HydrophobicContact CD1-SD 4.36Å; F307-M370 HydrophobicContact CD2-CE 3.51Å; F307-M370 HydrophobicContact CD2-SD 3.54Å; F307-M370 VanDerWaalsContact CD2-SD 3.54Å; F307-M370 HydrophobicContact CE1-CE 3.79Å; F307-M370 HydrophobicContact CE2-CE 3.63Å; F307-M370 HydrophobicContact CE2-SD 4.18Å; F307-M370 HydrophobicContact CG-CE 3.53Å; F307-M370 HydrophobicContact CG-CG 4.09Å; F307-M370 HydrophobicContact CG-SD 3.64Å; F307-M370 HydrophobicContact CZ-CE 3.77Å
308	A	98.8	Very high	85.7	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	149.5	179.7	0	0	0	0	0	114.4	V74 V323 Y324 I325 V368	V74-A308 HydrophobicContact CG2-CB 3.91Å; A308-V323 HydrophobicContact CB-CG2 4.24Å; A308-Y324 CarbonylContact C-O 3.6Å; A308-Y324 WeakPolarHBondContact CA-O 3.37Å; A308-Y324 WeakPolarHBondContact CB-O 3.45Å; A308-I325 HydrophobicContact CB-CG1 4Å; A308-V368 HydrophobicContact CB-CB 4.12Å; A308-V368 HydrophobicContact CB-CG2 4.36Å; A308-V368 PolarHBondContact N-O 2.87Å; A308-V368 PolarHBondContact O-N 3.16Å
309	V	98.8	Very high	87.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	108.7	172.8	-179.1	0	0	0	0	108.7	F277 L306 A311 V323 Y324 I349 A364 L367	F277-V309 HydrophobicContact CE2-CG2 3.77Å; F277-V309 HydrophobicContact CZ-CG1 4.03Å; F277-V309 HydrophobicContact CZ-CG2 3.96Å; L306-V309 HydrophobicContact CD1-CG2 4.13Å; L306-V309 HydrophobicContact CD2-CG2 3.68Å; L306-V309 HydrophobicContact CG-CG2 4.18Å; V309-A311 PolarHBondContact O-N 2.83Å; V309-V323 WeakPolarHBondContact O-CA 3.45Å; V309-V323 WeakPolarHBondContact O-CG2 3.38Å; V309-Y324 PolarHBondContact N-O 2.94Å; V309-Y324 PolarHBondContact O-N 3.06Å; V309-I349 HydrophobicContact CB-CG2 4.4Å; V309-I349 HydrophobicContact CG2-CG2 3.88Å; V309-A364 HydrophobicContact CG1-CB 3.53Å; V309-L367 HydrophobicContact CB-CD2 4.37Å; V309-L367 HydrophobicContact CG1-CD2 3.95Å; V309-L367 HydrophobicContact CG2-CD2 3.9Å
310	I	98.8	Very high	89.6	Confident	2 Å²	2	28 Å²	28	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	110.9	172.8	-62.7	153.3	0	0	0	106.9	L71 V74 Y321 V323 Y365 L366	L71-I310 HydrophobicContact CD2-CD1 3.78Å; V74-I310 HydrophobicContact CG2-CD1 3.83Å; V74-I310 HydrophobicContact CG2-CG1 3.88Å; I310-Y321 HydrophobicContact CG2-CD1 3.85Å; I310-Y321 HydrophobicContact CG2-CE1 4.35Å; I310-V323 HydrophobicContact CB-CG2 4.4Å; I310-V323 HydrophobicContact CG1-CB 4.11Å; I310-V323 HydrophobicContact CG1-CG2 3.57Å; I310-Y365 PolarHBondContact O-N 3.34Å; I310-L366 HydrophobicContact CB-CB 4.14Å; I310-L366 HydrophobicContact CD1-CB 3.8Å; I310-L366 HydrophobicContact CD1-CD1 3.9Å; I310-L366 HydrophobicContact CD1-CG 4.36Å; I310-L366 PolarHBondContact N-O 3.15Å; I310-L366 PolarHBondContact O-N 2.87Å
311	A	98.3	Very high	91.5	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	152.6	-175	0	0	0	0	0	111.7	V309 Y321 C322 Y324 T352 E362	V309-A311 PolarHBondContact O-N 2.83Å; A311-Y321 WeakPolarHBondContact O-CA 3.03Å; A311-Y321 WeakPolarHBondContact O-CD1 3.38Å; A311-C322 PolarHBondContact N-O 3.25Å; A311-C322 PolarHBondContact O-N 3.21Å; A311-C322 VanDerWaalsContact O-N 3.17Å; A311-Y324 HydrophobicContact CB-CD2 4.43Å; A311-Y324 HydrophobicContact CB-CE2 4.19Å; A311-T352 HydrophobicContact CB-CG2 3.9Å; A311-E362 HydrophobicContact CB-CB 4.43Å
312	H	97.1	Very high	93.3	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	120.7	-178.7	-175	-108.5	0	0	0	112.1	F261 K270 V315 G319 H320 Y321 T363	F261-H312 AromaticContact CE1-ND1 3.92Å; F261-H312 AromaticContact CZ-CE1 3.77Å; F261-H312 AromaticContact CZ-ND1 3.72Å; K270-H312 PolarHBondContact NZ-O 3.03Å; H312-V315 PolarHBondContact CE1-O 3.37Å; H312-G319 WeakPolarHBondContact NE2-CA 3.45Å; H312-H320 WeakPolarHBondContact CA-O 3.17Å; H312-H320 PolarHBondContact CD2-O 3.01Å; H312-Y321 HydrophobicContact CB-CD1 4.1Å; H312-Y321 HydrophobicContact CB-CE1 3.83Å; H312-Y321 AromaticContact CD2-CD1 3.99Å; H312-Y321 AromaticContact CD2-CD2 3.65Å; H312-Y321 AromaticContact CD2-CE1 3.77Å; H312-Y321 AromaticContact CD2-CE2 3.41Å; H312-Y321 VanDerWaalsContact CD2-CE2 3.41Å; H312-Y321 WeakPolarHBondContact CD2-CE2 3.45Å; H312-Y321 AromaticContact CD2-CG 3.96Å; H312-Y321 AromaticContact CD2-CZ 3.49Å; H312-Y321 VanDerWaalsContact CD2-CZ 3.49Å; H312-Y321 AromaticContact NE2-CE2 3.94Å; H312-T363 PolarHBondContact N-O 3.32Å; H312-T363 PolarHBondContact O-N 3.33Å; H312-T363 VanDerWaalsContact O-N 3.1Å; H312-T363 PolarHBondContact O-OG1 3.1Å
313	V	94.4	Very high	94.4	Very high	42 Å²	42	24.9 Å²	24.9	26%	0.255	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	148.4	172	179.9	0	0	0	0	109.8	G319 H320 E362	V313-G319 CarbonylContact O-C 3.56Å; V313-G319 WeakPolarHBondContact O-CA 3.31Å; V313-H320 HydrophobicContact CB-CB 4.35Å; V313-H320 PolarHBondContact N-O 2.93Å; V313-H320 PolarHBondContact O-N 3.4Å; V313-E362 HydrophobicContact CG2-CG 3.41Å; V313-E362 VanDerWaalsContact CG2-CG 3.41Å
314	G	92	Very high	94.7	Very high	3 Å²	3	21.3 Å²	21.3	3%	0.031	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	83.1	-159	173.2	0	0	0	0	0	114.2	K270	K270-G314 WeakPolarHBondContact CD-O 3.45Å; K270-G314 WeakPolarHBondContact CE-O 3.13Å; K270-G314 PolarHBondContact NZ-O 3.19Å
315	V	88.9	Confident	94.9	Very high	61 Å²	61	21.3 Å²	21.3	37%	0.37	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	167.7	-171.9	-61.7	0	0	0	0	112	H312 D317 S318 G319	H312-V315 PolarHBondContact CE1-O 3.37Å; V315-D317 VanDerWaalsContact C-N 3.32Å; V315-D317 PolarHBondContact O-N 2.82Å; V315-S318 WeakPolarHBondContact CG2-O 3.44Å; V315-S318 PolarHBondContact N-O 3.32Å; V315-S318 CarbonylContact O-C 3.43Å; V315-S318 PolarHBondContact O-N 3.31Å; V315-S318 VanDerWaalsContact O-N 3.11Å; V315-G319 PolarHBondContact O-N 3.07Å
316	A	85	Confident	94.9	Very high	15 Å²	15	23 Å²	23	12%	0.124	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-37.2	-169.7	0	0	0	0	0	114.8	F261 T268	F261-A316 HydrophobicContact CD1-CB 4.04Å; F261-A316 HydrophobicContact CE1-CB 4.2Å; T268-A316 HydrophobicContact CG2-CB 3.62Å
