A0A096NJY2_PAPAN Loading...

MAP/microtubule affinity-regulating kinase 3

Serine/threonine-protein kinase. Involved in the specific phosphorylation of microtubule-associated proteins for MAP2 and MAP4. Phosphorylates the microtubule-associated protein MAPT/TAU. Phosphorylates CDC25C on 'Ser-216'. Regulates localization and activity of some histone deacetylases by mediating phosphorylation of HDAC7, promoting subsequent interaction between HDAC7 and 14-3-3 and export from the nucleus. Regulates localization and activity of MITF by mediating its phosphorylation, promoting subsequent interaction between MITF and 14-3-3 and retention in the cytosol. Negatively regulates the Hippo signaling pathway and antagonizes the phosphorylation of LATS1. Cooperates with DLG5 to inhibit the kinase activity of STK3/MST2 toward LATS1. Phosphorylates PKP2 and KSR1.

AlphaFold DB (A0A2K6BK19), UniProt , Accession A0A096NJY2, Species PAPAN (Papio anubis, Olive baboon), Gene MARK3, Length 753 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.8	Very low	34.5	Very low	238 Å²	238	150.1 Å²	150.1	100%	1.172	84%	0.836	S	S	*	*				0	134	0	-61.1	166.7	175	0	0	108.3
2	S	36.8	Very low	34.3	Very low	105 Å²	105	150.5 Å²	150.5	73%	0.734	83%	0.827	S	S	*	*			cis	-152.4	126	-24	-75.4	0	0	0	0	110.2
3	T	31.9	Very low	34.1	Very low	126 Å²	126	155.2 Å²	155.2	77%	0.773	83%	0.825	S	S	*	*			trans	6.1	119.7	146.4	50	0	0	0	0	118.7
4	R	32.2	Very low	33.8	Very low	227 Å²	227	154 Å²	154	86%	0.857	82%	0.819	S	S	*	*				69.7	108.8	81	-90.7	-170.1	167.9	-179.8	-3.2	116.3
5	T	28.1	Very low	33.6	Very low	122 Å²	122	152.3 Å²	152.3	75%	0.748	82%	0.817	S	S	*	*				28.7	157.9	118.6	56.3	0	0	0	0	121.5
6	P	42.6	Very low	33.5	Very low	126 Å²	126	153.6 Å²	153.6	82%	0.818	82%	0.816	S	S	*	*			cis	-141.6	-158.3	15.3	38.9	-15.6	0	0	0	116.3
7	L	28	Very low	33.4	Very low	159 Å²	159	153.3 Å²	153.3	83%	0.832	82%	0.815	S	S	*	*			trans	-80.5	-159.6	169.5	-62.7	153.2	0	0	0	112.1
8	P	54.2	Low	33.3	Very low	110 Å²	110	154.3 Å²	154.3	71%	0.714	81%	0.814	S	S	*	*				-127	-179.2	-82.5	41.5	-25.9	0	0	0	113.2
9	T	30.3	Very low	33.2	Very low	149 Å²	149	153.8 Å²	153.8	91%	0.914	82%	0.818	S	S	*	*			trans	-171.6	162.2	142.2	19.5	0	0	0	0	114.1
10	V	31.4	Very low	33	Very low	127 Å²	127	150.5 Å²	150.5	77%	0.77	81%	0.807	S	S	*	*			trans	-84.8	153.8	171.7	174.2	0	0	0	0	111
11	N	29	Very low	33	Very low	162 Å²	162	152.3 Å²	152.3	87%	0.866	81%	0.811	S	S	*	*			trans	-152.3	153	145.5	-127.8	4.6	0	0	0	111.8
12	E	32	Very low	32.7	Very low	155 Å²	155	144.5 Å²	144.5	72%	0.724	79%	0.791	S	S	*	*			trans	-91.8	153.5	-177.1	-55.8	167.2	131.5	0	0	112.4
13	R	31.7	Very low	32.6	Very low	212 Å²	212	147.7 Å²	147.7	80%	0.8	80%	0.8	S	S	*	*				161.7	122.8	118.8	-87.2	167.3	-169.2	-174.4	2.8	113.8
14	D	29.2	Very low	32.6	Very low	138 Å²	138	144.2 Å²	144.2	74%	0.738	79%	0.789	S	S	*	*				46	164.6	122.3	-50.4	-33.9	0	0	0	123.8
15	T	31	Very low	32.8	Very low	129 Å²	129	145 Å²	145	79%	0.791	79%	0.792	S	S	*	*			trans	75.4	93.7	167.8	58.1	0	0	0	0	118
16	E	32.7	Very low	33.1	Very low	172 Å²	172	146.4 Å²	146.4	80%	0.804	79%	0.79	S	S	*	*				6.3	129.9	119.5	-54.6	175	145	0	0	116.9
17	N	30.6	Very low	32.6	Very low	149 Å²	149	147.7 Å²	147.7	80%	0.797	79%	0.785	S	S	*	*				-163.1	165.4	109.3	-113.4	-73.6	0	0	0	114.5
18	H	31.9	Very low	32.9	Very low	171 Å²	171	145.3 Å²	145.3	79%	0.792	78%	0.777	S	S	*	*			trans	-74.5	144.8	179	-64.9	-96.8	0	0	0	113
19	T	32.3	Very low	31.7	Very low	146 Å²	146	146.4 Å²	146.4	90%	0.896	78%	0.781	S	S	*	*			trans	-129.7	155.4	138.5	49.7	0	0	0	0	109.2
20	S	28.9	Very low	31.8	Very low	86 Å²	86	144.7 Å²	144.7	60%	0.601	78%	0.776	S	S	*	*			trans	-142.4	155.1	-162.1	54.4	0	0	0	0	112.9
21	H	32.7	Very low	32	Very low	190 Å²	190	149.7 Å²	149.7	88%	0.88	78%	0.781	S	S	*	*			trans	64.5	146.6	178.5	-46.3	-78.1	0	0	0	114.5
22	G	30.3	Very low	31.9	Very low	74 Å²	74	148.9 Å²	148.9	76%	0.763	78%	0.782	S	S	*	*			cis	-169.7	-167.1	-4.5	0	0	0	0	0	107.9
23	D	34.7	Very low	31.8	Very low	172 Å²	172	146.6 Å²	146.6	92%	0.92	78%	0.783	S	S	*	*			cis	-161.4	168.6	-9.4	-171.9	11.5	0	0	0	107.1
24	G	31.5	Very low	32	Very low	52 Å²	52	148.3 Å²	148.3	54%	0.536	79%	0.789	S	S	.	*			trans	113.3	96.9	153.9	0	0	0	0	0	118.5
25	R	36.5	Very low	32.1	Very low	244 Å²	244	147.5 Å²	147.5	92%	0.921	80%	0.795	S	S	*	*			trans	71	142.3	132.9	-71.6	173.2	-176.2	-169.8	-1.4	118
26	Q	34.3	Very low	32	Very low	151 Å²	151	145.4 Å²	145.4	71%	0.706	80%	0.799	S	S	*	*			cis	-138.8	139.6	6.7	-113.6	173.7	-53.2	0	0	109.5
27	E	31.4	Very low	32.1	Very low	154 Å²	154	141.6 Å²	141.6	72%	0.72	80%	0.797	S	S	*	*				59.4	140.4	96.5	-70.1	-166	114.4	0	0	117.6
28	V	34.7	Very low	32.2	Very low	109 Å²	109	146 Å²	146	66%	0.661	80%	0.802	S	S	*	*			cis	-164.5	146.8	-26	88.4	0	0	0	0	110.9
29	T	29.7	Very low	32	Very low	132 Å²	132	143.2 Å²	143.2	81%	0.81	80%	0.801	S	S	*	*			trans	62.3	162.6	168.3	64.7	0	0	0	0	117.7
30	S	30.6	Very low	32.1	Very low	114 Å²	114	147.9 Å²	147.9	80%	0.797	80%	0.802	S	S	*	*			cis	-133.9	165	8	64.6	0	0	0	0	113.4
31	R	35.9	Very low	32.2	Very low	232 Å²	232	151.4 Å²	151.4	88%	0.875	81%	0.814	S	S	*	*			trans	-100.4	155.6	-179.8	-67.7	173	169.5	163.7	-5.6	111.1
32	T	27.4	Very low	32.3	Very low	144 Å²	144	148.1 Å²	148.1	88%	0.883	81%	0.812	S	S	*	*			trans	-146.3	147.2	140.3	6.1	0	0	0	0	111.3
33	S	30.8	Very low	32.8	Very low	108 Å²	108	152.6 Å²	152.6	76%	0.755	82%	0.817	S	S	*	*			trans	-155.9	116.3	177.8	-49.4	0	0	0	0	109.9
34	R	33.9	Very low	32.9	Very low	247 Å²	247	149 Å²	149	93%	0.932	81%	0.811	S	S	*	*			trans	-168.1	132.7	151.6	-115.5	167.1	177.9	178.9	-2.3	114.9
35	S	32.9	Very low	33.4	Very low	121 Å²	121	152 Å²	152	85%	0.846	82%	0.824	S	S	*	*			trans	2.4	131.4	155.7	-46.3	0	0	0	0	121.4
36	G	27.7	Very low	33.6	Very low	85 Å²	85	146.6 Å²	146.6	88%	0.876	82%	0.822	S	S	*	*			trans	-151.2	115	150	0	0	0	0	0	109.4
37	A	34.8	Very low	33.9	Very low	92 Å²	92	143.9 Å²	143.9	76%	0.76	83%	0.826	S	S	*	*			trans	-119.8	162.4	-173.3	0	0	0	0	0	112.4
38	R	33.1	Very low	34.5	Very low	241 Å²	241	142.5 Å²	142.5	91%	0.909	82%	0.823	S	S	*	*			trans	109.5	135.3	-176.3	-66.1	158.5	-178.4	-175.6	0.9	112.1
39	C	28.8	Very low	35.6	Very low	113 Å²	113	146.6 Å²	146.6	76%	0.764	84%	0.835	S	S	*	*			cis	-147.1	130.6	-20.1	-89.4	0	0	0	0	107.4
40	R	33.3	Very low	37.3	Very low	245 Å²	245	143.7 Å²	143.7	93%	0.925	81%	0.812	S	S	*	*			trans	-114.2	126.4	162.1	-88.5	-176.5	169.1	167.9	-3.3	107.7	S42	R40-S42 PolarHBondContact O-N 3.43Å
41	N	32.2	Very low	40.1	Very low	159 Å²	159	142 Å²	142	85%	0.85	80%	0.798	S	S	*	*			trans	-73.4	113.7	176.2	-76	-6.6	0	0	0	109.3	I43	N41-I43 PolarHBondContact O-N 3.39Å
42	S	33.8	Very low	42.8	Very low	122 Å²	122	137.6 Å²	137.6	85%	0.853	79%	0.788	S	S	*	*			trans	-70.7	105.8	175.3	-55	0	0	0	0	110.7	R40	R40-S42 PolarHBondContact O-N 3.43Å
43	I	41	Very low	46	Very low	168 Å²	168	132.1 Å²	132.1	86%	0.862	75%	0.752	S	S	*	*			trans	-80.9	129.5	152.6	-62.4	178.7	0	0	0	106.2	N41 S45	N41-I43 PolarHBondContact O-N 3.39Å; I43-S45 PolarHBondContact O-N 2.79Å
44	A	36.5	Very low	49	Very low	95 Å²	95	129 Å²	129	79%	0.785	74%	0.737	S	S	*	*			trans	-66.5	126.9	-163	0	0	0	0	0	113.7	C46	A44-C46 PolarHBondContact O-N 3.28Å
45	S	41.6	Very low	52	Low	115 Å²	115	119 Å²	119	80%	0.804	70%	0.703	S	S	*	*			trans	-84.3	97	169.3	55.2	0	0	0	0	110.8	I43	I43-S45 PolarHBondContact O-N 2.79Å
46	C	41.1	Very low	55.1	Low	132 Å²	132	113.3 Å²	113.3	89%	0.892	66%	0.662	S	S	*	*			trans	-170.2	70.1	158.7	-102.8	0	0	0	0	111.8	A44	A44-C46 PolarHBondContact O-N 3.28Å
47	A	40.1	Very low	58.4	Low	94 Å²	94	115.3 Å²	115.3	78%	0.777	64%	0.644	S	S	*	*	S	Bend	trans	-162	102.3	163.8	0	0	0	0	0	110.8
48	D	44.8	Very low	61.3	Low	124 Å²	124	111.8 Å²	111.8	66%	0.663	61%	0.612	S	S	*	*			trans	35.3	89.7	157.7	-169.9	44.8	0	0	0	116.5	Q50	D48-Q50 PolarHBondContact O-N 2.87Å; D48-Q50 WeakPolarHBondContact OD2-CG 3.26Å; D48-Q50 PolarHBondContact OD2-NE2 3.24Å
49	E	57.1	Low	64.2	Low	195 Å²	195	102.7 Å²	102.7	91%	0.911	58%	0.581	S	S	*	*			trans	-68.4	79.9	174.9	-75.5	-157.7	148.3	0	0	112
50	Q	66.1	Low	67.1	Low	72 Å²	72	100 Å²	100	34%	0.336	56%	0.556	S	S	.	*			trans	-59.2	121.5	172	-68.9	133.7	24.4	0	0	109.3	D48 R57	D48-Q50 PolarHBondContact O-N 2.87Å; D48-Q50 WeakPolarHBondContact OD2-CG 3.26Å; D48-Q50 PolarHBondContact OD2-NE2 3.24Å; Q50-R57 HydrophobicContact CB-CG 3.93Å
51	P	89	Confident	69.9	Low	77 Å²	77	89.9 Å²	89.9	50%	0.5	52%	0.522	S	S	.	.			trans	-62.1	142.3	-165.4	22.1	-33.7	0	0	0	112	L58	P51-L58 HydrophobicContact CG-CD1 4.47Å; P51-L58 WeakPolarHBondContact O-CB 3.44Å; P51-L58 VanDerWaalsContact O-CG 3.27Å; P51-L58 WeakPolarHBondContact O-CG 3.17Å; P51-L58 PolarHBondContact O-N 3.26Å
52	H	92.1	Very high	72.6	Confident	141 Å²	141	83.5 Å²	83.5	65%	0.653	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	160.3	-178.5	66.2	95.2	0	0	0	112.4	Y56	H52-Y56 CarbonylContact C-O 3.59Å; H52-Y56 WeakPolarHBondContact CA-O 3.37Å; H52-Y56 WeakPolarHBondContact CB-O 3.37Å
53	I	94.6	Very high	75.2	Confident	28 Å²	28	78.5 Å²	78.5	14%	0.144	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	122.5	169.3	-179.3	61.7	0	0	0	107.6	N55 Y56 L58 I84 I122 Y129	I53-N55 PolarHBondContact O-N 2.94Å; I53-Y56 PolarHBondContact N-O 3.1Å; I53-Y56 WeakPolarHBondContact O-CB 3.43Å; I53-Y56 WeakPolarHBondContact O-CD2 3.5Å; I53-Y56 PolarHBondContact O-N 3.31Å; I53-L58 HydrophobicContact CG2-CD1 4.39Å; I53-L58 HydrophobicContact CG2-CD2 3.84Å; I53-L58 HydrophobicContact CG2-CG 4.18Å; I53-I84 HydrophobicContact CG2-CD1 4.21Å; I53-I122 HydrophobicContact CD1-CG2 4.31Å; I53-I122 HydrophobicContact CG1-CD1 4.1Å; I53-I122 HydrophobicContact CG1-CG2 4.47Å; I53-Y129 HydrophobicContact CB-CE1 4.46Å; I53-Y129 HydrophobicContact CD1-CD2 4.33Å; I53-Y129 HydrophobicContact CD1-CE1 4.49Å; I53-Y129 HydrophobicContact CD1-CE2 3.91Å; I53-Y129 HydrophobicContact CG1-CD1 4.02Å; I53-Y129 HydrophobicContact CG1-CD2 4.12Å; I53-Y129 HydrophobicContact CG1-CE1 3.97Å; I53-Y129 HydrophobicContact CG1-CE2 4.06Å; I53-Y129 HydrophobicContact CG1-CG 4.12Å; I53-Y129 HydrophobicContact CG2-CD1 4.31Å; I53-Y129 HydrophobicContact CG2-CE1 4.44Å
54	G	94.8	Very high	77.3	Confident	43 Å²	43	74.6 Å²	74.6	44%	0.443	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	-136.9	-166.7	0	0	0	0	0	111.6	Y56	G54-Y56 PolarHBondContact O-N 2.99Å; G54-Y56 VanDerWaalsContact O-N 3.15Å
55	N	96.1	Very high	79.2	Confident	38 Å²	38	72.4 Å²	72.4	20%	0.203	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	23.4	177	-65.4	-34.7	0	0	0	114.1	I53 H75 I76 E356	I53-N55 PolarHBondContact O-N 2.94Å; N55-H75 WeakPolarHBondContact CB-NE2 3.34Å; N55-H75 CarbonylContact O-C 3.33Å; N55-H75 WeakPolarHBondContact O-CA 3.37Å; N55-H75 PolarHBondContact O-CD2 2.9Å; N55-I76 WeakPolarHBondContact O-CB 3.23Å; N55-I76 VanDerWaalsContact O-CG1 3.31Å; N55-I76 WeakPolarHBondContact O-CG1 3.24Å; N55-I76 PolarHBondContact O-N 2.95Å; N55-E356 PolarHBondContact ND2-OE2 2.95Å
56	Y	98	Very high	80.8	Confident	0 Å²	0	74 Å²	74	0%	0	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	123.6	-174.8	-54.9	-89	0	0	0	113	H52 I53 G54 R74 H75 V82 I84 E120 I122 I131 A359 L363	H52-Y56 CarbonylContact C-O 3.59Å; H52-Y56 WeakPolarHBondContact CA-O 3.37Å; H52-Y56 WeakPolarHBondContact CB-O 3.37Å; I53-Y56 PolarHBondContact N-O 3.1Å; I53-Y56 WeakPolarHBondContact O-CB 3.43Å; I53-Y56 WeakPolarHBondContact O-CD2 3.5Å; I53-Y56 PolarHBondContact O-N 3.31Å; G54-Y56 PolarHBondContact O-N 2.99Å; G54-Y56 VanDerWaalsContact O-N 3.15Å; Y56-R74 WeakPolarHBondContact CA-O 3.12Å; Y56-H75 HydrophobicContact CD1-CB 3.83Å; Y56-H75 AromaticContact CD1-CD2 3.78Å; Y56-H75 HydrophobicContact CE1-CB 3.65Å; Y56-H75 AromaticContact CE1-CD2 3.33Å; Y56-H75 WeakPolarHBondContact CE1-CD2 3.14Å; Y56-H75 AromaticContact CE1-CG 3.73Å; Y56-H75 AromaticContact CZ-CD2 3.48Å; Y56-H75 VanDerWaalsContact CZ-CD2 3.48Å; Y56-V82 HydrophobicContact CD1-CG2 3.62Å; Y56-V82 HydrophobicContact CE1-CG1 4.42Å; Y56-V82 HydrophobicContact CE1-CG2 3.86Å; Y56-I84 HydrophobicContact CD1-CD1 4.32Å; Y56-I84 HydrophobicContact CG-CD1 3.95Å; Y56-E120 WeakPolarHBondContact CE2-OE2 3.46Å; Y56-E120 VanDerWaalsContact CZ-OE2 3.27Å; Y56-E120 PolarHBondContact OH-OE2 3.44Å; Y56-I122 HydrophobicContact CD2-CD1 4.29Å; Y56-I122 HydrophobicContact CE2-CD1 4.34Å; Y56-I131 HydrophobicContact CD1-CG2 4.32Å; Y56-I131 HydrophobicContact CD2-CG1 4.19Å; Y56-I131 HydrophobicContact CE1-CG1 4.4Å; Y56-I131 HydrophobicContact CE1-CG2 3.62Å; Y56-I131 HydrophobicContact CE2-CG1 3.87Å; Y56-I131 HydrophobicContact CE2-CG2 4.43Å; Y56-A359 WeakPolarHBondContact OH-CB 3.01Å; Y56-L363 HydrophobicContact CE1-CD1 4.39Å
57	R	97.1	Very high	82.6	Confident	127 Å²	127	73.3 Å²	73.3	48%	0.479	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	119.7	168.2	-170.5	-177.5	-59.9	-175.3	1.6	109.6	Q50 A73 R74	Q50-R57 HydrophobicContact CB-CG 3.93Å; R57-A73 CarbonylContact O-C 3.53Å; R57-A73 VanDerWaalsContact O-CA 3.22Å; R57-A73 WeakPolarHBondContact O-CA 3.28Å; R57-A73 WeakPolarHBondContact O-CB 3.22Å; R57-R74 PolarHBondContact N-O 2.66Å; R57-R74 PolarHBondContact O-N 2.72Å
58	L	95.7	Very high	84.9	Confident	18 Å²	18	70 Å²	70	9%	0.094	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	130.6	-179.7	-60.2	174.2	0	0	0	110.8	P51 I53 K71 A73 I84	P51-L58 HydrophobicContact CG-CD1 4.47Å; P51-L58 WeakPolarHBondContact O-CB 3.44Å; P51-L58 VanDerWaalsContact O-CG 3.27Å; P51-L58 WeakPolarHBondContact O-CG 3.17Å; P51-L58 PolarHBondContact O-N 3.26Å; I53-L58 HydrophobicContact CG2-CD1 4.39Å; I53-L58 HydrophobicContact CG2-CD2 3.84Å; I53-L58 HydrophobicContact CG2-CG 4.18Å; L58-K71 HydrophobicContact CB-CD 3.91Å; L58-K71 HydrophobicContact CD1-CD 4.22Å; L58-K71 HydrophobicContact CD2-CB 4.48Å; L58-K71 HydrophobicContact CD2-CD 4.14Å; L58-K71 HydrophobicContact CG-CD 4.33Å; L58-A73 HydrophobicContact CD2-CB 4.13Å; L58-I84 HydrophobicContact CD2-CD1 3.95Å
59	L	93.7	Very high	87.2	Confident	50 Å²	50	69.3 Å²	69.3	26%	0.262	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-145.6	174.6	-53.8	178.1	0	0	0	109.1	K71 L72 R74	L59-K71 PolarHBondContact O-NZ 3.03Å; L59-K71 VanDerWaalsContact O-NZ 3.07Å; L59-L72 CarbonylContact C-O 3.34Å; L59-L72 WeakPolarHBondContact CA-O 3.27Å; L59-L72 HydrophobicContact CB-CB 4.34Å; L59-L72 HydrophobicContact CB-CG 4.36Å; L59-L72 WeakPolarHBondContact CB-O 3.35Å; L59-L72 HydrophobicContact CD1-CD2 4.26Å; L59-L72 HydrophobicContact CD1-CG 4.21Å; L59-L72 PolarHBondContact N-O 2.78Å; L59-R74 HydrophobicContact CD1-CB 4.42Å
60	K	90.4	Very high	89	Confident	57 Å²	57	61.7 Å²	61.7	25%	0.248	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	152.9	-175.6	64.7	173.6	178	171.9	0	114	I62 L72 E714	K60-I62 HydrophobicContact CG-CG2 4.39Å; K60-I62 PolarHBondContact O-N 3.29Å; K60-L72 PolarHBondContact O-N 3.36Å; K60-E714 VanDerWaalsContact CD-OE1 3.32Å; K60-E714 WeakPolarHBondContact CD-OE1 3.22Å; K60-E714 WeakPolarHBondContact CE-OE1 3.48Å; K60-E714 IonicContact NZ-OE1 2.89Å; K60-E714 PolarHBondContact NZ-OE1 3.4Å; K60-E714 IonicContact NZ-OE2 3.02Å; K60-E714 PolarHBondContact NZ-OE2 2.99Å
61	T	91.3	Very high	90.4	Very high	33 Å²	33	60.1 Å²	60.1	20%	0.202	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	127.8	170.3	-57.7	0	0	0	0	108.8	G63 K64 K69	T61-G63 WeakPolarHBondContact CG2-O 3.37Å; T61-K64 HydrophobicContact CG2-CG 3.84Å; T61-K69 HydrophobicContact CG2-CD 4.42Å; T61-K69 HydrophobicContact CG2-CG 3.88Å
62	I	89.9	Confident	90.8	Very high	24 Å²	24	57.1 Å²	57.1	12%	0.123	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	-9.5	-179.2	59.5	175.4	0	0	0	113.6	K60 V70 L72 A83 Y134	K60-I62 HydrophobicContact CG-CG2 4.39Å; K60-I62 PolarHBondContact O-N 3.29Å; I62-V70 HydrophobicContact CD1-CG1 3.99Å; I62-V70 HydrophobicContact CG1-CB 4.2Å; I62-V70 HydrophobicContact CG1-CG1 3.78Å; I62-V70 WeakPolarHBondContact CG1-O 3.39Å; I62-V70 PolarHBondContact N-O 3.18Å; I62-L72 HydrophobicContact CD1-CB 4.34Å; I62-L72 HydrophobicContact CG2-CB 3.76Å; I62-A83 HydrophobicContact CD1-CB 4.08Å; I62-Y134 HydrophobicContact CD1-CD2 3.85Å; I62-Y134 HydrophobicContact CD1-CE2 3.79Å
63	G	87.7	Confident	91	Very high	17 Å²	17	50.4 Å²	50.4	18%	0.175	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	150.9	169.8	0	0	0	0	0	112.1	T61 V70 I733	T61-G63 WeakPolarHBondContact CG2-O 3.37Å; G63-V70 PolarHBondContact N-O 3.39Å; G63-V70 VanDerWaalsContact N-O 3.17Å; G63-V70 PolarHBondContact O-N 3.4Å; G63-I733 CarbonylContact C-O 3.54Å; G63-I733 WeakPolarHBondContact CA-O 3.46Å
64	K	85.4	Confident	91.1	Very high	87 Å²	87	53.7 Å²	53.7	38%	0.378	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	131.7	171.8	-49.8	172.6	-175	174	0	110	T61 I733	T61-K64 HydrophobicContact CG2-CG 3.84Å; K64-I733 HydrophobicContact CG-CG2 4.35Å; K64-I733 PolarHBondContact N-O 2.88Å
65	G	76.4	Confident	91.3	Very high	48 Å²	48	51.6 Å²	51.6	50%	0.495	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	177.5	168.9	0	0	0	0	0	111.3	F67 A68	G65-F67 VanDerWaalsContact C-N 3.28Å; G65-F67 PolarHBondContact O-N 2.82Å; G65-F67 VanDerWaalsContact O-N 3.16Å; G65-A68 PolarHBondContact N-O 2.85Å; G65-A68 PolarHBondContact O-N 2.77Å; G65-A68 VanDerWaalsContact O-O 3.09Å
66	N	75.3	Confident	91.3	Very high	148 Å²	148	54.3 Å²	54.3	79%	0.791	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-33	-168.5	-62.2	0.1	0	0	0	114.8
67	F	79.6	Confident	91.1	Very high	119 Å²	119	57.2 Å²	57.2	52%	0.522	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	4.2	-175.9	-49.4	-69.9	0	0	0	113.1	G65 L92	G65-F67 VanDerWaalsContact C-N 3.28Å; G65-F67 PolarHBondContact O-N 2.82Å; G65-F67 VanDerWaalsContact O-N 3.16Å; F67-L92 HydrophobicContact CB-CD2 4.11Å; F67-L92 HydrophobicContact CD1-CD2 4.33Å; F67-L92 HydrophobicContact CG-CD2 4.26Å
68	A	88.6	Confident	91	Very high	25 Å²	25	52.2 Å²	52.2	21%	0.207	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	142.7	-171.4	0	0	0	0	0	112.3	G65 K85 I86 I87	G65-A68 PolarHBondContact N-O 2.85Å; G65-A68 PolarHBondContact O-N 2.77Å; G65-A68 VanDerWaalsContact O-O 3.09Å; A68-K85 HydrophobicContact CB-CG 4.19Å; A68-I86 CarbonylContact C-O 3.55Å; A68-I86 VanDerWaalsContact CA-O 3.29Å; A68-I86 WeakPolarHBondContact CA-O 3.2Å; A68-I87 HydrophobicContact CB-CG1 4.06Å
69	K	92.8	Very high	90.9	Very high	108 Å²	108	52.9 Å²	52.9	47%	0.47	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122.9	175.4	-173	-177.8	-62.7	171.3	0	108.7	T61 I86	T61-K69 HydrophobicContact CG2-CD 4.42Å; T61-K69 HydrophobicContact CG2-CG 3.88Å; K69-I86 PolarHBondContact N-O 3.37Å; K69-I86 WeakPolarHBondContact O-CB 3.22Å; K69-I86 PolarHBondContact O-N 3.22Å
70	V	94.7	Very high	91	Very high	35 Å²	35	53.1 Å²	53.1	21%	0.212	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.6	178.6	-168.5	0	0	0	0	109.2	I62 G63 A83 I84 K85	I62-V70 HydrophobicContact CD1-CG1 3.99Å; I62-V70 HydrophobicContact CG1-CB 4.2Å; I62-V70 HydrophobicContact CG1-CG1 3.78Å; I62-V70 WeakPolarHBondContact CG1-O 3.39Å; I62-V70 PolarHBondContact N-O 3.18Å; G63-V70 PolarHBondContact N-O 3.39Å; G63-V70 VanDerWaalsContact N-O 3.17Å; G63-V70 PolarHBondContact O-N 3.4Å; V70-A83 HydrophobicContact CG1-CB 4.19Å; V70-I84 WeakPolarHBondContact CA-O 3.32Å; V70-K85 HydrophobicContact CG2-CB 4.38Å; V70-K85 HydrophobicContact CG2-CG 4.37Å
71	K	95.9	Very high	91.3	Very high	40 Å²	40	54.2 Å²	54.2	17%	0.174	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	145.6	173.1	-82.1	-160.8	164.2	-146.3	0	111.2	L58 L59 A83 I84 I86	L58-K71 HydrophobicContact CB-CD 3.91Å; L58-K71 HydrophobicContact CD1-CD 4.22Å; L58-K71 HydrophobicContact CD2-CB 4.48Å; L58-K71 HydrophobicContact CD2-CD 4.14Å; L58-K71 HydrophobicContact CG-CD 4.33Å; L59-K71 PolarHBondContact O-NZ 3.03Å; L59-K71 VanDerWaalsContact O-NZ 3.07Å; K71-A83 CarbonylContact O-C 3.57Å; K71-A83 WeakPolarHBondContact O-CA 3.42Å; K71-I84 PolarHBondContact N-O 3Å; K71-I84 PolarHBondContact O-N 3.21Å; K71-I86 HydrophobicContact CD-CD1 4.23Å; K71-I86 HydrophobicContact CG-CD1 4.2Å
72	L	96.2	Very high	91.5	Very high	13 Å²	13	52.6 Å²	52.6	7%	0.068	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	141.4	155.9	-178.1	62.9	0	0	0	107.9	L59 K60 I62 E81 Y134	L59-L72 CarbonylContact C-O 3.34Å; L59-L72 WeakPolarHBondContact CA-O 3.27Å; L59-L72 HydrophobicContact CB-CB 4.34Å; L59-L72 HydrophobicContact CB-CG 4.36Å; L59-L72 WeakPolarHBondContact CB-O 3.35Å; L59-L72 HydrophobicContact CD1-CD2 4.26Å; L59-L72 HydrophobicContact CD1-CG 4.21Å; L59-L72 PolarHBondContact N-O 2.78Å; K60-L72 PolarHBondContact O-N 3.36Å; I62-L72 HydrophobicContact CD1-CB 4.34Å; I62-L72 HydrophobicContact CG2-CB 3.76Å; L72-E81 HydrophobicContact CD1-CB 4.09Å; L72-Y134 HydrophobicContact CD1-CD1 3.44Å; L72-Y134 VanDerWaalsContact CD1-CD1 3.44Å; L72-Y134 HydrophobicContact CD1-CD2 4.05Å; L72-Y134 HydrophobicContact CD1-CE1 3.49Å; L72-Y134 VanDerWaalsContact CD1-CE1 3.49Å; L72-Y134 HydrophobicContact CD1-CE2 4.13Å; L72-Y134 HydrophobicContact CD1-CG 3.73Å; L72-Y134 HydrophobicContact CD2-CE1 4.38Å
73	A	97.4	Very high	91.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	162.5	173	0	0	0	0	0	110.3	R57 L58 E81 V82 I84	R57-A73 CarbonylContact O-C 3.53Å; R57-A73 VanDerWaalsContact O-CA 3.22Å; R57-A73 WeakPolarHBondContact O-CA 3.28Å; R57-A73 WeakPolarHBondContact O-CB 3.22Å; L58-A73 HydrophobicContact CD2-CB 4.13Å; A73-E81 WeakPolarHBondContact O-CA 3.27Å; A73-V82 HydrophobicContact CB-CG2 4Å; A73-V82 PolarHBondContact N-O 3.04Å; A73-V82 PolarHBondContact O-N 3.28Å; A73-I84 HydrophobicContact CB-CD1 3.52Å; A73-I84 HydrophobicContact CB-CG1 3.88Å
74	R	97.1	Very high	92.4	Very high	97 Å²	97	51 Å²	51	37%	0.366	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124.7	171.6	-167.4	176.1	-56.8	-67.8	-8.5	109.8	Y56 R57 L59 G79 R80 E81	Y56-R74 WeakPolarHBondContact CA-O 3.12Å; R57-R74 PolarHBondContact N-O 2.66Å; R57-R74 PolarHBondContact O-N 2.72Å; L59-R74 HydrophobicContact CD1-CB 4.42Å; R74-G79 WeakPolarHBondContact CD-O 3.22Å; R74-G79 VanDerWaalsContact CG-O 3.23Å; R74-G79 WeakPolarHBondContact CG-O 3.41Å; R74-G79 PolarHBondContact NH1-O 2.59Å; R74-R80 CarbonylContact C-O 3.57Å; R74-R80 WeakPolarHBondContact CA-O 3.4Å; R74-E81 IonicContact CZ-OE1 2.66Å; R74-E81 VanDerWaalsContact NH1-CG 3.27Å; R74-E81 IonicContact NH1-OE1 2.8Å; R74-E81 PolarHBondContact NH1-OE1 3.34Å; R74-E81 IonicContact NH2-OE1 3.31Å; R74-E81 PolarHBondContact NH2-OE1 2.79Å