317	D	83.3	Confident	94.5	Very high	113 Å²	113	24.3 Å²	24.3	60%	0.604	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.8	1	-179.4	-45.3	-56.1	0	0	0	112.9	V315	V315-D317 VanDerWaalsContact C-N 3.32Å; V315-D317 PolarHBondContact O-N 2.82Å
318	S	86.8	Confident	93.9	Very high	72 Å²	72	27.4 Å²	27.4	50%	0.503	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	91.9	179.5	-176.3	0	0	0	0	110.8	Q139 V315	Q139-S318 VanDerWaalsContact OE1-CA 3.24Å; V315-S318 WeakPolarHBondContact CG2-O 3.44Å; V315-S318 PolarHBondContact N-O 3.32Å; V315-S318 CarbonylContact O-C 3.43Å; V315-S318 PolarHBondContact O-N 3.31Å; V315-S318 VanDerWaalsContact O-N 3.11Å
319	G	91.2	Very high	93.1	Very high	19 Å²	19	33.3 Å²	33.3	20%	0.196	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	-172.3	177.2	0	0	0	0	0	114.4	Q139 H312 V313 V315	Q139-G319 PolarHBondContact NE2-O 2.94Å; Q139-G319 VanDerWaalsContact NE2-O 3.12Å; H312-G319 WeakPolarHBondContact NE2-CA 3.45Å; V313-G319 CarbonylContact O-C 3.56Å; V313-G319 WeakPolarHBondContact O-CA 3.31Å; V315-G319 PolarHBondContact O-N 3.07Å
320	H	95.4	Very high	92.6	Very high	51 Å²	51	36.5 Å²	36.5	24%	0.236	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	141.7	-178.9	179.5	70.5	0	0	0	110	C66 H312 V313 N337 D338	C66-H320 WeakPolarHBondContact CB-CE1 3.33Å; C66-H320 WeakPolarHBondContact CB-ND1 3.25Å; C66-H320 PolarHBondContact SG-ND1 3.02Å; H312-H320 WeakPolarHBondContact CA-O 3.17Å; H312-H320 PolarHBondContact CD2-O 3.01Å; V313-H320 HydrophobicContact CB-CB 4.35Å; V313-H320 PolarHBondContact N-O 2.93Å; V313-H320 PolarHBondContact O-N 3.4Å; H320-N337 PolarHBondContact NE2-OD1 2.9Å; H320-D338 IonicContact CE1-OD2 3.42Å; H320-D338 PolarHBondContact CE1-OD2 3.34Å
321	Y	97.5	Very high	92.1	Very high	6 Å²	6	38.1 Å²	38.1	2%	0.024	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.4	176.6	-76	-87.8	0	0	0	111.2	C66 C67 H140 A142 I310 A311 H312 Y365	C66-Y321 WeakPolarHBondContact CB-O 3.42Å; C67-Y321 HydrophobicContact CB-CD2 3.51Å; C67-Y321 HydrophobicContact CB-CE2 3.92Å; C67-Y321 HydrophobicContact CB-CG 4.1Å; H140-Y321 VanDerWaalsContact O-CE2 3.31Å; H140-Y321 WeakPolarHBondContact O-CE2 3.25Å; H140-Y321 PolarHBondContact O-OH 2.89Å; A142-Y321 HydrophobicContact CB-CD1 4.29Å; A142-Y321 HydrophobicContact CB-CE1 3.6Å; A142-Y321 PolarHBondContact N-OH 2.84Å; I310-Y321 HydrophobicContact CG2-CD1 3.85Å; I310-Y321 HydrophobicContact CG2-CE1 4.35Å; A311-Y321 WeakPolarHBondContact O-CA 3.03Å; A311-Y321 WeakPolarHBondContact O-CD1 3.38Å; H312-Y321 HydrophobicContact CB-CD1 4.1Å; H312-Y321 HydrophobicContact CB-CE1 3.83Å; H312-Y321 AromaticContact CD2-CD1 3.99Å; H312-Y321 AromaticContact CD2-CD2 3.65Å; H312-Y321 AromaticContact CD2-CE1 3.77Å; H312-Y321 AromaticContact CD2-CE2 3.41Å; H312-Y321 VanDerWaalsContact CD2-CE2 3.41Å; H312-Y321 WeakPolarHBondContact CD2-CE2 3.45Å; H312-Y321 AromaticContact CD2-CG 3.96Å; H312-Y321 AromaticContact CD2-CZ 3.49Å; H312-Y321 VanDerWaalsContact CD2-CZ 3.49Å; H312-Y321 AromaticContact NE2-CE2 3.94Å; Y321-Y365 HydrophobicContact CE1-CD1 4.2Å; Y321-Y365 HydrophobicContact CE1-CG 4.31Å
322	C	97.8	Very high	92	Very high	0 Å²	0	43 Å²	43	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	168.1	165.2	55.8	0	0	0	0	108.6	A311 N337	A311-C322 PolarHBondContact N-O 3.25Å; A311-C322 PolarHBondContact O-N 3.21Å; A311-C322 VanDerWaalsContact O-N 3.17Å; C322-N337 HydrophobicContact CB-CB 4.43Å
323	V	98.7	Very high	92	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	132.6	172.8	64.2	0	0	0	0	112.4	Q73 V74 A308 V309 I310 I325 F336	Q73-V323 HydrophobicContact CB-CG1 4.02Å; V74-V323 HydrophobicContact CG2-CG2 3.64Å; A308-V323 HydrophobicContact CB-CG2 4.24Å; V309-V323 WeakPolarHBondContact O-CA 3.45Å; V309-V323 WeakPolarHBondContact O-CG2 3.38Å; I310-V323 HydrophobicContact CB-CG2 4.4Å; I310-V323 HydrophobicContact CG1-CB 4.11Å; I310-V323 HydrophobicContact CG1-CG2 3.57Å; V323-I325 HydrophobicContact CG1-CD1 4.01Å; V323-I325 HydrophobicContact CG1-CG1 4.2Å; V323-I325 HydrophobicContact CG2-CD1 4.24Å; V323-I325 HydrophobicContact CG2-CG1 3.76Å; V323-F336 HydrophobicContact CG1-CB 3.83Å; V323-F336 PolarHBondContact N-O 2.97Å; V323-F336 VanDerWaalsContact N-O 3.09Å; V323-F336 PolarHBondContact O-N 3.32Å
324	Y	98.7	Very high	92.2	Very high	17 Å²	17	43.2 Å²	43.2	7%	0.067	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	127	169.8	-62.3	-96.1	0	0	0	108	A308 V309 A311 F334 C335 V344 I349 T352 E362	A308-Y324 CarbonylContact C-O 3.6Å; A308-Y324 WeakPolarHBondContact CA-O 3.37Å; A308-Y324 WeakPolarHBondContact CB-O 3.45Å; V309-Y324 PolarHBondContact N-O 2.94Å; V309-Y324 PolarHBondContact O-N 3.06Å; A311-Y324 HydrophobicContact CB-CD2 4.43Å; A311-Y324 HydrophobicContact CB-CE2 4.19Å; Y324-F334 CarbonylContact C-O 3.56Å; Y324-F334 WeakPolarHBondContact CA-O 3.31Å; Y324-C335 HydrophobicContact CD1-CB 3.89Å; Y324-C335 HydrophobicContact CE1-CB 3.64Å; Y324-V344 HydrophobicContact CD1-CG2 3.76Å; Y324-V344 HydrophobicContact CE1-CG1 4.38Å; Y324-V344 HydrophobicContact CE1-CG2 4.04Å; Y324-I349 HydrophobicContact CD1-CD1 4.26Å; Y324-I349 HydrophobicContact CD1-CG1 3.47Å; Y324-I349 VanDerWaalsContact CD1-CG1 3.47Å; Y324-I349 HydrophobicContact CE1-CG1 4.16Å; Y324-I349 HydrophobicContact CG-CG1 3.84Å; Y324-T352 HydrophobicContact CD2-CG2 4.21Å; Y324-T352 HydrophobicContact CE2-CG2 3.79Å; Y324-E362 WeakPolarHBondContact CE2-OE2 3.4Å; Y324-E362 PolarHBondContact OH-OE2 3.41Å