75	H	97.4	Very high	92.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	128.4	169.6	-172.6	-124.2	0	0	0	109.4	N55 Y56 T78 G79 R80 T360 L363	N55-H75 WeakPolarHBondContact CB-NE2 3.34Å; N55-H75 CarbonylContact O-C 3.33Å; N55-H75 WeakPolarHBondContact O-CA 3.37Å; N55-H75 PolarHBondContact O-CD2 2.9Å; Y56-H75 HydrophobicContact CD1-CB 3.83Å; Y56-H75 AromaticContact CD1-CD2 3.78Å; Y56-H75 HydrophobicContact CE1-CB 3.65Å; Y56-H75 AromaticContact CE1-CD2 3.33Å; Y56-H75 WeakPolarHBondContact CE1-CD2 3.14Å; Y56-H75 AromaticContact CE1-CG 3.73Å; Y56-H75 AromaticContact CZ-CD2 3.48Å; Y56-H75 VanDerWaalsContact CZ-CD2 3.48Å; H75-T78 PolarHBondContact ND1-OG1 3.18Å; H75-G79 VanDerWaalsContact O-CA 3.24Å; H75-G79 WeakPolarHBondContact O-CA 3.43Å; H75-G79 PolarHBondContact O-N 2.97Å; H75-R80 PolarHBondContact N-O 3.21Å; H75-T360 PolarHBondContact CE1-OG1 3.08Å; H75-T360 VanDerWaalsContact CE1-OG1 3.31Å; H75-L363 HydrophobicContact CB-CD1 3.85Å
76	I	96	Very high	93.8	Very high	94 Å²	94	47 Å²	47	48%	0.482	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-45.6	-168.9	-66	168	0	0	0	110.5	N55 T78	N55-I76 WeakPolarHBondContact O-CB 3.23Å; N55-I76 VanDerWaalsContact O-CG1 3.31Å; N55-I76 WeakPolarHBondContact O-CG1 3.24Å; N55-I76 PolarHBondContact O-N 2.95Å; I76-T78 PolarHBondContact O-N 3.2Å
77	L	94.5	Very high	94.7	Very high	62 Å²	62	40.2 Å²	40.2	33%	0.325	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-31.2	-174.7	-52.9	177.8	0	0	0	113.5	M338 Y340	L77-M338 HydrophobicContact CB-CE 4.29Å; L77-M338 HydrophobicContact CB-SD 4.06Å; L77-M338 VanDerWaalsContact O-CE 3.27Å; L77-M338 WeakPolarHBondContact O-CE 3.43Å; L77-Y340 HydrophobicContact CD1-CE2 4.08Å; L77-Y340 WeakPolarHBondContact CD1-OH 3.43Å
78	T	95.3	Very high	95.4	Very high	22 Å²	22	36.9 Å²	36.9	14%	0.135	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115	-0.7	-174.3	66.3	0	0	0	0	114.2	H75 I76 R80 M338 T360 L363 L364	H75-T78 PolarHBondContact ND1-OG1 3.18Å; I76-T78 PolarHBondContact O-N 3.2Å; T78-R80 WeakPolarHBondContact O-CD 3.31Å; T78-R80 WeakPolarHBondContact O-CG 3.34Å; T78-R80 PolarHBondContact O-N 3.44Å; T78-M338 HydrophobicContact CG2-CE 4.47Å; T78-T360 HydrophobicContact CG2-CG2 4.03Å; T78-L363 HydrophobicContact CG2-CB 4.38Å; T78-L364 HydrophobicContact CG2-CD2 3.78Å; T78-L364 HydrophobicContact CG2-CG 3.85Å
79	G	94.1	Very high	95.6	Very high	31 Å²	31	37.4 Å²	37.4	32%	0.32	19%	0.185	S	C	.	.			trans	65.8	0.2	-178.4	0	0	0	0	0	115.8	R74 H75	R74-G79 WeakPolarHBondContact CD-O 3.22Å; R74-G79 VanDerWaalsContact CG-O 3.23Å; R74-G79 WeakPolarHBondContact CG-O 3.41Å; R74-G79 PolarHBondContact NH1-O 2.59Å; H75-G79 VanDerWaalsContact O-CA 3.24Å; H75-G79 WeakPolarHBondContact O-CA 3.43Å; H75-G79 PolarHBondContact O-N 2.97Å
80	R	94.4	Very high	95.5	Very high	56 Å²	56	36.7 Å²	36.7	21%	0.211	19%	0.19	C	C	.	.			trans	-79.1	146.4	-169	-59.7	-43.4	-175.1	92.3	9.2	113.4	R74 H75 T78 L363 R366 K367	R74-R80 CarbonylContact C-O 3.57Å; R74-R80 WeakPolarHBondContact CA-O 3.4Å; H75-R80 PolarHBondContact N-O 3.21Å; T78-R80 WeakPolarHBondContact O-CD 3.31Å; T78-R80 WeakPolarHBondContact O-CG 3.34Å; T78-R80 PolarHBondContact O-N 3.44Å; R80-L363 HydrophobicContact CB-CD2 4.23Å; R80-R366 VanDerWaalsContact CZ-O 3.27Å; R80-R366 PolarHBondContact NH1-O 3.02Å; R80-R366 PolarHBondContact NH2-O 3.27Å; R80-K367 PolarHBondContact NH1-O 3.39Å
81	E	96.4	Very high	95.1	Very high	79 Å²	79	40.9 Å²	40.9	37%	0.369	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	135.7	174.5	-62.4	-164.9	173.4	0	0	111.6	L72 A73 R74 Y134	L72-E81 HydrophobicContact CD1-CB 4.09Å; A73-E81 WeakPolarHBondContact O-CA 3.27Å; R74-E81 IonicContact CZ-OE1 2.66Å; R74-E81 VanDerWaalsContact NH1-CG 3.27Å; R74-E81 IonicContact NH1-OE1 2.8Å; R74-E81 PolarHBondContact NH1-OE1 3.34Å; R74-E81 IonicContact NH2-OE1 3.31Å; R74-E81 PolarHBondContact NH2-OE1 2.79Å; E81-Y134 HydrophobicContact CB-CD1 4.03Å; E81-Y134 WeakPolarHBondContact OE2-CE1 3.21Å
82	V	97.5	Very high	94.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	155.4	-178.8	-62	0	0	0	0	110.5	Y56 A73 I84 F119 I131 M132 L363	Y56-V82 HydrophobicContact CD1-CG2 3.62Å; Y56-V82 HydrophobicContact CE1-CG1 4.42Å; Y56-V82 HydrophobicContact CE1-CG2 3.86Å; A73-V82 HydrophobicContact CB-CG2 4Å; A73-V82 PolarHBondContact N-O 3.04Å; A73-V82 PolarHBondContact O-N 3.28Å; V82-I84 HydrophobicContact CG2-CD1 4.38Å; V82-I84 HydrophobicContact CG2-CG1 4.1Å; V82-F119 HydrophobicContact CG1-CD2 3.99Å; V82-F119 HydrophobicContact CG1-CE2 4.03Å; V82-I131 HydrophobicContact CB-CG2 3.94Å; V82-I131 HydrophobicContact CG1-CG2 4.17Å; V82-I131 HydrophobicContact CG2-CG2 3.87Å; V82-M132 WeakPolarHBondContact CA-O 3.36Å; V82-M132 WeakPolarHBondContact CB-O 3.37Å; V82-L363 HydrophobicContact CG1-CD1 4.33Å; V82-L363 HydrophobicContact CG1-CD2 3.82Å
83	A	97.7	Very high	94.4	Very high	7 Å²	7	43.8 Å²	43.8	6%	0.058	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	121.8	171.5	0	0	0	0	0	109.3	I62 V70 K71 M132	I62-A83 HydrophobicContact CD1-CB 4.08Å; V70-A83 HydrophobicContact CG1-CB 4.19Å; K71-A83 CarbonylContact O-C 3.57Å; K71-A83 WeakPolarHBondContact O-CA 3.42Å; A83-M132 HydrophobicContact CB-CE 4.23Å; A83-M132 PolarHBondContact N-O 2.81Å; A83-M132 WeakPolarHBondContact O-CB 3.28Å; A83-M132 PolarHBondContact O-N 3Å
84	I	97.6	Very high	94	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	112.3	178.7	-53.1	-171.1	0	0	0	109.2	I53 Y56 L58 V70 K71 A73 V82 I86 Y129 L130 I131	I53-I84 HydrophobicContact CG2-CD1 4.21Å; Y56-I84 HydrophobicContact CD1-CD1 4.32Å; Y56-I84 HydrophobicContact CG-CD1 3.95Å; L58-I84 HydrophobicContact CD2-CD1 3.95Å; V70-I84 WeakPolarHBondContact CA-O 3.32Å; K71-I84 PolarHBondContact N-O 3Å; K71-I84 PolarHBondContact O-N 3.21Å; A73-I84 HydrophobicContact CB-CD1 3.52Å; A73-I84 HydrophobicContact CB-CG1 3.88Å; V82-I84 HydrophobicContact CG2-CD1 4.38Å; V82-I84 HydrophobicContact CG2-CG1 4.1Å; I84-I86 HydrophobicContact CG2-CG1 4.04Å; I84-I86 PolarHBondContact O-N 3.1Å; I84-Y129 HydrophobicContact CG2-CD1 4.04Å; I84-L130 CarbonylContact C-O 3.19Å; I84-L130 WeakPolarHBondContact CA-O 3.39Å; I84-I131 HydrophobicContact CD1-CG1 4.04Å; I84-I131 HydrophobicContact CG1-CG1 4.1Å; I84-I131 HydrophobicContact CG2-CD1 4.35Å
85	K	96.1	Very high	93.5	Very high	18 Å²	18	47.6 Å²	47.6	8%	0.078	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	104.7	172.2	-177.4	177.3	168.9	-179.7	0	107.7	A68 V70 I87 E103 L130 M132 D196	A68-K85 HydrophobicContact CB-CG 4.19Å; V70-K85 HydrophobicContact CG2-CB 4.38Å; V70-K85 HydrophobicContact CG2-CG 4.37Å; K85-I87 HydrophobicContact CD-CD1 4.19Å; K85-I87 HydrophobicContact CG-CD1 4Å; K85-I87 HydrophobicContact CG-CG1 4Å; K85-E103 IonicContact NZ-OE1 2.68Å; K85-E103 PolarHBondContact NZ-OE1 2.94Å; K85-E103 IonicContact NZ-OE2 2.76Å; K85-E103 PolarHBondContact NZ-OE2 3.01Å; K85-L130 HydrophobicContact CB-CB 4.34Å; K85-L130 PolarHBondContact N-O 3.43Å; K85-L130 PolarHBondContact O-N 3.17Å; K85-M132 HydrophobicContact CB-CE 3.7Å; K85-M132 HydrophobicContact CB-SD 4.23Å; K85-D196 IonicContact NZ-OD1 3.16Å; K85-D196 PolarHBondContact NZ-OD1 2.82Å
86	I	95.7	Very high	92.9	Very high	32 Å²	32	49 Å²	49	16%	0.164	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	124.2	-178.8	-48.5	177.4	0	0	0	108.4	A68 K69 K71 I84 T127 Y129	A68-I86 CarbonylContact C-O 3.55Å; A68-I86 VanDerWaalsContact CA-O 3.29Å; A68-I86 WeakPolarHBondContact CA-O 3.2Å; K69-I86 PolarHBondContact N-O 3.37Å; K69-I86 WeakPolarHBondContact O-CB 3.22Å; K69-I86 PolarHBondContact O-N 3.22Å; K71-I86 HydrophobicContact CD-CD1 4.23Å; K71-I86 HydrophobicContact CG-CD1 4.2Å; I84-I86 HydrophobicContact CG2-CG1 4.04Å; I84-I86 PolarHBondContact O-N 3.1Å; I86-T127 HydrophobicContact CG2-CG2 3.68Å; I86-Y129 HydrophobicContact CB-CD1 4.32Å; I86-Y129 HydrophobicContact CB-CE1 4.4Å; I86-Y129 HydrophobicContact CD1-CD1 4.45Å; I86-Y129 HydrophobicContact CD1-CE1 4.25Å; I86-Y129 HydrophobicContact CG1-CD1 3.87Å; I86-Y129 HydrophobicContact CG1-CE1 4.07Å; I86-Y129 HydrophobicContact CG2-CD1 3.96Å; I86-Y129 HydrophobicContact CG2-CE1 3.65Å
87	I	94.5	Very high	92.6	Very high	7 Å²	7	47.1 Å²	47.1	4%	0.036	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.3	-170.5	-52.4	171.5	0	0	0	109.1	A68 K85 K89 L92 L100 T127 L128 L130	A68-I87 HydrophobicContact CB-CG1 4.06Å; K85-I87 HydrophobicContact CD-CD1 4.19Å; K85-I87 HydrophobicContact CG-CD1 4Å; K85-I87 HydrophobicContact CG-CG1 4Å; I87-K89 PolarHBondContact O-N 2.81Å; I87-L92 HydrophobicContact CG2-CD1 4.14Å; I87-L100 HydrophobicContact CD1-CD1 3.45Å; I87-L100 VanDerWaalsContact CD1-CD1 3.45Å; I87-L100 HydrophobicContact CG2-CD2 3.9Å; I87-T127 WeakPolarHBondContact O-CA 3.21Å; I87-T127 WeakPolarHBondContact O-CG2 3.22Å; I87-L128 PolarHBondContact N-O 3.25Å; I87-L128 PolarHBondContact O-N 3.4Å; I87-L130 HydrophobicContact CD1-CD1 4.1Å; I87-L130 HydrophobicContact CD1-CG 4.37Å
88	D	92.9	Very high	92.2	Very high	48 Å²	48	50.5 Å²	50.5	26%	0.257	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	112.2	178.4	-177.3	-15.7	0	0	0	109.9	T90 Q91	D88-T90 VanDerWaalsContact C-N 3.29Å; D88-T90 PolarHBondContact O-N 2.9Å; D88-T90 WeakPolarHBondContact OD1-CA 3.32Å; D88-T90 WeakPolarHBondContact OD1-CB 3.15Å; D88-T90 PolarHBondContact OD1-N 3.47Å; D88-T90 PolarHBondContact OD1-OG1 3.26Å; D88-T90 PolarHBondContact OD2-OG1 2.9Å; D88-Q91 HydrophobicContact CB-CG 4.4Å; D88-Q91 PolarHBondContact OD2-NE2 3.04Å
89	K	92.6	Very high	91.9	Very high	36 Å²	36	52.9 Å²	52.9	16%	0.157	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-70.2	-25.9	-179.5	-66.5	-171.7	-71.6	168.5	0	112.3	I87 Q91 L92 L97 E123 T124 E125 K126 L128	I87-K89 PolarHBondContact O-N 2.81Å; K89-Q91 PolarHBondContact O-N 3.02Å; K89-L92 PolarHBondContact O-N 2.88Å; K89-L97 HydrophobicContact CB-CD1 4.39Å; K89-L97 HydrophobicContact CD-CD1 4.33Å; K89-L97 HydrophobicContact CG-CD1 4.32Å; K89-E123 IonicContact NZ-OE1 2.91Å; K89-E123 PolarHBondContact NZ-OE1 3.18Å; K89-T124 WeakPolarHBondContact CE-O 3.17Å; K89-T124 PolarHBondContact NZ-O 3.15Å; K89-E125 WeakPolarHBondContact CE-O 3.49Å; K89-E125 PolarHBondContact NZ-O 3.02Å; K89-K126 WeakPolarHBondContact CB-O 3.41Å; K89-K126 PolarHBondContact N-O 2.73Å; K89-L128 HydrophobicContact CG-CB 4.49Å
90	T	91.1	Very high	91.7	Very high	93 Å²	93	51.8 Å²	51.8	57%	0.571	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-69.6	-21.9	-178.3	73.1	0	0	0	0	112.6	D88 K126	D88-T90 VanDerWaalsContact C-N 3.29Å; D88-T90 PolarHBondContact O-N 2.9Å; D88-T90 WeakPolarHBondContact OD1-CA 3.32Å; D88-T90 WeakPolarHBondContact OD1-CB 3.15Å; D88-T90 PolarHBondContact OD1-N 3.47Å; D88-T90 PolarHBondContact OD1-OG1 3.26Å; D88-T90 PolarHBondContact OD2-OG1 2.9Å; T90-K126 HydrophobicContact CG2-CB 3.92Å; T90-K126 HydrophobicContact CG2-CD 4.47Å; T90-K126 HydrophobicContact CG2-CG 3.8Å
91	Q	87.6	Confident	91.5	Very high	123 Å²	123	53.6 Å²	53.6	58%	0.575	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-90.4	0.9	176.7	-61.4	-175.6	52.8	0	0	113.3	D88 K89	D88-Q91 HydrophobicContact CB-CG 4.4Å; D88-Q91 PolarHBondContact OD2-NE2 3.04Å; K89-Q91 PolarHBondContact O-N 3.02Å
92	L	87.4	Confident	91.4	Very high	29 Å²	29	52.1 Å²	52.1	15%	0.152	27%	0.271	C	S	.	.			trans	-101.3	130	-178.2	-56.7	-176.3	0	0	0	111.8	F67 I87 K89 L97 L100	F67-L92 HydrophobicContact CB-CD2 4.11Å; F67-L92 HydrophobicContact CD1-CD2 4.33Å; F67-L92 HydrophobicContact CG-CD2 4.26Å; I87-L92 HydrophobicContact CG2-CD1 4.14Å; K89-L92 PolarHBondContact O-N 2.88Å; L92-L97 HydrophobicContact CD1-CD1 4.47Å; L92-L100 HydrophobicContact CD1-CD2 3.73Å
93	N	88.8	Confident	91.2	Very high	85 Å²	85	52.6 Å²	52.6	46%	0.455	27%	0.273	S	S	.	.			trans	-71	161.1	163.5	64.7	73.3	0	0	0	110.7	T95 S96 L97	N93-T95 VanDerWaalsContact C-N 3.26Å; N93-T95 PolarHBondContact O-N 2.95Å; N93-T95 VanDerWaalsContact O-N 3.14Å; N93-T95 WeakPolarHBondContact OD1-CB 3.45Å; N93-T95 PolarHBondContact OD1-N 3.37Å; N93-T95 VanDerWaalsContact OD1-N 3.15Å; N93-S96 PolarHBondContact ND2-OG 3.16Å; N93-S96 WeakPolarHBondContact O-CA 3.43Å; N93-S96 WeakPolarHBondContact O-CB 3.41Å; N93-S96 PolarHBondContact O-N 2.92Å; N93-S96 PolarHBondContact OD1-N 3.31Å; N93-L97 PolarHBondContact O-N 3.27Å
94	P	88.5	Confident	91.1	Very high	98 Å²	98	53 Å²	53	64%	0.636	28%	0.275	S	S	*	.	H	α-helix	trans	-54.3	-36	-177.4	-29.4	36.6	0	0	0	114.7	L97 Q98	P94-L97 WeakPolarHBondContact O-CB 3.35Å; P94-L97 PolarHBondContact O-N 3.49Å; P94-Q98 WeakPolarHBondContact O-CG 3.4Å; P94-Q98 PolarHBondContact O-N 2.69Å
95	T	86.9	Confident	91	Very high	80 Å²	80	59.8 Å²	59.8	49%	0.491	30%	0.3	S	S	.	.	H	α-helix	trans	-69.4	-34.4	177.6	-45.5	0	0	0	0	112.2	N93 K99	N93-T95 VanDerWaalsContact C-N 3.26Å; N93-T95 PolarHBondContact O-N 2.95Å; N93-T95 VanDerWaalsContact O-N 3.14Å; N93-T95 WeakPolarHBondContact OD1-CB 3.45Å; N93-T95 PolarHBondContact OD1-N 3.37Å; N93-T95 VanDerWaalsContact OD1-N 3.15Å; T95-K99 VanDerWaalsContact O-CG 3.31Å; T95-K99 WeakPolarHBondContact O-CG 3.46Å; T95-K99 PolarHBondContact O-N 3.4Å
96	S	86.3	Confident	91	Very high	28 Å²	28	58.9 Å²	58.9	20%	0.196	30%	0.297	C	S	.	.	H	α-helix	trans	-71.6	-36.2	170.7	-68.5	0	0	0	0	112.1	N93 K99 L100	N93-S96 PolarHBondContact ND2-OG 3.16Å; N93-S96 WeakPolarHBondContact O-CA 3.43Å; N93-S96 WeakPolarHBondContact O-CB 3.41Å; N93-S96 PolarHBondContact O-N 2.92Å; N93-S96 PolarHBondContact OD1-N 3.31Å; S96-K99 PolarHBondContact O-N 2.75Å; S96-L100 PolarHBondContact O-N 3.15Å
97	L	87.8	Confident	91	Very high	56 Å²	56	57.9 Å²	57.9	29%	0.293	29%	0.291	S	S	.	.	H	α-helix	trans	-63.1	-42.7	174.3	-163.5	82.9	0	0	0	111.6	K89 L92 N93 P94 L100 F101	K89-L97 HydrophobicContact CB-CD1 4.39Å; K89-L97 HydrophobicContact CD-CD1 4.33Å; K89-L97 HydrophobicContact CG-CD1 4.32Å; L92-L97 HydrophobicContact CD1-CD1 4.47Å; N93-L97 PolarHBondContact O-N 3.27Å; P94-L97 WeakPolarHBondContact O-CB 3.35Å; P94-L97 PolarHBondContact O-N 3.49Å; L97-L100 WeakPolarHBondContact O-CB 3.38Å; L97-L100 PolarHBondContact O-N 3.05Å; L97-F101 HydrophobicContact CD1-CE2 4.37Å; L97-F101 HydrophobicContact CD2-CE2 3.86Å; L97-F101 HydrophobicContact CG-CD2 4.17Å; L97-F101 HydrophobicContact CG-CE2 3.73Å; L97-F101 WeakPolarHBondContact O-CD2 3.44Å; L97-F101 PolarHBondContact O-N 3.32Å
98	Q	87.6	Confident	91.1	Very high	133 Å²	133	61 Å²	61	62%	0.621	30%	0.304	S	S	*	.	H	α-helix	trans	-62.4	-40.9	173.3	-74.1	177	-6.1	0	0	112.7	P94 L100 R102	P94-Q98 WeakPolarHBondContact O-CG 3.4Å; P94-Q98 PolarHBondContact O-N 2.69Å; Q98-L100 VanDerWaalsContact C-N 3.31Å; Q98-L100 PolarHBondContact O-N 3.06Å; Q98-R102 PolarHBondContact O-N 3.46Å; Q98-R102 VanDerWaalsContact O-N 3.08Å
99	K	87.5	Confident	91.2	Very high	72 Å²	72	62.3 Å²	62.3	31%	0.313	31%	0.311	S	S	.	.	H	α-helix	trans	-61.4	-40.3	173.4	-71.7	167.4	-174.5	173	0	111.4	T95 S96 R102 E103	T95-K99 VanDerWaalsContact O-CG 3.31Å; T95-K99 WeakPolarHBondContact O-CG 3.46Å; T95-K99 PolarHBondContact O-N 3.4Å; S96-K99 PolarHBondContact O-N 2.75Å; K99-R102 PolarHBondContact O-N 3.31Å; K99-E103 PolarHBondContact O-N 3.23Å
100	L	90.1	Very high	91.4	Very high	8 Å²	8	60.8 Å²	60.8	4%	0.042	31%	0.305	C	S	.	.	H	α-helix	trans	-64	-49	177.9	179.1	58.1	0	0	0	112.4	I87 L92 S96 L97 Q98 R102 E103 V104 L128	I87-L100 HydrophobicContact CD1-CD1 3.45Å; I87-L100 VanDerWaalsContact CD1-CD1 3.45Å; I87-L100 HydrophobicContact CG2-CD2 3.9Å; L92-L100 HydrophobicContact CD1-CD2 3.73Å; S96-L100 PolarHBondContact O-N 3.15Å; L97-L100 WeakPolarHBondContact O-CB 3.38Å; L97-L100 PolarHBondContact O-N 3.05Å; Q98-L100 VanDerWaalsContact C-N 3.31Å; Q98-L100 PolarHBondContact O-N 3.06Å; L100-R102 PolarHBondContact O-N 3.35Å; L100-E103 WeakPolarHBondContact O-CB 3.4Å; L100-E103 PolarHBondContact O-N 2.75Å; L100-E103 VanDerWaalsContact O-N 3.11Å; L100-V104 WeakPolarHBondContact O-CG2 3.36Å; L100-V104 PolarHBondContact O-N 3.01Å; L100-L128 HydrophobicContact CD1-CD2 3.98Å; L100-L128 HydrophobicContact CD2-CB 4.48Å; L100-L128 HydrophobicContact CD2-CD2 3.72Å; L100-L128 HydrophobicContact CG-CD2 3.8Å
101	F	91.3	Very high	91.6	Very high	94 Å²	94	57.7 Å²	57.7	41%	0.412	28%	0.284	S	S	.	.	H	α-helix	trans	-62.8	-31	176.2	-72	-56	0	0	0	112.7	L97 R105	L97-F101 HydrophobicContact CD1-CE2 4.37Å; L97-F101 HydrophobicContact CD2-CE2 3.86Å; L97-F101 HydrophobicContact CG-CD2 4.17Å; L97-F101 HydrophobicContact CG-CE2 3.73Å; L97-F101 WeakPolarHBondContact O-CD2 3.44Å; L97-F101 PolarHBondContact O-N 3.32Å; F101-R105 PolarHBondContact O-N 3.47Å
102	R	93.5	Very high	92	Very high	47 Å²	47	52.2 Å²	52.2	18%	0.177	26%	0.259	C	S	.	.	H	α-helix	trans	-70.7	-40.3	171.3	-169.5	179.7	63.2	-128.3	-5	112.6	Q98 K99 L100 V104 R105 I106 S200 N201	Q98-R102 PolarHBondContact O-N 3.46Å; Q98-R102 VanDerWaalsContact O-N 3.08Å; K99-R102 PolarHBondContact O-N 3.31Å; L100-R102 PolarHBondContact O-N 3.35Å; R102-V104 VanDerWaalsContact C-N 3.32Å; R102-V104 PolarHBondContact O-N 3.15Å; R102-R105 PolarHBondContact O-N 2.91Å; R102-I106 HydrophobicContact CG-CD1 3.79Å; R102-I106 HydrophobicContact CG-CG1 4.32Å; R102-I106 WeakPolarHBondContact O-CB 3.48Å; R102-I106 WeakPolarHBondContact O-CG1 3.33Å; R102-I106 PolarHBondContact O-N 3.42Å; R102-S200 PolarHBondContact NE-O 3.46Å; R102-S200 PolarHBondContact NH2-O 2.81Å; R102-N201 WeakPolarHBondContact CD-OD1 3.31Å; R102-N201 PolarHBondContact NE-OD1 3.38Å; R102-N201 PolarHBondContact NH1-OD1 3.49Å
103	E	93.6	Very high	92.5	Very high	10 Å²	10	54.2 Å²	54.2	5%	0.047	27%	0.274	C	S	.	.	H	α-helix	trans	-55.4	-49.1	172	177.8	173.3	-163.1	0	0	110.2	K85 K99 L100 R105 I106 M107 F197 G198	K85-E103 IonicContact NZ-OE1 2.68Å; K85-E103 PolarHBondContact NZ-OE1 2.94Å; K85-E103 IonicContact NZ-OE2 2.76Å; K85-E103 PolarHBondContact NZ-OE2 3.01Å; K99-E103 PolarHBondContact O-N 3.23Å; L100-E103 WeakPolarHBondContact O-CB 3.4Å; L100-E103 PolarHBondContact O-N 2.75Å; L100-E103 VanDerWaalsContact O-N 3.11Å; E103-R105 PolarHBondContact O-N 2.97Å; E103-I106 PolarHBondContact O-N 3.48Å; E103-M107 HydrophobicContact CG-CG 4.39Å; E103-M107 HydrophobicContact CG-SD 4.07Å; E103-M107 WeakPolarHBondContact O-CB 3.43Å; E103-M107 VanDerWaalsContact O-CG 3.31Å; E103-M107 WeakPolarHBondContact O-CG 3.33Å; E103-M107 PolarHBondContact O-N 3.07Å; E103-F197 HydrophobicContact CG-CB 4.07Å; E103-F197 PolarHBondContact OE1-N 2.65Å; E103-G198 VanDerWaalsContact CD-N 3.32Å; E103-G198 PolarHBondContact OE1-N 2.87Å; E103-G198 WeakPolarHBondContact OE2-CA 3.48Å
104	V	94.9	Very high	93	Very high	17 Å²	17	51 Å²	51	10%	0.103	26%	0.256	C	S	.	.	H	α-helix	trans	-58.7	-48.2	176.9	176.9	0	0	0	0	111.8	L100 R102 I106 M107 K108 V121 L128 L130	L100-V104 WeakPolarHBondContact O-CG2 3.36Å; L100-V104 PolarHBondContact O-N 3.01Å; R102-V104 VanDerWaalsContact C-N 3.32Å; R102-V104 PolarHBondContact O-N 3.15Å; V104-I106 PolarHBondContact O-N 2.87Å; V104-M107 PolarHBondContact O-N 2.86Å; V104-K108 WeakPolarHBondContact O-CG 3.39Å; V104-K108 PolarHBondContact O-N 3.07Å; V104-V121 HydrophobicContact CG1-CG1 4.46Å; V104-V121 HydrophobicContact CG1-CG2 3.98Å; V104-L128 HydrophobicContact CG2-CD2 3.98Å; V104-L130 HydrophobicContact CG2-CD1 4.18Å; V104-L130 HydrophobicContact CG2-CD2 3.66Å
105	R	95.9	Very high	93.4	Very high	141 Å²	141	46.5 Å²	46.5	53%	0.532	23%	0.227	S	C	.	.	H	α-helix	trans	-58.2	-47.8	178.1	-174.7	-163.3	-64	164.4	-5.7	111.6	F101 R102 E103 K108 I109 E202	F101-R105 PolarHBondContact O-N 3.47Å; R102-R105 PolarHBondContact O-N 2.91Å; E103-R105 PolarHBondContact O-N 2.97Å; R105-K108 PolarHBondContact O-N 3.49Å; R105-I109 PolarHBondContact O-N 2.76Å; R105-E202 WeakPolarHBondContact CD-OE1 3.33Å; R105-E202 IonicContact CZ-OE1 2.74Å; R105-E202 IonicContact NE-OE1 2.75Å; R105-E202 IonicContact NH1-OE1 2.81Å; R105-E202 PolarHBondContact NH1-OE1 3.21Å; R105-E202 IonicContact NH1-OE2 3.32Å
106	I	96.6	Very high	93.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.3	-43.9	-179.9	-76.2	174.5	0	0	0	110.3	R102 E103 V104 K108 I109 L110 I174 F197 S200 E202	R102-I106 HydrophobicContact CG-CD1 3.79Å; R102-I106 HydrophobicContact CG-CG1 4.32Å; R102-I106 WeakPolarHBondContact O-CB 3.48Å; R102-I106 WeakPolarHBondContact O-CG1 3.33Å; R102-I106 PolarHBondContact O-N 3.42Å; E103-I106 PolarHBondContact O-N 3.48Å; V104-I106 PolarHBondContact O-N 2.87Å; I106-K108 VanDerWaalsContact C-N 3.31Å; I106-K108 PolarHBondContact O-N 3.17Å; I106-I109 WeakPolarHBondContact O-CG1 3.21Å; I106-I109 PolarHBondContact O-N 2.77Å; I106-I109 VanDerWaalsContact O-N 3.16Å; I106-L110 HydrophobicContact CG2-CD1 3.55Å; I106-L110 HydrophobicContact CG2-CG 4.3Å; I106-L110 VanDerWaalsContact O-CG 3.32Å; I106-L110 WeakPolarHBondContact O-CG 3.16Å; I106-L110 PolarHBondContact O-N 2.89Å; I106-I174 HydrophobicContact CD1-CG1 4.49Å; I106-I174 HydrophobicContact CD1-CG2 4.23Å; I106-I174 HydrophobicContact CG1-CG1 4.28Å; I106-I174 HydrophobicContact CG2-CD1 4.16Å; I106-I174 HydrophobicContact CG2-CG1 4.44Å; I106-I174 HydrophobicContact CG2-CG2 3.89Å; I106-F197 HydrophobicContact CG2-CB 4.42Å; I106-F197 HydrophobicContact CG2-CD1 3.74Å; I106-F197 HydrophobicContact CG2-CE1 4.44Å; I106-F197 HydrophobicContact CG2-CG 4.33Å; I106-S200 VanDerWaalsContact CD1-OG 3.24Å; I106-S200 WeakPolarHBondContact CD1-OG 3.45Å; I106-E202 HydrophobicContact CD1-CG 4.49Å
107	M	96.1	Very high	94.4	Very high	11 Å²	11	43.4 Å²	43.4	5%	0.054	20%	0.204	C	C	.	.	H	α-helix	trans	-64.9	-29.8	175.6	-70.5	-171.7	73.1	0	0	113.7	E103 V104 I109 L118 L130 M132 F197	E103-M107 HydrophobicContact CG-CG 4.39Å; E103-M107 HydrophobicContact CG-SD 4.07Å; E103-M107 WeakPolarHBondContact O-CB 3.43Å; E103-M107 VanDerWaalsContact O-CG 3.31Å; E103-M107 WeakPolarHBondContact O-CG 3.33Å; E103-M107 PolarHBondContact O-N 3.07Å; V104-M107 PolarHBondContact O-N 2.86Å; M107-I109 VanDerWaalsContact C-N 3.28Å; M107-I109 PolarHBondContact O-N 2.7Å; M107-L118 HydrophobicContact CB-CB 4.28Å; M107-L118 HydrophobicContact CB-CD2 4.08Å; M107-L118 HydrophobicContact CE-CB 4.27Å; M107-L118 HydrophobicContact CE-CD1 4.21Å; M107-L130 HydrophobicContact SD-CD1 4.44Å; M107-M132 HydrophobicContact CE-CG 4.03Å; M107-M132 HydrophobicContact CE-SD 3.71Å; M107-F197 HydrophobicContact CG-CB 4.39Å