325	I	98.5	Very high	92.5	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.1	178.8	-53	176.9	0	0	0	109.2	Q73 V74 M77 F307 A308 V323 W333 F334 F336	Q73-I325 HydrophobicContact CB-CD1 3.83Å; V74-I325 HydrophobicContact CG2-CD1 4.31Å; M77-I325 HydrophobicContact CB-CD1 4.17Å; M77-I325 HydrophobicContact CB-CG2 4.02Å; M77-I325 HydrophobicContact CG-CD1 3.88Å; M77-I325 HydrophobicContact CG-CG2 4.36Å; F307-I325 HydrophobicContact CD2-CG2 4.31Å; F307-I325 HydrophobicContact CE1-CG2 4.42Å; F307-I325 HydrophobicContact CE2-CG2 3.72Å; F307-I325 HydrophobicContact CZ-CG2 3.79Å; F307-I325 WeakPolarHBondContact O-CA 3.38Å; A308-I325 HydrophobicContact CB-CG1 4Å; V323-I325 HydrophobicContact CG1-CD1 4.01Å; V323-I325 HydrophobicContact CG1-CG1 4.2Å; V323-I325 HydrophobicContact CG2-CD1 4.24Å; V323-I325 HydrophobicContact CG2-CG1 3.76Å; I325-W333 VanDerWaalsContact C-CE3 3.4Å; I325-F334 PolarHBondContact N-O 3.3Å; I325-F334 PolarHBondContact O-N 3.47Å; I325-F336 HydrophobicContact CB-CD2 4.24Å; I325-F336 HydrophobicContact CB-CE2 3.86Å; I325-F336 HydrophobicContact CD1-CD2 4Å; I325-F336 HydrophobicContact CD1-CE2 3.98Å; I325-F336 HydrophobicContact CD1-CZ 4.48Å; I325-F336 HydrophobicContact CG1-CD2 4.08Å; I325-F336 HydrophobicContact CG1-CE2 4.11Å
326	R	96.7	Very high	92.9	Very high	69 Å²	69	40.8 Å²	40.8	26%	0.26	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	120.3	172.6	-161.9	175.2	179.7	-169.4	-0.9	108.8	E305 F307 A328 G331 K332 W333	E305-R326 IonicContact OE2-CZ 3.72Å; E305-R326 IonicContact OE2-NH1 2.72Å; E305-R326 PolarHBondContact OE2-NH1 3.12Å; E305-R326 IonicContact OE2-NH2 3.81Å; F307-R326 PolarHBondContact O-N 3.08Å; R326-A328 PolarHBondContact O-N 2.78Å; R326-G331 WeakPolarHBondContact CG-O 3.47Å; R326-G331 PolarHBondContact NE-O 2.89Å; R326-K332 WeakPolarHBondContact CA-O 3.34Å; R326-W333 HydrophobicContact CB-CD2 3.86Å; R326-W333 HydrophobicContact CB-CE3 3.77Å; R326-W333 HydrophobicContact CB-CH2 3.75Å; R326-W333 HydrophobicContact CB-CZ2 3.86Å; R326-W333 HydrophobicContact CB-CZ3 3.72Å; R326-W333 HydrophobicContact CG-CD2 4.11Å; R326-W333 HydrophobicContact CG-CZ2 4.17Å; R326-W333 VanDerWaalsContact N-CE3 3.29Å; R326-W333 VanDerWaalsContact N-CZ3 3.29Å
327	N	90.7	Very high	93.5	Very high	29 Å²	29	42.9 Å²	42.9	16%	0.155	25%	0.247	C	C	.	.			trans	-71.1	121.5	176.1	178.5	25.5	0	0	0	110	V329 D330 G331 K332 F334	N327-V329 PolarHBondContact O-N 2.89Å; N327-V329 PolarHBondContact OD1-N 2.92Å; N327-D330 WeakPolarHBondContact CB-OD1 3.4Å; N327-D330 PolarHBondContact ND2-OD1 2.91Å; N327-G331 VanDerWaalsContact O-CA 3.25Å; N327-G331 WeakPolarHBondContact O-CA 3.21Å; N327-G331 PolarHBondContact O-N 2.92Å; N327-K332 PolarHBondContact N-O 2.93Å; N327-F334 HydrophobicContact CB-CD2 4.08Å; N327-F334 HydrophobicContact CB-CE2 3.82Å
328	A	84	Confident	94.2	Very high	74 Å²	74	38.5 Å²	38.5	61%	0.612	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-19.7	-179.5	0	0	0	0	0	113.7	M79 R326	M79-A328 HydrophobicContact SD-CB 4.35Å; R326-A328 PolarHBondContact O-N 2.78Å
329	V	83.6	Confident	94.7	Very high	124 Å²	124	36.8 Å²	36.8	75%	0.752	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-43.2	-176.1	-177.9	0	0	0	0	113	N327	N327-V329 PolarHBondContact O-N 2.89Å; N327-V329 PolarHBondContact OD1-N 2.92Å
330	D	86.4	Confident	94.9	Very high	68 Å²	68	40.9 Å²	40.9	36%	0.364	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.7	6.2	-176	73.3	-14.8	0	0	0	114.1	N327 K332	N327-D330 WeakPolarHBondContact CB-OD1 3.4Å; N327-D330 PolarHBondContact ND2-OD1 2.91Å; D330-K332 PolarHBondContact O-N 3.29Å; D330-K332 VanDerWaalsContact O-N 3.12Å; D330-K332 PolarHBondContact OD1-N 2.65Å; D330-K332 VanDerWaalsContact OD2-CD 3.24Å; D330-K332 WeakPolarHBondContact OD2-CD 3.47Å; D330-K332 VanDerWaalsContact OD2-CE 3.27Å; D330-K332 WeakPolarHBondContact OD2-CE 3.15Å; D330-K332 IonicContact OD2-NZ 2.7Å; D330-K332 PolarHBondContact OD2-NZ 3.19Å
331	G	89.7	Confident	94.9	Very high	35 Å²	35	40.4 Å²	40.4	36%	0.361	23%	0.227	S	C	.	.			trans	69.9	1.1	177.1	0	0	0	0	0	115.1	R326 N327	R326-G331 WeakPolarHBondContact CG-O 3.47Å; R326-G331 PolarHBondContact NE-O 2.89Å; N327-G331 VanDerWaalsContact O-CA 3.25Å; N327-G331 WeakPolarHBondContact O-CA 3.21Å; N327-G331 PolarHBondContact O-N 2.92Å
332	K	94.8	Very high	94.8	Very high	104 Å²	104	43.4 Å²	43.4	45%	0.452	25%	0.248	S	C	.	.			trans	-81.3	150.3	-174.2	-63.9	-173.5	-162.7	126.4	0	112.6	R326 N327 D330 F334 L343	R326-K332 WeakPolarHBondContact CA-O 3.34Å; N327-K332 PolarHBondContact N-O 2.93Å; D330-K332 PolarHBondContact O-N 3.29Å; D330-K332 VanDerWaalsContact O-N 3.12Å; D330-K332 PolarHBondContact OD1-N 2.65Å; D330-K332 VanDerWaalsContact OD2-CD 3.24Å; D330-K332 WeakPolarHBondContact OD2-CD 3.47Å; D330-K332 VanDerWaalsContact OD2-CE 3.27Å; D330-K332 WeakPolarHBondContact OD2-CE 3.15Å; D330-K332 IonicContact OD2-NZ 2.7Å; D330-K332 PolarHBondContact OD2-NZ 3.19Å; K332-F334 HydrophobicContact CB-CE2 3.82Å; K332-F334 HydrophobicContact CB-CZ 4.28Å; K332-L343 HydrophobicContact CB-CD1 3.81Å; K332-L343 HydrophobicContact CD-CD1 3.75Å; K332-L343 HydrophobicContact CG-CD1 4.3Å
333	W	97.8	Very high	94.8	Very high	13 Å²	13	48.7 Å²	48.7	5%	0.049	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	135.2	177.4	-74.9	108.5	0	0	0	111.9	E279 L306 I325 R326 L343 V344 I349	E279-W333 PolarHBondContact OE2-NE1 2.91Å; L306-W333 HydrophobicContact CB-CH2 4.19Å; L306-W333 HydrophobicContact CB-CZ2 4.28Å; L306-W333 HydrophobicContact CD2-CH2 3.8Å; L306-W333 HydrophobicContact CD2-CZ2 4.02Å; L306-W333 HydrophobicContact CG-CH2 3.79Å; L306-W333 HydrophobicContact CG-CZ2 4.25Å; L306-W333 WeakPolarHBondContact O-CH2 3.47Å; I325-W333 VanDerWaalsContact C-CE3 3.4Å; R326-W333 HydrophobicContact CB-CD2 3.86Å; R326-W333 HydrophobicContact CB-CE3 3.77Å; R326-W333 HydrophobicContact CB-CH2 3.75Å; R326-W333 HydrophobicContact CB-CZ2 3.86Å; R326-W333 HydrophobicContact CB-CZ3 3.72Å; R326-W333 HydrophobicContact CG-CD2 4.11Å; R326-W333 HydrophobicContact CG-CZ2 4.17Å; R326-W333 VanDerWaalsContact N-CE3 3.29Å; R326-W333 VanDerWaalsContact N-CZ3 3.29Å; W333-L343 WeakPolarHBondContact O-CD1 3.21Å; W333-V344 HydrophobicContact CB-CG2 3.91Å; W333-V344 PolarHBondContact O-N 3.45Å; W333-I349 HydrophobicContact CB-CD1 3.8Å; W333-I349 HydrophobicContact CD2-CD1 3.13Å; W333-I349 HydrophobicContact CE3-CD1 3.3Å; W333-I349 HydrophobicContact CG-CD1 3.38Å; W333-I349 HydrophobicContact CH2-CD1 4.34Å; W333-I349 HydrophobicContact CZ2-CD1 4.21Å; W333-I349 HydrophobicContact CZ3-CD1 3.92Å
334	F	97.8	Very high	94.7	Very high	34 Å²	34	49.7 Å²	49.7	15%	0.149	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	133.2	176.2	-65.1	-90.9	0	0	0	110.7	L56 Y324 I325 N327 K332 F336 I341 C342 L343	L56-F334 HydrophobicContact CD1-CB 4.06Å; L56-F334 HydrophobicContact CD1-CD1 3.74Å; L56-F334 HydrophobicContact CD1-CD2 3.71Å; L56-F334 HydrophobicContact CD1-CE1 4.05Å; L56-F334 HydrophobicContact CD1-CE2 4.03Å; L56-F334 HydrophobicContact CD1-CG 3.55Å; L56-F334 HydrophobicContact CD1-CZ 4.18Å; Y324-F334 CarbonylContact C-O 3.56Å; Y324-F334 WeakPolarHBondContact CA-O 3.31Å; I325-F334 PolarHBondContact N-O 3.3Å; I325-F334 PolarHBondContact O-N 3.47Å; N327-F334 HydrophobicContact CB-CD2 4.08Å; N327-F334 HydrophobicContact CB-CE2 3.82Å; K332-F334 HydrophobicContact CB-CE2 3.82Å; K332-F334 HydrophobicContact CB-CZ 4.28Å; F334-F336 HydrophobicContact CB-CD2 4.29Å; F334-F336 HydrophobicContact CB-CE2 3.79Å; F334-I341 HydrophobicContact CB-CG2 4.2Å; F334-I341 HydrophobicContact CD1-CG2 4.19Å; F334-C342 CarbonylContact C-O 3.44Å; F334-C342 VanDerWaalsContact CA-O 3.27Å; F334-C342 WeakPolarHBondContact CA-O 3.36Å; F334-L343 HydrophobicContact CD1-CB 4.37Å; F334-L343 HydrophobicContact CD1-CD1 4.33Å; F334-L343 HydrophobicContact CE1-CB 4.19Å; F334-L343 HydrophobicContact CE1-CD1 3.86Å; F334-L343 HydrophobicContact CE2-CD1 4.41Å; F334-L343 HydrophobicContact CZ-CD1 3.9Å
335	C	98.3	Very high	94.7	Very high	8 Å²	8	51 Å²	51	5%	0.054	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	119.5	169.1	-178	0	0	0	0	109.5	Y324 I341 C342 V344	Y324-C335 HydrophobicContact CD1-CB 3.89Å; Y324-C335 HydrophobicContact CE1-CB 3.64Å; C335-I341 WeakPolarHBondContact O-CA 3.29Å; C335-C342 PolarHBondContact N-O 2.84Å; C335-C342 PolarHBondContact O-N 2.97Å; C335-C342 VanDerWaalsContact O-N 3.14Å; C335-V344 HydrophobicContact CB-CG1 3.78Å; C335-V344 HydrophobicContact CB-CG2 4.3Å
336	F	98.3	Very high	94.6	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.018	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	106.2	172.3	-65.4	-109.2	0	0	0	108.4	L56 Q73 M77 V323 I325 F334 I341	L56-F336 HydrophobicContact CB-CE1 4.39Å; L56-F336 HydrophobicContact CB-CZ 4.4Å; L56-F336 HydrophobicContact CD1-CE2 4.4Å; L56-F336 HydrophobicContact CD1-CZ 3.82Å; L56-F336 HydrophobicContact CD2-CZ 4.16Å; L56-F336 HydrophobicContact CG-CZ 4.36Å; Q73-F336 HydrophobicContact CB-CD1 4.38Å; Q73-F336 HydrophobicContact CG-CB 4.29Å; Q73-F336 HydrophobicContact CG-CD1 3.85Å; Q73-F336 HydrophobicContact CG-CE1 4.48Å; Q73-F336 HydrophobicContact CG-CG 4.29Å; M77-F336 HydrophobicContact CE-CZ 4.46Å; M77-F336 HydrophobicContact CG-CZ 4.26Å; M77-F336 HydrophobicContact SD-CZ 4.23Å; V323-F336 HydrophobicContact CG1-CB 3.83Å; V323-F336 PolarHBondContact N-O 2.97Å; V323-F336 VanDerWaalsContact N-O 3.09Å; V323-F336 PolarHBondContact O-N 3.32Å; I325-F336 HydrophobicContact CB-CD2 4.24Å; I325-F336 HydrophobicContact CB-CE2 3.86Å; I325-F336 HydrophobicContact CD1-CD2 4Å; I325-F336 HydrophobicContact CD1-CE2 3.98Å; I325-F336 HydrophobicContact CD1-CZ 4.48Å; I325-F336 HydrophobicContact CG1-CD2 4.08Å; I325-F336 HydrophobicContact CG1-CE2 4.11Å; F334-F336 HydrophobicContact CB-CD2 4.29Å; F334-F336 HydrophobicContact CB-CE2 3.79Å; F336-I341 HydrophobicContact CD1-CD1 3.46Å; F336-I341 VanDerWaalsContact CD1-CD1 3.46Å; F336-I341 HydrophobicContact CD1-CG1 3.69Å; F336-I341 HydrophobicContact CE1-CD1 3.47Å; F336-I341 VanDerWaalsContact CE1-CD1 3.47Å; F336-I341 HydrophobicContact CE1-CG1 4.14Å; F336-I341 HydrophobicContact CG-CD1 4.42Å; F336-I341 HydrophobicContact CG-CG1 4.22Å; F336-I341 HydrophobicContact CZ-CD1 4.4Å
337	N	97.7	Very high	94.6	Very high	60 Å²	60	55.2 Å²	55.2	32%	0.321	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	83.5	178.3	-171.6	-6.8	0	0	0	108.9	H320 C322 S339 N340	H320-N337 PolarHBondContact NE2-OD1 2.9Å; C322-N337 HydrophobicContact CB-CB 4.43Å; N337-S339 PolarHBondContact O-N 3.18Å; N337-S339 VanDerWaalsContact O-N 3.1Å; N337-N340 CarbonylContact C-O 3.54Å; N337-N340 PolarHBondContact N-O 3.14Å; N337-N340 PolarHBondContact O-N 2.86Å
338	D	97.6	Very high	94.9	Very high	20 Å²	20	57.2 Å²	57.2	11%	0.107	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	-109.8	-171.1	-69.5	-42.6	0	0	0	112.3	G58 L59 N61 C66 N69 H320 N340	G58-D338 CarbonylContact C-O 3.53Å; G58-D338 WeakPolarHBondContact CA-O 3.35Å; L59-D338 PolarHBondContact N-O 2.58Å; L59-D338 CarbonylContact O-C 3.54Å; L59-D338 WeakPolarHBondContact O-CA 3.49Å; L59-D338 WeakPolarHBondContact O-CB 3.1Å; N61-D338 HydrophobicContact CB-CB 4.17Å; N61-D338 WeakPolarHBondContact CB-OD2 3.36Å; N61-D338 PolarHBondContact ND2-OD2 3.34Å; C66-D338 WeakPolarHBondContact CA-OD1 3.36Å; N69-D338 WeakPolarHBondContact CB-OD1 3.42Å; N69-D338 PolarHBondContact ND2-OD1 2.78Å; H320-D338 IonicContact CE1-OD2 3.42Å; H320-D338 PolarHBondContact CE1-OD2 3.34Å; D338-N340 VanDerWaalsContact C-N 3.32Å
339	S	96.6	Very high	95.5	Very high	36 Å²	36	53.7 Å²	53.7	25%	0.252	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.6	-178.5	55.9	0	0	0	0	114.2	L59 A119 N337	L59-S339 PolarHBondContact O-N 2.88Å; A119-S339 VanDerWaalsContact CB-CB 3.49Å; N337-S339 PolarHBondContact O-N 3.18Å; N337-S339 VanDerWaalsContact O-N 3.1Å
340	N	96.3	Very high	96.1	Very high	106 Å²	106	51.3 Å²	51.3	57%	0.567	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	129.9	178.8	-59	-56.7	0	0	0	109.2	N337 D338	N337-N340 CarbonylContact C-O 3.54Å; N337-N340 PolarHBondContact N-O 3.14Å; N337-N340 PolarHBondContact O-N 2.86Å; D338-N340 VanDerWaalsContact C-N 3.32Å