108	K	95.6	Very high	94.9	Very high	71 Å²	71	40.8 Å²	40.8	31%	0.309	19%	0.19	S	C	.	.	H	α-helix	trans	-71	-16.8	174.1	-74.7	-164.9	176.4	-161.5	0	114.3	V104 R105 I106 L118 K353 Y354	V104-K108 WeakPolarHBondContact O-CG 3.39Å; V104-K108 PolarHBondContact O-N 3.07Å; R105-K108 PolarHBondContact O-N 3.49Å; I106-K108 VanDerWaalsContact C-N 3.31Å; I106-K108 PolarHBondContact O-N 3.17Å; K108-L118 HydrophobicContact CG-CD2 3.73Å; K108-K353 PolarHBondContact NZ-O 3.41Å; K108-Y354 HydrophobicContact CB-CD2 4.24Å; K108-Y354 HydrophobicContact CB-CE2 3.71Å; K108-Y354 HydrophobicContact CD-CD2 3.46Å; K108-Y354 VanDerWaalsContact CD-CD2 3.46Å; K108-Y354 HydrophobicContact CD-CE2 3.83Å; K108-Y354 HydrophobicContact CD-CG 4.16Å; K108-Y354 HydrophobicContact CG-CD2 3.56Å; K108-Y354 HydrophobicContact CG-CE2 3.54Å; K108-Y354 HydrophobicContact CG-CG 4.09Å; K108-Y354 PolarHBondContact O-OH 2.63Å
109	I	95.2	Very high	95.3	Very high	76 Å²	76	34.6 Å²	34.6	39%	0.39	16%	0.161	S	C	.	.	H	α-helix	trans	-114.4	2.5	-178.4	65.6	174.9	0	0	0	114.3	R105 I106 M107 K172 I174	R105-I109 PolarHBondContact O-N 2.76Å; I106-I109 WeakPolarHBondContact O-CG1 3.21Å; I106-I109 PolarHBondContact O-N 2.77Å; I106-I109 VanDerWaalsContact O-N 3.16Å; M107-I109 VanDerWaalsContact C-N 3.28Å; M107-I109 PolarHBondContact O-N 2.7Å; I109-K172 WeakPolarHBondContact O-CD 3.44Å; I109-K172 PolarHBondContact O-NZ 2.91Å; I109-I174 HydrophobicContact CD1-CD1 3.98Å; I109-I174 HydrophobicContact CG1-CD1 4.16Å
110	L	96.3	Very high	95.9	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.026	15%	0.148	C	C	.	.			trans	-103.7	121.3	176.8	-71	173.7	0	0	0	111.4	I106 I115 Y168 I174 F197	I106-L110 HydrophobicContact CG2-CD1 3.55Å; I106-L110 HydrophobicContact CG2-CG 4.3Å; I106-L110 VanDerWaalsContact O-CG 3.32Å; I106-L110 WeakPolarHBondContact O-CG 3.16Å; I106-L110 PolarHBondContact O-N 2.89Å; L110-I115 HydrophobicContact CB-CG2 4.43Å; L110-I115 HydrophobicContact CD1-CD1 4.49Å; L110-I115 HydrophobicContact CD2-CD1 4.25Å; L110-Y168 HydrophobicContact CB-CE1 4.39Å; L110-Y168 HydrophobicContact CD2-CD1 3.97Å; L110-Y168 HydrophobicContact CD2-CE1 3.47Å; L110-Y168 VanDerWaalsContact CD2-CE1 3.47Å; L110-I174 HydrophobicContact CD1-CD1 4.41Å; L110-I174 HydrophobicContact CD2-CD1 3.73Å; L110-I174 HydrophobicContact CG-CD1 4.03Å; L110-F197 HydrophobicContact CD1-CD1 3.76Å; L110-F197 HydrophobicContact CD1-CE1 3.27Å; L110-F197 HydrophobicContact CD1-CE2 4.37Å; L110-F197 HydrophobicContact CD1-CG 4.48Å; L110-F197 HydrophobicContact CD1-CZ 3.63Å
111	N	95.5	Very high	96.2	Very high	28 Å²	28	32.8 Å²	32.8	15%	0.15	16%	0.156	C	C	.	.			trans	-145.4	71.7	-172.4	177	46.8	0	0	0	109.2	K117 Y168 E321 L324	N111-K117 PolarHBondContact OD1-NZ 3.2Å; N111-Y168 PolarHBondContact N-OH 2.68Å; N111-E321 VanDerWaalsContact CB-OE1 3.28Å; N111-E321 WeakPolarHBondContact CB-OE1 3.5Å; N111-E321 PolarHBondContact ND2-OE1 3.4Å; N111-L324 WeakPolarHBondContact ND2-CD2 3.48Å
112	H	97.8	Very high	96.5	Very high	8 Å²	8	29.7 Å²	29.7	4%	0.037	14%	0.143	C	C	.	.			trans	-125.3	140.8	-178.7	179	-81.9	0	0	0	109.3	N114 I115 S164 A165 Y168 F319	H112-N114 PolarHBondContact ND1-N 2.92Å; H112-N114 PolarHBondContact O-N 3.4Å; H112-I115 HydrophobicContact CB-CB 4.3Å; H112-I115 HydrophobicContact CB-CD1 3.84Å; H112-I115 HydrophobicContact CB-CG1 3.95Å; H112-I115 PolarHBondContact O-N 3.34Å; H112-S164 PolarHBondContact NE2-OG 3.28Å; H112-A165 VanDerWaalsContact CE1-CA 3.48Å; H112-A165 WeakPolarHBondContact CE1-CA 3.39Å; H112-A165 PolarHBondContact CE1-N 2.83Å; H112-A165 PolarHBondContact NE2-N 2.85Å; H112-Y168 HydrophobicContact CB-CD1 3.64Å; H112-Y168 HydrophobicContact CB-CE1 3.73Å; H112-Y168 HydrophobicContact CB-CG 4.18Å; H112-Y168 AromaticContact CD2-CG 3.93Å; H112-F319 HydrophobicContact CB-CE1 4.43Å; H112-F319 AromaticContact CD2-CD1 3.44Å; H112-F319 VanDerWaalsContact CD2-CD1 3.44Å; H112-F319 WeakPolarHBondContact CD2-CD1 3.36Å; H112-F319 AromaticContact CD2-CD2 3.92Å; H112-F319 AromaticContact CD2-CE1 3.97Å; H112-F319 AromaticContact CD2-CG 3.39Å; H112-F319 WeakPolarHBondContact CD2-CG 3.49Å; H112-F319 AromaticContact NE2-CG 3.79Å
113	P	97.1	Very high	96.6	Very high	71 Å²	71	32.1 Å²	32.1	46%	0.461	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-26.9	-174.2	21.5	-34.6	0	0	0	114.3	K193 F319	P113-K193 WeakPolarHBondContact O-CE 3.49Å; P113-K193 PolarHBondContact O-NZ 3.12Å; P113-F319 VanDerWaalsContact CD-CZ 3.43Å; P113-F319 HydrophobicContact CG-CE2 3.97Å; P113-F319 HydrophobicContact CG-CZ 4.32Å
114	N	98.3	Very high	96.6	Very high	16 Å²	16	34.4 Å²	34.4	9%	0.086	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	19.4	178.1	-55.8	110.3	0	0	0	115.3	H112 Q161 A165 I192 K193 I194	H112-N114 PolarHBondContact ND1-N 2.92Å; H112-N114 PolarHBondContact O-N 3.4Å; N114-Q161 HydrophobicContact CB-CB 4.25Å; N114-A165 HydrophobicContact CB-CB 4.27Å; N114-I192 WeakPolarHBondContact CA-O 3.44Å; N114-I192 HydrophobicContact CB-CB 4.45Å; N114-I192 HydrophobicContact CB-CG2 4.38Å; N114-I192 VanDerWaalsContact CB-O 3.23Å; N114-I192 WeakPolarHBondContact CB-O 3.43Å; N114-I192 PolarHBondContact ND2-O 2.92Å; N114-K193 WeakPolarHBondContact O-CA 3.27Å; N114-I194 PolarHBondContact O-N 2.89Å
115	I	98.3	Very high	96.5	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.021	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-113.5	144.4	168.6	-62.8	179.9	0	0	0	108.3	L110 H112 K117 A165 Y168 F197	L110-I115 HydrophobicContact CB-CG2 4.43Å; L110-I115 HydrophobicContact CD1-CD1 4.49Å; L110-I115 HydrophobicContact CD2-CD1 4.25Å; H112-I115 HydrophobicContact CB-CB 4.3Å; H112-I115 HydrophobicContact CB-CD1 3.84Å; H112-I115 HydrophobicContact CB-CG1 3.95Å; H112-I115 PolarHBondContact O-N 3.34Å; I115-K117 PolarHBondContact O-N 2.95Å; I115-K117 VanDerWaalsContact O-N 3.15Å; I115-A165 HydrophobicContact CD1-CB 4.3Å; I115-A165 HydrophobicContact CG1-CB 3.86Å; I115-Y168 HydrophobicContact CD1-CD1 3.9Å; I115-Y168 HydrophobicContact CD1-CE1 4.2Å; I115-F197 HydrophobicContact CD1-CZ 4.36Å; I115-F197 HydrophobicContact CG2-CE2 3.76Å; I115-F197 HydrophobicContact CG2-CZ 3.83Å
116	V	97.3	Very high	96.4	Very high	9 Å²	9	39.4 Å²	39.4	6%	0.055	20%	0.198	C	C	.	.			trans	-64.4	110.5	172.7	169.2	0	0	0	0	109.6	M132 E133 K193 I194 A195	V116-M132 HydrophobicContact CG1-CB 3.75Å; V116-M132 HydrophobicContact CG1-CG 4.49Å; V116-M132 HydrophobicContact CG1-SD 4.37Å; V116-E133 HydrophobicContact CG1-CB 4.22Å; V116-K193 HydrophobicContact CG2-CB 3.93Å; V116-I194 WeakPolarHBondContact CG2-O 3.49Å; V116-I194 PolarHBondContact N-O 3.07Å; V116-A195 HydrophobicContact CG2-CB 3.86Å
117	K	96.3	Very high	96.3	Very high	34 Å²	34	40.8 Å²	40.8	15%	0.148	21%	0.206	C	C	.	.			trans	-75.2	138.1	179.5	-174.6	155.8	-174	167.5	0	111.8	N111 I115 F119 M132 E133	N111-K117 PolarHBondContact OD1-NZ 3.2Å; I115-K117 PolarHBondContact O-N 2.95Å; I115-K117 VanDerWaalsContact O-N 3.15Å; K117-F119 HydrophobicContact CB-CE1 4.39Å; K117-F119 HydrophobicContact CG-CE1 4.2Å; K117-M132 CarbonylContact O-C 3.54Å; K117-M132 WeakPolarHBondContact O-CA 3.43Å; K117-E133 PolarHBondContact O-N 2.88Å
118	L	97.6	Very high	96.3	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	145.6	168.1	-171.8	70.7	0	0	0	110.3	M107 K108 V121 L130 M132 Y354	M107-L118 HydrophobicContact CB-CB 4.28Å; M107-L118 HydrophobicContact CB-CD2 4.08Å; M107-L118 HydrophobicContact CE-CB 4.27Å; M107-L118 HydrophobicContact CE-CD1 4.21Å; K108-L118 HydrophobicContact CG-CD2 3.73Å; L118-V121 HydrophobicContact CD1-CG2 4.34Å; L118-V121 HydrophobicContact CD2-CG2 3.86Å; L118-V121 HydrophobicContact CG-CG2 4.46Å; L118-L130 HydrophobicContact CD1-CB 4.13Å; L118-M132 HydrophobicContact CD1-CG 4.31Å; L118-Y354 HydrophobicContact CB-CD1 4.33Å; L118-Y354 HydrophobicContact CB-CE1 4.07Å; L118-Y354 HydrophobicContact CD2-CD1 3.85Å; L118-Y354 HydrophobicContact CD2-CE1 4.07Å; L118-Y354 HydrophobicContact CD2-CG 4.35Å; L118-Y354 HydrophobicContact CG-CD1 3.93Å; L118-Y354 HydrophobicContact CG-CE1 4.16Å
119	F	97.6	Very high	96.3	Very high	3 Å²	3	38.8 Å²	38.8	1%	0.013	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	-42.8	172.4	-52.4	-53.2	0	0	0	112.2	V82 K117 I131 M132 E133 Y354 A359 L362 L363 R366	V82-F119 HydrophobicContact CG1-CD2 3.99Å; V82-F119 HydrophobicContact CG1-CE2 4.03Å; K117-F119 HydrophobicContact CB-CE1 4.39Å; K117-F119 HydrophobicContact CG-CE1 4.2Å; F119-I131 HydrophobicContact CB-CG2 4.38Å; F119-I131 HydrophobicContact CD2-CG2 4.27Å; F119-I131 PolarHBondContact N-O 3.3Å; F119-M132 VanDerWaalsContact CE2-C 3.41Å; F119-E133 HydrophobicContact CE2-CB 4.34Å; F119-E133 VanDerWaalsContact CE2-N 3.33Å; F119-E133 HydrophobicContact CZ-CB 4.06Å; F119-Y354 WeakPolarHBondContact O-CD1 3.43Å; F119-A359 HydrophobicContact CB-CB 4.09Å; F119-L362 HydrophobicContact CD1-CB 4.01Å; F119-L362 HydrophobicContact CD1-CD1 4.4Å; F119-L363 HydrophobicContact CD1-CD2 4.38Å; F119-L363 HydrophobicContact CD2-CD2 3.73Å; F119-L363 HydrophobicContact CD2-CG 4.37Å; F119-L363 HydrophobicContact CE1-CD2 4.35Å; F119-L363 HydrophobicContact CE2-CD2 3.67Å; F119-L363 HydrophobicContact CG-CD2 4.1Å; F119-L363 HydrophobicContact CG-CG 4.34Å; F119-L363 HydrophobicContact CZ-CD2 4.01Å; F119-R366 VanDerWaalsContact CZ-NE 3.29Å
120	E	98.2	Very high	96.5	Very high	10 Å²	10	35.2 Å²	35.2	5%	0.047	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	153.4	-173.3	-151.3	174.4	128.1	0	0	112	Y56 I122 I131 Y354 E356 A359	Y56-E120 WeakPolarHBondContact CE2-OE2 3.46Å; Y56-E120 VanDerWaalsContact CZ-OE2 3.27Å; Y56-E120 PolarHBondContact OH-OE2 3.44Å; E120-I122 HydrophobicContact CG-CG1 4.32Å; E120-I122 WeakPolarHBondContact OE1-CD1 3.5Å; E120-I122 WeakPolarHBondContact OE1-CG1 3.35Å; E120-I131 HydrophobicContact CB-CB 3.8Å; E120-I131 HydrophobicContact CB-CD1 4.1Å; E120-I131 HydrophobicContact CB-CG1 3.98Å; E120-I131 HydrophobicContact CB-CG2 4.49Å; E120-I131 PolarHBondContact N-O 2.58Å; E120-I131 PolarHBondContact O-N 3.45Å; E120-Y354 WeakPolarHBondContact CA-O 3.25Å; E120-Y354 WeakPolarHBondContact CG-O 3.41Å; E120-E356 WeakPolarHBondContact OE2-CA 3.06Å; E120-A359 HydrophobicContact CB-CB 3.77Å; E120-A359 HydrophobicContact CG-CB 4Å; E120-A359 WeakPolarHBondContact OE2-CB 3.16Å
121	V	97.9	Very high	96.5	Very high	32 Å²	32	35 Å²	35	19%	0.194	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	105.2	170.4	-177.5	0	0	0	0	108.7	V104 L118 L128 L130 Y354	V104-V121 HydrophobicContact CG1-CG1 4.46Å; V104-V121 HydrophobicContact CG1-CG2 3.98Å; L118-V121 HydrophobicContact CD1-CG2 4.34Å; L118-V121 HydrophobicContact CD2-CG2 3.86Å; L118-V121 HydrophobicContact CG-CG2 4.46Å; V121-L128 HydrophobicContact CG1-CD1 3.76Å; V121-L130 HydrophobicContact CG1-CD2 3.98Å; V121-L130 HydrophobicContact CG2-CD2 4.13Å; V121-Y354 PolarHBondContact N-O 2.84Å
122	I	97.3	Very high	96.7	Very high	30 Å²	30	34.5 Å²	34.5	15%	0.154	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	122.7	172.8	-53.3	172	0	0	0	108	I53 Y56 E120 Y129 I131	I53-I122 HydrophobicContact CD1-CG2 4.31Å; I53-I122 HydrophobicContact CG1-CD1 4.1Å; I53-I122 HydrophobicContact CG1-CG2 4.47Å; Y56-I122 HydrophobicContact CD2-CD1 4.29Å; Y56-I122 HydrophobicContact CE2-CD1 4.34Å; E120-I122 HydrophobicContact CG-CG1 4.32Å; E120-I122 WeakPolarHBondContact OE1-CD1 3.5Å; E120-I122 WeakPolarHBondContact OE1-CG1 3.35Å; I122-Y129 HydrophobicContact CB-CD2 4.4Å; I122-Y129 HydrophobicContact CG2-CD2 4.44Å; I122-Y129 PolarHBondContact N-O 2.88Å; I122-Y129 PolarHBondContact O-N 2.79Å; I122-I131 HydrophobicContact CD1-CD1 4.08Å; I122-I131 HydrophobicContact CG1-CD1 4.04Å
123	E	95.1	Very high	96.6	Very high	98 Å²	98	34.9 Å²	34.9	46%	0.458	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.6	177	-173.2	160.9	-168	0	0	111	K89 L128	K89-E123 IonicContact NZ-OE1 2.91Å; K89-E123 PolarHBondContact NZ-OE1 3.18Å; E123-L128 HydrophobicContact CB-CD1 3.61Å; E123-L128 HydrophobicContact CG-CD1 3.8Å
124	T	94.3	Very high	96.6	Very high	58 Å²	58	33.6 Å²	33.6	36%	0.356	16%	0.162	S	C	.	.			trans	-115.7	174.9	166	75.3	0	0	0	0	109.1	K89 K126 T127 Y129	K89-T124 WeakPolarHBondContact CE-O 3.17Å; K89-T124 PolarHBondContact NZ-O 3.15Å; T124-K126 PolarHBondContact O-N 3.42Å; T124-K126 PolarHBondContact OG1-N 2.7Å; T124-T127 PolarHBondContact N-O 2.88Å; T124-T127 PolarHBondContact OG1-N 3.43Å; T124-T127 VanDerWaalsContact OG1-N 3.07Å; T124-T127 PolarHBondContact OG1-O 3.37Å; T124-Y129 HydrophobicContact CG2-CE2 4.19Å
125	E	92.8	Very high	96.4	Very high	152 Å²	152	33.3 Å²	33.3	71%	0.71	16%	0.162	S	C	*	.	S	Bend	trans	-48.1	-46.3	174.1	-176.1	-163.7	-157.9	0	0	112.3	K89	K89-E125 WeakPolarHBondContact CE-O 3.49Å; K89-E125 PolarHBondContact NZ-O 3.02Å
126	K	93	Very high	96	Very high	111 Å²	111	35 Å²	35	48%	0.483	17%	0.174	S	C	.	.	S	Bend	trans	-107.5	-18.1	-167.8	-68.3	170.5	175.7	119.3	0	114.4	K89 T90 T124	K89-K126 WeakPolarHBondContact CB-O 3.41Å; K89-K126 PolarHBondContact N-O 2.73Å; T90-K126 HydrophobicContact CG2-CB 3.92Å; T90-K126 HydrophobicContact CG2-CD 4.47Å; T90-K126 HydrophobicContact CG2-CG 3.8Å; T124-K126 PolarHBondContact O-N 3.42Å; T124-K126 PolarHBondContact OG1-N 2.7Å
127	T	94.3	Very high	95.4	Very high	28 Å²	28	34.9 Å²	34.9	17%	0.172	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	143.4	-171.3	-44.6	0	0	0	0	111.4	I86 I87 T124 Y129	I86-T127 HydrophobicContact CG2-CG2 3.68Å; I87-T127 WeakPolarHBondContact O-CA 3.21Å; I87-T127 WeakPolarHBondContact O-CG2 3.22Å; T124-T127 PolarHBondContact N-O 2.88Å; T124-T127 PolarHBondContact OG1-N 3.43Å; T124-T127 VanDerWaalsContact OG1-N 3.07Å; T124-T127 PolarHBondContact OG1-O 3.37Å; T127-Y129 HydrophobicContact CG2-CD2 4.12Å; T127-Y129 HydrophobicContact CG2-CE1 4.17Å; T127-Y129 HydrophobicContact CG2-CE2 3.56Å
128	L	95.7	Very high	95	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	135.3	167.9	-168.2	68.3	0	0	0	109.5	I87 K89 L100 V104 V121 E123 L130	I87-L128 PolarHBondContact N-O 3.25Å; I87-L128 PolarHBondContact O-N 3.4Å; K89-L128 HydrophobicContact CG-CB 4.49Å; L100-L128 HydrophobicContact CD1-CD2 3.98Å; L100-L128 HydrophobicContact CD2-CB 4.48Å; L100-L128 HydrophobicContact CD2-CD2 3.72Å; L100-L128 HydrophobicContact CG-CD2 3.8Å; V104-L128 HydrophobicContact CG2-CD2 3.98Å; V121-L128 HydrophobicContact CG1-CD1 3.76Å; E123-L128 HydrophobicContact CB-CD1 3.61Å; E123-L128 HydrophobicContact CG-CD1 3.8Å; L128-L130 HydrophobicContact CD2-CD2 3.92Å; L128-L130 HydrophobicContact CG-CD2 3.98Å
129	Y	97.3	Very high	94.6	Very high	39 Å²	39	34.9 Å²	34.9	15%	0.153	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	116.7	177.8	-57.2	-100.3	0	0	0	108.7	I53 I84 I86 I122 T124 T127 I131	I53-Y129 HydrophobicContact CB-CE1 4.46Å; I53-Y129 HydrophobicContact CD1-CD2 4.33Å; I53-Y129 HydrophobicContact CD1-CE1 4.49Å; I53-Y129 HydrophobicContact CD1-CE2 3.91Å; I53-Y129 HydrophobicContact CG1-CD1 4.02Å; I53-Y129 HydrophobicContact CG1-CD2 4.12Å; I53-Y129 HydrophobicContact CG1-CE1 3.97Å; I53-Y129 HydrophobicContact CG1-CE2 4.06Å; I53-Y129 HydrophobicContact CG1-CG 4.12Å; I53-Y129 HydrophobicContact CG2-CD1 4.31Å; I53-Y129 HydrophobicContact CG2-CE1 4.44Å; I84-Y129 HydrophobicContact CG2-CD1 4.04Å; I86-Y129 HydrophobicContact CB-CD1 4.32Å; I86-Y129 HydrophobicContact CB-CE1 4.4Å; I86-Y129 HydrophobicContact CD1-CD1 4.45Å; I86-Y129 HydrophobicContact CD1-CE1 4.25Å; I86-Y129 HydrophobicContact CG1-CD1 3.87Å; I86-Y129 HydrophobicContact CG1-CE1 4.07Å; I86-Y129 HydrophobicContact CG2-CD1 3.96Å; I86-Y129 HydrophobicContact CG2-CE1 3.65Å; I122-Y129 HydrophobicContact CB-CD2 4.4Å; I122-Y129 HydrophobicContact CG2-CD2 4.44Å; I122-Y129 PolarHBondContact N-O 2.88Å; I122-Y129 PolarHBondContact O-N 2.79Å; T124-Y129 HydrophobicContact CG2-CE2 4.19Å; T127-Y129 HydrophobicContact CG2-CD2 4.12Å; T127-Y129 HydrophobicContact CG2-CE1 4.17Å; T127-Y129 HydrophobicContact CG2-CE2 3.56Å; Y129-I131 WeakPolarHBondContact O-CD1 3.3Å
130	L	97.6	Very high	94.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	115.6	173.8	-49.9	-176.8	0	0	0	108.5	I84 K85 I87 V104 M107 L118 V121 L128 M132	I84-L130 CarbonylContact C-O 3.19Å; I84-L130 WeakPolarHBondContact CA-O 3.39Å; K85-L130 HydrophobicContact CB-CB 4.34Å; K85-L130 PolarHBondContact N-O 3.43Å; K85-L130 PolarHBondContact O-N 3.17Å; I87-L130 HydrophobicContact CD1-CD1 4.1Å; I87-L130 HydrophobicContact CD1-CG 4.37Å; V104-L130 HydrophobicContact CG2-CD1 4.18Å; V104-L130 HydrophobicContact CG2-CD2 3.66Å; M107-L130 HydrophobicContact SD-CD1 4.44Å; L118-L130 HydrophobicContact CD1-CB 4.13Å; V121-L130 HydrophobicContact CG1-CD2 3.98Å; V121-L130 HydrophobicContact CG2-CD2 4.13Å; L128-L130 HydrophobicContact CD2-CD2 3.92Å; L128-L130 HydrophobicContact CG-CD2 3.98Å; L130-M132 HydrophobicContact CB-CG 4.35Å; L130-M132 HydrophobicContact CB-SD 4.46Å
131	I	98.3	Very high	93.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	120.6	-178.1	-63.3	60.1	0	0	0	107.7	Y56 V82 I84 F119 E120 I122 Y129	Y56-I131 HydrophobicContact CD1-CG2 4.32Å; Y56-I131 HydrophobicContact CD2-CG1 4.19Å; Y56-I131 HydrophobicContact CE1-CG1 4.4Å; Y56-I131 HydrophobicContact CE1-CG2 3.62Å; Y56-I131 HydrophobicContact CE2-CG1 3.87Å; Y56-I131 HydrophobicContact CE2-CG2 4.43Å; V82-I131 HydrophobicContact CB-CG2 3.94Å; V82-I131 HydrophobicContact CG1-CG2 4.17Å; V82-I131 HydrophobicContact CG2-CG2 3.87Å; I84-I131 HydrophobicContact CD1-CG1 4.04Å; I84-I131 HydrophobicContact CG1-CG1 4.1Å; I84-I131 HydrophobicContact CG2-CD1 4.35Å; F119-I131 HydrophobicContact CB-CG2 4.38Å; F119-I131 HydrophobicContact CD2-CG2 4.27Å; F119-I131 PolarHBondContact N-O 3.3Å; E120-I131 HydrophobicContact CB-CB 3.8Å; E120-I131 HydrophobicContact CB-CD1 4.1Å; E120-I131 HydrophobicContact CB-CG1 3.98Å; E120-I131 HydrophobicContact CB-CG2 4.49Å; E120-I131 PolarHBondContact N-O 2.58Å; E120-I131 PolarHBondContact O-N 3.45Å; I122-I131 HydrophobicContact CD1-CD1 4.08Å; I122-I131 HydrophobicContact CG1-CD1 4.04Å; Y129-I131 WeakPolarHBondContact O-CD1 3.3Å
132	M	97.8	Very high	92.7	Very high	19 Å²	19	34.4 Å²	34.4	9%	0.094	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	165.5	-164.6	-48.7	177.5	-57.5	0	0	112.6	V82 A83 K85 M107 V116 K117 L118 F119 L130 Y134	V82-M132 WeakPolarHBondContact CA-O 3.36Å; V82-M132 WeakPolarHBondContact CB-O 3.37Å; A83-M132 HydrophobicContact CB-CE 4.23Å; A83-M132 PolarHBondContact N-O 2.81Å; A83-M132 WeakPolarHBondContact O-CB 3.28Å; A83-M132 PolarHBondContact O-N 3Å; K85-M132 HydrophobicContact CB-CE 3.7Å; K85-M132 HydrophobicContact CB-SD 4.23Å; M107-M132 HydrophobicContact CE-CG 4.03Å; M107-M132 HydrophobicContact CE-SD 3.71Å; V116-M132 HydrophobicContact CG1-CB 3.75Å; V116-M132 HydrophobicContact CG1-CG 4.49Å; V116-M132 HydrophobicContact CG1-SD 4.37Å; K117-M132 CarbonylContact O-C 3.54Å; K117-M132 WeakPolarHBondContact O-CA 3.43Å; L118-M132 HydrophobicContact CD1-CG 4.31Å; F119-M132 VanDerWaalsContact CE2-C 3.41Å; L130-M132 HydrophobicContact CB-CG 4.35Å; L130-M132 HydrophobicContact CB-SD 4.46Å; M132-Y134 PolarHBondContact O-N 3.28Å
133	E	96.9	Very high	92	Very high	16 Å²	16	34.2 Å²	34.2	8%	0.075	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	128.3	167.6	169.9	161.2	-146.4	0	0	112.3	V116 K117 F119 K193 R366	V116-E133 HydrophobicContact CG1-CB 4.22Å; K117-E133 PolarHBondContact O-N 2.88Å; F119-E133 HydrophobicContact CE2-CB 4.34Å; F119-E133 VanDerWaalsContact CE2-N 3.33Å; F119-E133 HydrophobicContact CZ-CB 4.06Å; E133-K193 WeakPolarHBondContact OE1-CE 3.35Å; E133-K193 IonicContact OE1-NZ 2.64Å; E133-K193 PolarHBondContact OE1-NZ 2.86Å; E133-K193 IonicContact OE2-NZ 3.1Å; E133-K193 PolarHBondContact OE2-NZ 3.49Å; E133-R366 IonicContact OE1-CZ 3.46Å; E133-R366 IonicContact OE1-NH1 3.73Å; E133-R366 PolarHBondContact OE1-NH1 3.01Å; E133-R366 IonicContact OE1-NH2 3.96Å; E133-R366 PolarHBondContact OE1-NH2 2.83Å; E133-R366 IonicContact OE2-CZ 2.68Å; E133-R366 IonicContact OE2-NH1 3.4Å; E133-R366 IonicContact OE2-NH2 2.66Å; E133-R366 PolarHBondContact OE2-NH2 2.69Å
134	Y	95.9	Very high	91.5	Very high	43 Å²	43	29.8 Å²	29.8	17%	0.169	15%	0.151	C	C	.	.			trans	-85.8	120.8	171.8	176.4	-136.5	0	0	0	111.4	I62 L72 E81 M132	I62-Y134 HydrophobicContact CD1-CD2 3.85Å; I62-Y134 HydrophobicContact CD1-CE2 3.79Å; L72-Y134 HydrophobicContact CD1-CD1 3.44Å; L72-Y134 VanDerWaalsContact CD1-CD1 3.44Å; L72-Y134 HydrophobicContact CD1-CD2 4.05Å; L72-Y134 HydrophobicContact CD1-CE1 3.49Å; L72-Y134 VanDerWaalsContact CD1-CE1 3.49Å; L72-Y134 HydrophobicContact CD1-CE2 4.13Å; L72-Y134 HydrophobicContact CD1-CG 3.73Å; L72-Y134 HydrophobicContact CD2-CE1 4.38Å; E81-Y134 HydrophobicContact CB-CD1 4.03Å; E81-Y134 WeakPolarHBondContact OE2-CE1 3.21Å; M132-Y134 PolarHBondContact O-N 3.28Å
135	A	94.2	Very high	90.6	Very high	11 Å²	11	28.1 Å²	28.1	9%	0.091	14%	0.141	C	C	.	.			trans	-97.2	103.1	171.4	0	0	0	0	0	109.7	L185 L186 K193	A135-L185 HydrophobicContact CB-CB 3.58Å; A135-L185 HydrophobicContact CB-CD1 4Å; A135-L185 HydrophobicContact CB-CG 4.45Å; A135-L186 CarbonylContact C-O 3.55Å; A135-L186 WeakPolarHBondContact CB-O 3.41Å; A135-K193 HydrophobicContact CB-CB 4.21Å; A135-K193 HydrophobicContact CB-CG 4.25Å
136	S	90.3	Very high	89.8	Confident	39 Å²	39	22.6 Å²	22.6	27%	0.273	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-18	-168.4	58	0	0	0	0	115.5	G138 L186 R729	S136-G138 VanDerWaalsContact C-N 3.3Å; S136-G138 PolarHBondContact O-N 3.19Å; S136-L186 PolarHBondContact N-O 3.3Å; S136-R729 PolarHBondContact O-NH2 3.41Å
137	G	86.2	Confident	89.3	Confident	6 Å²	6	20.9 Å²	20.9	6%	0.062	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-14	-178.3	0	0	0	0	0	114.7	L186	G137-L186 VanDerWaalsContact CA-O 3.27Å; G137-L186 WeakPolarHBondContact CA-O 3.28Å; G137-L186 PolarHBondContact N-O 2.7Å
138	G	87.9	Confident	88.8	Confident	11 Å²	11	21 Å²	21	11%	0.113	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	92.3	-157.6	-179	0	0	0	0	0	113.1	S136 L185 L186	S136-G138 VanDerWaalsContact C-N 3.3Å; S136-G138 PolarHBondContact O-N 3.19Å; G138-L185 CarbonylContact O-C 3.51Å; G138-L185 WeakPolarHBondContact O-CA 3.4Å; G138-L186 PolarHBondContact O-N 2.83Å
139	E	89.1	Confident	88.5	Confident	25 Å²	25	25.3 Å²	25.3	12%	0.117	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	148.3	-178.7	-70.5	170	-144.6	0	0	112.1	F141 D142 Y143 E182 L185 R732	E139-F141 HydrophobicContact CB-CB 4.38Å; E139-F141 PolarHBondContact O-N 3.45Å; E139-D142 HydrophobicContact CB-CB 4.27Å; E139-D142 WeakPolarHBondContact O-CB 3.2Å; E139-D142 PolarHBondContact O-N 2.98Å; E139-D142 VanDerWaalsContact O-N 3.1Å; E139-Y143 PolarHBondContact O-N 2.64Å; E139-E182 WeakPolarHBondContact OE2-CA 3.45Å; E139-L185 HydrophobicContact CG-CD2 3.76Å; E139-R732 IonicContact OE1-CZ 3.59Å; E139-R732 IonicContact OE1-NE 3.51Å; E139-R732 PolarHBondContact OE1-NE 2.79Å; E139-R732 IonicContact OE1-NH2 2.78Å; E139-R732 PolarHBondContact OE1-NH2 3.1Å; E139-R732 IonicContact OE2-CZ 3.27Å; E139-R732 IonicContact OE2-NE 2.88Å; E139-R732 PolarHBondContact OE2-NE 3.2Å; E139-R732 IonicContact OE2-NH2 2.82Å; E139-R732 PolarHBondContact OE2-NH2 3.06Å