341	I	96.4	Very high	96.5	Very high	41 Å²	41	51.1 Å²	51.1	21%	0.21	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.2	171.2	-59.1	173.5	0	0	0	107.2	L56 V57 F334 C335 F336	L56-I341 HydrophobicContact CB-CD1 3.87Å; L56-I341 HydrophobicContact CB-CG2 4.47Å; L56-I341 HydrophobicContact CD1-CG2 4.26Å; V57-I341 VanDerWaalsContact C-CD1 3.44Å; F334-I341 HydrophobicContact CB-CG2 4.2Å; F334-I341 HydrophobicContact CD1-CG2 4.19Å; C335-I341 WeakPolarHBondContact O-CA 3.29Å; F336-I341 HydrophobicContact CD1-CD1 3.46Å; F336-I341 VanDerWaalsContact CD1-CD1 3.46Å; F336-I341 HydrophobicContact CD1-CG1 3.69Å; F336-I341 HydrophobicContact CE1-CD1 3.47Å; F336-I341 VanDerWaalsContact CE1-CD1 3.47Å; F336-I341 HydrophobicContact CE1-CG1 4.14Å; F336-I341 HydrophobicContact CG-CD1 4.42Å; F336-I341 HydrophobicContact CG-CG1 4.22Å; F336-I341 HydrophobicContact CZ-CD1 4.4Å
342	C	95.4	Very high	96.9	Very high	68 Å²	68	49.5 Å²	49.5	46%	0.459	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	148.3	172.5	52	0	0	0	0	111.2	F334 C335	F334-C342 CarbonylContact C-O 3.44Å; F334-C342 VanDerWaalsContact CA-O 3.27Å; F334-C342 WeakPolarHBondContact CA-O 3.36Å; C335-C342 PolarHBondContact N-O 2.84Å; C335-C342 PolarHBondContact O-N 2.97Å; C335-C342 VanDerWaalsContact O-N 3.14Å
343	L	96.8	Very high	97	Very high	111 Å²	111	45.9 Å²	45.9	58%	0.581	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67	138.4	164.5	-177.6	74.4	0	0	0	108.5	K332 W333 F334	K332-L343 HydrophobicContact CB-CD1 3.81Å; K332-L343 HydrophobicContact CD-CD1 3.75Å; K332-L343 HydrophobicContact CG-CD1 4.3Å; W333-L343 WeakPolarHBondContact O-CD1 3.21Å; F334-L343 HydrophobicContact CD1-CB 4.37Å; F334-L343 HydrophobicContact CD1-CD1 4.33Å; F334-L343 HydrophobicContact CE1-CB 4.19Å; F334-L343 HydrophobicContact CE1-CD1 3.86Å; F334-L343 HydrophobicContact CE2-CD1 4.41Å; F334-L343 HydrophobicContact CZ-CD1 3.9Å
344	V	97.2	Very high	96.8	Very high	22 Å²	22	45.6 Å²	45.6	13%	0.133	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	159.7	-179.7	-65.2	0	0	0	0	109.9	Y324 W333 C335 D348	Y324-V344 HydrophobicContact CD1-CG2 3.76Å; Y324-V344 HydrophobicContact CE1-CG1 4.38Å; Y324-V344 HydrophobicContact CE1-CG2 4.04Å; W333-V344 HydrophobicContact CB-CG2 3.91Å; W333-V344 PolarHBondContact O-N 3.45Å; C335-V344 HydrophobicContact CB-CG1 3.78Å; C335-V344 HydrophobicContact CB-CG2 4.3Å; V344-D348 WeakPolarHBondContact CA-OD2 3.4Å; V344-D348 HydrophobicContact CB-CB 3.95Å; V344-D348 WeakPolarHBondContact CB-OD2 3.23Å
345	S	97.4	Very high	96.3	Very high	45 Å²	45	46.3 Å²	46.3	32%	0.315	25%	0.254	S	S	.	.			trans	-92.1	177.5	175.7	83.6	0	0	0	0	112.1	E347 D348	S345-E347 VanDerWaalsContact C-N 3.34Å; S345-E347 WeakPolarHBondContact CB-OE2 3.4Å; S345-E347 PolarHBondContact OG-N 2.91Å; S345-E347 PolarHBondContact OG-OE2 3.4Å; S345-D348 PolarHBondContact N-OD2 2.76Å; S345-D348 PolarHBondContact OG-N 2.75Å
346	W	96.8	Very high	95.3	Very high	40 Å²	40	49.1 Å²	49.1	15%	0.152	27%	0.272	C	S	.	.	H	α-helix	trans	-66.4	-38.8	171.4	172.5	-130.5	0	0	0	111.2	F277 E279 L306 D348 I349 Q350 Y353	F277-W346 HydrophobicContact CD2-CH2 4.15Å; F277-W346 AromaticContact CE2-CH2 3.95Å; F277-W346 HydrophobicContact CE2-CH2 3.95Å; F277-W346 HydrophobicContact CE2-CZ3 4.26Å; E279-W346 HydrophobicContact CG-CD2 3.54Å; E279-W346 VanDerWaalsContact CG-CE2 3.5Å; E279-W346 HydrophobicContact CG-CE3 3.54Å; E279-W346 HydrophobicContact CG-CG 4.3Å; E279-W346 HydrophobicContact CG-CH2 3.61Å; E279-W346 HydrophobicContact CG-CZ2 3.56Å; E279-W346 HydrophobicContact CG-CZ3 3.58Å; L306-W346 HydrophobicContact CD2-CH2 4.08Å; L306-W346 HydrophobicContact CD2-CZ3 3.72Å; W346-D348 VanDerWaalsContact C-N 3.28Å; W346-D348 PolarHBondContact O-N 3.09Å; W346-I349 HydrophobicContact CE3-CB 3.85Å; W346-I349 HydrophobicContact CE3-CD1 4.11Å; W346-I349 HydrophobicContact CE3-CG2 4Å; W346-I349 HydrophobicContact CZ3-CB 4.02Å; W346-I349 HydrophobicContact CZ3-CG2 3.62Å; W346-I349 CarbonylContact O-C 3.57Å; W346-I349 WeakPolarHBondContact O-CA 3.16Å; W346-I349 WeakPolarHBondContact O-CB 3.41Å; W346-I349 PolarHBondContact O-N 3.42Å; W346-Q350 HydrophobicContact CD2-CG 4.16Å; W346-Q350 HydrophobicContact CG-CG 4.45Å; W346-Q350 HydrophobicContact CZ2-CG 4.1Å; W346-Q350 WeakPolarHBondContact O-CG 3.5Å; W346-Q350 PolarHBondContact O-N 2.76Å; W346-Y353 WeakPolarHBondContact CZ2-OH 3.47Å
347	E	96.8	Very high	94.5	Very high	118 Å²	118	55.2 Å²	55.2	55%	0.551	31%	0.305	S	S	*	.	H	α-helix	trans	-59.8	-35.7	177.6	-59.4	74.2	-163.4	0	0	112.4	S345 I349 Q350 C351	S345-E347 VanDerWaalsContact C-N 3.34Å; S345-E347 WeakPolarHBondContact CB-OE2 3.4Å; S345-E347 PolarHBondContact OG-N 2.91Å; S345-E347 PolarHBondContact OG-OE2 3.4Å; E347-I349 VanDerWaalsContact C-N 3.3Å; E347-I349 PolarHBondContact O-N 2.8Å; E347-Q350 WeakPolarHBondContact O-CB 3.34Å; E347-Q350 PolarHBondContact O-N 3.34Å; E347-C351 PolarHBondContact O-N 3.09Å; E347-C351 PolarHBondContact O-SG 2.83Å; E347-C351 VanDerWaalsContact O-SG 3.33Å
348	D	96.4	Very high	93.6	Very high	71 Å²	71	59.7 Å²	59.7	38%	0.38	32%	0.318	S	S	.	.	H	α-helix	trans	-60.9	-39.5	171.3	-67.6	-41.5	0	0	0	111.3	V344 S345 W346 C351	V344-D348 WeakPolarHBondContact CA-OD2 3.4Å; V344-D348 HydrophobicContact CB-CB 3.95Å; V344-D348 WeakPolarHBondContact CB-OD2 3.23Å; S345-D348 PolarHBondContact N-OD2 2.76Å; S345-D348 PolarHBondContact OG-N 2.75Å; W346-D348 VanDerWaalsContact C-N 3.28Å; W346-D348 PolarHBondContact O-N 3.09Å; D348-C351 VanDerWaalsContact O-CB 3.23Å; D348-C351 WeakPolarHBondContact O-CB 3.38Å; D348-C351 PolarHBondContact O-N 3.27Å