140	V	89.6	Confident	88.3	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.006	13%	0.131	C	C	.	.	H	α-helix	trans	-61	-31.1	167.6	172.2	0	0	0	0	110.8	Y143 L144 M150 L184 L186 I192 L246	V140-Y143 WeakPolarHBondContact O-CB 3.34Å; V140-Y143 PolarHBondContact O-N 2.97Å; V140-L144 WeakPolarHBondContact O-CG 3.5Å; V140-L144 PolarHBondContact O-N 3.26Å; V140-M150 HydrophobicContact CG1-CE 4.27Å; V140-L184 HydrophobicContact CB-CB 3.93Å; V140-L184 HydrophobicContact CG2-CB 3.71Å; V140-L184 WeakPolarHBondContact CG2-O 3.41Å; V140-L184 PolarHBondContact N-O 3.32Å; V140-L186 HydrophobicContact CG2-CD1 4.09Å; V140-L186 HydrophobicContact CG2-CD2 3.91Å; V140-L186 HydrophobicContact CG2-CG 3.82Å; V140-I192 HydrophobicContact CG2-CD1 3.42Å; V140-I192 VanDerWaalsContact CG2-CD1 3.42Å; V140-L246 HydrophobicContact CG1-CD2 3.5Å
141	F	82.9	Confident	88.2	Confident	19 Å²	19	31.4 Å²	31.4	8%	0.083	17%	0.165	C	C	.	.	H	α-helix	trans	-62.1	-46.8	170.7	-170.5	-80.4	0	0	0	112.2	E139 Y143 L144 V145 A181 S737 K741	E139-F141 HydrophobicContact CB-CB 4.38Å; E139-F141 PolarHBondContact O-N 3.45Å; F141-Y143 VanDerWaalsContact C-N 3.26Å; F141-Y143 PolarHBondContact O-N 3.1Å; F141-L144 WeakPolarHBondContact O-CA 3.33Å; F141-L144 WeakPolarHBondContact O-CB 3.41Å; F141-L144 PolarHBondContact O-N 2.66Å; F141-V145 HydrophobicContact CD1-CG2 3.73Å; F141-V145 HydrophobicContact CE1-CG2 3.4Å; F141-V145 VanDerWaalsContact CE1-CG2 3.4Å; F141-V145 HydrophobicContact CZ-CG2 4.38Å; F141-V145 PolarHBondContact O-N 2.76Å; F141-V145 VanDerWaalsContact O-N 3.07Å; F141-A181 HydrophobicContact CB-CB 3.96Å; F141-A181 HydrophobicContact CD2-CB 4.07Å; F141-A181 PolarHBondContact N-O 3.29Å; F141-S737 WeakPolarHBondContact CE1-O 3.26Å; F141-S737 VanDerWaalsContact CZ-O 3.28Å; F141-S737 WeakPolarHBondContact CZ-O 3.45Å; F141-K741 HydrophobicContact CE1-CB 3.86Å; F141-K741 HydrophobicContact CE1-CD 4.34Å; F141-K741 HydrophobicContact CZ-CB 3.95Å; F141-K741 HydrophobicContact CZ-CD 3.91Å
142	D	80.1	Confident	88.2	Confident	14 Å²	14	32.9 Å²	32.9	8%	0.075	17%	0.172	C	C	.	.	H	α-helix	trans	-59.8	-35.4	179.3	-72.3	5.1	0	0	0	112	E139 L144 V145 A146 R732 F740	E139-D142 HydrophobicContact CB-CB 4.27Å; E139-D142 WeakPolarHBondContact O-CB 3.2Å; E139-D142 PolarHBondContact O-N 2.98Å; E139-D142 VanDerWaalsContact O-N 3.1Å; D142-L144 PolarHBondContact O-N 3.31Å; D142-V145 PolarHBondContact O-N 2.85Å; D142-A146 PolarHBondContact O-N 2.93Å; D142-R732 PolarHBondContact OD2-N 3.19Å; D142-F740 WeakPolarHBondContact OD1-CE1 3.37Å
143	Y	82.8	Confident	88.2	Confident	27 Å²	27	40.2 Å²	40.2	11%	0.106	20%	0.203	C	C	.	.	H	α-helix	trans	-54.3	-52	169.2	-176.2	-65.8	0	0	0	110.8	E139 V140 F141 V145 A146 H147 M150 E154 M190 T661	E139-Y143 PolarHBondContact O-N 2.64Å; V140-Y143 WeakPolarHBondContact O-CB 3.34Å; V140-Y143 PolarHBondContact O-N 2.97Å; F141-Y143 VanDerWaalsContact C-N 3.26Å; F141-Y143 PolarHBondContact O-N 3.1Å; Y143-V145 PolarHBondContact O-N 3.14Å; Y143-A146 PolarHBondContact O-N 3.04Å; Y143-A146 VanDerWaalsContact O-N 3.17Å; Y143-H147 HydrophobicContact CD1-CB 3.98Å; Y143-H147 HydrophobicContact CE1-CB 3.53Å; Y143-H147 AromaticContact CE1-CG 3.72Å; Y143-H147 AromaticContact CZ-CG 3.95Å; Y143-H147 WeakPolarHBondContact O-CB 3.32Å; Y143-H147 PolarHBondContact O-N 3.35Å; Y143-H147 PolarHBondContact O-ND1 2.92Å; Y143-H147 VanDerWaalsContact O-ND1 3.16Å; Y143-M150 HydrophobicContact CD1-CE 3.48Å; Y143-M150 VanDerWaalsContact CD1-CE 3.48Å; Y143-M150 HydrophobicContact CD1-CG 4.12Å; Y143-M150 HydrophobicContact CD2-CE 4.12Å; Y143-M150 HydrophobicContact CE1-CE 3.86Å; Y143-M150 HydrophobicContact CE1-CG 3.74Å; Y143-M150 HydrophobicContact CE2-CE 4.41Å; Y143-M150 HydrophobicContact CG-CE 3.69Å; Y143-E154 PolarHBondContact OH-OE1 2.82Å; Y143-E154 PolarHBondContact OH-OE2 3.14Å; Y143-M190 HydrophobicContact CD2-CE 3.82Å; Y143-M190 HydrophobicContact CE2-CE 4.22Å; Y143-T661 HydrophobicContact CD2-CG2 3.41Å; Y143-T661 VanDerWaalsContact CD2-CG2 3.41Å; Y143-T661 HydrophobicContact CE2-CG2 4.04Å; Y143-T661 HydrophobicContact CG-CG2 4.1Å
144	L	84.1	Confident	88.1	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.021	21%	0.214	C	C	.	.	H	α-helix	trans	-67.3	-22.3	-176.7	-62.6	173.8	0	0	0	113.1	V140 F141 D142 G148 M150 T245 L246	V140-L144 WeakPolarHBondContact O-CG 3.5Å; V140-L144 PolarHBondContact O-N 3.26Å; F141-L144 WeakPolarHBondContact O-CA 3.33Å; F141-L144 WeakPolarHBondContact O-CB 3.41Å; F141-L144 PolarHBondContact O-N 2.66Å; D142-L144 PolarHBondContact O-N 3.31Å; L144-G148 WeakPolarHBondContact CA-O 3.45Å; L144-G148 WeakPolarHBondContact CD2-O 3.38Å; L144-G148 VanDerWaalsContact O-CA 3.24Å; L144-G148 WeakPolarHBondContact O-CA 3.38Å; L144-G148 PolarHBondContact O-N 2.96Å; L144-G148 VanDerWaalsContact O-N 3.16Å; L144-M150 HydrophobicContact CD2-CE 4.35Å; L144-M150 HydrophobicContact CD2-CG 4.04Å; L144-T245 HydrophobicContact CD1-CG2 4.04Å; L144-L246 HydrophobicContact CD1-CD2 4.32Å
145	V	75.3	Confident	88.2	Confident	24 Å²	24	40.5 Å²	40.5	15%	0.145	21%	0.206	C	C	.	.	H	α-helix	trans	-68.5	-54	168.6	-178.8	0	0	0	0	110.1	F141 D142 Y143 K741 A744	F141-V145 HydrophobicContact CD1-CG2 3.73Å; F141-V145 HydrophobicContact CE1-CG2 3.4Å; F141-V145 VanDerWaalsContact CE1-CG2 3.4Å; F141-V145 HydrophobicContact CZ-CG2 4.38Å; F141-V145 PolarHBondContact O-N 2.76Å; F141-V145 VanDerWaalsContact O-N 3.07Å; D142-V145 PolarHBondContact O-N 2.85Å; Y143-V145 PolarHBondContact O-N 3.14Å; V145-K741 HydrophobicContact CG1-CB 4.49Å; V145-K741 HydrophobicContact CG1-CG 4.25Å; V145-K741 HydrophobicContact CG2-CB 3.79Å; V145-K741 HydrophobicContact CG2-CD 4.28Å; V145-K741 HydrophobicContact CG2-CG 3.88Å; V145-A744 HydrophobicContact CG1-CB 4.27Å
146	A	77.6	Confident	88.4	Confident	36 Å²	36	41.4 Å²	41.4	30%	0.298	21%	0.207	S	C	.	.	H	α-helix	trans	-74.4	-27.1	-172.1	0	0	0	0	0	114.7	D142 Y143 S663	D142-A146 PolarHBondContact O-N 2.93Å; Y143-A146 PolarHBondContact O-N 3.04Å; Y143-A146 VanDerWaalsContact O-N 3.17Å; A146-S663 PolarHBondContact O-OG 3.06Å
147	H	80.7	Confident	88.7	Confident	74 Å²	74	41.5 Å²	41.5	34%	0.343	21%	0.21	S	C	.	.	H	α-helix	trans	-115.2	-13.7	-172.4	-61	67.1	0	0	0	113.4	Y143 T661 W662	Y143-H147 HydrophobicContact CD1-CB 3.98Å; Y143-H147 HydrophobicContact CE1-CB 3.53Å; Y143-H147 AromaticContact CE1-CG 3.72Å; Y143-H147 AromaticContact CZ-CG 3.95Å; Y143-H147 WeakPolarHBondContact O-CB 3.32Å; Y143-H147 PolarHBondContact O-N 3.35Å; Y143-H147 PolarHBondContact O-ND1 2.92Å; Y143-H147 VanDerWaalsContact O-ND1 3.16Å; H147-T661 VanDerWaalsContact CE1-C 3.49Å; H147-T661 VanDerWaalsContact CE1-CB 3.48Å; H147-T661 WeakPolarHBondContact CE1-CB 3.47Å; H147-W662 PolarHBondContact NE2-O 3.45Å; H147-W662 VanDerWaalsContact NE2-O 3.12Å
148	G	84.2	Confident	89.2	Confident	30 Å²	30	42.6 Å²	42.6	31%	0.309	21%	0.213	S	C	.	.			trans	69.5	-150.6	-163.7	0	0	0	0	0	111.5	L144	L144-G148 WeakPolarHBondContact CA-O 3.45Å; L144-G148 WeakPolarHBondContact CD2-O 3.38Å; L144-G148 VanDerWaalsContact O-CA 3.24Å; L144-G148 WeakPolarHBondContact O-CA 3.38Å; L144-G148 PolarHBondContact O-N 2.96Å; L144-G148 VanDerWaalsContact O-N 3.16Å
149	R	90.3	Very high	89.7	Confident	94 Å²	94	42.1 Å²	42.1	36%	0.355	21%	0.208	S	C	.	.	S	Bend	trans	-66.9	140.7	-176.8	77.5	-167.3	-167.7	80.2	-0.9	112.7	V247 S248 Y275	R149-V247 WeakPolarHBondContact CD-O 3.35Å; R149-V247 PolarHBondContact NH1-O 2.93Å; R149-S248 VanDerWaalsContact CB-C 3.41Å; R149-Y275 VanDerWaalsContact NH1-CE2 3.3Å; R149-Y275 VanDerWaalsContact NH2-CD2 3.32Å
150	M	93.7	Very high	90.2	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-69.7	152	170.8	-68.6	178.9	-175.1	0	0	111	V140 Y143 L144 E154 A155 K158 L246	V140-M150 HydrophobicContact CG1-CE 4.27Å; Y143-M150 HydrophobicContact CD1-CE 3.48Å; Y143-M150 VanDerWaalsContact CD1-CE 3.48Å; Y143-M150 HydrophobicContact CD1-CG 4.12Å; Y143-M150 HydrophobicContact CD2-CE 4.12Å; Y143-M150 HydrophobicContact CE1-CE 3.86Å; Y143-M150 HydrophobicContact CE1-CG 3.74Å; Y143-M150 HydrophobicContact CE2-CE 4.41Å; Y143-M150 HydrophobicContact CG-CE 3.69Å; L144-M150 HydrophobicContact CD2-CE 4.35Å; L144-M150 HydrophobicContact CD2-CG 4.04Å; M150-E154 HydrophobicContact SD-CG 4.39Å; M150-A155 HydrophobicContact CB-CB 4.04Å; M150-K158 HydrophobicContact SD-CG 4.44Å; M150-L246 HydrophobicContact CE-CD2 3.99Å; M150-L246 PolarHBondContact N-O 3.04Å; M150-L246 HydrophobicContact SD-CD2 3.78Å
151	K	95.4	Very high	90.6	Very high	164 Å²	164	43.5 Å²	43.5	71%	0.713	21%	0.214	S	C	*	.	P	Polyproline II helix	trans	-74	145.3	166.2	-67	177.3	-177.4	173.8	0	109	K153 E154 A155	K151-K153 VanDerWaalsContact C-N 3.26Å; K151-K153 PolarHBondContact O-N 2.94Å; K151-K153 VanDerWaalsContact O-N 3.09Å; K151-E154 WeakPolarHBondContact O-CA 3.22Å; K151-E154 WeakPolarHBondContact O-CB 3.11Å; K151-E154 PolarHBondContact O-N 3.02Å; K151-A155 PolarHBondContact O-N 3.02Å
152	E	97.7	Very high	91.4	Very high	32 Å²	32	42.6 Å²	42.6	15%	0.15	21%	0.21	C	C	.	.	H	α-helix	trans	-55.7	-35.1	-173.4	-71.7	-173.9	-156.5	0	0	114.4	E154 A155 R156 V247 M276 S277 W306	E152-E154 VanDerWaalsContact C-N 3.31Å; E152-E154 PolarHBondContact O-N 2.74Å; E152-A155 PolarHBondContact O-N 2.88Å; E152-R156 WeakPolarHBondContact O-CB 3.2Å; E152-R156 PolarHBondContact O-N 2.81Å; E152-V247 HydrophobicContact CG-CB 4.49Å; E152-V247 HydrophobicContact CG-CG1 4.13Å; E152-M276 WeakPolarHBondContact OE1-CA 3.36Å; E152-S277 PolarHBondContact OE1-N 2.87Å; E152-S277 PolarHBondContact OE1-OG 2.88Å; E152-S277 WeakPolarHBondContact OE2-CB 3.32Å; E152-S277 PolarHBondContact OE2-OG 2.85Å; E152-W306 HydrophobicContact CB-CZ2 3.88Å; E152-W306 HydrophobicContact CG-CZ2 4.15Å; E152-W306 WeakPolarHBondContact O-CZ2 3.42Å; E152-W306 PolarHBondContact OE2-NE1 2.91Å
153	K	97.1	Very high	92.2	Very high	172 Å²	172	42 Å²	42	75%	0.748	21%	0.206	S	C	*	.	H	α-helix	trans	-62.1	-36.2	174.7	-178.5	171.9	-179.9	171.6	0	113	K151 A157	K151-K153 VanDerWaalsContact C-N 3.26Å; K151-K153 PolarHBondContact O-N 2.94Å; K151-K153 VanDerWaalsContact O-N 3.09Å; K153-A157 PolarHBondContact O-N 3.19Å
154	E	95.3	Very high	93	Very high	66 Å²	66	41.3 Å²	41.3	31%	0.308	21%	0.206	S	C	.	.	H	α-helix	trans	-79.4	-45.5	177.9	178	176	-153	0	0	111	Y143 M150 K151 E152 R156 A157 K158	Y143-E154 PolarHBondContact OH-OE1 2.82Å; Y143-E154 PolarHBondContact OH-OE2 3.14Å; M150-E154 HydrophobicContact SD-CG 4.39Å; K151-E154 WeakPolarHBondContact O-CA 3.22Å; K151-E154 WeakPolarHBondContact O-CB 3.11Å; K151-E154 PolarHBondContact O-N 3.02Å; E152-E154 VanDerWaalsContact C-N 3.31Å; E152-E154 PolarHBondContact O-N 2.74Å; E154-R156 VanDerWaalsContact C-N 3.26Å; E154-R156 PolarHBondContact O-N 2.75Å; E154-A157 PolarHBondContact O-N 3.42Å; E154-A157 VanDerWaalsContact O-N 3.12Å; E154-K158 PolarHBondContact O-N 2.93Å
155	A	97.2	Very high	93.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-54.8	-43.9	173.6	0	0	0	0	0	110.9	M150 K151 E152 A157 K158 F159 L246 V247 W306	M150-A155 HydrophobicContact CB-CB 4.04Å; K151-A155 PolarHBondContact O-N 3.02Å; E152-A155 PolarHBondContact O-N 2.88Å; A155-A157 PolarHBondContact O-N 3.44Å; A155-K158 PolarHBondContact O-N 2.9Å; A155-F159 WeakPolarHBondContact O-CB 3.44Å; A155-F159 PolarHBondContact O-N 3.18Å; A155-L246 HydrophobicContact CB-CB 4.19Å; A155-V247 HydrophobicContact CB-CG1 3.69Å; A155-W306 HydrophobicContact CB-CH2 4.19Å
156	R	98.3	Very high	94.8	Very high	30 Å²	30	40.1 Å²	40.1	11%	0.113	20%	0.199	C	C	.	.	H	α-helix	trans	-57.1	-46.7	174.8	179.4	-177.4	-57.3	135.8	13.9	112.7	E152 E154 K158 F159 R160 W306 A309	E152-R156 WeakPolarHBondContact O-CB 3.2Å; E152-R156 PolarHBondContact O-N 2.81Å; E154-R156 VanDerWaalsContact C-N 3.26Å; E154-R156 PolarHBondContact O-N 2.75Å; R156-K158 VanDerWaalsContact C-N 3.29Å; R156-K158 PolarHBondContact O-N 2.88Å; R156-F159 PolarHBondContact O-N 3.09Å; R156-R160 HydrophobicContact CG-CG 4.37Å; R156-R160 WeakPolarHBondContact O-CB 3.47Å; R156-R160 VanDerWaalsContact O-CG 3.3Å; R156-R160 WeakPolarHBondContact O-CG 3.4Å; R156-R160 PolarHBondContact O-N 3.49Å; R156-W306 HydrophobicContact CB-CH2 3.81Å; R156-W306 HydrophobicContact CB-CZ2 4.24Å; R156-W306 HydrophobicContact CB-CZ3 3.98Å; R156-W306 WeakPolarHBondContact CD-O 3.27Å; R156-W306 HydrophobicContact CG-CZ3 4.4Å; R156-W306 PolarHBondContact NE-O 2.81Å; R156-A309 WeakPolarHBondContact CD-O 3.01Å; R156-A309 PolarHBondContact NH1-O 2.83Å
157	A	97.1	Very high	95.8	Very high	40 Å²	40	38.7 Å²	38.7	33%	0.331	19%	0.186	S	C	.	.	H	α-helix	trans	-60.4	-39.6	179.8	0	0	0	0	0	112.1	K153 E154 A155	K153-A157 PolarHBondContact O-N 3.19Å; E154-A157 PolarHBondContact O-N 3.42Å; E154-A157 VanDerWaalsContact O-N 3.12Å; A155-A157 PolarHBondContact O-N 3.44Å
158	K	97.6	Very high	96.7	Very high	30 Å²	30	35.3 Å²	35.3	13%	0.13	17%	0.17	C	C	.	.	H	α-helix	trans	-73	-42.2	173.3	-53.5	-49.3	170.4	-165.4	0	112	M150 E154 A155 R156 R160 Q161 I162 M190 I192	M150-K158 HydrophobicContact SD-CG 4.44Å; E154-K158 PolarHBondContact O-N 2.93Å; A155-K158 PolarHBondContact O-N 2.9Å; R156-K158 VanDerWaalsContact C-N 3.29Å; R156-K158 PolarHBondContact O-N 2.88Å; K158-R160 PolarHBondContact O-N 2.95Å; K158-Q161 WeakPolarHBondContact O-CB 3.39Å; K158-Q161 PolarHBondContact O-N 2.7Å; K158-Q161 VanDerWaalsContact O-N 3.11Å; K158-I162 WeakPolarHBondContact O-CG1 3.31Å; K158-I162 PolarHBondContact O-N 2.84Å; K158-M190 WeakPolarHBondContact CE-O 3.43Å; K158-M190 PolarHBondContact NZ-O 3.46Å; K158-I192 HydrophobicContact CB-CD1 4.08Å; K158-I192 HydrophobicContact CB-CG1 3.97Å; K158-I192 HydrophobicContact CD-CG1 4.33Å
159	F	98.4	Very high	97.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-71.6	-29.7	-174.4	-160.5	-105.8	0	0	0	113.1	A155 R156 I162 V163 L239 I242 L243 L246 F287 W306 I307	A155-F159 WeakPolarHBondContact O-CB 3.44Å; A155-F159 PolarHBondContact O-N 3.18Å; R156-F159 PolarHBondContact O-N 3.09Å; F159-I162 HydrophobicContact CD2-CD1 4.08Å; F159-I162 PolarHBondContact O-N 3.39Å; F159-V163 HydrophobicContact CD1-CG2 3.87Å; F159-V163 HydrophobicContact CE1-CG2 3.59Å; F159-V163 HydrophobicContact CZ-CG2 4.01Å; F159-V163 WeakPolarHBondContact O-CB 3.43Å; F159-V163 VanDerWaalsContact O-CG2 3.32Å; F159-V163 WeakPolarHBondContact O-CG2 3.47Å; F159-V163 PolarHBondContact O-N 2.85Å; F159-L239 HydrophobicContact CE2-CB 4.38Å; F159-L239 HydrophobicContact CE2-CD2 4.29Å; F159-L239 WeakPolarHBondContact CE2-O 3.39Å; F159-L239 HydrophobicContact CZ-CB 4.11Å; F159-L239 WeakPolarHBondContact CZ-O 3.28Å; F159-I242 HydrophobicContact CD2-CG2 4.47Å; F159-I242 HydrophobicContact CE2-CG2 4.3Å; F159-L243 HydrophobicContact CD1-CD1 4.15Å; F159-L243 HydrophobicContact CD2-CB 4.24Å; F159-L243 HydrophobicContact CD2-CD1 4.36Å; F159-L243 HydrophobicContact CE1-CB 4.24Å; F159-L243 HydrophobicContact CE1-CD1 4.36Å; F159-L243 HydrophobicContact CE1-CD2 4.08Å; F159-L243 HydrophobicContact CE1-CG 4.46Å; F159-L243 HydrophobicContact CE2-CB 3.71Å; F159-L243 HydrophobicContact CG-CD1 4.15Å; F159-L243 HydrophobicContact CZ-CB 3.71Å; F159-L243 HydrophobicContact CZ-CD2 4.3Å; F159-L243 HydrophobicContact CZ-CG 4.41Å; F159-L246 HydrophobicContact CD2-CD1 4.1Å; F159-F287 AromaticContact CE1-CE2 3.59Å; F159-F287 HydrophobicContact CE1-CE2 3.59Å; F159-F287 AromaticContact CE1-CZ 3.49Å; F159-F287 HydrophobicContact CE1-CZ 3.49Å; F159-F287 VanDerWaalsContact CE1-CZ 3.49Å; F159-F287 HydrophobicContact CZ-CE1 4.32Å; F159-F287 AromaticContact CZ-CE2 3.67Å; F159-F287 HydrophobicContact CZ-CE2 3.67Å; F159-F287 AromaticContact CZ-CZ 3.45Å; F159-F287 HydrophobicContact CZ-CZ 3.45Å; F159-F287 VanDerWaalsContact CZ-CZ 3.45Å; F159-W306 HydrophobicContact CB-CZ3 4.38Å; F159-W306 HydrophobicContact CD1-CZ3 4.18Å; F159-I307 HydrophobicContact CD1-CD1 3.64Å; F159-I307 HydrophobicContact CE1-CD1 4.05Å
160	R	98.6	Very high	97.7	Very high	16 Å²	16	30.6 Å²	30.6	6%	0.06	14%	0.144	C	C	.	.	H	α-helix	trans	-56.7	-47	165.6	-74.3	170	69.2	83.8	-0.9	111.6	R156 K158 V163 S164 I307 N308 D314 L316	R156-R160 HydrophobicContact CG-CG 4.37Å; R156-R160 WeakPolarHBondContact O-CB 3.47Å; R156-R160 VanDerWaalsContact O-CG 3.3Å; R156-R160 WeakPolarHBondContact O-CG 3.4Å; R156-R160 PolarHBondContact O-N 3.49Å; K158-R160 PolarHBondContact O-N 2.95Å; R160-V163 PolarHBondContact O-N 2.91Å; R160-S164 WeakPolarHBondContact O-CB 3.15Å; R160-S164 PolarHBondContact O-N 3.12Å; R160-I307 WeakPolarHBondContact CD-O 3.24Å; R160-I307 HydrophobicContact CG-CG2 4.11Å; R160-I307 PolarHBondContact NH1-O 2.96Å; R160-N308 PolarHBondContact NH1-OD1 3.15Å; R160-D314 IonicContact CZ-OD2 3.77Å; R160-D314 PolarHBondContact NH2-O 3.44Å; R160-D314 IonicContact NH2-OD2 3.98Å; R160-D314 PolarHBondContact NH2-OD2 2.91Å; R160-L316 HydrophobicContact CB-CD1 4.46Å; R160-L316 HydrophobicContact CB-CD2 4.25Å; R160-L316 HydrophobicContact CG-CD2 4.29Å
161	Q	98.6	Very high	97.9	Very high	40 Å²	40	35.7 Å²	35.7	19%	0.187	17%	0.168	C	C	.	.	H	α-helix	trans	-63.5	-42	177.2	-68.2	179.2	-23.1	0	0	112.2	N114 K158 A165 N191 I192	N114-Q161 HydrophobicContact CB-CB 4.25Å; K158-Q161 WeakPolarHBondContact O-CB 3.39Å; K158-Q161 PolarHBondContact O-N 2.7Å; K158-Q161 VanDerWaalsContact O-N 3.11Å; Q161-A165 WeakPolarHBondContact O-CB 3.13Å; Q161-A165 PolarHBondContact O-N 3Å; Q161-A165 VanDerWaalsContact O-N 3.11Å; Q161-N191 PolarHBondContact NE2-OD1 2.83Å; Q161-I192 HydrophobicContact CB-CB 3.95Å; Q161-I192 HydrophobicContact CB-CG1 4.14Å
162	I	98.7	Very high	97.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64	-50.3	176.6	-59.6	162.3	0	0	0	110.7	K158 F159 S164 A165 V166 L184 I192 I194 L239 I242 L246	K158-I162 WeakPolarHBondContact O-CG1 3.31Å; K158-I162 PolarHBondContact O-N 2.84Å; F159-I162 HydrophobicContact CD2-CD1 4.08Å; F159-I162 PolarHBondContact O-N 3.39Å; I162-S164 VanDerWaalsContact C-N 3.34Å; I162-S164 PolarHBondContact O-N 2.88Å; I162-A165 PolarHBondContact O-N 2.96Å; I162-V166 HydrophobicContact CG2-CG2 4.39Å; I162-V166 WeakPolarHBondContact O-CG2 3.37Å; I162-V166 PolarHBondContact O-N 3.23Å; I162-L184 HydrophobicContact CD1-CD1 3.61Å; I162-L184 HydrophobicContact CD1-CD2 4.48Å; I162-L184 HydrophobicContact CG1-CD1 4.24Å; I162-L184 HydrophobicContact CG1-CD2 4.21Å; I162-L184 HydrophobicContact CG2-CD2 4.37Å; I162-I192 HydrophobicContact CD1-CD1 4.15Å; I162-I192 HydrophobicContact CD1-CG1 4.41Å; I162-I192 HydrophobicContact CG1-CB 4.4Å; I162-I192 HydrophobicContact CG1-CD1 4.1Å; I162-I192 HydrophobicContact CG1-CG1 3.94Å; I162-I192 HydrophobicContact CG1-CG2 3.78Å; I162-I194 HydrophobicContact CG2-CD1 4.26Å; I162-L239 HydrophobicContact CG2-CD2 3.29Å; I162-I242 HydrophobicContact CD1-CG2 4.22Å; I162-L246 HydrophobicContact CD1-CD1 4.45Å
163	V	98.8	Very high	97.9	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.1	-40.4	-179.3	169.2	0	0	0	0	111.4	F159 R160 Q167 L298 M302 L316	F159-V163 HydrophobicContact CD1-CG2 3.87Å; F159-V163 HydrophobicContact CE1-CG2 3.59Å; F159-V163 HydrophobicContact CZ-CG2 4.01Å; F159-V163 WeakPolarHBondContact O-CB 3.43Å; F159-V163 VanDerWaalsContact O-CG2 3.32Å; F159-V163 WeakPolarHBondContact O-CG2 3.47Å; F159-V163 PolarHBondContact O-N 2.85Å; R160-V163 PolarHBondContact O-N 2.91Å; V163-Q167 VanDerWaalsContact O-CB 3.25Å; V163-Q167 WeakPolarHBondContact O-CB 3.4Å; V163-Q167 PolarHBondContact O-N 2.76Å; V163-L298 HydrophobicContact CG1-CD2 4.49Å; V163-M302 HydrophobicContact CG1-CG 3.63Å; V163-L316 HydrophobicContact CB-CD2 4.23Å; V163-L316 HydrophobicContact CG1-CD2 4Å
164	S	98.8	Very high	97.9	Very high	14 Å²	14	27.9 Å²	27.9	10%	0.098	13%	0.13	C	C	.	.	H	α-helix	trans	-57.8	-50	173.3	-171	0	0	0	0	112.1	H112 R160 I162 Q167 Y168	H112-S164 PolarHBondContact NE2-OG 3.28Å; R160-S164 WeakPolarHBondContact O-CB 3.15Å; R160-S164 PolarHBondContact O-N 3.12Å; I162-S164 VanDerWaalsContact C-N 3.34Å; I162-S164 PolarHBondContact O-N 2.88Å; S164-Q167 PolarHBondContact O-N 2.78Å; S164-Y168 WeakPolarHBondContact O-CB 3.4Å; S164-Y168 PolarHBondContact O-N 2.94Å
165	A	98.7	Very high	98	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.4	-42.9	-178.5	0	0	0	0	0	112.9	H112 N114 I115 Q161 I162 C169 I194	H112-A165 VanDerWaalsContact CE1-CA 3.48Å; H112-A165 WeakPolarHBondContact CE1-CA 3.39Å; H112-A165 PolarHBondContact CE1-N 2.83Å; H112-A165 PolarHBondContact NE2-N 2.85Å; N114-A165 HydrophobicContact CB-CB 4.27Å; I115-A165 HydrophobicContact CD1-CB 4.3Å; I115-A165 HydrophobicContact CG1-CB 3.86Å; Q161-A165 WeakPolarHBondContact O-CB 3.13Å; Q161-A165 PolarHBondContact O-N 3Å; Q161-A165 VanDerWaalsContact O-N 3.11Å; I162-A165 PolarHBondContact O-N 2.96Å; A165-C169 PolarHBondContact O-N 3.15Å; A165-C169 VanDerWaalsContact O-N 3.13Å; A165-C169 PolarHBondContact O-SG 3.05Å; A165-C169 VanDerWaalsContact O-SG 3.37Å; A165-I194 HydrophobicContact CB-CD1 3.58Å; A165-I194 HydrophobicContact CB-CG1 4.19Å
166	V	98.7	Very high	98	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.018	12%	0.116	C	C	.	.	H	α-helix	trans	-74	-36.7	-179.7	-177.9	0	0	0	0	111.6	I162 Y168 C169 H170 L179 I194 D235 L239 L298	I162-V166 HydrophobicContact CG2-CG2 4.39Å; I162-V166 WeakPolarHBondContact O-CG2 3.37Å; I162-V166 PolarHBondContact O-N 3.23Å; V166-Y168 VanDerWaalsContact C-N 3.34Å; V166-Y168 PolarHBondContact O-N 2.83Å; V166-C169 WeakPolarHBondContact O-CB 3.48Å; V166-C169 PolarHBondContact O-N 3.42Å; V166-H170 PolarHBondContact O-CD2 3.09Å; V166-H170 PolarHBondContact O-N 3Å; V166-L179 HydrophobicContact CG1-CD1 3.98Å; V166-L179 HydrophobicContact CG2-CD1 3.78Å; V166-L179 HydrophobicContact CG2-CD2 4.09Å; V166-I194 HydrophobicContact CG2-CD1 3.68Å; V166-D235 HydrophobicContact CG1-CB 4.07Å; V166-L239 HydrophobicContact CB-CD1 4.14Å; V166-L239 HydrophobicContact CG1-CD1 4.03Å; V166-L239 HydrophobicContact CG2-CD1 4.35Å; V166-L239 HydrophobicContact CG2-CD2 4.31Å; V166-L298 HydrophobicContact CB-CD1 4.02Å; V166-L298 HydrophobicContact CG1-CD1 3.77Å
167	Q	98.6	Very high	97.8	Very high	5 Å²	5	24.2 Å²	24.2	2%	0.023	11%	0.114	C	C	.	.	H	α-helix	trans	-64.3	-39.6	173.6	-176.8	-81.6	-29.2	0	0	111.5	V163 S164 C169 H170 Q171 L298 E299 M302	V163-Q167 VanDerWaalsContact O-CB 3.25Å; V163-Q167 WeakPolarHBondContact O-CB 3.4Å; V163-Q167 PolarHBondContact O-N 2.76Å; S164-Q167 PolarHBondContact O-N 2.78Å; Q167-C169 PolarHBondContact O-N 2.97Å; Q167-H170 PolarHBondContact O-N 2.8Å; Q167-H170 VanDerWaalsContact O-N 3.16Å; Q167-Q171 WeakPolarHBondContact O-CB 3.17Å; Q167-Q171 PolarHBondContact O-N 3.19Å; Q167-L298 HydrophobicContact CB-CB 3.88Å; Q167-L298 HydrophobicContact CB-CD1 3.95Å; Q167-L298 HydrophobicContact CG-CB 4.04Å; Q167-E299 HydrophobicContact CG-CG 4.46Å; Q167-M302 HydrophobicContact CB-CE 3.92Å; Q167-M302 HydrophobicContact CB-SD 4.13Å; Q167-M302 HydrophobicContact CG-CE 4.05Å; Q167-M302 HydrophobicContact CG-SD 3.77Å
168	Y	98.6	Very high	97.7	Very high	4 Å²	4	22.5 Å²	22.5	2%	0.016	10%	0.099	C	C	.	.	H	α-helix	trans	-59.2	-43.5	172.8	167	-98.6	0	0	0	112.3	L110 N111 H112 I115 S164 V166 Q171 K172 F319 E321	L110-Y168 HydrophobicContact CB-CE1 4.39Å; L110-Y168 HydrophobicContact CD2-CD1 3.97Å; L110-Y168 HydrophobicContact CD2-CE1 3.47Å; L110-Y168 VanDerWaalsContact CD2-CE1 3.47Å; N111-Y168 PolarHBondContact N-OH 2.68Å; H112-Y168 HydrophobicContact CB-CD1 3.64Å; H112-Y168 HydrophobicContact CB-CE1 3.73Å; H112-Y168 HydrophobicContact CB-CG 4.18Å; H112-Y168 AromaticContact CD2-CG 3.93Å; I115-Y168 HydrophobicContact CD1-CD1 3.9Å; I115-Y168 HydrophobicContact CD1-CE1 4.2Å; S164-Y168 WeakPolarHBondContact O-CB 3.4Å; S164-Y168 PolarHBondContact O-N 2.94Å; V166-Y168 VanDerWaalsContact C-N 3.34Å; V166-Y168 PolarHBondContact O-N 2.83Å; Y168-Q171 PolarHBondContact O-N 3.06Å; Y168-K172 HydrophobicContact CE2-CD 4.26Å; Y168-K172 PolarHBondContact O-N 3.04Å; Y168-K172 VanDerWaalsContact OH-CE 3.28Å; Y168-K172 WeakPolarHBondContact OH-CE 3.34Å; Y168-K172 PolarHBondContact OH-NZ 3Å; Y168-K172 VanDerWaalsContact OH-NZ 3.12Å; Y168-F319 AromaticContact CD2-CD1 3.71Å; Y168-F319 HydrophobicContact CD2-CD1 3.71Å; Y168-F319 HydrophobicContact CD2-CE1 4.49Å; Y168-F319 HydrophobicContact CE2-CD1 4.03Å; Y168-F319 HydrophobicContact CE2-CE1 4.4Å; Y168-F319 HydrophobicContact CG-CD1 4.32Å; Y168-E321 HydrophobicContact CE2-CB 4.24Å; Y168-E321 WeakPolarHBondContact CE2-OE2 3.42Å; Y168-E321 PolarHBondContact OH-OE2 3Å
169	C	98.3	Very high	97.6	Very high	4 Å²	4	21.1 Å²	21.1	3%	0.027	9%	0.093	C	C	.	.	H	α-helix	trans	-58.2	-48.3	171.2	-68.3	0	0	0	0	111.7	A165 V166 Q167 Q171 K172 R173 I174	A165-C169 PolarHBondContact O-N 3.15Å; A165-C169 VanDerWaalsContact O-N 3.13Å; A165-C169 PolarHBondContact O-SG 3.05Å; A165-C169 VanDerWaalsContact O-SG 3.37Å; V166-C169 WeakPolarHBondContact O-CB 3.48Å; V166-C169 PolarHBondContact O-N 3.42Å; Q167-C169 PolarHBondContact O-N 2.97Å; C169-Q171 VanDerWaalsContact C-N 3.31Å; C169-Q171 PolarHBondContact O-N 3.34Å; C169-K172 CarbonylContact O-C 3.05Å; C169-K172 WeakPolarHBondContact O-CA 3.5Å; C169-K172 PolarHBondContact O-N 2.84Å; C169-K172 VanDerWaalsContact O-N 3.09Å; C169-R173 PolarHBondContact O-N 2.86Å; C169-I174 CarbonylContact C-O 3.49Å; C169-I174 HydrophobicContact CB-CB 4.23Å; C169-I174 HydrophobicContact CB-CG2 4.31Å; C169-I174 PolarHBondContact O-N 3.28Å; C169-I174 VanDerWaalsContact O-O 3.12Å
170	H	97.8	Very high	97.3	Very high	20 Å²	20	22.6 Å²	22.6	9%	0.093	10%	0.099	C	C	.	.	H	α-helix	trans	-62	-37.8	-179.2	-67.8	-176.8	0	0	0	112.2	V166 Q167 R173 I174 P232 D235	V166-H170 PolarHBondContact O-CD2 3.09Å; V166-H170 PolarHBondContact O-N 3Å; Q167-H170 PolarHBondContact O-N 2.8Å; Q167-H170 VanDerWaalsContact O-N 3.16Å; H170-R173 PolarHBondContact O-N 3.37Å; H170-R173 VanDerWaalsContact O-N 3.08Å; H170-I174 PolarHBondContact CD2-O 3.27Å; H170-I174 PolarHBondContact N-O 3.43Å; H170-P232 PolarHBondContact CE1-O 2.81Å; H170-P232 VanDerWaalsContact CE1-O 3.31Å; H170-D235 IonicContact CD2-OD2 2.67Å; H170-D235 IonicContact CE1-OD2 3.28Å; H170-D235 WeakPolarHBondContact NE2-CB 3.44Å; H170-D235 IonicContact NE2-OD2 2.94Å; H170-D235 PolarHBondContact NE2-OD2 2.67Å
171	Q	97.1	Very high	96.6	Very high	110 Å²	110	21.9 Å²	21.9	51%	0.514	10%	0.097	S	C	.	.	H	α-helix	trans	-63.8	-39.4	173.8	-176.9	172.8	-19.3	0	0	111.8	Q167 Y168 C169 R173	Q167-Q171 WeakPolarHBondContact O-CB 3.17Å; Q167-Q171 PolarHBondContact O-N 3.19Å; Y168-Q171 PolarHBondContact O-N 3.06Å; C169-Q171 VanDerWaalsContact C-N 3.31Å; C169-Q171 PolarHBondContact O-N 3.34Å; Q171-R173 PolarHBondContact O-N 3.44Å
172	K	96.9	Very high	95.9	Very high	73 Å²	73	21.8 Å²	21.8	32%	0.317	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	16.9	170.5	-71	-156.5	175.6	-171.1	0	114.5	I109 Y168 C169 I174 E321	I109-K172 WeakPolarHBondContact O-CD 3.44Å; I109-K172 PolarHBondContact O-NZ 2.91Å; Y168-K172 HydrophobicContact CE2-CD 4.26Å; Y168-K172 PolarHBondContact O-N 3.04Å; Y168-K172 VanDerWaalsContact OH-CE 3.28Å; Y168-K172 WeakPolarHBondContact OH-CE 3.34Å; Y168-K172 PolarHBondContact OH-NZ 3Å; Y168-K172 VanDerWaalsContact OH-NZ 3.12Å; C169-K172 CarbonylContact O-C 3.05Å; C169-K172 WeakPolarHBondContact O-CA 3.5Å; C169-K172 PolarHBondContact O-N 2.84Å; C169-K172 VanDerWaalsContact O-N 3.09Å; K172-I174 HydrophobicContact CB-CD1 3.98Å; K172-I174 PolarHBondContact O-N 2.73Å; K172-E321 WeakPolarHBondContact CE-OE2 3.46Å; K172-E321 IonicContact NZ-OE1 2.81Å; K172-E321 IonicContact NZ-OE2 3.48Å; K172-E321 PolarHBondContact NZ-OE2 3.01Å
173	R	97.1	Very high	95.6	Very high	129 Å²	129	22.6 Å²	22.6	49%	0.487	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	26.9	179.7	-59.6	-62	-178.1	-166.7	-3.8	114.8	C169 H170 Q171 E202 F203	C169-R173 PolarHBondContact O-N 2.86Å; H170-R173 PolarHBondContact O-N 3.37Å; H170-R173 VanDerWaalsContact O-N 3.08Å; Q171-R173 PolarHBondContact O-N 3.44Å; R173-E202 CarbonylContact O-C 3.51Å; R173-E202 VanDerWaalsContact O-CA 3.29Å; R173-E202 WeakPolarHBondContact O-CA 3.48Å; R173-F203 VanDerWaalsContact C-CE1 3.43Å; R173-F203 VanDerWaalsContact CA-CE1 3.45Å; R173-F203 HydrophobicContact CB-CD1 4.44Å; R173-F203 HydrophobicContact CB-CE1 4.35Å; R173-F203 WeakPolarHBondContact O-CD1 3.34Å; R173-F203 PolarHBondContact O-N 3.28Å
174	I	97.5	Very high	95.4	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	136	178	-64.9	152.8	0	0	0	109.6	I106 I109 L110 C169 H170 K172 N201	I106-I174 HydrophobicContact CD1-CG1 4.49Å; I106-I174 HydrophobicContact CD1-CG2 4.23Å; I106-I174 HydrophobicContact CG1-CG1 4.28Å; I106-I174 HydrophobicContact CG2-CD1 4.16Å; I106-I174 HydrophobicContact CG2-CG1 4.44Å; I106-I174 HydrophobicContact CG2-CG2 3.89Å; I109-I174 HydrophobicContact CD1-CD1 3.98Å; I109-I174 HydrophobicContact CG1-CD1 4.16Å; L110-I174 HydrophobicContact CD1-CD1 4.41Å; L110-I174 HydrophobicContact CD2-CD1 3.73Å; L110-I174 HydrophobicContact CG-CD1 4.03Å; C169-I174 CarbonylContact C-O 3.49Å; C169-I174 HydrophobicContact CB-CB 4.23Å; C169-I174 HydrophobicContact CB-CG2 4.31Å; C169-I174 PolarHBondContact O-N 3.28Å; C169-I174 VanDerWaalsContact O-O 3.12Å; H170-I174 PolarHBondContact CD2-O 3.27Å; H170-I174 PolarHBondContact N-O 3.43Å; K172-I174 HydrophobicContact CB-CD1 3.98Å; K172-I174 PolarHBondContact O-N 2.73Å; I174-N201 WeakPolarHBondContact CA-O 3.5Å
175	V	96.9	Very high	95.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	141.2	170.4	-71.6	0	0	0	0	110.4	R177 S200 N201 F203 L209 P232 D235	V175-R177 HydrophobicContact CB-CG 4.23Å; V175-R177 HydrophobicContact CG2-CG 4Å; V175-S200 CarbonylContact O-C 3.54Å; V175-S200 WeakPolarHBondContact O-CA 3.27Å; V175-S200 WeakPolarHBondContact O-CB 3.39Å; V175-N201 HydrophobicContact CG2-CB 4.4Å; V175-N201 WeakPolarHBondContact CG2-O 3.43Å; V175-N201 PolarHBondContact N-O 3.26Å; V175-N201 PolarHBondContact O-N 3.41Å; V175-F203 HydrophobicContact CG1-CD1 3.59Å; V175-F203 HydrophobicContact CG1-CE1 3.88Å; V175-F203 HydrophobicContact CG1-CG 4.38Å; V175-L209 HydrophobicContact CG2-CD1 3.94Å; V175-P232 HydrophobicContact CG1-CG 4.02Å; V175-D235 WeakPolarHBondContact CA-OD2 3.36Å
176	H	96.9	Very high	95	Very high	3 Å²	3	23.9 Å²	23.9	1%	0.014	11%	0.106	C	C	.	.			trans	-88	-43.9	-169.6	-169	-78.5	0	0	0	112.7	D178 L179 A195 F197 F199 S200 D235	H176-D178 PolarHBondContact CE1-O 3.47Å; H176-D178 VanDerWaalsContact ND1-C 3.34Å; H176-D178 PolarHBondContact ND1-O 2.71Å; H176-D178 PolarHBondContact O-N 2.65Å; H176-L179 HydrophobicContact CB-CD1 4.32Å; H176-L179 HydrophobicContact CB-CD2 4.04Å; H176-L179 HydrophobicContact CB-CG 3.84Å; H176-L179 PolarHBondContact ND1-N 3.41Å; H176-A195 PolarHBondContact NE2-O 3.15Å; H176-F197 AromaticContact CD2-CD1 3.86Å; H176-F197 AromaticContact CD2-CE1 3.6Å; H176-F197 AromaticContact CD2-CZ 3.81Å; H176-F199 CarbonylContact O-C 3.5Å; H176-S200 PolarHBondContact O-N 2.83Å; H176-D235 PolarHBondContact N-OD1 3.45Å; H176-D235 PolarHBondContact N-OD2 3.45Å
177	R	95.3	Very high	94.7	Very high	17 Å²	17	25.1 Å²	25.1	6%	0.064	11%	0.113	C	C	.	.	S	Bend	trans	63.8	-13.2	174.3	-50.8	-170.7	-62	173.8	-0.1	117.6	V175 F199 G214 Y229 V234 D235	V175-R177 HydrophobicContact CB-CG 4.23Å; V175-R177 HydrophobicContact CG2-CG 4Å; R177-F199 PolarHBondContact NE-O 3.41Å; R177-F199 PolarHBondContact NH2-O 2.83Å; R177-G214 WeakPolarHBondContact O-CA 3.17Å; R177-Y229 WeakPolarHBondContact CD-OH 3.36Å; R177-Y229 PolarHBondContact NH1-OH 2.77Å; R177-V234 HydrophobicContact CG-CG2 4.18Å; R177-D235 WeakPolarHBondContact CA-OD1 3.42Å; R177-D235 PolarHBondContact N-OD1 2.58Å
178	D	94.1	Very high	94.2	Very high	3 Å²	3	26.3 Å²	26.3	2%	0.016	12%	0.123	C	C	.	.			trans	-124.1	51.4	167.6	-167.2	38.8	0	0	0	111.7	H176 K180 N183 F199 G214 S215	H176-D178 PolarHBondContact CE1-O 3.47Å; H176-D178 VanDerWaalsContact ND1-C 3.34Å; H176-D178 PolarHBondContact ND1-O 2.71Å; H176-D178 PolarHBondContact O-N 2.65Å; D178-K180 PolarHBondContact O-N 3.01Å; D178-K180 IonicContact OD1-NZ 2.83Å; D178-K180 IonicContact OD2-NZ 3.19Å; D178-K180 PolarHBondContact OD2-NZ 3.4Å; D178-N183 PolarHBondContact O-ND2 2.9Å; D178-N183 PolarHBondContact OD2-ND2 3.11Å; D178-N183 VanDerWaalsContact OD2-ND2 3.15Å; D178-F199 HydrophobicContact CB-CB 3.99Å; D178-F199 HydrophobicContact CB-CD2 3.7Å; D178-F199 HydrophobicContact CB-CG 4.15Å; D178-G214 VanDerWaalsContact OD1-CA 3.28Å; D178-G214 WeakPolarHBondContact OD1-CA 3.44Å; D178-S215 WeakPolarHBondContact OD1-CB 3.37Å; D178-S215 PolarHBondContact OD1-N 2.94Å; D178-S215 PolarHBondContact OD1-OG 3.46Å
179	L	96.4	Very high	93.7	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	15%	0.147	C	C	.	.			trans	-76.6	116.8	172.9	-73.8	173.9	0	0	0	110.1	V166 H176 I194 Y218 D235 L239 I242	V166-L179 HydrophobicContact CG1-CD1 3.98Å; V166-L179 HydrophobicContact CG2-CD1 3.78Å; V166-L179 HydrophobicContact CG2-CD2 4.09Å; H176-L179 HydrophobicContact CB-CD1 4.32Å; H176-L179 HydrophobicContact CB-CD2 4.04Å; H176-L179 HydrophobicContact CB-CG 3.84Å; H176-L179 PolarHBondContact ND1-N 3.41Å; L179-I194 HydrophobicContact CD2-CG2 4.21Å; L179-Y218 WeakPolarHBondContact O-CB 3.47Å; L179-D235 HydrophobicContact CD1-CB 3.71Å; L179-L239 HydrophobicContact CD1-CD2 4.28Å; L179-L239 HydrophobicContact CD1-CG 4.16Å; L179-I242 HydrophobicContact CB-CD1 4.01Å
180	K	90.4	Very high	93.3	Very high	31 Å²	31	32 Å²	32	14%	0.135	15%	0.153	C	C	.	.			trans	-152.1	160.5	-178.7	66.1	-167.8	-173.4	-146	0	110.9	D178 E182 N183 L184 S215 Y218	D178-K180 PolarHBondContact O-N 3.01Å; D178-K180 IonicContact OD1-NZ 2.83Å; D178-K180 IonicContact OD2-NZ 3.19Å; D178-K180 PolarHBondContact OD2-NZ 3.4Å; K180-E182 WeakPolarHBondContact CB-OE2 3.43Å; K180-E182 HydrophobicContact CD-CB 4.33Å; K180-E182 HydrophobicContact CG-CB 4.06Å; K180-E182 PolarHBondContact O-N 2.52Å; K180-E182 VanDerWaalsContact O-N 3.13Å; K180-N183 WeakPolarHBondContact CE-ND2 3.39Å; K180-N183 VanDerWaalsContact CE-OD1 3.27Å; K180-N183 WeakPolarHBondContact CE-OD1 3.28Å; K180-N183 HydrophobicContact CG-CB 3.95Å; K180-N183 PolarHBondContact O-N 2.95Å; K180-L184 PolarHBondContact O-N 3.38Å; K180-S215 WeakPolarHBondContact CD-OG 3.35Å; K180-S215 PolarHBondContact NZ-OG 3.11Å; K180-Y218 HydrophobicContact CB-CD1 4.15Å; K180-Y218 HydrophobicContact CB-CD2 3.59Å; K180-Y218 HydrophobicContact CB-CE1 3.98Å; K180-Y218 HydrophobicContact CB-CE2 3.37Å; K180-Y218 HydrophobicContact CB-CG 3.96Å
181	A	85.4	Confident	93.2	Very high	2 Å²	2	33.4 Å²	33.4	2%	0.017	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.5	-176.6	0	0	0	0	0	114	F141 Y218	F141-A181 HydrophobicContact CB-CB 3.96Å; F141-A181 HydrophobicContact CD2-CB 4.07Å; F141-A181 PolarHBondContact N-O 3.29Å; A181-Y218 WeakPolarHBondContact CB-OH 3.19Å; A181-Y218 PolarHBondContact N-OH 3.37Å; A181-Y218 VanDerWaalsContact N-OH 3.12Å
182	E	83.4	Confident	93.2	Very high	37 Å²	37	28.2 Å²	28.2	17%	0.173	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-29.9	174.2	-52.4	93.7	119.1	0	0	113.2	E139 K180 L184 Y218 S737	E139-E182 WeakPolarHBondContact OE2-CA 3.45Å; K180-E182 WeakPolarHBondContact CB-OE2 3.43Å; K180-E182 HydrophobicContact CD-CB 4.33Å; K180-E182 HydrophobicContact CG-CB 4.06Å; K180-E182 PolarHBondContact O-N 2.52Å; K180-E182 VanDerWaalsContact O-N 3.13Å; E182-L184 VanDerWaalsContact C-N 3.28Å; E182-Y218 PolarHBondContact OE2-OH 3.03Å; E182-S737 WeakPolarHBondContact CG-OG 3.49Å
183	N	91.4	Very high	93.2	Very high	17 Å²	17	25.4 Å²	25.4	9%	0.091	13%	0.125	C	C	.	.	S	Bend	trans	-90	5.4	176.9	-71.2	-3.1	0	0	0	112.1	D178 K180 A195	D178-N183 PolarHBondContact O-ND2 2.9Å; D178-N183 PolarHBondContact OD2-ND2 3.11Å; D178-N183 VanDerWaalsContact OD2-ND2 3.15Å; K180-N183 WeakPolarHBondContact CE-ND2 3.39Å; K180-N183 VanDerWaalsContact CE-OD1 3.27Å; K180-N183 WeakPolarHBondContact CE-OD1 3.28Å; K180-N183 HydrophobicContact CG-CB 3.95Å; K180-N183 PolarHBondContact O-N 2.95Å; N183-A195 PolarHBondContact O-N 2.63Å
184	L	95	Very high	93.3	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	102.4	172	-61.9	179.5	0	0	0	108.7	V140 I162 K180 E182 I192 I194 I242	V140-L184 HydrophobicContact CB-CB 3.93Å; V140-L184 HydrophobicContact CG2-CB 3.71Å; V140-L184 WeakPolarHBondContact CG2-O 3.41Å; V140-L184 PolarHBondContact N-O 3.32Å; I162-L184 HydrophobicContact CD1-CD1 3.61Å; I162-L184 HydrophobicContact CD1-CD2 4.48Å; I162-L184 HydrophobicContact CG1-CD1 4.24Å; I162-L184 HydrophobicContact CG1-CD2 4.21Å; I162-L184 HydrophobicContact CG2-CD2 4.37Å; K180-L184 PolarHBondContact O-N 3.38Å; E182-L184 VanDerWaalsContact C-N 3.28Å; L184-I192 HydrophobicContact CD2-CG2 4.4Å; L184-I194 HydrophobicContact CD2-CD1 4.22Å; L184-I194 HydrophobicContact CD2-CG1 3.77Å; L184-I242 HydrophobicContact CD1-CD1 4.23Å; L184-I242 HydrophobicContact CD1-CG2 3.83Å
185	L	95.1	Very high	93.1	Very high	41 Å²	41	20 Å²	20	22%	0.215	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	167.1	177	-50.5	-177.5	0	0	0	111.2	A135 G138 E139 I192 K193 A195	A135-L185 HydrophobicContact CB-CB 3.58Å; A135-L185 HydrophobicContact CB-CD1 4Å; A135-L185 HydrophobicContact CB-CG 4.45Å; G138-L185 CarbonylContact O-C 3.51Å; G138-L185 WeakPolarHBondContact O-CA 3.4Å; E139-L185 HydrophobicContact CG-CD2 3.76Å; L185-I192 CarbonylContact O-C 3.55Å; L185-I192 WeakPolarHBondContact O-CA 3.12Å; L185-K193 HydrophobicContact CB-CB 4.2Å; L185-K193 WeakPolarHBondContact CB-O 3.42Å; L185-K193 PolarHBondContact N-O 2.84Å; L185-K193 PolarHBondContact O-N 2.81Å; L185-A195 HydrophobicContact CD1-CB 3.81Å; L185-A195 HydrophobicContact CG-CB 4.03Å
186	L	93.9	Very high	92.8	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.7	179.4	-68.2	162.8	0	0	0	110.3	A135 S136 G137 G138 V140 M190 N191 I192	A135-L186 CarbonylContact C-O 3.55Å; A135-L186 WeakPolarHBondContact CB-O 3.41Å; S136-L186 PolarHBondContact N-O 3.3Å; G137-L186 VanDerWaalsContact CA-O 3.27Å; G137-L186 WeakPolarHBondContact CA-O 3.28Å; G137-L186 PolarHBondContact N-O 2.7Å; G138-L186 PolarHBondContact O-N 2.83Å; V140-L186 HydrophobicContact CG2-CD1 4.09Å; V140-L186 HydrophobicContact CG2-CD2 3.91Å; V140-L186 HydrophobicContact CG2-CG 3.82Å; L186-M190 HydrophobicContact CD1-CE 3.78Å; L186-M190 VanDerWaalsContact CD2-O 3.31Å; L186-M190 WeakPolarHBondContact CD2-O 3.21Å; L186-N191 WeakPolarHBondContact CA-O 3.3Å; L186-I192 HydrophobicContact CD2-CD1 4.22Å
187	D	91.8	Very high	92.6	Very high	28 Å²	28	23 Å²	23	15%	0.15	12%	0.124	C	C	.	.			trans	-80.4	-179.1	171.2	71.6	19.8	0	0	0	112.8	D189 M190 N191 K193	D187-D189 PolarHBondContact O-N 3.27Å; D187-D189 WeakPolarHBondContact OD1-CA 3.44Å; D187-D189 PolarHBondContact OD1-N 2.91Å; D187-M190 WeakPolarHBondContact O-CA 3.18Å; D187-M190 PolarHBondContact O-N 2.74Å; D187-M190 PolarHBondContact OD1-N 3.38Å; D187-M190 VanDerWaalsContact OD1-N 3.09Å; D187-N191 PolarHBondContact N-O 2.94Å; D187-N191 PolarHBondContact OD1-N 2.93Å; D187-N191 PolarHBondContact OD1-ND2 2.86Å; D187-N191 VanDerWaalsContact OD1-ND2 3.12Å; D187-N191 WeakPolarHBondContact OD2-CB 3.48Å; D187-N191 PolarHBondContact OD2-ND2 2.76Å; D187-K193 HydrophobicContact CB-CG 4.28Å
188	A	88.4	Confident	92.2	Very high	30 Å²	30	23 Å²	23	25%	0.248	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.9	-179.3	0	0	0	0	0	113.9	R659	A188-R659 WeakPolarHBondContact O-CD 3.39Å; A188-R659 PolarHBondContact O-NE 3.48Å; A188-R659 PolarHBondContact O-NH1 3.33Å
189	D	88.9	Confident	91.8	Very high	96 Å²	96	26.9 Å²	26.9	51%	0.513	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	7.4	173.7	-87.3	-56.5	0	0	0	113.2	D187 N191 R659	D187-D189 PolarHBondContact O-N 3.27Å; D187-D189 WeakPolarHBondContact OD1-CA 3.44Å; D187-D189 PolarHBondContact OD1-N 2.91Å; D189-N191 VanDerWaalsContact C-N 3.31Å; D189-N191 WeakPolarHBondContact CB-ND2 3.28Å; D189-R659 IonicContact OD1-CZ 2.7Å; D189-R659 IonicContact OD1-NH1 2.89Å; D189-R659 PolarHBondContact OD1-NH1 3.39Å; D189-R659 IonicContact OD1-NH2 3.21Å; D189-R659 PolarHBondContact OD1-NH2 3.26Å
190	M	89.6	Confident	91.6	Very high	31 Å²	31	26.9 Å²	26.9	15%	0.153	15%	0.146	C	C	.	.			trans	66.7	22.5	-177.1	-54.2	-68.8	-67.3	0	0	113.9	Y143 K158 L186 D187 T661	Y143-M190 HydrophobicContact CD2-CE 3.82Å; Y143-M190 HydrophobicContact CE2-CE 4.22Å; K158-M190 WeakPolarHBondContact CE-O 3.43Å; K158-M190 PolarHBondContact NZ-O 3.46Å; L186-M190 HydrophobicContact CD1-CE 3.78Å; L186-M190 VanDerWaalsContact CD2-O 3.31Å; L186-M190 WeakPolarHBondContact CD2-O 3.21Å; D187-M190 WeakPolarHBondContact O-CA 3.18Å; D187-M190 PolarHBondContact O-N 2.74Å; D187-M190 PolarHBondContact OD1-N 3.38Å; D187-M190 VanDerWaalsContact OD1-N 3.09Å; M190-T661 HydrophobicContact CE-CG2 3.44Å; M190-T661 VanDerWaalsContact CE-CG2 3.44Å; M190-T661 HydrophobicContact SD-CG2 4.49Å
191	N	95.1	Very high	91.6	Very high	51 Å²	51	26.7 Å²	26.7	27%	0.273	15%	0.147	S	C	.	.			trans	-78.3	150.6	172.2	-52.1	-74.8	0	0	0	110.9	Q161 L186 D187 D189	Q161-N191 PolarHBondContact NE2-OD1 2.83Å; L186-N191 WeakPolarHBondContact CA-O 3.3Å; D187-N191 PolarHBondContact N-O 2.94Å; D187-N191 PolarHBondContact OD1-N 2.93Å; D187-N191 PolarHBondContact OD1-ND2 2.86Å; D187-N191 VanDerWaalsContact OD1-ND2 3.12Å; D187-N191 WeakPolarHBondContact OD2-CB 3.48Å; D187-N191 PolarHBondContact OD2-ND2 2.76Å; D189-N191 VanDerWaalsContact C-N 3.31Å; D189-N191 WeakPolarHBondContact CB-ND2 3.28Å
192	I	97.6	Very high	91.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	139.6	177	-66.7	-69	0	0	0	111	N114 V140 K158 Q161 I162 L184 L185 L186 I194	N114-I192 WeakPolarHBondContact CA-O 3.44Å; N114-I192 HydrophobicContact CB-CB 4.45Å; N114-I192 HydrophobicContact CB-CG2 4.38Å; N114-I192 VanDerWaalsContact CB-O 3.23Å; N114-I192 WeakPolarHBondContact CB-O 3.43Å; N114-I192 PolarHBondContact ND2-O 2.92Å; V140-I192 HydrophobicContact CG2-CD1 3.42Å; V140-I192 VanDerWaalsContact CG2-CD1 3.42Å; K158-I192 HydrophobicContact CB-CD1 4.08Å; K158-I192 HydrophobicContact CB-CG1 3.97Å; K158-I192 HydrophobicContact CD-CG1 4.33Å; Q161-I192 HydrophobicContact CB-CB 3.95Å; Q161-I192 HydrophobicContact CB-CG1 4.14Å; I162-I192 HydrophobicContact CD1-CD1 4.15Å; I162-I192 HydrophobicContact CD1-CG1 4.41Å; I162-I192 HydrophobicContact CG1-CB 4.4Å; I162-I192 HydrophobicContact CG1-CD1 4.1Å; I162-I192 HydrophobicContact CG1-CG1 3.94Å; I162-I192 HydrophobicContact CG1-CG2 3.78Å; L184-I192 HydrophobicContact CD2-CG2 4.4Å; L185-I192 CarbonylContact O-C 3.55Å; L185-I192 WeakPolarHBondContact O-CA 3.12Å; L186-I192 HydrophobicContact CD2-CD1 4.22Å; I192-I194 HydrophobicContact CG2-CG1 4.06Å
193	K	97.8	Very high	92.3	Very high	15 Å²	15	29.5 Å²	29.5	7%	0.065	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	102.7	168.8	-64.7	-67	-176.7	169.3	0	108.7	P113 N114 V116 E133 A135 L185 D187	P113-K193 WeakPolarHBondContact O-CE 3.49Å; P113-K193 PolarHBondContact O-NZ 3.12Å; N114-K193 WeakPolarHBondContact O-CA 3.27Å; V116-K193 HydrophobicContact CG2-CB 3.93Å; E133-K193 WeakPolarHBondContact OE1-CE 3.35Å; E133-K193 IonicContact OE1-NZ 2.64Å; E133-K193 PolarHBondContact OE1-NZ 2.86Å; E133-K193 IonicContact OE2-NZ 3.1Å; E133-K193 PolarHBondContact OE2-NZ 3.49Å; A135-K193 HydrophobicContact CB-CB 4.21Å; A135-K193 HydrophobicContact CB-CG 4.25Å; L185-K193 HydrophobicContact CB-CB 4.2Å; L185-K193 WeakPolarHBondContact CB-O 3.42Å; L185-K193 PolarHBondContact N-O 2.84Å; L185-K193 PolarHBondContact O-N 2.81Å; D187-K193 HydrophobicContact CB-CG 4.28Å
194	I	98	Very high	92.2	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.015	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	133	175.4	-54	-168.3	0	0	0	109.4	N114 V116 I162 A165 V166 L179 L184 I192 F197	N114-I194 PolarHBondContact O-N 2.89Å; V116-I194 WeakPolarHBondContact CG2-O 3.49Å; V116-I194 PolarHBondContact N-O 3.07Å; I162-I194 HydrophobicContact CG2-CD1 4.26Å; A165-I194 HydrophobicContact CB-CD1 3.58Å; A165-I194 HydrophobicContact CB-CG1 4.19Å; V166-I194 HydrophobicContact CG2-CD1 3.68Å; L179-I194 HydrophobicContact CD2-CG2 4.21Å; L184-I194 HydrophobicContact CD2-CD1 4.22Å; L184-I194 HydrophobicContact CD2-CG1 3.77Å; I192-I194 HydrophobicContact CG2-CG1 4.06Å; I194-F197 HydrophobicContact CG2-CE2 4.42Å; I194-F197 HydrophobicContact CG2-CZ 4.36Å
195	A	94.6	Very high	91.8	Very high	14 Å²	14	38.5 Å²	38.5	12%	0.116	21%	0.214	C	C	.	.			trans	-133.5	169.1	-174.3	0	0	0	0	0	112.9	V116 H176 N183 L185	V116-A195 HydrophobicContact CG2-CB 3.86Å; H176-A195 PolarHBondContact NE2-O 3.15Å; N183-A195 PolarHBondContact O-N 2.63Å; L185-A195 HydrophobicContact CD1-CB 3.81Å; L185-A195 HydrophobicContact CG-CB 4.03Å