349	I	97.3	Very high	92.2	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-72.3	-34.4	177.8	-61.7	163.7	0	0	0	111.2	F277 V309 Y324 W333 W346 E347 C351 T352	F277-I349 HydrophobicContact CE2-CG2 4.21Å; F277-I349 HydrophobicContact CZ-CG2 4.27Å; V309-I349 HydrophobicContact CB-CG2 4.4Å; V309-I349 HydrophobicContact CG2-CG2 3.88Å; Y324-I349 HydrophobicContact CD1-CD1 4.26Å; Y324-I349 HydrophobicContact CD1-CG1 3.47Å; Y324-I349 VanDerWaalsContact CD1-CG1 3.47Å; Y324-I349 HydrophobicContact CE1-CG1 4.16Å; Y324-I349 HydrophobicContact CG-CG1 3.84Å; W333-I349 HydrophobicContact CB-CD1 3.8Å; W333-I349 HydrophobicContact CD2-CD1 3.13Å; W333-I349 HydrophobicContact CE3-CD1 3.3Å; W333-I349 HydrophobicContact CG-CD1 3.38Å; W333-I349 HydrophobicContact CH2-CD1 4.34Å; W333-I349 HydrophobicContact CZ2-CD1 4.21Å; W333-I349 HydrophobicContact CZ3-CD1 3.92Å; W346-I349 HydrophobicContact CE3-CB 3.85Å; W346-I349 HydrophobicContact CE3-CD1 4.11Å; W346-I349 HydrophobicContact CE3-CG2 4Å; W346-I349 HydrophobicContact CZ3-CB 4.02Å; W346-I349 HydrophobicContact CZ3-CG2 3.62Å; W346-I349 CarbonylContact O-C 3.57Å; W346-I349 WeakPolarHBondContact O-CA 3.16Å; W346-I349 WeakPolarHBondContact O-CB 3.41Å; W346-I349 PolarHBondContact O-N 3.42Å; E347-I349 VanDerWaalsContact C-N 3.3Å; E347-I349 PolarHBondContact O-N 2.8Å; I349-C351 PolarHBondContact O-N 2.89Å; I349-T352 VanDerWaalsContact O-CB 3.29Å; I349-T352 WeakPolarHBondContact O-CB 3.17Å; I349-T352 WeakPolarHBondContact O-CG2 3.36Å; I349-T352 PolarHBondContact O-N 3.12Å; I349-T352 PolarHBondContact O-OG1 2.7Å
350	Q	96.8	Very high	91.2	Very high	73 Å²	73	71 Å²	71	34%	0.341	36%	0.358	S	S	.	.	H	α-helix	trans	-60.8	-24.8	173.6	-62.2	-167.4	-26.3	0	0	112.5	W346 E347 T352 Y353	W346-Q350 HydrophobicContact CD2-CG 4.16Å; W346-Q350 HydrophobicContact CG-CG 4.45Å; W346-Q350 HydrophobicContact CZ2-CG 4.1Å; W346-Q350 WeakPolarHBondContact O-CG 3.5Å; W346-Q350 PolarHBondContact O-N 2.76Å; E347-Q350 WeakPolarHBondContact O-CB 3.34Å; E347-Q350 PolarHBondContact O-N 3.34Å; Q350-T352 PolarHBondContact O-N 3.38Å; Q350-T352 VanDerWaalsContact O-N 3.09Å; Q350-Y353 HydrophobicContact CB-CD2 4.16Å; Q350-Y353 HydrophobicContact CB-CE2 3.67Å; Q350-Y353 HydrophobicContact CG-CE2 3.84Å; Q350-Y353 PolarHBondContact NE2-OH 3.47Å; Q350-Y353 WeakPolarHBondContact O-CB 3.32Å; Q350-Y353 VanDerWaalsContact O-CD2 3.24Å; Q350-Y353 WeakPolarHBondContact O-CD2 3.34Å; Q350-Y353 PolarHBondContact O-N 2.58Å; Q350-Y353 VanDerWaalsContact O-N 3.09Å
351	C	95.2	Very high	90.6	Very high	65 Å²	65	68.8 Å²	68.8	44%	0.439	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-61.2	-16.9	171.7	-60.6	0	0	0	0	113	E347 D348 I349 Q361	E347-C351 PolarHBondContact O-N 3.09Å; E347-C351 PolarHBondContact O-SG 2.83Å; E347-C351 VanDerWaalsContact O-SG 3.33Å; D348-C351 VanDerWaalsContact O-CB 3.23Å; D348-C351 WeakPolarHBondContact O-CB 3.38Å; D348-C351 PolarHBondContact O-N 3.27Å; I349-C351 PolarHBondContact O-N 2.89Å; C351-Q361 PolarHBondContact O-NE2 3.48Å
352	T	97.5	Very high	90.4	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-85	-3.5	176.3	76	0	0	0	0	114.3	F277 A311 Y324 I349 Q350 G354 E362 T363 A364	F277-T352 WeakPolarHBondContact CZ-OG1 3.24Å; A311-T352 HydrophobicContact CB-CG2 3.9Å; Y324-T352 HydrophobicContact CD2-CG2 4.21Å; Y324-T352 HydrophobicContact CE2-CG2 3.79Å; I349-T352 VanDerWaalsContact O-CB 3.29Å; I349-T352 WeakPolarHBondContact O-CB 3.17Å; I349-T352 WeakPolarHBondContact O-CG2 3.36Å; I349-T352 PolarHBondContact O-N 3.12Å; I349-T352 PolarHBondContact O-OG1 2.7Å; Q350-T352 PolarHBondContact O-N 3.38Å; Q350-T352 VanDerWaalsContact O-N 3.09Å; T352-G354 PolarHBondContact O-N 3.01Å; T352-G354 VanDerWaalsContact O-N 3.13Å; T352-E362 HydrophobicContact CG2-CB 4.16Å; T352-T363 CarbonylContact O-C 3.57Å; T352-T363 VanDerWaalsContact O-CA 3.3Å; T352-T363 WeakPolarHBondContact O-CA 3.35Å; T352-A364 PolarHBondContact O-N 2.84Å
353	Y	97.3	Very high	90.4	Very high	28 Å²	28	65.7 Å²	65.7	11%	0.11	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-57.4	-28.9	173.4	-64.4	-25	0	0	0	112.1	R260 A274 L275 H276 F277 W346 Q350	R260-Y353 PolarHBondContact NH2-O 2.84Å; A274-Y353 WeakPolarHBondContact CA-O 3.27Å; L275-Y353 PolarHBondContact N-O 2.95Å; L275-Y353 WeakPolarHBondContact O-CA 3.46Å; L275-Y353 WeakPolarHBondContact O-CB 3.4Å; L275-Y353 WeakPolarHBondContact O-CD1 3.45Å; H276-Y353 HydrophobicContact CB-CD2 4.47Å; H276-Y353 HydrophobicContact CB-CE2 4.31Å; H276-Y353 AromaticContact CD2-CD2 3.44Å; H276-Y353 VanDerWaalsContact CD2-CD2 3.44Å; H276-Y353 WeakPolarHBondContact CD2-CD2 3.24Å; H276-Y353 AromaticContact CD2-CE2 3.5Å; H276-Y353 VanDerWaalsContact CD2-CE2 3.5Å; H276-Y353 WeakPolarHBondContact CD2-CE2 3.48Å; F277-Y353 AromaticContact CD1-CD1 3.68Å; F277-Y353 HydrophobicContact CD1-CD1 3.68Å; F277-Y353 AromaticContact CD1-CE1 3.75Å; F277-Y353 HydrophobicContact CD1-CE1 3.75Å; F277-Y353 HydrophobicContact CD2-CE1 4.11Å; F277-Y353 AromaticContact CE1-CD1 3.44Å; F277-Y353 HydrophobicContact CE1-CD1 3.44Å; F277-Y353 VanDerWaalsContact CE1-CD1 3.44Å; F277-Y353 AromaticContact CE1-CE1 3.7Å; F277-Y353 HydrophobicContact CE1-CE1 3.7Å; F277-Y353 HydrophobicContact CE2-CE1 4.04Å; F277-Y353 HydrophobicContact CG-CD1 4.36Å; F277-Y353 AromaticContact CG-CE1 3.96Å; F277-Y353 HydrophobicContact CG-CE1 3.96Å; F277-Y353 AromaticContact CZ-CD1 3.93Å; F277-Y353 HydrophobicContact CZ-CD1 3.93Å; F277-Y353 AromaticContact CZ-CE1 3.84Å; F277-Y353 HydrophobicContact CZ-CE1 3.84Å; F277-Y353 PolarHBondContact O-OH 2.79Å; W346-Y353 WeakPolarHBondContact CZ2-OH 3.47Å; Q350-Y353 HydrophobicContact CB-CD2 4.16Å; Q350-Y353 HydrophobicContact CB-CE2 3.67Å; Q350-Y353 HydrophobicContact CG-CE2 3.84Å; Q350-Y353 PolarHBondContact NE2-OH 3.47Å; Q350-Y353 WeakPolarHBondContact O-CB 3.32Å; Q350-Y353 VanDerWaalsContact O-CD2 3.24Å; Q350-Y353 WeakPolarHBondContact O-CD2 3.34Å; Q350-Y353 PolarHBondContact O-N 2.58Å; Q350-Y353 VanDerWaalsContact O-N 3.09Å
354	G	92.9	Very high	90.5	Very high	8 Å²	8	60.4 Å²	60.4	8%	0.082	30%	0.295	C	S	.	.			trans	94.4	160.4	-179.5	0	0	0	0	0	113	C272 A274 T352	C272-G354 CarbonylContact O-C 2.87Å; A274-G354 VanDerWaalsContact CA-O 3.24Å; A274-G354 WeakPolarHBondContact CA-O 3.13Å; A274-G354 VanDerWaalsContact CB-O 3.23Å; A274-G354 WeakPolarHBondContact CB-O 3.32Å; T352-G354 PolarHBondContact O-N 3.01Å; T352-G354 VanDerWaalsContact O-N 3.13Å
355	N	87.4	Confident	90.6	Very high	48 Å²	48	59.4 Å²	59.4	26%	0.257	29%	0.289	S	S	.	.			trans	-138.3	127	176.9	-170.2	-41.5	0	0	0	110.5	C272 N357 Y358	C272-N355 CarbonylContact O-C 3.43Å; C272-N355 WeakPolarHBondContact O-CA 3.49Å; C272-N355 PolarHBondContact O-N 3.23Å; N355-N357 PolarHBondContact O-N 2.97Å; N355-N357 VanDerWaalsContact O-N 3.16Å; N355-N357 WeakPolarHBondContact OD1-CB 3.27Å; N355-N357 PolarHBondContact OD1-N 2.85Å; N355-Y358 HydrophobicContact CB-CD2 4.26Å; N355-Y358 PolarHBondContact O-N 3.11Å