196	D	88.9	Confident	91.3	Very high	60 Å²	60	40 Å²	40	32%	0.321	24%	0.24	S	C	.	.			trans	62.4	75	175.7	-158.3	34.4	0	0	0	116.1	K85 G198	K85-D196 IonicContact NZ-OD1 3.16Å; K85-D196 PolarHBondContact NZ-OD1 2.82Å; D196-G198 PolarHBondContact O-N 2.82Å
197	F	93.2	Very high	91.2	Very high	5 Å²	5	43.3 Å²	43.3	2%	0.022	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-81.4	11.5	179.3	-76.2	-100.7	0	0	0	113.4	E103 I106 M107 L110 I115 H176 I194 F199 S200	E103-F197 HydrophobicContact CG-CB 4.07Å; E103-F197 PolarHBondContact OE1-N 2.65Å; I106-F197 HydrophobicContact CG2-CB 4.42Å; I106-F197 HydrophobicContact CG2-CD1 3.74Å; I106-F197 HydrophobicContact CG2-CE1 4.44Å; I106-F197 HydrophobicContact CG2-CG 4.33Å; M107-F197 HydrophobicContact CG-CB 4.39Å; L110-F197 HydrophobicContact CD1-CD1 3.76Å; L110-F197 HydrophobicContact CD1-CE1 3.27Å; L110-F197 HydrophobicContact CD1-CE2 4.37Å; L110-F197 HydrophobicContact CD1-CG 4.48Å; L110-F197 HydrophobicContact CD1-CZ 3.63Å; I115-F197 HydrophobicContact CD1-CZ 4.36Å; I115-F197 HydrophobicContact CG2-CE2 3.76Å; I115-F197 HydrophobicContact CG2-CZ 3.83Å; H176-F197 AromaticContact CD2-CD1 3.86Å; H176-F197 AromaticContact CD2-CE1 3.6Å; H176-F197 AromaticContact CD2-CZ 3.81Å; I194-F197 HydrophobicContact CG2-CE2 4.42Å; I194-F197 HydrophobicContact CG2-CZ 4.36Å; F197-F199 PolarHBondContact O-N 2.88Å; F197-F199 VanDerWaalsContact O-N 3.12Å; F197-S200 VanDerWaalsContact O-CB 3.22Å; F197-S200 WeakPolarHBondContact O-CB 3.32Å; F197-S200 PolarHBondContact O-N 2.92Å; F197-S200 PolarHBondContact O-OG 2.93Å
198	G	86.6	Confident	91.1	Very high	18 Å²	18	47 Å²	47	19%	0.186	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-60.1	-22.8	-176.9	0	0	0	0	0	115.7	E103 D196	E103-G198 VanDerWaalsContact CD-N 3.32Å; E103-G198 PolarHBondContact OE1-N 2.87Å; E103-G198 WeakPolarHBondContact OE2-CA 3.48Å; D196-G198 PolarHBondContact O-N 2.82Å
199	F	85.6	Confident	91.3	Very high	83 Å²	83	46.7 Å²	46.7	36%	0.364	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-97.9	-7	173	-69	-70.7	0	0	0	114.3	H176 R177 D178 F197 C213	H176-F199 CarbonylContact O-C 3.5Å; R177-F199 PolarHBondContact NE-O 3.41Å; R177-F199 PolarHBondContact NH2-O 2.83Å; D178-F199 HydrophobicContact CB-CB 3.99Å; D178-F199 HydrophobicContact CB-CD2 3.7Å; D178-F199 HydrophobicContact CB-CG 4.15Å; F197-F199 PolarHBondContact O-N 2.88Å; F197-F199 VanDerWaalsContact O-N 3.12Å; F199-C213 HydrophobicContact CD1-CB 3.85Å; F199-C213 HydrophobicContact CE1-CB 4.41Å
200	S	92	Very high	91.3	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.007	27%	0.271	C	S	.	.			trans	-63.9	160.6	-176.8	71.3	0	0	0	0	112.8	R102 I106 V175 H176 F197	R102-S200 PolarHBondContact NE-O 3.46Å; R102-S200 PolarHBondContact NH2-O 2.81Å; I106-S200 VanDerWaalsContact CD1-OG 3.24Å; I106-S200 WeakPolarHBondContact CD1-OG 3.45Å; V175-S200 CarbonylContact O-C 3.54Å; V175-S200 WeakPolarHBondContact O-CA 3.27Å; V175-S200 WeakPolarHBondContact O-CB 3.39Å; H176-S200 PolarHBondContact O-N 2.83Å; F197-S200 VanDerWaalsContact O-CB 3.22Å; F197-S200 WeakPolarHBondContact O-CB 3.32Å; F197-S200 PolarHBondContact O-N 2.92Å; F197-S200 PolarHBondContact O-OG 2.93Å
201	N	91.6	Very high	91.2	Very high	28 Å²	28	47.9 Å²	47.9	15%	0.15	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	158.5	174.2	-160.1	31.1	0	0	0	112	R102 I174 V175 L209	R102-N201 WeakPolarHBondContact CD-OD1 3.31Å; R102-N201 PolarHBondContact NE-OD1 3.38Å; R102-N201 PolarHBondContact NH1-OD1 3.49Å; I174-N201 WeakPolarHBondContact CA-O 3.5Å; V175-N201 HydrophobicContact CG2-CB 4.4Å; V175-N201 WeakPolarHBondContact CG2-O 3.43Å; V175-N201 PolarHBondContact N-O 3.26Å; V175-N201 PolarHBondContact O-N 3.41Å; N201-L209 WeakPolarHBondContact ND2-CD2 3.4Å
202	E	92.1	Very high	90.9	Very high	77 Å²	77	50 Å²	50	36%	0.36	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	147.4	164.5	-64.7	159.2	-136.2	0	0	109.1	R105 I106 R173	R105-E202 WeakPolarHBondContact CD-OE1 3.33Å; R105-E202 IonicContact CZ-OE1 2.74Å; R105-E202 IonicContact NE-OE1 2.75Å; R105-E202 IonicContact NH1-OE1 2.81Å; R105-E202 PolarHBondContact NH1-OE1 3.21Å; R105-E202 IonicContact NH1-OE2 3.32Å; I106-E202 HydrophobicContact CD1-CG 4.49Å; R173-E202 CarbonylContact O-C 3.51Å; R173-E202 VanDerWaalsContact O-CA 3.29Å; R173-E202 WeakPolarHBondContact O-CA 3.48Å
203	F	91.5	Very high	90.2	Very high	21 Å²	21	50.7 Å²	50.7	9%	0.092	29%	0.293	C	S	.	.			trans	-132.4	139	175.5	78.4	-86.7	0	0	0	112.6	R173 V175 P232	R173-F203 VanDerWaalsContact C-CE1 3.43Å; R173-F203 VanDerWaalsContact CA-CE1 3.45Å; R173-F203 HydrophobicContact CB-CD1 4.44Å; R173-F203 HydrophobicContact CB-CE1 4.35Å; R173-F203 WeakPolarHBondContact O-CD1 3.34Å; R173-F203 PolarHBondContact O-N 3.28Å; V175-F203 HydrophobicContact CG1-CD1 3.59Å; V175-F203 HydrophobicContact CG1-CE1 3.88Å; V175-F203 HydrophobicContact CG1-CG 4.38Å; F203-P232 HydrophobicContact CD1-CG 4.3Å; F203-P232 HydrophobicContact CD2-CG 4.25Å; F203-P232 HydrophobicContact CE1-CG 3.65Å; F203-P232 HydrophobicContact CE2-CG 3.61Å; F203-P232 HydrophobicContact CZ-CG 3.28Å
204	T	89.3	Confident	89.7	Confident	95 Å²	95	50.7 Å²	50.7	58%	0.583	30%	0.297	S	S	*	.			trans	-116.5	131.5	-177.7	-55.1	0	0	0	0	109.7	G206 S207	T204-G206 PolarHBondContact O-N 3.36Å; T204-S207 WeakPolarHBondContact O-CB 3.46Å; T204-S207 PolarHBondContact O-N 3.12Å; T204-S207 VanDerWaalsContact O-O 3.13Å
205	V	86	Confident	89.2	Confident	110 Å²	110	51.8 Å²	51.8	67%	0.667	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	128	179	-178.4	0	0	0	0	110	S207	V205-S207 VanDerWaalsContact C-N 3.33Å
206	G	85.3	Confident	89.1	Confident	73 Å²	73	53.3 Å²	53.3	75%	0.753	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	-13.9	-175	0	0	0	0	0	115.1	T204	T204-G206 PolarHBondContact O-N 3.36Å
207	S	90.2	Very high	89.2	Confident	70 Å²	70	52 Å²	52	49%	0.49	31%	0.308	S	S	.	.			trans	-100.6	133.4	171	-61.1	0	0	0	0	110.4	T204 V205	T204-S207 WeakPolarHBondContact O-CB 3.46Å; T204-S207 PolarHBondContact O-N 3.12Å; T204-S207 VanDerWaalsContact O-O 3.13Å; V205-S207 VanDerWaalsContact C-N 3.33Å
208	K	91.4	Very high	89.3	Confident	106 Å²	106	52.3 Å²	52.3	46%	0.461	31%	0.31	S	S	.	.			trans	-108.8	141.8	-180	-64.1	-169.4	-175.4	-62.3	0	112.8	K228 Y229 D230	K208-K228 HydrophobicContact CB-CB 3.79Å; K208-K228 HydrophobicContact CD-CB 4.03Å; K208-Y229 CarbonylContact C-O 3.6Å; K208-Y229 VanDerWaalsContact CA-O 3.32Å; K208-Y229 WeakPolarHBondContact CA-O 3.38Å; K208-Y229 WeakPolarHBondContact CB-O 3.3Å; K208-D230 IonicContact NZ-OD1 2.69Å; K208-D230 PolarHBondContact NZ-OD1 2.89Å; K208-D230 IonicContact NZ-OD2 3.39Å; K208-D230 PolarHBondContact NZ-OD2 3.49Å
209	L	91.3	Very high	89.8	Confident	24 Å²	24	51.7 Å²	51.7	13%	0.126	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-81.9	150.8	169.8	-55	-178.4	0	0	0	110.2	V175 N201 K228 Y229	V175-L209 HydrophobicContact CG2-CD1 3.94Å; N201-L209 WeakPolarHBondContact ND2-CD2 3.4Å; L209-K228 CarbonylContact O-C 3.57Å; L209-K228 WeakPolarHBondContact O-CA 3.47Å; L209-K228 WeakPolarHBondContact O-CB 3.45Å; L209-Y229 HydrophobicContact CB-CD1 4.34Å; L209-Y229 HydrophobicContact CB-CD2 4.03Å; L209-Y229 HydrophobicContact CB-CE1 3.95Å; L209-Y229 HydrophobicContact CB-CE2 3.61Å; L209-Y229 HydrophobicContact CB-CG 4.37Å; L209-Y229 HydrophobicContact CD1-CD2 4.46Å; L209-Y229 HydrophobicContact CD1-CE2 3.78Å; L209-Y229 HydrophobicContact CG-CE2 4.27Å; L209-Y229 PolarHBondContact N-O 3.49Å; L209-Y229 VanDerWaalsContact O-CD1 3.27Å; L209-Y229 WeakPolarHBondContact O-CD1 3.46Å; L209-Y229 PolarHBondContact O-N 3.11Å
210	D	89.6	Confident	90.3	Very high	90 Å²	90	47.7 Å²	47.7	48%	0.481	29%	0.285	S	S	.	.			trans	-127.8	-14.6	-180	48.4	25.1	0	0	0	114.1	F212 K228	D210-F212 PolarHBondContact O-N 3.33Å; D210-K228 HydrophobicContact CB-CD 3.95Å; D210-K228 HydrophobicContact CB-CG 3.96Å; D210-K228 IonicContact OD2-NZ 3.68Å; D210-K228 PolarHBondContact OD2-NZ 3.48Å
211	T	86.6	Confident	90.6	Very high	61 Å²	61	47.8 Å²	47.8	37%	0.374	29%	0.286	S	S	.	.			trans	-70.1	117.6	-173	-43.1	0	0	0	0	111.6	C213 Y229	T211-C213 HydrophobicContact CG2-CB 4.47Å; T211-C213 PolarHBondContact O-N 3.01Å; T211-Y229 PolarHBondContact O-OH 3.43Å
212	F	88.9	Confident	90.8	Very high	96 Å²	96	46.8 Å²	46.8	42%	0.421	28%	0.28	S	S	.	.			trans	-65.9	121	161.6	-168.4	-74.5	0	0	0	108.9	D210 A219 L223 F224	D210-F212 PolarHBondContact O-N 3.33Å; F212-A219 HydrophobicContact CZ-CB 4.26Å; F212-L223 HydrophobicContact CD2-CB 3.69Å; F212-L223 WeakPolarHBondContact CD2-O 3.34Å; F212-L223 HydrophobicContact CE2-CB 3.72Å; F212-F224 HydrophobicContact CE2-CD1 4.43Å; F212-F224 HydrophobicContact CE2-CG 4.48Å
213	C	84.8	Confident	91	Very high	14 Å²	14	43.7 Å²	43.7	10%	0.095	27%	0.266	C	S	.	.			trans	-156.5	170	176.9	53.4	0	0	0	0	109.9	F199 T211	F199-C213 HydrophobicContact CD1-CB 3.85Å; F199-C213 HydrophobicContact CE1-CB 4.41Å; T211-C213 HydrophobicContact CG2-CB 4.47Å; T211-C213 PolarHBondContact O-N 3.01Å
214	G	85.5	Confident	91.1	Very high	16 Å²	16	43.2 Å²	43.2	17%	0.165	26%	0.264	C	S	.	.	S	Bend	trans	84.2	173.4	-172.3	0	0	0	0	0	114.1	R177 D178	R177-G214 WeakPolarHBondContact O-CA 3.17Å; D178-G214 VanDerWaalsContact OD1-CA 3.28Å; D178-G214 WeakPolarHBondContact OD1-CA 3.44Å
215	S	89.1	Confident	91.3	Very high	26 Å²	26	43 Å²	43	18%	0.182	26%	0.257	C	S	.	.			trans	-83.1	121.5	-169.8	-56.7	0	0	0	0	111.6	D178 K180 P217 Y218 A219	D178-S215 WeakPolarHBondContact OD1-CB 3.37Å; D178-S215 PolarHBondContact OD1-N 2.94Å; D178-S215 PolarHBondContact OD1-OG 3.46Å; K180-S215 WeakPolarHBondContact CD-OG 3.35Å; K180-S215 PolarHBondContact NZ-OG 3.11Å; S215-P217 VanDerWaalsContact C-CD 3.43Å; S215-P217 WeakPolarHBondContact O-CD 3.19Å; S215-P217 VanDerWaalsContact O-N 3.09Å; S215-Y218 PolarHBondContact O-N 2.86Å; S215-A219 PolarHBondContact O-N 3.11Å
216	P	91.4	Very high	91.6	Very high	46 Å²	46	41 Å²	41	30%	0.299	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-35.5	-166.3	-30.9	35.5	0	0	0	118.3	Y218 A219 F224 L258 L261	P216-Y218 PolarHBondContact O-N 2.96Å; P216-A219 PolarHBondContact O-N 2.94Å; P216-F224 HydrophobicContact CB-CZ 4.19Å; P216-F224 WeakPolarHBondContact O-CZ 3.23Å; P216-L258 HydrophobicContact CB-CD1 3.8Å; P216-L258 HydrophobicContact CG-CD1 4.15Å; P216-L261 HydrophobicContact CB-CD2 3.83Å
217	P	90.9	Very high	92	Very high	31 Å²	31	43.1 Å²	43.1	20%	0.201	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.1	178	-22.8	35	0	0	0	114.6	S215 L251 L261	S215-P217 VanDerWaalsContact C-CD 3.43Å; S215-P217 WeakPolarHBondContact O-CD 3.19Å; S215-P217 VanDerWaalsContact O-N 3.09Å; P217-L251 HydrophobicContact CB-CD1 3.88Å; P217-L251 HydrophobicContact CB-CD2 4.18Å; P217-L251 HydrophobicContact CG-CD1 4.42Å; P217-L261 HydrophobicContact CG-CD2 4.15Å
218	Y	96.4	Very high	92.2	Very high	12 Å²	12	45.8 Å²	45.8	5%	0.047	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-11.8	178	-57.3	-93.2	0	0	0	112.3	L179 K180 A181 E182 S215 P216 W237 S238 V241 I242 L251	L179-Y218 WeakPolarHBondContact O-CB 3.47Å; K180-Y218 HydrophobicContact CB-CD1 4.15Å; K180-Y218 HydrophobicContact CB-CD2 3.59Å; K180-Y218 HydrophobicContact CB-CE1 3.98Å; K180-Y218 HydrophobicContact CB-CE2 3.37Å; K180-Y218 HydrophobicContact CB-CG 3.96Å; A181-Y218 WeakPolarHBondContact CB-OH 3.19Å; A181-Y218 PolarHBondContact N-OH 3.37Å; A181-Y218 VanDerWaalsContact N-OH 3.12Å; E182-Y218 PolarHBondContact OE2-OH 3.03Å; S215-Y218 PolarHBondContact O-N 2.86Å; P216-Y218 PolarHBondContact O-N 2.96Å; Y218-W237 VanDerWaalsContact O-CD1 3.3Å; Y218-S238 PolarHBondContact O-OG 3.15Å; Y218-V241 HydrophobicContact CD1-CB 3.91Å; Y218-V241 HydrophobicContact CD1-CG1 3.39Å; Y218-V241 HydrophobicContact CE1-CG1 3.79Å; Y218-V241 HydrophobicContact CG-CG1 4.09Å; Y218-I242 HydrophobicContact CD1-CG1 4.14Å; Y218-I242 HydrophobicContact CE1-CG1 3.96Å; Y218-L251 HydrophobicContact CE1-CD2 4.37Å
219	A	96.2	Very high	92.3	Very high	5 Å²	5	41 Å²	41	4%	0.041	23%	0.228	C	C	.	.			trans	-69	141.5	-175	0	0	0	0	0	113	F212 S215 P216 L223 F224 W237	F212-A219 HydrophobicContact CZ-CB 4.26Å; S215-A219 PolarHBondContact O-N 3.11Å; P216-A219 PolarHBondContact O-N 2.94Å; A219-L223 HydrophobicContact CB-CD1 4.1Å; A219-F224 HydrophobicContact CB-CD2 4.41Å; A219-F224 HydrophobicContact CB-CE2 3.81Å; A219-F224 HydrophobicContact CB-CZ 4.43Å; A219-W237 PolarHBondContact O-NE1 2.7Å
220	A	97.3	Very high	92.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.237	C	C	.	.			trans	-75.3	152.7	-177.2	0	0	0	0	0	113.3	E222 L223 F224 V234 W237	A220-E222 VanDerWaalsContact C-N 3.26Å; A220-E222 VanDerWaalsContact CB-CD 3.46Å; A220-E222 HydrophobicContact CB-CG 4.11Å; A220-E222 WeakPolarHBondContact CB-OE1 3.36Å; A220-E222 PolarHBondContact O-N 2.85Å; A220-L223 HydrophobicContact CB-CG 4.47Å; A220-L223 WeakPolarHBondContact O-CB 3.44Å; A220-L223 PolarHBondContact O-N 3Å; A220-F224 PolarHBondContact O-N 2.96Å; A220-V234 HydrophobicContact CB-CB 4.04Å; A220-V234 HydrophobicContact CB-CG1 4.18Å; A220-W237 HydrophobicContact CB-CB 3.87Å; A220-W237 HydrophobicContact CB-CD2 4.49Å; A220-W237 HydrophobicContact CB-CG 3.84Å
221	P	97.4	Very high	92.6	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.019	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-37.6	-177.6	-27.1	34.4	0	0	0	114.3	L223 F224 Q225 W237 V265 L266 L290	P221-L223 VanDerWaalsContact C-N 3.3Å; P221-L223 PolarHBondContact O-N 2.97Å; P221-F224 CarbonylContact O-C 3.59Å; P221-F224 WeakPolarHBondContact O-CB 3.49Å; P221-F224 PolarHBondContact O-N 2.83Å; P221-Q225 WeakPolarHBondContact O-CG 3.29Å; P221-Q225 PolarHBondContact O-N 2.68Å; P221-Q225 VanDerWaalsContact O-N 3.16Å; P221-W237 HydrophobicContact CG-CD2 4.33Å; P221-W237 HydrophobicContact CG-CE3 4.08Å; P221-W237 HydrophobicContact CG-CH2 3.51Å; P221-W237 HydrophobicContact CG-CZ2 3.78Å; P221-W237 HydrophobicContact CG-CZ3 3.66Å; P221-V265 HydrophobicContact CB-CG1 4.4Å; P221-V265 HydrophobicContact CG-CG1 4.01Å; P221-L266 HydrophobicContact CB-CD2 4.01Å; P221-L266 WeakPolarHBondContact O-CD2 3.25Å; P221-L290 HydrophobicContact CB-CD2 4.11Å; P221-L290 HydrophobicContact CG-CD2 3.61Å
222	E	96.5	Very high	93.1	Very high	6 Å²	6	36.9 Å²	36.9	3%	0.028	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-35.1	176.9	52	-90.5	-151.6	0	0	113.3	A220 Q225 G226 K227 V234 R295	A220-E222 VanDerWaalsContact C-N 3.26Å; A220-E222 VanDerWaalsContact CB-CD 3.46Å; A220-E222 HydrophobicContact CB-CG 4.11Å; A220-E222 WeakPolarHBondContact CB-OE1 3.36Å; A220-E222 PolarHBondContact O-N 2.85Å; E222-Q225 CarbonylContact O-C 3.52Å; E222-Q225 PolarHBondContact O-N 2.84Å; E222-Q225 VanDerWaalsContact O-N 3.12Å; E222-G226 PolarHBondContact O-N 3.35Å; E222-K227 HydrophobicContact CB-CB 4.29Å; E222-K227 PolarHBondContact O-N 3.48Å; E222-V234 HydrophobicContact CG-CG1 4.35Å; E222-R295 IonicContact OE1-CZ 2.65Å; E222-R295 IonicContact OE1-NH1 2.71Å; E222-R295 PolarHBondContact OE1-NH1 2.86Å; E222-R295 IonicContact OE1-NH2 2.77Å; E222-R295 PolarHBondContact OE1-NH2 3.16Å; E222-R295 VanDerWaalsContact OE1-NH2 3.16Å; E222-R295 IonicContact OE2-CZ 2.81Å; E222-R295 IonicContact OE2-NH1 3.17Å; E222-R295 IonicContact OE2-NH2 3.85Å; E222-R295 PolarHBondContact OE2-NH2 3.08Å
223	L	95.8	Very high	93.5	Very high	12 Å²	12	33.5 Å²	33.5	6%	0.063	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-66.3	-46.1	175.1	-57.6	177.9	0	0	0	110	F212 A219 A220 P221 Q225 G226 Y229 V234	F212-L223 HydrophobicContact CD2-CB 3.69Å; F212-L223 WeakPolarHBondContact CD2-O 3.34Å; F212-L223 HydrophobicContact CE2-CB 3.72Å; A219-L223 HydrophobicContact CB-CD1 4.1Å; A220-L223 HydrophobicContact CB-CG 4.47Å; A220-L223 WeakPolarHBondContact O-CB 3.44Å; A220-L223 PolarHBondContact O-N 3Å; P221-L223 VanDerWaalsContact C-N 3.3Å; P221-L223 PolarHBondContact O-N 2.97Å; L223-Q225 PolarHBondContact O-N 3.11Å; L223-G226 PolarHBondContact O-N 2.97Å; L223-Y229 HydrophobicContact CD2-CD1 3.58Å; L223-Y229 HydrophobicContact CD2-CE1 3.33Å; L223-Y229 HydrophobicContact CD2-CE2 4.42Å; L223-Y229 HydrophobicContact CD2-CG 4.25Å; L223-V234 HydrophobicContact CD2-CG1 4.45Å
224	F	93.6	Very high	94.1	Very high	12 Å²	12	33 Å²	33	5%	0.053	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-64	-8.1	172.8	-76.8	-76.3	0	0	0	114.5	F212 P216 A219 A220 P221 L258 L261 R262 V265 L266	F212-F224 HydrophobicContact CE2-CD1 4.43Å; F212-F224 HydrophobicContact CE2-CG 4.48Å; P216-F224 HydrophobicContact CB-CZ 4.19Å; P216-F224 WeakPolarHBondContact O-CZ 3.23Å; A219-F224 HydrophobicContact CB-CD2 4.41Å; A219-F224 HydrophobicContact CB-CE2 3.81Å; A219-F224 HydrophobicContact CB-CZ 4.43Å; A220-F224 PolarHBondContact O-N 2.96Å; P221-F224 CarbonylContact O-C 3.59Å; P221-F224 WeakPolarHBondContact O-CB 3.49Å; P221-F224 PolarHBondContact O-N 2.83Å; F224-L258 HydrophobicContact CE1-CD1 3.91Å; F224-L258 HydrophobicContact CZ-CD1 4.46Å; F224-L261 HydrophobicContact CZ-CG 4.41Å; F224-R262 HydrophobicContact CB-CG 4.12Å; F224-R262 HydrophobicContact CD1-CB 3.71Å; F224-R262 HydrophobicContact CD1-CG 3.66Å; F224-R262 HydrophobicContact CE1-CB 3.92Å; F224-R262 HydrophobicContact CE1-CG 4.39Å; F224-R262 HydrophobicContact CG-CB 4.49Å; F224-R262 HydrophobicContact CG-CG 4.16Å; F224-R262 VanDerWaalsContact O-CZ 3.29Å; F224-R262 PolarHBondContact O-NE 2.62Å; F224-R262 PolarHBondContact O-NH2 3.47Å; F224-V265 HydrophobicContact CD2-CB 4.3Å; F224-V265 HydrophobicContact CD2-CG1 3.74Å; F224-V265 HydrophobicContact CE2-CB 4.21Å; F224-V265 HydrophobicContact CE2-CG1 3.91Å; F224-V265 HydrophobicContact CE2-CG2 4.11Å; F224-L266 HydrophobicContact CB-CD2 3.98Å; F224-L266 HydrophobicContact CB-CG 4.41Å
225	Q	93.3	Very high	94.7	Very high	91 Å²	91	32.2 Å²	32.2	43%	0.425	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-104.2	-1.5	173.2	-68.4	175.2	-4.9	0	0	113	P221 E222 L223 K227 L266	P221-Q225 WeakPolarHBondContact O-CG 3.29Å; P221-Q225 PolarHBondContact O-N 2.68Å; P221-Q225 VanDerWaalsContact O-N 3.16Å; E222-Q225 CarbonylContact O-C 3.52Å; E222-Q225 PolarHBondContact O-N 2.84Å; E222-Q225 VanDerWaalsContact O-N 3.12Å; L223-Q225 PolarHBondContact O-N 3.11Å; Q225-K227 HydrophobicContact CB-CD 4.07Å; Q225-K227 HydrophobicContact CB-CG 3.96Å; Q225-K227 PolarHBondContact O-N 2.99Å; Q225-L266 HydrophobicContact CG-CD2 3.78Å
226	G	93	Very high	95.2	Very high	66 Å²	66	31.1 Å²	31.1	68%	0.68	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.8	21	-175.2	0	0	0	0	0	113.7	E222 L223	E222-G226 PolarHBondContact O-N 3.35Å; L223-G226 PolarHBondContact O-N 2.97Å
227	K	93.7	Very high	95.5	Very high	118 Å²	118	29 Å²	29	51%	0.513	16%	0.157	S	C	.	.			trans	-81.8	141.2	-177.1	-73.5	178.2	176.7	169.6	0	110.9	E222 Q225	E222-K227 HydrophobicContact CB-CB 4.29Å; E222-K227 PolarHBondContact O-N 3.48Å; Q225-K227 HydrophobicContact CB-CD 4.07Å; Q225-K227 HydrophobicContact CB-CG 3.96Å; Q225-K227 PolarHBondContact O-N 2.99Å
228	K	94	Very high	95.9	Very high	127 Å²	127	27.7 Å²	27.7	55%	0.552	15%	0.149	S	C	*	.			trans	-68.1	136.6	169.6	-53	-150.3	177.8	-147.4	0	110.2	K208 L209 D210	K208-K228 HydrophobicContact CB-CB 3.79Å; K208-K228 HydrophobicContact CD-CB 4.03Å; L209-K228 CarbonylContact O-C 3.57Å; L209-K228 WeakPolarHBondContact O-CA 3.47Å; L209-K228 WeakPolarHBondContact O-CB 3.45Å; D210-K228 HydrophobicContact CB-CD 3.95Å; D210-K228 HydrophobicContact CB-CG 3.96Å; D210-K228 IonicContact OD2-NZ 3.68Å; D210-K228 PolarHBondContact OD2-NZ 3.48Å
229	Y	93.9	Very high	96	Very high	5 Å²	5	27.1 Å²	27.1	2%	0.02	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-127.6	153	-170.4	59.3	-83.8	0	0	0	110.6	R177 K208 L209 T211 L223 E233 V234	R177-Y229 WeakPolarHBondContact CD-OH 3.36Å; R177-Y229 PolarHBondContact NH1-OH 2.77Å; K208-Y229 CarbonylContact C-O 3.6Å; K208-Y229 VanDerWaalsContact CA-O 3.32Å; K208-Y229 WeakPolarHBondContact CA-O 3.38Å; K208-Y229 WeakPolarHBondContact CB-O 3.3Å; L209-Y229 HydrophobicContact CB-CD1 4.34Å; L209-Y229 HydrophobicContact CB-CD2 4.03Å; L209-Y229 HydrophobicContact CB-CE1 3.95Å; L209-Y229 HydrophobicContact CB-CE2 3.61Å; L209-Y229 HydrophobicContact CB-CG 4.37Å; L209-Y229 HydrophobicContact CD1-CD2 4.46Å; L209-Y229 HydrophobicContact CD1-CE2 3.78Å; L209-Y229 HydrophobicContact CG-CE2 4.27Å; L209-Y229 PolarHBondContact N-O 3.49Å; L209-Y229 VanDerWaalsContact O-CD1 3.27Å; L209-Y229 WeakPolarHBondContact O-CD1 3.46Å; L209-Y229 PolarHBondContact O-N 3.11Å; T211-Y229 PolarHBondContact O-OH 3.43Å; L223-Y229 HydrophobicContact CD2-CD1 3.58Å; L223-Y229 HydrophobicContact CD2-CE1 3.33Å; L223-Y229 HydrophobicContact CD2-CE2 4.42Å; L223-Y229 HydrophobicContact CD2-CG 4.25Å; Y229-E233 WeakPolarHBondContact CB-OE1 3.37Å; Y229-V234 HydrophobicContact CD2-CG1 3.64Å; Y229-V234 HydrophobicContact CE2-CG1 4.17Å; Y229-V234 HydrophobicContact CE2-CG2 4.31Å; Y229-V234 HydrophobicContact CG-CG1 4.08Å
230	D	92.9	Very high	96.1	Very high	60 Å²	60	26.9 Å²	26.9	32%	0.321	15%	0.145	S	C	.	.			trans	-78.9	-32.6	-178.2	-65.9	-67.7	0	0	0	111.7	K208 E233	K208-D230 IonicContact NZ-OD1 2.69Å; K208-D230 PolarHBondContact NZ-OD1 2.89Å; K208-D230 IonicContact NZ-OD2 3.39Å; K208-D230 PolarHBondContact NZ-OD2 3.49Å; D230-E233 PolarHBondContact N-OE1 3.16Å
231	G	93.4	Very high	96.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.145	C	C	.	.	S	Bend	trans	135.1	-74	170.7	0	0	0	0	0	113	E233 V234	G231-E233 PolarHBondContact N-OE1 2.99Å; G231-E233 PolarHBondContact N-OE2 3.42Å; G231-E233 PolarHBondContact O-N 3.24Å; G231-V234 WeakPolarHBondContact O-CG2 3.48Å; G231-V234 PolarHBondContact O-N 3.38Å; G231-V234 VanDerWaalsContact O-N 3.09Å
232	P	97.1	Very high	96.2	Very high	29 Å²	29	26.8 Å²	26.8	19%	0.188	14%	0.144	C	C	.	.	H	α-helix	trans	-50.5	-34.4	-170.9	-33.1	39.2	0	0	0	115.5	H170 V175 F203 V234 D235 V236	H170-P232 PolarHBondContact CE1-O 2.81Å; H170-P232 VanDerWaalsContact CE1-O 3.31Å; V175-P232 HydrophobicContact CG1-CG 4.02Å; F203-P232 HydrophobicContact CD1-CG 4.3Å; F203-P232 HydrophobicContact CD2-CG 4.25Å; F203-P232 HydrophobicContact CE1-CG 3.65Å; F203-P232 HydrophobicContact CE2-CG 3.61Å; F203-P232 HydrophobicContact CZ-CG 3.28Å; P232-V234 VanDerWaalsContact C-N 3.26Å; P232-V234 PolarHBondContact O-N 3.19Å; P232-D235 PolarHBondContact O-N 2.96Å; P232-V236 WeakPolarHBondContact O-CG2 3.34Å; P232-V236 PolarHBondContact O-N 3.12Å; P232-V236 VanDerWaalsContact O-N 3.1Å