356	P	77.7	Confident	90.6	Very high	68 Å²	68	57.3 Å²	57.3	44%	0.442	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.7	-178.9	27.6	-35.9	0	0	0	113.5	H273 H359	H273-P356 HydrophobicContact CB-CB 4.39Å; P356-H359 PolarHBondContact O-CE1 2.89Å
357	N	80.8	Confident	90.7	Very high	132 Å²	132	55.4 Å²	55.4	71%	0.706	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-15.4	-178.4	-59.8	-20.9	0	0	0	113.2	N355	N355-N357 PolarHBondContact O-N 2.97Å; N355-N357 VanDerWaalsContact O-N 3.16Å; N355-N357 WeakPolarHBondContact OD1-CB 3.27Å; N355-N357 PolarHBondContact OD1-N 2.85Å
358	Y	79.2	Confident	90.8	Very high	154 Å²	154	49.9 Å²	49.9	60%	0.604	24%	0.241	S	C	*	.			trans	-126.1	80.9	-175.8	-63	-80.5	0	0	0	110.9	N355 W360 Q361	N355-Y358 HydrophobicContact CB-CD2 4.26Å; N355-Y358 PolarHBondContact O-N 3.11Å; Y358-W360 PolarHBondContact O-N 3.14Å; Y358-W360 VanDerWaalsContact O-N 3.08Å; Y358-Q361 WeakPolarHBondContact O-CB 3.38Å; Y358-Q361 PolarHBondContact O-N 3.13Å
359	H	69	Low	90.9	Very high	105 Å²	105	46.5 Å²	46.5	49%	0.486	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-18.8	-176.3	-59.1	-41.7	0	0	0	115.1	P356	P356-H359 PolarHBondContact O-CE1 2.89Å
360	W	74.9	Confident	90.8	Very high	188 Å²	188	48.3 Å²	48.3	71%	0.712	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-9.6	177.1	-61.9	101.1	0	0	0	114	Y358	Y358-W360 PolarHBondContact O-N 3.14Å; Y358-W360 VanDerWaalsContact O-N 3.08Å
361	Q	83.6	Confident	90.6	Very high	60 Å²	60	48.1 Å²	48.1	28%	0.28	23%	0.23	S	C	.	.	S	Bend	trans	-66	153.5	176.4	-170.2	169.1	-7.6	0	0	111	K270 C351 Y358	K270-Q361 PolarHBondContact NZ-O 2.85Å; C351-Q361 PolarHBondContact O-NE2 3.48Å; Y358-Q361 WeakPolarHBondContact O-CB 3.38Å; Y358-Q361 PolarHBondContact O-N 3.13Å
362	E	91.4	Very high	90.3	Very high	43 Å²	43	48.9 Å²	48.9	20%	0.201	23%	0.228	C	C	.	.			trans	-57	140.9	169	-75.8	-176.4	-168.8	0	0	111.6	A311 V313 Y324 T352	A311-E362 HydrophobicContact CB-CB 4.43Å; V313-E362 HydrophobicContact CG2-CG 3.41Å; V313-E362 VanDerWaalsContact CG2-CG 3.41Å; Y324-E362 WeakPolarHBondContact CE2-OE2 3.4Å; Y324-E362 PolarHBondContact OH-OE2 3.41Å; T352-E362 HydrophobicContact CG2-CB 4.16Å
363	T	96.9	Very high	89.1	Confident	1 Å²	1	57 Å²	57	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	121.8	172.1	64.1	0	0	0	0	109.4	R260 K270 C272 H312 T352 Y365	R260-T363 WeakPolarHBondContact CD-OG1 3.23Å; K270-T363 WeakPolarHBondContact CE-OG1 3.43Å; K270-T363 PolarHBondContact NZ-OG1 2.97Å; C272-T363 HydrophobicContact CB-CG2 4.37Å; H312-T363 PolarHBondContact N-O 3.32Å; H312-T363 PolarHBondContact O-N 3.33Å; H312-T363 VanDerWaalsContact O-N 3.1Å; H312-T363 PolarHBondContact O-OG1 3.1Å; T352-T363 CarbonylContact O-C 3.57Å; T352-T363 VanDerWaalsContact O-CA 3.3Å; T352-T363 WeakPolarHBondContact O-CA 3.35Å; T363-Y365 PolarHBondContact O-N 3.12Å
364	A	98.3	Very high	86.7	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	130.1	171.2	0	0	0	0	0	110.1	L258 R260 F277 V309 T352 L367	L258-A364 HydrophobicContact CD1-CB 4.25Å; R260-A364 WeakPolarHBondContact CD-O 3.25Å; R260-A364 PolarHBondContact NE-O 2.88Å; F277-A364 HydrophobicContact CD1-CB 4.44Å; F277-A364 HydrophobicContact CE1-CB 3.49Å; F277-A364 VanDerWaalsContact CE1-CB 3.49Å; F277-A364 HydrophobicContact CZ-CB 3.97Å; V309-A364 HydrophobicContact CG1-CB 3.53Å; T352-A364 PolarHBondContact O-N 2.84Å; A364-L367 HydrophobicContact CB-CD2 3.92Å
365	Y	98.3	Very high	86.4	Confident	1 Å²	1	67.7 Å²	67.7	0%	0.004	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	-46.1	-171	179.9	-84.9	0	0	0	111.4	D141 A142 A143 H257 L258 R260 F261 I310 Y321 T363	D141-Y365 PolarHBondContact OD1-OH 2.83Å; D141-Y365 PolarHBondContact OD2-OH 2.75Å; A142-Y365 HydrophobicContact CB-CD1 3.88Å; A142-Y365 HydrophobicContact CB-CE1 3.82Å; A143-Y365 HydrophobicContact CB-CE1 4.02Å; H257-Y365 AromaticContact CD2-CZ 3.96Å; H257-Y365 AromaticContact NE2-CZ 3.58Å; H257-Y365 PolarHBondContact NE2-OH 3.37Å; L258-Y365 PolarHBondContact N-O 3.39Å; R260-Y365 HydrophobicContact CB-CD2 4.16Å; F261-Y365 HydrophobicContact CD1-CE2 4.39Å; F261-Y365 AromaticContact CD2-CE2 3.64Å; F261-Y365 HydrophobicContact CD2-CE2 3.64Å; F261-Y365 HydrophobicContact CE1-CE2 4.37Å; F261-Y365 HydrophobicContact CE2-CD2 4.31Å; F261-Y365 AromaticContact CE2-CE2 3.62Å; F261-Y365 HydrophobicContact CE2-CE2 3.62Å; F261-Y365 HydrophobicContact CG-CE2 4.04Å; F261-Y365 HydrophobicContact CZ-CD2 4.27Å; F261-Y365 HydrophobicContact CZ-CE2 4Å; I310-Y365 PolarHBondContact O-N 3.34Å; Y321-Y365 HydrophobicContact CE1-CD1 4.2Å; Y321-Y365 HydrophobicContact CE1-CG 4.31Å; T363-Y365 PolarHBondContact O-N 3.12Å
366	L	98.8	Very high	86.4	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	135.3	161.1	-61	-179	0	0	0	109.3	L71 A142 A143 Y146 I256 H257 I310	L71-L366 HydrophobicContact CD2-CD1 4.15Å; A142-L366 HydrophobicContact CB-CD1 4.43Å; A143-L366 HydrophobicContact CB-CD2 4Å; Y146-L366 HydrophobicContact CG-CD1 4.39Å; I256-L366 CarbonylContact O-C 3.58Å; I256-L366 WeakPolarHBondContact O-CA 3.48Å; H257-L366 HydrophobicContact CB-CD2 3.57Å; I310-L366 HydrophobicContact CB-CB 4.14Å; I310-L366 HydrophobicContact CD1-CB 3.8Å; I310-L366 HydrophobicContact CD1-CD1 3.9Å; I310-L366 HydrophobicContact CD1-CG 4.36Å; I310-L366 PolarHBondContact N-O 3.15Å; I310-L366 PolarHBondContact O-N 2.87Å