233	E	97.1	Very high	96.3	Very high	25 Å²	25	26.5 Å²	26.5	12%	0.117	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-30.6	-178.3	68.7	-86.4	-155.1	0	0	113.5	Y229 D230 G231 V236 W237 P292 R295	Y229-E233 WeakPolarHBondContact CB-OE1 3.37Å; D230-E233 PolarHBondContact N-OE1 3.16Å; G231-E233 PolarHBondContact N-OE1 2.99Å; G231-E233 PolarHBondContact N-OE2 3.42Å; G231-E233 PolarHBondContact O-N 3.24Å; E233-V236 WeakPolarHBondContact O-CB 3.48Å; E233-V236 PolarHBondContact O-N 3.05Å; E233-W237 PolarHBondContact O-N 3.39Å; E233-P292 HydrophobicContact CB-CB 4.11Å; E233-P292 HydrophobicContact CG-CB 3.69Å; E233-R295 VanDerWaalsContact C-NH1 3.33Å; E233-R295 WeakPolarHBondContact O-CD 3.28Å; E233-R295 PolarHBondContact O-NH1 3.43Å
234	V	97.8	Very high	96.4	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.012	14%	0.142	C	C	.	.	H	α-helix	trans	-76.7	-34.2	-177.4	-44.4	0	0	0	0	111	R177 A220 E222 L223 Y229 G231 P232 W237 S238	R177-V234 HydrophobicContact CG-CG2 4.18Å; A220-V234 HydrophobicContact CB-CB 4.04Å; A220-V234 HydrophobicContact CB-CG1 4.18Å; E222-V234 HydrophobicContact CG-CG1 4.35Å; L223-V234 HydrophobicContact CD2-CG1 4.45Å; Y229-V234 HydrophobicContact CD2-CG1 3.64Å; Y229-V234 HydrophobicContact CE2-CG1 4.17Å; Y229-V234 HydrophobicContact CE2-CG2 4.31Å; Y229-V234 HydrophobicContact CG-CG1 4.08Å; G231-V234 WeakPolarHBondContact O-CG2 3.48Å; G231-V234 PolarHBondContact O-N 3.38Å; G231-V234 VanDerWaalsContact O-N 3.09Å; P232-V234 VanDerWaalsContact C-N 3.26Å; P232-V234 PolarHBondContact O-N 3.19Å; V234-W237 PolarHBondContact O-N 2.77Å; V234-S238 PolarHBondContact O-N 2.65Å; V234-S238 PolarHBondContact O-OG 3.49Å
235	D	98.3	Very high	96.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.9	-41.3	168.7	-71.9	-21.7	0	0	0	110.6	V166 H170 V175 H176 R177 L179 P232 W237 S238 L239	V166-D235 HydrophobicContact CG1-CB 4.07Å; H170-D235 IonicContact CD2-OD2 2.67Å; H170-D235 IonicContact CE1-OD2 3.28Å; H170-D235 WeakPolarHBondContact NE2-CB 3.44Å; H170-D235 IonicContact NE2-OD2 2.94Å; H170-D235 PolarHBondContact NE2-OD2 2.67Å; V175-D235 WeakPolarHBondContact CA-OD2 3.36Å; H176-D235 PolarHBondContact N-OD1 3.45Å; H176-D235 PolarHBondContact N-OD2 3.45Å; R177-D235 WeakPolarHBondContact CA-OD1 3.42Å; R177-D235 PolarHBondContact N-OD1 2.58Å; L179-D235 HydrophobicContact CD1-CB 3.71Å; P232-D235 PolarHBondContact O-N 2.96Å; D235-W237 PolarHBondContact O-N 3.32Å; D235-S238 WeakPolarHBondContact O-CB 3.44Å; D235-S238 PolarHBondContact O-N 3.36Å; D235-S238 VanDerWaalsContact O-N 3.16Å; D235-L239 VanDerWaalsContact O-CG 3.3Å; D235-L239 WeakPolarHBondContact O-CG 3.46Å; D235-L239 PolarHBondContact O-N 3.37Å
236	V	98.6	Very high	96.5	Very high	4 Å²	4	22 Å²	22	2%	0.024	12%	0.122	C	C	.	.	H	α-helix	trans	-59	-46.1	175	174.8	0	0	0	0	111.1	P232 E233 S238 L239 G240 F287 R295 G296 L298 I301	P232-V236 WeakPolarHBondContact O-CG2 3.34Å; P232-V236 PolarHBondContact O-N 3.12Å; P232-V236 VanDerWaalsContact O-N 3.1Å; E233-V236 WeakPolarHBondContact O-CB 3.48Å; E233-V236 PolarHBondContact O-N 3.05Å; V236-S238 VanDerWaalsContact C-N 3.34Å; V236-S238 PolarHBondContact O-N 3.42Å; V236-L239 PolarHBondContact O-N 2.94Å; V236-G240 PolarHBondContact O-N 3.18Å; V236-F287 HydrophobicContact CG1-CD1 3.61Å; V236-F287 HydrophobicContact CG1-CE1 4.17Å; V236-F287 WeakPolarHBondContact O-CD1 3.45Å; V236-R295 HydrophobicContact CG1-CG 3.73Å; V236-G296 WeakPolarHBondContact CG1-O 3.32Å; V236-L298 HydrophobicContact CG2-CD2 3.88Å; V236-L298 HydrophobicContact CG2-CG 3.93Å; V236-I301 HydrophobicContact CG1-CD1 4.16Å
237	W	98.6	Very high	96.7	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.3	-45.6	174.3	175.9	-85	0	0	0	111.8	Y218 A219 A220 P221 E233 V234 D235 L239 G240 V241 F253 V265 L288 L290	Y218-W237 VanDerWaalsContact O-CD1 3.3Å; A219-W237 PolarHBondContact O-NE1 2.7Å; A220-W237 HydrophobicContact CB-CB 3.87Å; A220-W237 HydrophobicContact CB-CD2 4.49Å; A220-W237 HydrophobicContact CB-CG 3.84Å; P221-W237 HydrophobicContact CG-CD2 4.33Å; P221-W237 HydrophobicContact CG-CE3 4.08Å; P221-W237 HydrophobicContact CG-CH2 3.51Å; P221-W237 HydrophobicContact CG-CZ2 3.78Å; P221-W237 HydrophobicContact CG-CZ3 3.66Å; E233-W237 PolarHBondContact O-N 3.39Å; V234-W237 PolarHBondContact O-N 2.77Å; D235-W237 PolarHBondContact O-N 3.32Å; W237-L239 VanDerWaalsContact C-N 3.27Å; W237-L239 PolarHBondContact O-N 3.23Å; W237-G240 WeakPolarHBondContact O-CA 3.46Å; W237-G240 PolarHBondContact O-N 3.02Å; W237-V241 PolarHBondContact O-N 3.44Å; W237-V241 VanDerWaalsContact O-N 3.13Å; W237-F253 AromaticContact CH2-CE2 3.88Å; W237-F253 HydrophobicContact CH2-CE2 3.88Å; W237-F253 AromaticContact CH2-CZ 3.96Å; W237-F253 HydrophobicContact CH2-CZ 3.96Å; W237-F253 HydrophobicContact CZ2-CD2 4.01Å; W237-F253 AromaticContact CZ2-CE2 3.32Å; W237-F253 HydrophobicContact CZ2-CE2 3.32Å; W237-F253 AromaticContact CZ2-CZ 3.88Å; W237-F253 HydrophobicContact CZ2-CZ 3.88Å; W237-V265 HydrophobicContact CZ2-CG1 4.03Å; W237-L288 HydrophobicContact CD2-CD2 3.94Å; W237-L288 HydrophobicContact CE3-CD2 4.1Å; W237-L288 HydrophobicContact CG-CD2 4.46Å; W237-L288 HydrophobicContact CH2-CD2 4.43Å; W237-L288 HydrophobicContact CZ2-CD2 4.28Å; W237-L288 VanDerWaalsContact CZ3-C 3.43Å; W237-L288 HydrophobicContact CZ3-CB 4.21Å; W237-L288 HydrophobicContact CZ3-CD2 4.34Å; W237-L290 HydrophobicContact CH2-CD2 4.08Å; W237-L290 HydrophobicContact CZ3-CD2 4.31Å
238	S	98.4	Very high	96.7	Very high	4 Å²	4	13.9 Å²	13.9	3%	0.028	7%	0.069	C	C	.	.	H	α-helix	trans	-58.8	-38.2	178.6	-53.3	0	0	0	0	111.9	Y218 V234 D235 V236 V241 I242	Y218-S238 PolarHBondContact O-OG 3.15Å; V234-S238 PolarHBondContact O-N 2.65Å; V234-S238 PolarHBondContact O-OG 3.49Å; D235-S238 WeakPolarHBondContact O-CB 3.44Å; D235-S238 PolarHBondContact O-N 3.36Å; D235-S238 VanDerWaalsContact O-N 3.16Å; V236-S238 VanDerWaalsContact C-N 3.34Å; V236-S238 PolarHBondContact O-N 3.42Å; S238-V241 WeakPolarHBondContact O-CB 3.38Å; S238-V241 PolarHBondContact O-N 2.84Å; S238-I242 WeakPolarHBondContact O-CG1 3.45Å; S238-I242 PolarHBondContact O-N 2.83Å
239	L	98.7	Very high	96.5	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-65.8	-33.8	174.3	-71.5	171.5	0	0	0	113.1	F159 I162 V166 L179 D235 V236 W237 I242 L243 F287 L298	F159-L239 HydrophobicContact CE2-CB 4.38Å; F159-L239 HydrophobicContact CE2-CD2 4.29Å; F159-L239 WeakPolarHBondContact CE2-O 3.39Å; F159-L239 HydrophobicContact CZ-CB 4.11Å; F159-L239 WeakPolarHBondContact CZ-O 3.28Å; I162-L239 HydrophobicContact CG2-CD2 3.29Å; V166-L239 HydrophobicContact CB-CD1 4.14Å; V166-L239 HydrophobicContact CG1-CD1 4.03Å; V166-L239 HydrophobicContact CG2-CD1 4.35Å; V166-L239 HydrophobicContact CG2-CD2 4.31Å; L179-L239 HydrophobicContact CD1-CD2 4.28Å; L179-L239 HydrophobicContact CD1-CG 4.16Å; D235-L239 VanDerWaalsContact O-CG 3.3Å; D235-L239 WeakPolarHBondContact O-CG 3.46Å; D235-L239 PolarHBondContact O-N 3.37Å; V236-L239 PolarHBondContact O-N 2.94Å; W237-L239 VanDerWaalsContact C-N 3.27Å; W237-L239 PolarHBondContact O-N 3.23Å; L239-I242 HydrophobicContact CD2-CD1 4.31Å; L239-I242 PolarHBondContact O-N 2.91Å; L239-L243 WeakPolarHBondContact O-CB 3.26Å; L239-L243 PolarHBondContact O-N 2.8Å; L239-F287 HydrophobicContact CB-CD1 4.15Å; L239-F287 HydrophobicContact CB-CE1 3.68Å; L239-F287 HydrophobicContact CB-CZ 4.26Å; L239-F287 HydrophobicContact CD1-CE1 4.46Å; L239-L298 HydrophobicContact CD1-CD1 4.12Å; L239-L298 HydrophobicContact CD1-CD2 3.78Å
240	G	98.6	Very high	96.2	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-63.3	-41.8	169.9	0	0	0	0	0	112.8	V236 W237 L243 Y244 L284 F287	V236-G240 PolarHBondContact O-N 3.18Å; W237-G240 WeakPolarHBondContact O-CA 3.46Å; W237-G240 PolarHBondContact O-N 3.02Å; G240-L243 PolarHBondContact O-N 3.16Å; G240-Y244 WeakPolarHBondContact O-CB 3.5Å; G240-Y244 PolarHBondContact O-N 2.83Å; G240-L284 WeakPolarHBondContact O-CD2 3.34Å; G240-F287 VanDerWaalsContact CA-CB 3.47Å
241	V	98.3	Very high	96.1	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-63.2	-44	174.9	178.2	0	0	0	0	110.8	Y218 W237 S238 T245 L251 P252 L288	Y218-V241 HydrophobicContact CD1-CB 3.91Å; Y218-V241 HydrophobicContact CD1-CG1 3.39Å; Y218-V241 HydrophobicContact CE1-CG1 3.79Å; Y218-V241 HydrophobicContact CG-CG1 4.09Å; W237-V241 PolarHBondContact O-N 3.44Å; W237-V241 VanDerWaalsContact O-N 3.13Å; S238-V241 WeakPolarHBondContact O-CB 3.38Å; S238-V241 PolarHBondContact O-N 2.84Å; V241-T245 WeakPolarHBondContact O-CB 3.47Å; V241-T245 PolarHBondContact O-N 3.18Å; V241-T245 PolarHBondContact O-OG1 3.17Å; V241-L251 HydrophobicContact CG1-CD2 3.89Å; V241-P252 HydrophobicContact CB-CG 4.27Å; V241-P252 HydrophobicContact CG1-CG 4.03Å; V241-P252 HydrophobicContact CG2-CG 4.07Å; V241-L288 HydrophobicContact CG2-CD2 4.05Å
242	I	97.9	Very high	96.2	Very high	1 Å²	1	11.1 Å²	11.1	1%	0.005	7%	0.069	C	C	.	.	H	α-helix	trans	-61.1	-51.1	175.1	-70.9	160.8	0	0	0	111.1	F159 I162 L179 L184 Y218 S238 L239 Y244 T245 L246	F159-I242 HydrophobicContact CD2-CG2 4.47Å; F159-I242 HydrophobicContact CE2-CG2 4.3Å; I162-I242 HydrophobicContact CD1-CG2 4.22Å; L179-I242 HydrophobicContact CB-CD1 4.01Å; L184-I242 HydrophobicContact CD1-CD1 4.23Å; L184-I242 HydrophobicContact CD1-CG2 3.83Å; Y218-I242 HydrophobicContact CD1-CG1 4.14Å; Y218-I242 HydrophobicContact CE1-CG1 3.96Å; S238-I242 WeakPolarHBondContact O-CG1 3.45Å; S238-I242 PolarHBondContact O-N 2.83Å; L239-I242 HydrophobicContact CD2-CD1 4.31Å; L239-I242 PolarHBondContact O-N 2.91Å; I242-Y244 PolarHBondContact O-N 3.16Å; I242-T245 WeakPolarHBondContact O-CB 3.45Å; I242-T245 PolarHBondContact O-N 2.66Å; I242-T245 VanDerWaalsContact O-N 3.07Å; I242-L246 HydrophobicContact CG2-CD1 3.95Å; I242-L246 HydrophobicContact CG2-CG 4.33Å; I242-L246 WeakPolarHBondContact O-CG 3.45Å; I242-L246 PolarHBondContact O-N 3.3Å
243	L	98.4	Very high	96.1	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-55.4	-50.2	179.9	176.4	58	0	0	0	111.7	F159 L239 G240 T245 L246 V247 L283 L284 F287 W306	F159-L243 HydrophobicContact CD1-CD1 4.15Å; F159-L243 HydrophobicContact CD2-CB 4.24Å; F159-L243 HydrophobicContact CD2-CD1 4.36Å; F159-L243 HydrophobicContact CE1-CB 4.24Å; F159-L243 HydrophobicContact CE1-CD1 4.36Å; F159-L243 HydrophobicContact CE1-CD2 4.08Å; F159-L243 HydrophobicContact CE1-CG 4.46Å; F159-L243 HydrophobicContact CE2-CB 3.71Å; F159-L243 HydrophobicContact CG-CD1 4.15Å; F159-L243 HydrophobicContact CZ-CB 3.71Å; F159-L243 HydrophobicContact CZ-CD2 4.3Å; F159-L243 HydrophobicContact CZ-CG 4.41Å; L239-L243 WeakPolarHBondContact O-CB 3.26Å; L239-L243 PolarHBondContact O-N 2.8Å; G240-L243 PolarHBondContact O-N 3.16Å; L243-T245 VanDerWaalsContact C-N 3.27Å; L243-T245 PolarHBondContact O-N 2.98Å; L243-L246 PolarHBondContact O-N 3.47Å; L243-V247 HydrophobicContact CD1-CG1 4.26Å; L243-V247 WeakPolarHBondContact O-CG2 3.47Å; L243-V247 PolarHBondContact O-N 2.85Å; L243-L283 HydrophobicContact CD2-CD2 3.6Å; L243-L283 HydrophobicContact CD2-CG 3.78Å; L243-L284 HydrophobicContact CB-CD2 4.08Å; L243-L284 HydrophobicContact CD2-CD2 3.88Å; L243-L284 HydrophobicContact CD2-CG 4.09Å; L243-L284 HydrophobicContact CG-CD2 3.96Å; L243-L284 HydrophobicContact CG-CG 4.44Å; L243-F287 HydrophobicContact CD2-CD2 4.17Å; L243-F287 HydrophobicContact CD2-CE2 3.95Å; L243-W306 HydrophobicContact CD1-CE3 4.47Å; L243-W306 HydrophobicContact CD1-CH2 3.51Å; L243-W306 HydrophobicContact CD1-CZ2 4.24Å; L243-W306 HydrophobicContact CD1-CZ3 3.66Å
244	Y	97.9	Very high	95.6	Very high	13 Å²	13	13.4 Å²	13.4	5%	0.051	8%	0.08	C	C	.	.	H	α-helix	trans	-57.4	-43.5	177.1	-179.3	-82.9	0	0	0	111.2	G240 I242 L246 V247 S248 S250 L251 P252 Y270 R271 M276 L284	G240-Y244 WeakPolarHBondContact O-CB 3.5Å; G240-Y244 PolarHBondContact O-N 2.83Å; I242-Y244 PolarHBondContact O-N 3.16Å; Y244-L246 PolarHBondContact O-N 3.35Å; Y244-V247 PolarHBondContact O-N 3.37Å; Y244-S248 WeakPolarHBondContact CD1-OG 3.49Å; Y244-S248 WeakPolarHBondContact CE1-OG 3.5Å; Y244-S248 VanDerWaalsContact O-CB 3.29Å; Y244-S248 WeakPolarHBondContact O-CB 3.43Å; Y244-S248 PolarHBondContact O-N 3.48Å; Y244-S248 PolarHBondContact O-OG 3.21Å; Y244-S250 WeakPolarHBondContact CD1-O 3.39Å; Y244-S250 VanDerWaalsContact CE1-O 3.23Å; Y244-S250 WeakPolarHBondContact CE1-O 3.36Å; Y244-L251 VanDerWaalsContact CE1-C 3.46Å; Y244-L251 WeakPolarHBondContact CE1-O 3.38Å; Y244-P252 HydrophobicContact CD1-CB 3.63Å; Y244-P252 HydrophobicContact CD1-CG 3.99Å; Y244-P252 VanDerWaalsContact CD1-N 3.34Å; Y244-P252 HydrophobicContact CD2-CB 4.1Å; Y244-P252 VanDerWaalsContact CE1-CA 3.48Å; Y244-P252 HydrophobicContact CE1-CB 3.91Å; Y244-P252 HydrophobicContact CE2-CB 4.35Å; Y244-P252 HydrophobicContact CG-CB 3.74Å; Y244-P252 HydrophobicContact CG-CG 4.16Å; Y244-Y270 AromaticContact CD2-CD2 3.97Å; Y244-Y270 HydrophobicContact CD2-CD2 3.97Å; Y244-Y270 HydrophobicContact CD2-CE2 4.42Å; Y244-Y270 AromaticContact CE2-CD2 3.85Å; Y244-Y270 HydrophobicContact CE2-CD2 3.85Å; Y244-R271 VanDerWaalsContact CE2-O 3.3Å; Y244-R271 WeakPolarHBondContact CE2-O 3.42Å; Y244-R271 PolarHBondContact OH-O 2.96Å; Y244-R271 VanDerWaalsContact OH-O 3.1Å; Y244-M276 HydrophobicContact CD2-CE 4.08Å; Y244-M276 HydrophobicContact CE2-CE 4.25Å; Y244-L284 HydrophobicContact CD2-CD1 4.08Å
245	T	95	Very high	94.8	Very high	6 Å²	6	14.2 Å²	14.2	4%	0.037	9%	0.089	C	C	.	.	H	α-helix	trans	-65.6	-38.2	-179.1	-54.6	0	0	0	0	112.2	L144 V241 I242 L243 G249 S250	L144-T245 HydrophobicContact CD1-CG2 4.04Å; V241-T245 WeakPolarHBondContact O-CB 3.47Å; V241-T245 PolarHBondContact O-N 3.18Å; V241-T245 PolarHBondContact O-OG1 3.17Å; I242-T245 WeakPolarHBondContact O-CB 3.45Å; I242-T245 PolarHBondContact O-N 2.66Å; I242-T245 VanDerWaalsContact O-N 3.07Å; L243-T245 VanDerWaalsContact C-N 3.27Å; L243-T245 PolarHBondContact O-N 2.98Å; T245-G249 VanDerWaalsContact O-CA 3.29Å; T245-G249 WeakPolarHBondContact O-CA 3.33Å; T245-G249 PolarHBondContact O-N 3.29Å; T245-S250 WeakPolarHBondContact CA-O 3.29Å
246	L	95.9	Very high	93.8	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-62.5	-48.4	175.4	-66.3	167.4	0	0	0	112.1	V140 L144 M150 A155 F159 I162 I242 L243 Y244	V140-L246 HydrophobicContact CG1-CD2 3.5Å; L144-L246 HydrophobicContact CD1-CD2 4.32Å; M150-L246 HydrophobicContact CE-CD2 3.99Å; M150-L246 PolarHBondContact N-O 3.04Å; M150-L246 HydrophobicContact SD-CD2 3.78Å; A155-L246 HydrophobicContact CB-CB 4.19Å; F159-L246 HydrophobicContact CD2-CD1 4.1Å; I162-L246 HydrophobicContact CD1-CD1 4.45Å; I242-L246 HydrophobicContact CG2-CD1 3.95Å; I242-L246 HydrophobicContact CG2-CG 4.33Å; I242-L246 WeakPolarHBondContact O-CG 3.45Å; I242-L246 PolarHBondContact O-N 3.3Å; L243-L246 PolarHBondContact O-N 3.47Å; Y244-L246 PolarHBondContact O-N 3.35Å
247	V	96.8	Very high	93	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-86.3	-19.5	-171.5	-56.3	0	0	0	0	114.5	R149 E152 A155 L243 Y244 M276 W306	R149-V247 WeakPolarHBondContact CD-O 3.35Å; R149-V247 PolarHBondContact NH1-O 2.93Å; E152-V247 HydrophobicContact CG-CB 4.49Å; E152-V247 HydrophobicContact CG-CG1 4.13Å; A155-V247 HydrophobicContact CB-CG1 3.69Å; L243-V247 HydrophobicContact CD1-CG1 4.26Å; L243-V247 WeakPolarHBondContact O-CG2 3.47Å; L243-V247 PolarHBondContact O-N 2.85Å; Y244-V247 PolarHBondContact O-N 3.37Å; V247-M276 HydrophobicContact CG2-CE 3.61Å; V247-W306 HydrophobicContact CG1-CZ2 4.29Å
248	S	93.6	Very high	92.3	Very high	12 Å²	12	31.1 Å²	31.1	8%	0.084	17%	0.173	C	C	.	.	H	α-helix	trans	-106.7	-27.6	178.5	73.6	0	0	0	0	114.5	R149 Y244 S250 Y275	R149-S248 VanDerWaalsContact CB-C 3.41Å; Y244-S248 WeakPolarHBondContact CD1-OG 3.49Å; Y244-S248 WeakPolarHBondContact CE1-OG 3.5Å; Y244-S248 VanDerWaalsContact O-CB 3.29Å; Y244-S248 WeakPolarHBondContact O-CB 3.43Å; Y244-S248 PolarHBondContact O-N 3.48Å; Y244-S248 PolarHBondContact O-OG 3.21Å; S248-S250 PolarHBondContact OG-N 3.33Å; S248-S250 PolarHBondContact OG-O 2.71Å; S248-S250 VanDerWaalsContact OG-O 3.06Å; S248-Y275 PolarHBondContact O-OH 2.73Å
249	G	88.8	Confident	91.9	Very high	11 Å²	11	37.8 Å²	37.8	11%	0.113	20%	0.201	C	C	.	.	S	Bend	trans	82.2	5.8	-174.6	0	0	0	0	0	115	T245 K741	T245-G249 VanDerWaalsContact O-CA 3.29Å; T245-G249 WeakPolarHBondContact O-CA 3.33Å; T245-G249 PolarHBondContact O-N 3.29Å; G249-K741 PolarHBondContact O-NZ 3.1Å
250	S	88	Confident	91.6	Very high	61 Å²	61	39.7 Å²	39.7	43%	0.427	21%	0.21	S	C	.	.	S	Bend	trans	-139.7	165	177	63.6	0	0	0	0	112	Y244 T245 S248	Y244-S250 WeakPolarHBondContact CD1-O 3.39Å; Y244-S250 VanDerWaalsContact CE1-O 3.23Å; Y244-S250 WeakPolarHBondContact CE1-O 3.36Å; T245-S250 WeakPolarHBondContact CA-O 3.29Å; S248-S250 PolarHBondContact OG-N 3.33Å; S248-S250 PolarHBondContact OG-O 2.71Å; S248-S250 VanDerWaalsContact OG-O 3.06Å
251	L	91.1	Very high	91.2	Very high	50 Å²	50	40.2 Å²	40.2	26%	0.262	21%	0.213	S	C	.	.			trans	-73.2	149.8	175.5	-70.3	161.9	0	0	0	111.3	P217 Y218 V241 Y244 D254	P217-L251 HydrophobicContact CB-CD1 3.88Å; P217-L251 HydrophobicContact CB-CD2 4.18Å; P217-L251 HydrophobicContact CG-CD1 4.42Å; Y218-L251 HydrophobicContact CE1-CD2 4.37Å; V241-L251 HydrophobicContact CG1-CD2 3.89Å; Y244-L251 VanDerWaalsContact CE1-C 3.46Å; Y244-L251 WeakPolarHBondContact CE1-O 3.38Å; L251-D254 HydrophobicContact CB-CB 4.43Å
252	P	95.1	Very high	91	Very high	13 Å²	13	46 Å²	46	8%	0.084	24%	0.235	C	C	.	.	S	Bend	trans	-75.4	-28.2	173.7	29	-30.9	0	0	0	112.4	V241 Y244 Y270 L288	V241-P252 HydrophobicContact CB-CG 4.27Å; V241-P252 HydrophobicContact CG1-CG 4.03Å; V241-P252 HydrophobicContact CG2-CG 4.07Å; Y244-P252 HydrophobicContact CD1-CB 3.63Å; Y244-P252 HydrophobicContact CD1-CG 3.99Å; Y244-P252 VanDerWaalsContact CD1-N 3.34Å; Y244-P252 HydrophobicContact CD2-CB 4.1Å; Y244-P252 VanDerWaalsContact CE1-CA 3.48Å; Y244-P252 HydrophobicContact CE1-CB 3.91Å; Y244-P252 HydrophobicContact CE2-CB 4.35Å; Y244-P252 HydrophobicContact CG-CB 3.74Å; Y244-P252 HydrophobicContact CG-CG 4.16Å; P252-Y270 HydrophobicContact CB-CG 4.23Å; P252-L288 HydrophobicContact CB-CD1 4.43Å
253	F	94.9	Very high	91	Very high	3 Å²	3	50.9 Å²	50.9	1%	0.013	26%	0.258	C	S	.	.	S	Bend	trans	-132	126.6	176.3	-42.1	-69.5	0	0	0	108.3	W237 L261 V265 Y270 L288	W237-F253 AromaticContact CH2-CE2 3.88Å; W237-F253 HydrophobicContact CH2-CE2 3.88Å; W237-F253 AromaticContact CH2-CZ 3.96Å; W237-F253 HydrophobicContact CH2-CZ 3.96Å; W237-F253 HydrophobicContact CZ2-CD2 4.01Å; W237-F253 AromaticContact CZ2-CE2 3.32Å; W237-F253 HydrophobicContact CZ2-CE2 3.32Å; W237-F253 AromaticContact CZ2-CZ 3.88Å; W237-F253 HydrophobicContact CZ2-CZ 3.88Å; F253-L261 HydrophobicContact CB-CD1 4.17Å; F253-V265 HydrophobicContact CB-CG2 3.68Å; F253-V265 HydrophobicContact CD2-CG2 4.08Å; F253-V265 HydrophobicContact CG-CG2 3.92Å; F253-Y270 HydrophobicContact CE1-CD1 4.08Å; F253-Y270 AromaticContact CZ-CD1 3.84Å; F253-Y270 HydrophobicContact CZ-CD1 3.84Å; F253-L288 HydrophobicContact CE2-CD1 4.37Å; F253-L288 HydrophobicContact CE2-CD2 4.25Å; F253-L288 HydrophobicContact CZ-CD1 4.42Å
254	D	86.6	Confident	90.8	Very high	98 Å²	98	55.1 Å²	55.1	52%	0.524	27%	0.274	S	S	.	.			trans	-151.5	158.2	-178	-176	23.3	0	0	0	108.1	L251 R264	L251-D254 HydrophobicContact CB-CB 4.43Å; D254-R264 WeakPolarHBondContact O-CD 3.39Å; D254-R264 PolarHBondContact O-NH1 3.4Å
255	G	80.7	Confident	90.8	Very high	19 Å²	19	54.5 Å²	54.5	20%	0.196	27%	0.271	C	S	.	.			trans	-169.7	151.4	-177.6	0	0	0	0	0	113.4	N257	G255-N257 PolarHBondContact O-N 3.17Å
256	Q	78.6	Confident	90.9	Very high	182 Å²	182	56.7 Å²	56.7	85%	0.85	28%	0.283	S	S	*	.	S	Bend	trans	-66.4	-12.2	-176.2	-61.6	-174.1	-10.1	0	0	113.3	E260	Q256-E260 PolarHBondContact N-OE2 2.82Å
257	N	81.2	Confident	91	Very high	72 Å²	72	63.7 Å²	63.7	39%	0.385	31%	0.309	S	S	.	.	S	Bend	trans	-158	164.9	-179.7	52.8	74.7	0	0	0	109.6	G255 K259 E260 L261	G255-N257 PolarHBondContact O-N 3.17Å; N257-K259 PolarHBondContact O-N 2.85Å; N257-K259 VanDerWaalsContact O-N 3.16Å; N257-K259 WeakPolarHBondContact OD1-CB 3.37Å; N257-K259 PolarHBondContact OD1-N 3.09Å; N257-E260 PolarHBondContact ND2-OE1 2.85Å; N257-E260 PolarHBondContact O-N 2.93Å; N257-E260 PolarHBondContact OD1-N 3.49Å; N257-L261 PolarHBondContact O-N 3.32Å; N257-L261 VanDerWaalsContact O-N 3.08Å
258	L	83.1	Confident	90.9	Very high	106 Å²	106	64.3 Å²	64.3	56%	0.555	32%	0.315	S	S	*	.	H	α-helix	trans	-60.6	-26.1	-177.8	-172.2	61.7	0	0	0	113.5	P216 F224 L261 R262	P216-L258 HydrophobicContact CB-CD1 3.8Å; P216-L258 HydrophobicContact CG-CD1 4.15Å; F224-L258 HydrophobicContact CE1-CD1 3.91Å; F224-L258 HydrophobicContact CZ-CD1 4.46Å; L258-L261 HydrophobicContact CD1-CD2 4.42Å; L258-R262 WeakPolarHBondContact O-CB 3.15Å; L258-R262 PolarHBondContact O-N 2.86Å
259	K	91.1	Very high	91	Very high	143 Å²	143	71.2 Å²	71.2	62%	0.622	34%	0.344	S	S	*	.	H	α-helix	trans	-71	-50.9	177.3	178.4	-173.7	166.9	-172.9	0	111.1	N257 L261 R262 E263	N257-K259 PolarHBondContact O-N 2.85Å; N257-K259 VanDerWaalsContact O-N 3.16Å; N257-K259 WeakPolarHBondContact OD1-CB 3.37Å; N257-K259 PolarHBondContact OD1-N 3.09Å; K259-L261 VanDerWaalsContact C-N 3.32Å; K259-L261 PolarHBondContact O-N 2.88Å; K259-R262 WeakPolarHBondContact O-CB 3.11Å; K259-R262 PolarHBondContact O-N 3.01Å; K259-E263 WeakPolarHBondContact CE-OE1 3.41Å; K259-E263 WeakPolarHBondContact CG-OE1 3.32Å; K259-E263 IonicContact NZ-OE1 3.96Å; K259-E263 WeakPolarHBondContact O-CG 3.36Å; K259-E263 PolarHBondContact O-N 2.78Å
260	E	91.6	Very high	91.3	Very high	41 Å²	41	72.9 Å²	72.9	19%	0.192	35%	0.347	C	S	.	.	H	α-helix	trans	-58.9	-42.9	174.5	-82.6	173.3	-127.9	0	0	112.4	Q256 N257 E263 R264	Q256-E260 PolarHBondContact N-OE2 2.82Å; N257-E260 PolarHBondContact ND2-OE1 2.85Å; N257-E260 PolarHBondContact O-N 2.93Å; N257-E260 PolarHBondContact OD1-N 3.49Å; E260-E263 PolarHBondContact O-N 2.84Å; E260-R264 WeakPolarHBondContact O-CB 3.44Å; E260-R264 WeakPolarHBondContact O-CD 3.48Å; E260-R264 VanDerWaalsContact O-CG 3.23Å; E260-R264 WeakPolarHBondContact O-CG 3.31Å; E260-R264 PolarHBondContact O-N 3.2Å; E260-R264 IonicContact OE2-CZ 2.83Å; E260-R264 IonicContact OE2-NH1 2.65Å; E260-R264 IonicContact OE2-NH2 2.7Å; E260-R264 PolarHBondContact OE2-NH2 2.65Å