367	L	98.9	Very high	86.8	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	138.1	166.5	-53.4	175.1	0	0	0	108.1	L211 T255 I256 L258 F277 L306 V309 A364 Y369	L211-L367 HydrophobicContact CD1-CD1 4.29Å; L211-L367 HydrophobicContact CD2-CD1 3.92Å; T255-L367 WeakPolarHBondContact CA-O 3.15Å; I256-L367 HydrophobicContact CB-CB 4.3Å; I256-L367 PolarHBondContact N-O 3.2Å; I256-L367 PolarHBondContact O-N 2.92Å; L258-L367 HydrophobicContact CD1-CD1 4.15Å; L258-L367 HydrophobicContact CD1-CG 4.25Å; L258-L367 HydrophobicContact CD2-CD1 4.47Å; L258-L367 HydrophobicContact CG-CD1 4.43Å; L258-L367 HydrophobicContact CG-CG 4.45Å; F277-L367 HydrophobicContact CB-CD1 3.73Å; F277-L367 HydrophobicContact CD1-CD1 3.92Å; F277-L367 HydrophobicContact CD1-CD2 3.9Å; F277-L367 HydrophobicContact CD2-CD1 4.24Å; F277-L367 HydrophobicContact CD2-CD2 3.98Å; F277-L367 HydrophobicContact CE1-CD2 3.79Å; F277-L367 HydrophobicContact CE2-CD2 3.9Å; F277-L367 HydrophobicContact CG-CD1 3.7Å; F277-L367 HydrophobicContact CG-CD2 3.99Å; F277-L367 HydrophobicContact CZ-CD2 3.81Å; L306-L367 HydrophobicContact CD1-CB 4.26Å; L306-L367 HydrophobicContact CD1-CD2 4.46Å; V309-L367 HydrophobicContact CB-CD2 4.37Å; V309-L367 HydrophobicContact CG1-CD2 3.95Å; V309-L367 HydrophobicContact CG2-CD2 3.9Å; A364-L367 HydrophobicContact CB-CD2 3.92Å; L367-Y369 HydrophobicContact CB-CD2 4.26Å; L367-Y369 HydrophobicContact CB-CE2 3.9Å; L367-Y369 HydrophobicContact CD1-CE2 4.13Å
368	V	98.8	Very high	87.2	Confident	2 Å²	2	65.1 Å²	65.1	1%	0.012	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	123.7	175	-170.9	0	0	0	0	108.2	V74 T253 L254 T255 F307 A308	V74-V368 HydrophobicContact CG1-CG2 3.97Å; T253-V368 HydrophobicContact CG2-CG1 3.48Å; T253-V368 VanDerWaalsContact CG2-CG1 3.48Å; L254-V368 WeakPolarHBondContact O-CA 3.43Å; T255-V368 HydrophobicContact CG2-CG2 4.33Å; F307-V368 WeakPolarHBondContact CA-O 3.47Å; F307-V368 HydrophobicContact CD1-CB 4.2Å; F307-V368 HydrophobicContact CD1-CG1 3.85Å; F307-V368 PolarHBondContact N-O 2.98Å; A308-V368 HydrophobicContact CB-CB 4.12Å; A308-V368 HydrophobicContact CB-CG2 4.36Å; A308-V368 PolarHBondContact N-O 2.87Å; A308-V368 PolarHBondContact O-N 3.16Å
369	Y	98	Very high	87.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	141.9	-179.5	-79.8	-88.2	0	0	0	109.2	L211 T253 L254 I256 P278 L281 E305 L306 L367	L211-Y369 HydrophobicContact CD2-CE2 3.81Å; L211-Y369 WeakPolarHBondContact CD2-OH 3.49Å; T253-Y369 CarbonylContact C-O 3.38Å; L254-Y369 PolarHBondContact N-O 3.4Å; L254-Y369 PolarHBondContact O-N 2.93Å; I256-Y369 HydrophobicContact CD1-CD2 4.02Å; I256-Y369 HydrophobicContact CD1-CE2 4.1Å; P278-Y369 PolarHBondContact O-OH 3.25Å; L281-Y369 HydrophobicContact CB-CD1 4.03Å; L281-Y369 HydrophobicContact CB-CE1 3.66Å; L281-Y369 HydrophobicContact CD2-CD1 4.46Å; L281-Y369 HydrophobicContact CD2-CD2 4.31Å; L281-Y369 HydrophobicContact CD2-CE1 4.29Å; L281-Y369 HydrophobicContact CD2-CE2 4.1Å; L281-Y369 HydrophobicContact CD2-CG 4.49Å; E305-Y369 CarbonylContact O-C 3.04Å; E305-Y369 WeakPolarHBondContact O-CA 3.26Å; L306-Y369 HydrophobicContact CB-CD1 4.03Å; L306-Y369 HydrophobicContact CB-CE1 3.67Å; L306-Y369 HydrophobicContact CD1-CD1 4.17Å; L306-Y369 HydrophobicContact CD1-CD2 3.98Å; L306-Y369 HydrophobicContact CD1-CE1 3.76Å; L306-Y369 HydrophobicContact CD1-CE2 3.57Å; L306-Y369 HydrophobicContact CD1-CG 4.26Å; L306-Y369 VanDerWaalsContact CD1-CZ 3.43Å; L306-Y369 HydrophobicContact CG-CE1 4.28Å; L367-Y369 HydrophobicContact CB-CD2 4.26Å; L367-Y369 HydrophobicContact CB-CE2 3.9Å; L367-Y369 HydrophobicContact CD1-CE2 4.13Å
370	M	95.8	Very high	89	Confident	39 Å²	39	56.5 Å²	56.5	19%	0.192	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	135.6	173.1	-75.3	174.7	169.8	0	0	109.9	N78 Q252 Y304 E305 F307	N78-M370 HydrophobicContact CB-CE 4.01Å; N78-M370 VanDerWaalsContact ND2-CE 3.27Å; N78-M370 WeakPolarHBondContact ND2-CE 3.01Å; Q252-M370 WeakPolarHBondContact O-CA 3.47Å; Y304-M370 CarbonylContact C-O 3.58Å; Y304-M370 VanDerWaalsContact CA-O 3.31Å; Y304-M370 WeakPolarHBondContact CA-O 3.36Å; Y304-M370 VanDerWaalsContact CD1-C 3.43Å; E305-M370 PolarHBondContact N-O 3.08Å; E305-M370 PolarHBondContact O-N 3.18Å; F307-M370 HydrophobicContact CB-CB 4.44Å; F307-M370 HydrophobicContact CB-CE 4.29Å; F307-M370 HydrophobicContact CB-CG 3.79Å; F307-M370 HydrophobicContact CB-SD 3.84Å; F307-M370 HydrophobicContact CD1-CE 3.68Å; F307-M370 HydrophobicContact CD1-SD 4.36Å; F307-M370 HydrophobicContact CD2-CE 3.51Å; F307-M370 HydrophobicContact CD2-SD 3.54Å; F307-M370 VanDerWaalsContact CD2-SD 3.54Å; F307-M370 HydrophobicContact CE1-CE 3.79Å; F307-M370 HydrophobicContact CE2-CE 3.63Å; F307-M370 HydrophobicContact CE2-SD 4.18Å; F307-M370 HydrophobicContact CG-CE 3.53Å; F307-M370 HydrophobicContact CG-CG 4.09Å; F307-M370 HydrophobicContact CG-SD 3.64Å; F307-M370 HydrophobicContact CZ-CE 3.77Å
371	K	93.1	Very high	90	Very high	69 Å²	69	47.1 Å²	47.1	30%	0.3	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	132.7	177.1	-163.9	-177	-177.1	179.4	0	109	Q252 Y304 E373	Q252-K371 PolarHBondContact NE2-O 3.13Å; Q252-K371 PolarHBondContact O-N 3.18Å; Y304-K371 HydrophobicContact CD1-CB 4.09Å; Y304-K371 HydrophobicContact CE1-CB 3.52Å; Y304-K371 HydrophobicContact CE1-CG 4.12Å; Y304-K371 HydrophobicContact CE2-CB 4.32Å; Y304-K371 HydrophobicContact CE2-CG 4Å; K371-E373 PolarHBondContact O-N 3.02Å
372	M	87.6	Confident	90.4	Very high	80 Å²	80	46.1 Å²	46.1	39%	0.394	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-68	129.3	170.3	-67.9	-105.3	-78.1	0	0	109.2	Q303 E305	Q303-M372 HydrophobicContact CB-CB 4.47Å; Q303-M372 HydrophobicContact CB-CG 4.45Å; Q303-M372 HydrophobicContact CG-CG 4.25Å; Q303-M372 PolarHBondContact O-N 3.17Å; E305-M372 HydrophobicContact CG-CG 3.77Å; E305-M372 HydrophobicContact CG-SD 3.52Å; E305-M372 VanDerWaalsContact CG-SD 3.52Å
373	E	72.4	Confident	90.4	Very high	172 Å²	172	46.3 Å²	46.3	80%	0.804	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-71.2	130.1	164	-63.9	-175.2	162.7	0	0	107.7	K371	K371-E373 PolarHBondContact O-N 3.02Å
374	C	47.7	Very low	89.8	Confident	192 Å²	192	50.5 Å²	50.5	100%	1.297	27%	0.273	S	S	*	.			trans	-92.4	0	-178.3	-62	0	0	0	0	111.9

Retrieved 374 of 374 residues in 125 ms (Link to these results)

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