261	L	91.5	Very high	91.6	Very high	11 Å²	11	79.4 Å²	79.4	6%	0.058	36%	0.362	C	S	.	.	H	α-helix	trans	-60.5	-48.8	177	177.2	60.2	0	0	0	110.5	P216 P217 F224 F253 N257 L258 K259 E263 R264 V265	P216-L261 HydrophobicContact CB-CD2 3.83Å; P217-L261 HydrophobicContact CG-CD2 4.15Å; F224-L261 HydrophobicContact CZ-CG 4.41Å; F253-L261 HydrophobicContact CB-CD1 4.17Å; N257-L261 PolarHBondContact O-N 3.32Å; N257-L261 VanDerWaalsContact O-N 3.08Å; L258-L261 HydrophobicContact CD1-CD2 4.42Å; K259-L261 VanDerWaalsContact C-N 3.32Å; K259-L261 PolarHBondContact O-N 2.88Å; L261-E263 PolarHBondContact O-N 2.88Å; L261-R264 PolarHBondContact O-N 2.91Å; L261-V265 HydrophobicContact CD1-CG2 4.05Å; L261-V265 HydrophobicContact CG-CG2 4.44Å; L261-V265 WeakPolarHBondContact O-CB 3.49Å; L261-V265 WeakPolarHBondContact O-CG2 3.46Å; L261-V265 PolarHBondContact O-N 3.31Å
262	R	93.9	Very high	91.8	Very high	120 Å²	120	79.9 Å²	79.9	45%	0.453	36%	0.364	S	S	.	.	H	α-helix	trans	-55.3	-49.7	174.7	178.4	176.1	-167	-155.1	4.4	111.6	F224 L258 K259 R264 V265 L266	F224-R262 HydrophobicContact CB-CG 4.12Å; F224-R262 HydrophobicContact CD1-CB 3.71Å; F224-R262 HydrophobicContact CD1-CG 3.66Å; F224-R262 HydrophobicContact CE1-CB 3.92Å; F224-R262 HydrophobicContact CE1-CG 4.39Å; F224-R262 HydrophobicContact CG-CB 4.49Å; F224-R262 HydrophobicContact CG-CG 4.16Å; F224-R262 VanDerWaalsContact O-CZ 3.29Å; F224-R262 PolarHBondContact O-NE 2.62Å; F224-R262 PolarHBondContact O-NH2 3.47Å; L258-R262 WeakPolarHBondContact O-CB 3.15Å; L258-R262 PolarHBondContact O-N 2.86Å; K259-R262 WeakPolarHBondContact O-CB 3.11Å; K259-R262 PolarHBondContact O-N 3.01Å; R262-R264 VanDerWaalsContact C-N 3.3Å; R262-R264 PolarHBondContact O-N 2.97Å; R262-V265 PolarHBondContact O-N 3.36Å; R262-L266 HydrophobicContact CG-CD1 3.79Å; R262-L266 HydrophobicContact CG-CG 4.2Å; R262-L266 WeakPolarHBondContact O-CB 3.1Å; R262-L266 WeakPolarHBondContact O-CG 3.4Å; R262-L266 PolarHBondContact O-N 2.89Å
263	E	96.4	Very high	91.7	Very high	105 Å²	105	79.9 Å²	79.9	49%	0.491	37%	0.365	S	S	.	.	H	α-helix	trans	-60.5	-38.6	179.1	-73.4	170.7	-170	0	0	112.3	K259 E260 L261 R267	K259-E263 WeakPolarHBondContact CE-OE1 3.41Å; K259-E263 WeakPolarHBondContact CG-OE1 3.32Å; K259-E263 IonicContact NZ-OE1 3.96Å; K259-E263 WeakPolarHBondContact O-CG 3.36Å; K259-E263 PolarHBondContact O-N 2.78Å; E260-E263 PolarHBondContact O-N 2.84Å; L261-E263 PolarHBondContact O-N 2.88Å; E263-R267 WeakPolarHBondContact O-CB 3.14Å; E263-R267 PolarHBondContact O-N 2.77Å; E263-R267 VanDerWaalsContact O-N 3.11Å
264	R	96	Very high	91.7	Very high	89 Å²	89	89.2 Å²	89.2	34%	0.336	41%	0.405	S	S	.	.	H	α-helix	trans	-72.8	-41.5	178.6	-69.1	164.1	-167.6	-178.5	11.4	112.4	D254 E260 L261 R262 R267 G268	D254-R264 WeakPolarHBondContact O-CD 3.39Å; D254-R264 PolarHBondContact O-NH1 3.4Å; E260-R264 WeakPolarHBondContact O-CB 3.44Å; E260-R264 WeakPolarHBondContact O-CD 3.48Å; E260-R264 VanDerWaalsContact O-CG 3.23Å; E260-R264 WeakPolarHBondContact O-CG 3.31Å; E260-R264 PolarHBondContact O-N 3.2Å; E260-R264 IonicContact OE2-CZ 2.83Å; E260-R264 IonicContact OE2-NH1 2.65Å; E260-R264 IonicContact OE2-NH2 2.7Å; E260-R264 PolarHBondContact OE2-NH2 2.65Å; L261-R264 PolarHBondContact O-N 2.91Å; R262-R264 VanDerWaalsContact C-N 3.3Å; R262-R264 PolarHBondContact O-N 2.97Å; R264-R267 PolarHBondContact O-N 3.44Å; R264-G268 PolarHBondContact O-N 3.38Å
265	V	97.1	Very high	92.1	Very high	0 Å²	0	88.3 Å²	88.3	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-63	-49.9	174.1	169.2	0	0	0	0	110.9	P221 F224 W237 F253 L261 R262 R267 G268 L290	P221-V265 HydrophobicContact CB-CG1 4.4Å; P221-V265 HydrophobicContact CG-CG1 4.01Å; F224-V265 HydrophobicContact CD2-CB 4.3Å; F224-V265 HydrophobicContact CD2-CG1 3.74Å; F224-V265 HydrophobicContact CE2-CB 4.21Å; F224-V265 HydrophobicContact CE2-CG1 3.91Å; F224-V265 HydrophobicContact CE2-CG2 4.11Å; W237-V265 HydrophobicContact CZ2-CG1 4.03Å; F253-V265 HydrophobicContact CB-CG2 3.68Å; F253-V265 HydrophobicContact CD2-CG2 4.08Å; F253-V265 HydrophobicContact CG-CG2 3.92Å; L261-V265 HydrophobicContact CD1-CG2 4.05Å; L261-V265 HydrophobicContact CG-CG2 4.44Å; L261-V265 WeakPolarHBondContact O-CB 3.49Å; L261-V265 WeakPolarHBondContact O-CG2 3.46Å; L261-V265 PolarHBondContact O-N 3.31Å; R262-V265 PolarHBondContact O-N 3.36Å; V265-R267 PolarHBondContact O-N 3.31Å; V265-G268 PolarHBondContact O-N 3.07Å; V265-L290 WeakPolarHBondContact O-CD2 3.48Å
266	L	97.4	Very high	92.9	Very high	52 Å²	52	88.2 Å²	88.2	27%	0.272	39%	0.39	S	S	.	.	H	α-helix	trans	-64	-27.2	179.3	-67	-177.4	0	0	0	113	P221 F224 Q225 R262	P221-L266 HydrophobicContact CB-CD2 4.01Å; P221-L266 WeakPolarHBondContact O-CD2 3.25Å; F224-L266 HydrophobicContact CB-CD2 3.98Å; F224-L266 HydrophobicContact CB-CG 4.41Å; Q225-L266 HydrophobicContact CG-CD2 3.78Å; R262-L266 HydrophobicContact CG-CD1 3.79Å; R262-L266 HydrophobicContact CG-CG 4.2Å; R262-L266 WeakPolarHBondContact O-CB 3.1Å; R262-L266 WeakPolarHBondContact O-CG 3.4Å; R262-L266 PolarHBondContact O-N 2.89Å
267	R	97.3	Very high	93.8	Very high	148 Å²	148	81.4 Å²	81.4	56%	0.558	36%	0.362	S	S	*	.	H	α-helix	trans	-77	-22.3	173.4	-171.1	179.5	70	-179.3	2.6	113.2	E263 R264 V265 K269	E263-R267 WeakPolarHBondContact O-CB 3.14Å; E263-R267 PolarHBondContact O-N 2.77Å; E263-R267 VanDerWaalsContact O-N 3.11Å; R264-R267 PolarHBondContact O-N 3.44Å; V265-R267 PolarHBondContact O-N 3.31Å; R267-K269 HydrophobicContact CG-CB 4.32Å; R267-K269 HydrophobicContact CG-CD 4.27Å; R267-K269 HydrophobicContact CG-CG 4.22Å; R267-K269 PolarHBondContact O-N 3.48Å
268	G	95.6	Very high	94.6	Very high	14 Å²	14	82.3 Å²	82.3	14%	0.144	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	9.1	176.7	0	0	0	0	0	116.3	R264 V265	R264-G268 PolarHBondContact O-N 3.38Å; V265-G268 PolarHBondContact O-N 3.07Å
269	K	94.3	Very high	95.3	Very high	157 Å²	157	79.3 Å²	79.3	68%	0.683	36%	0.355	S	S	*	.			trans	-98.2	110.1	-176.5	-70.7	-175.1	179.7	-174.6	0	111.6	R267	R267-K269 HydrophobicContact CG-CB 4.32Å; R267-K269 HydrophobicContact CG-CD 4.27Å; R267-K269 HydrophobicContact CG-CG 4.22Å; R267-K269 PolarHBondContact O-N 3.48Å
270	Y	96	Very high	95.7	Very high	46 Å²	46	72.5 Å²	72.5	18%	0.18	33%	0.325	C	S	.	.			trans	-112.2	168.9	172.6	56.3	-81.7	0	0	0	110.8	Y244 P252 F253 I272 L284 L288	Y244-Y270 AromaticContact CD2-CD2 3.97Å; Y244-Y270 HydrophobicContact CD2-CD2 3.97Å; Y244-Y270 HydrophobicContact CD2-CE2 4.42Å; Y244-Y270 AromaticContact CE2-CD2 3.85Å; Y244-Y270 HydrophobicContact CE2-CD2 3.85Å; P252-Y270 HydrophobicContact CB-CG 4.23Å; F253-Y270 HydrophobicContact CE1-CD1 4.08Å; F253-Y270 AromaticContact CZ-CD1 3.84Å; F253-Y270 HydrophobicContact CZ-CD1 3.84Å; Y270-I272 HydrophobicContact CD2-CD1 3.92Å; Y270-I272 HydrophobicContact CE2-CD1 3.5Å; Y270-L284 HydrophobicContact CE2-CB 4.35Å; Y270-L284 HydrophobicContact CE2-CD1 4.47Å; Y270-L288 HydrophobicContact CD1-CD1 3.92Å; Y270-L288 HydrophobicContact CE1-CB 3.84Å; Y270-L288 HydrophobicContact CE1-CD1 3.61Å; Y270-L288 HydrophobicContact CE1-CG 4.37Å; Y270-L288 HydrophobicContact CE2-CD1 4.23Å; Y270-L288 HydrophobicContact CG-CD1 4.38Å
271	R	94	Very high	96	Very high	198 Å²	198	72.9 Å²	72.9	75%	0.747	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-96.9	130.2	-177.8	178.4	-178.8	-178.8	179.2	2.9	110.8	Y244 P273	Y244-R271 VanDerWaalsContact CE2-O 3.3Å; Y244-R271 WeakPolarHBondContact CE2-O 3.42Å; Y244-R271 PolarHBondContact OH-O 2.96Å; Y244-R271 VanDerWaalsContact OH-O 3.1Å; R271-P273 WeakPolarHBondContact O-CD 3.39Å
272	I	96.1	Very high	96.4	Very high	60 Å²	60	75.8 Å²	75.8	31%	0.308	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-84	122.5	166.9	-53	-51	0	0	0	109.2	Y270 M276 E281	Y270-I272 HydrophobicContact CD2-CD1 3.92Å; Y270-I272 HydrophobicContact CE2-CD1 3.5Å; I272-M276 HydrophobicContact CD1-SD 4.15Å; I272-M276 HydrophobicContact CG2-CB 4.32Å; I272-M276 HydrophobicContact CG2-SD 3.95Å; I272-E281 HydrophobicContact CD1-CG 3.77Å; I272-E281 HydrophobicContact CG1-CG 3.93Å; I272-E281 HydrophobicContact CG2-CG 4.3Å
273	P	93.1	Very high	96.6	Very high	14 Å²	14	70 Å²	70	9%	0.091	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-75.9	145.1	171.9	-13.5	29.7	0	0	0	111.3	R271 Y275 M276	R271-P273 WeakPolarHBondContact O-CD 3.39Å; P273-Y275 HydrophobicContact CB-CD1 3.97Å; P273-Y275 HydrophobicContact CB-CD2 3.87Å; P273-Y275 HydrophobicContact CB-CE1 3.6Å; P273-Y275 HydrophobicContact CB-CE2 3.47Å; P273-Y275 VanDerWaalsContact CB-CE2 3.47Å; P273-Y275 HydrophobicContact CB-CG 4.11Å; P273-Y275 HydrophobicContact CG-CE1 4.5Å; P273-Y275 HydrophobicContact CG-CE2 3.81Å; P273-Y275 PolarHBondContact O-N 3.2Å; P273-M276 HydrophobicContact CG-CE 4.4Å; P273-M276 WeakPolarHBondContact O-CB 3.42Å; P273-M276 PolarHBondContact O-N 2.95Å
274	F	94.5	Very high	96.7	Very high	198 Å²	198	65 Å²	65	87%	0.868	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-16	-180	71.9	-92.7	0	0	0	115.1
275	Y	93.7	Very high	96.8	Very high	80 Å²	80	65.6 Å²	65.6	31%	0.314	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	0.9	-179	57.5	-116.5	0	0	0	113.8	R149 S248 P273	R149-Y275 VanDerWaalsContact NH1-CE2 3.3Å; R149-Y275 VanDerWaalsContact NH2-CD2 3.32Å; S248-Y275 PolarHBondContact O-OH 2.73Å; P273-Y275 HydrophobicContact CB-CD1 3.97Å; P273-Y275 HydrophobicContact CB-CD2 3.87Å; P273-Y275 HydrophobicContact CB-CE1 3.6Å; P273-Y275 HydrophobicContact CB-CE2 3.47Å; P273-Y275 VanDerWaalsContact CB-CE2 3.47Å; P273-Y275 HydrophobicContact CB-CG 4.11Å; P273-Y275 HydrophobicContact CG-CE1 4.5Å; P273-Y275 HydrophobicContact CG-CE2 3.81Å; P273-Y275 PolarHBondContact O-N 3.2Å
276	M	97.6	Very high	96.8	Very high	17 Å²	17	69 Å²	69	8%	0.084	32%	0.315	C	S	.	.	S	Bend	trans	-87.2	134.7	176.8	-179.4	-177.4	-79.6	0	0	108.9	E152 Y244 V247 I272 P273 C280 E281 L284	E152-M276 WeakPolarHBondContact OE1-CA 3.36Å; Y244-M276 HydrophobicContact CD2-CE 4.08Å; Y244-M276 HydrophobicContact CE2-CE 4.25Å; V247-M276 HydrophobicContact CG2-CE 3.61Å; I272-M276 HydrophobicContact CD1-SD 4.15Å; I272-M276 HydrophobicContact CG2-CB 4.32Å; I272-M276 HydrophobicContact CG2-SD 3.95Å; P273-M276 HydrophobicContact CG-CE 4.4Å; P273-M276 WeakPolarHBondContact O-CB 3.42Å; P273-M276 PolarHBondContact O-N 2.95Å; M276-C280 HydrophobicContact CG-CB 3.83Å; M276-E281 HydrophobicContact SD-CB 4.4Å; M276-L284 HydrophobicContact CE-CD1 3.59Å; M276-L284 HydrophobicContact SD-CD1 3.68Å
277	S	98.3	Very high	96.9	Very high	38 Å²	38	66.5 Å²	66.5	27%	0.266	30%	0.302	S	S	.	.			trans	-71.1	150.1	177.5	71.3	0	0	0	0	111.9	E152 D279 C280 E281	E152-S277 PolarHBondContact OE1-N 2.87Å; E152-S277 PolarHBondContact OE1-OG 2.88Å; E152-S277 WeakPolarHBondContact OE2-CB 3.32Å; E152-S277 PolarHBondContact OE2-OG 2.85Å; S277-D279 PolarHBondContact O-N 2.99Å; S277-C280 WeakPolarHBondContact O-CB 3.24Å; S277-C280 PolarHBondContact O-N 3.24Å; S277-C280 WeakPolarHBondContact OG-CB 3.42Å; S277-C280 PolarHBondContact OG-N 3.31Å; S277-C280 VanDerWaalsContact OG-N 3.11Å; S277-E281 PolarHBondContact O-N 3.43Å
278	T	98.3	Very high	96.9	Very high	92 Å²	92	60 Å²	60	56%	0.564	28%	0.279	S	S	*	.	H	α-helix	trans	-58.9	-31.9	174.2	-46	0	0	0	0	112	N282	T278-N282 VanDerWaalsContact O-CB 3.28Å; T278-N282 WeakPolarHBondContact O-CB 3.46Å; T278-N282 PolarHBondContact O-N 3.46Å; T278-N282 PolarHBondContact O-ND2 2.98Å
279	D	98.4	Very high	97.1	Very high	42 Å²	42	60.8 Å²	60.8	23%	0.225	28%	0.281	C	S	.	.	H	α-helix	trans	-67.1	-40.9	173.7	-67.1	-34.7	0	0	0	111.5	S277 N282 L283 R305 W306	S277-D279 PolarHBondContact O-N 2.99Å; D279-N282 PolarHBondContact O-N 3.46Å; D279-L283 PolarHBondContact O-N 2.68Å; D279-R305 VanDerWaalsContact CG-NH1 3.25Å; D279-R305 WeakPolarHBondContact OD1-CD 3.36Å; D279-R305 IonicContact OD1-CZ 4Å; D279-R305 IonicContact OD1-NE 3.15Å; D279-R305 IonicContact OD1-NH1 3.55Å; D279-R305 PolarHBondContact OD1-NH1 3.22Å; D279-R305 IonicContact OD2-CZ 2.66Å; D279-R305 IonicContact OD2-NE 3.37Å; D279-R305 IonicContact OD2-NH1 3.85Å; D279-R305 PolarHBondContact OD2-NH1 2.77Å; D279-W306 HydrophobicContact CB-CB 4.1Å; D279-W306 HydrophobicContact CB-CG 4.49Å
280	C	98.6	Very high	97.2	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.2	-42.3	175.1	-167.1	0	0	0	0	111.9	M276 S277 N282 L283 L284 W306	M276-C280 HydrophobicContact CG-CB 3.83Å; S277-C280 WeakPolarHBondContact O-CB 3.24Å; S277-C280 PolarHBondContact O-N 3.24Å; S277-C280 WeakPolarHBondContact OG-CB 3.42Å; S277-C280 PolarHBondContact OG-N 3.31Å; S277-C280 VanDerWaalsContact OG-N 3.11Å; C280-N282 VanDerWaalsContact C-N 3.34Å; C280-N282 PolarHBondContact O-N 2.92Å; C280-L283 PolarHBondContact O-N 2.84Å; C280-L284 WeakPolarHBondContact O-CG 3.37Å; C280-L284 PolarHBondContact O-N 3.21Å; C280-W306 HydrophobicContact CB-CG 4.36Å
281	E	98.3	Very high	97.3	Very high	49 Å²	49	58.2 Å²	58.2	23%	0.229	28%	0.277	C	S	.	.	H	α-helix	trans	-60	-44.1	173.8	-173.9	-168.2	154.7	0	0	111.4	I272 M276 S277 L284 K285	I272-E281 HydrophobicContact CD1-CG 3.77Å; I272-E281 HydrophobicContact CG1-CG 3.93Å; I272-E281 HydrophobicContact CG2-CG 4.3Å; M276-E281 HydrophobicContact SD-CB 4.4Å; S277-E281 PolarHBondContact O-N 3.43Å; E281-L284 PolarHBondContact O-N 2.92Å; E281-K285 VanDerWaalsContact CD-NZ 3.31Å; E281-K285 WeakPolarHBondContact O-CG 3.4Å; E281-K285 PolarHBondContact O-N 3.15Å; E281-K285 WeakPolarHBondContact OE1-CE 3.35Å; E281-K285 IonicContact OE1-NZ 3.85Å; E281-K285 PolarHBondContact OE1-NZ 3.37Å
282	N	98.4	Very high	97.4	Very high	72 Å²	72	50.7 Å²	50.7	39%	0.385	25%	0.254	S	S	.	.	H	α-helix	trans	-66.4	-38.8	179	-72.4	-20.1	0	0	0	112.3	T278 D279 C280 K285 R286	T278-N282 VanDerWaalsContact O-CB 3.28Å; T278-N282 WeakPolarHBondContact O-CB 3.46Å; T278-N282 PolarHBondContact O-N 3.46Å; T278-N282 PolarHBondContact O-ND2 2.98Å; D279-N282 PolarHBondContact O-N 3.46Å; C280-N282 VanDerWaalsContact C-N 3.34Å; C280-N282 PolarHBondContact O-N 2.92Å; N282-K285 WeakPolarHBondContact O-CB 3.43Å; N282-K285 PolarHBondContact O-N 2.96Å; N282-K285 PolarHBondContact OD1-NZ 3.13Å; N282-K285 VanDerWaalsContact OD1-NZ 3.15Å; N282-R286 WeakPolarHBondContact O-CG 3.4Å; N282-R286 PolarHBondContact O-N 3.48Å
283	L	98.6	Very high	97.4	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.1	-43.3	171.3	176.2	56.9	0	0	0	111.9	L243 D279 C280 K285 R286 F287 I301 D304 W306 I307	L243-L283 HydrophobicContact CD2-CD2 3.6Å; L243-L283 HydrophobicContact CD2-CG 3.78Å; D279-L283 PolarHBondContact O-N 2.68Å; C280-L283 PolarHBondContact O-N 2.84Å; L283-K285 VanDerWaalsContact C-N 3.28Å; L283-K285 PolarHBondContact O-N 3.27Å; L283-R286 WeakPolarHBondContact O-CB 3.35Å; L283-R286 PolarHBondContact O-N 2.91Å; L283-F287 HydrophobicContact CD1-CD2 3.93Å; L283-F287 HydrophobicContact CD1-CE2 3.51Å; L283-F287 HydrophobicContact CD1-CZ 4.36Å; L283-F287 HydrophobicContact CD2-CE2 4.19Å; L283-F287 HydrophobicContact CG-CD2 4.01Å; L283-F287 HydrophobicContact CG-CE2 3.71Å; L283-F287 WeakPolarHBondContact O-CD2 3.39Å; L283-F287 PolarHBondContact O-N 3.03Å; L283-I301 HydrophobicContact CD1-CG2 3.99Å; L283-D304 HydrophobicContact CD1-CB 4.07Å; L283-W306 HydrophobicContact CB-CB 4.27Å; L283-W306 HydrophobicContact CD2-CB 3.99Å; L283-W306 HydrophobicContact CD2-CD2 4.02Å; L283-W306 HydrophobicContact CD2-CE3 3.43Å; L283-W306 VanDerWaalsContact CD2-CE3 3.43Å; L283-W306 HydrophobicContact CD2-CG 4.27Å; L283-W306 HydrophobicContact CD2-CZ3 4.22Å; L283-I307 HydrophobicContact CD2-CD1 3.9Å; L283-I307 HydrophobicContact CD2-CG1 3.98Å
284	L	98.7	Very high	97.6	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61	-35.1	175.8	-74.8	167.9	0	0	0	112.7	G240 L243 Y244 Y270 M276 C280 E281 R286 F287 L288	G240-L284 WeakPolarHBondContact O-CD2 3.34Å; L243-L284 HydrophobicContact CB-CD2 4.08Å; L243-L284 HydrophobicContact CD2-CD2 3.88Å; L243-L284 HydrophobicContact CD2-CG 4.09Å; L243-L284 HydrophobicContact CG-CD2 3.96Å; L243-L284 HydrophobicContact CG-CG 4.44Å; Y244-L284 HydrophobicContact CD2-CD1 4.08Å; Y270-L284 HydrophobicContact CE2-CB 4.35Å; Y270-L284 HydrophobicContact CE2-CD1 4.47Å; M276-L284 HydrophobicContact CE-CD1 3.59Å; M276-L284 HydrophobicContact SD-CD1 3.68Å; C280-L284 WeakPolarHBondContact O-CG 3.37Å; C280-L284 PolarHBondContact O-N 3.21Å; E281-L284 PolarHBondContact O-N 2.92Å; L284-R286 PolarHBondContact O-N 2.93Å; L284-F287 PolarHBondContact O-N 3.5Å; L284-L288 HydrophobicContact CD2-CD1 4.33Å; L284-L288 PolarHBondContact O-N 3.34Å
285	K	98	Very high	97.8	Very high	100 Å²	100	53.4 Å²	53.4	44%	0.435	27%	0.267	S	S	.	.	H	α-helix	trans	-64.6	-18.8	172	-69.9	167.3	-171.3	154.2	0	113.8	E281 N282 L283 V289	E281-K285 VanDerWaalsContact CD-NZ 3.31Å; E281-K285 WeakPolarHBondContact O-CG 3.4Å; E281-K285 PolarHBondContact O-N 3.15Å; E281-K285 WeakPolarHBondContact OE1-CE 3.35Å; E281-K285 IonicContact OE1-NZ 3.85Å; E281-K285 PolarHBondContact OE1-NZ 3.37Å; N282-K285 WeakPolarHBondContact O-CB 3.43Å; N282-K285 PolarHBondContact O-N 2.96Å; N282-K285 PolarHBondContact OD1-NZ 3.13Å; N282-K285 VanDerWaalsContact OD1-NZ 3.15Å; L283-K285 VanDerWaalsContact C-N 3.28Å; L283-K285 PolarHBondContact O-N 3.27Å; K285-V289 WeakPolarHBondContact O-CG2 3.19Å
286	R	98.1	Very high	97.9	Very high	71 Å²	71	50 Å²	50	27%	0.268	26%	0.256	S	S	.	.	H	α-helix	trans	-87.2	-29.6	175.4	-59.1	177.2	71.8	-164.4	-1.8	112.7	N282 L283 L284 G296 Q300 D304	N282-R286 WeakPolarHBondContact O-CG 3.4Å; N282-R286 PolarHBondContact O-N 3.48Å; L283-R286 WeakPolarHBondContact O-CB 3.35Å; L283-R286 PolarHBondContact O-N 2.91Å; L284-R286 PolarHBondContact O-N 2.93Å; R286-G296 PolarHBondContact O-N 3.29Å; R286-Q300 PolarHBondContact NH1-O 2.87Å; R286-Q300 VanDerWaalsContact NH1-O 3.11Å; R286-Q300 VanDerWaalsContact NH2-C 3.29Å; R286-Q300 PolarHBondContact NH2-O 3.27Å; R286-D304 WeakPolarHBondContact CD-OD2 3.29Å; R286-D304 IonicContact CZ-OD2 3.84Å; R286-D304 IonicContact NE-OD2 2.66Å; R286-D304 IonicContact NH1-OD2 2.67Å; R286-D304 PolarHBondContact NH1-OD2 3.16Å
287	F	98.5	Very high	97.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-83.1	-52.8	175.6	-75.1	-68.2	0	0	0	113.2	F159 V236 L239 G240 L243 L283 L284 V289 R295 L298 I301	F159-F287 AromaticContact CE1-CE2 3.59Å; F159-F287 HydrophobicContact CE1-CE2 3.59Å; F159-F287 AromaticContact CE1-CZ 3.49Å; F159-F287 HydrophobicContact CE1-CZ 3.49Å; F159-F287 VanDerWaalsContact CE1-CZ 3.49Å; F159-F287 HydrophobicContact CZ-CE1 4.32Å; F159-F287 AromaticContact CZ-CE2 3.67Å; F159-F287 HydrophobicContact CZ-CE2 3.67Å; F159-F287 AromaticContact CZ-CZ 3.45Å; F159-F287 HydrophobicContact CZ-CZ 3.45Å; F159-F287 VanDerWaalsContact CZ-CZ 3.45Å; V236-F287 HydrophobicContact CG1-CD1 3.61Å; V236-F287 HydrophobicContact CG1-CE1 4.17Å; V236-F287 WeakPolarHBondContact O-CD1 3.45Å; L239-F287 HydrophobicContact CB-CD1 4.15Å; L239-F287 HydrophobicContact CB-CE1 3.68Å; L239-F287 HydrophobicContact CB-CZ 4.26Å; L239-F287 HydrophobicContact CD1-CE1 4.46Å; G240-F287 VanDerWaalsContact CA-CB 3.47Å; L243-F287 HydrophobicContact CD2-CD2 4.17Å; L243-F287 HydrophobicContact CD2-CE2 3.95Å; L283-F287 HydrophobicContact CD1-CD2 3.93Å; L283-F287 HydrophobicContact CD1-CE2 3.51Å; L283-F287 HydrophobicContact CD1-CZ 4.36Å; L283-F287 HydrophobicContact CD2-CE2 4.19Å; L283-F287 HydrophobicContact CG-CD2 4.01Å; L283-F287 HydrophobicContact CG-CE2 3.71Å; L283-F287 WeakPolarHBondContact O-CD2 3.39Å; L283-F287 PolarHBondContact O-N 3.03Å; L284-F287 PolarHBondContact O-N 3.5Å; F287-V289 PolarHBondContact O-N 2.79Å; F287-R295 WeakPolarHBondContact O-CD 3.29Å; F287-R295 WeakPolarHBondContact O-CG 3.17Å; F287-L298 HydrophobicContact CE1-CD2 4.21Å; F287-I301 HydrophobicContact CD1-CD1 3.9Å; F287-I301 HydrophobicContact CE1-CD1 3.69Å; F287-I301 HydrophobicContact CE1-CG2 4.2Å; F287-I301 HydrophobicContact CE2-CG2 4.19Å; F287-I301 HydrophobicContact CZ-CD1 4.12Å; F287-I301 HydrophobicContact CZ-CG2 3.62Å
288	L	98.5	Very high	97.8	Very high	12 Å²	12	50.9 Å²	50.9	6%	0.063	26%	0.261	C	S	.	.	S	Bend	trans	-86.8	48.8	-169	-62	-179.6	0	0	0	112.3	W237 V241 P252 F253 Y270 L284	W237-L288 HydrophobicContact CD2-CD2 3.94Å; W237-L288 HydrophobicContact CE3-CD2 4.1Å; W237-L288 HydrophobicContact CG-CD2 4.46Å; W237-L288 HydrophobicContact CH2-CD2 4.43Å; W237-L288 HydrophobicContact CZ2-CD2 4.28Å; W237-L288 VanDerWaalsContact CZ3-C 3.43Å; W237-L288 HydrophobicContact CZ3-CB 4.21Å; W237-L288 HydrophobicContact CZ3-CD2 4.34Å; V241-L288 HydrophobicContact CG2-CD2 4.05Å; P252-L288 HydrophobicContact CB-CD1 4.43Å; F253-L288 HydrophobicContact CE2-CD1 4.37Å; F253-L288 HydrophobicContact CE2-CD2 4.25Å; F253-L288 HydrophobicContact CZ-CD1 4.42Å; Y270-L288 HydrophobicContact CD1-CD1 3.92Å; Y270-L288 HydrophobicContact CE1-CB 3.84Å; Y270-L288 HydrophobicContact CE1-CD1 3.61Å; Y270-L288 HydrophobicContact CE1-CG 4.37Å; Y270-L288 HydrophobicContact CE2-CD1 4.23Å; Y270-L288 HydrophobicContact CG-CD1 4.38Å; L284-L288 HydrophobicContact CD2-CD1 4.33Å; L284-L288 PolarHBondContact O-N 3.34Å
289	V	98.3	Very high	97.7	Very high	30 Å²	30	52 Å²	52	18%	0.182	26%	0.259	C	S	.	.			trans	-92	123.9	179.2	-172	0	0	0	0	110.4	K285 F287 N291 K294 R295	K285-V289 WeakPolarHBondContact O-CG2 3.19Å; F287-V289 PolarHBondContact O-N 2.79Å; V289-N291 VanDerWaalsContact C-N 3.3Å; V289-N291 WeakPolarHBondContact CG1-O 3.4Å; V289-N291 PolarHBondContact O-N 3.01Å; V289-K294 HydrophobicContact CG1-CB 3.83Å; V289-R295 HydrophobicContact CB-CB 4.21Å; V289-R295 HydrophobicContact CB-CG 4.18Å; V289-R295 HydrophobicContact CG2-CG 4.47Å; V289-R295 PolarHBondContact O-NE 3.3Å; V289-R295 PolarHBondContact O-NH2 3.22Å
290	L	97.9	Very high	97.7	Very high	79 Å²	79	54.9 Å²	54.9	41%	0.414	27%	0.272	S	S	.	.	S	Bend	trans	-64.8	-28.5	-178.9	-70.6	179.7	0	0	0	114.2	P221 W237 V265	P221-L290 HydrophobicContact CB-CD2 4.11Å; P221-L290 HydrophobicContact CG-CD2 3.61Å; W237-L290 HydrophobicContact CH2-CD2 4.08Å; W237-L290 HydrophobicContact CZ3-CD2 4.31Å; V265-L290 WeakPolarHBondContact O-CD2 3.48Å
291	N	97.4	Very high	97.6	Very high	70 Å²	70	54.9 Å²	54.9	37%	0.374	27%	0.272	S	S	.	.	S	Bend	trans	-94.4	114.9	173.3	-178.7	-26.7	0	0	0	108.8	V289 I293 K294 R295	V289-N291 VanDerWaalsContact C-N 3.3Å; V289-N291 WeakPolarHBondContact CG1-O 3.4Å; V289-N291 PolarHBondContact O-N 3.01Å; N291-I293 VanDerWaalsContact C-N 3.28Å; N291-I293 PolarHBondContact O-N 3.04Å; N291-I293 WeakPolarHBondContact OD1-CB 3.32Å; N291-I293 PolarHBondContact OD1-N 3.05Å; N291-K294 HydrophobicContact CB-CB 4.28Å; N291-K294 HydrophobicContact CB-CD 4.48Å; N291-K294 HydrophobicContact CB-CG 4.3Å; N291-K294 PolarHBondContact O-N 2.79Å; N291-R295 PolarHBondContact O-N 3.45Å
292	P	97	Very high	97.6	Very high	40 Å²	40	52.6 Å²	52.6	26%	0.26	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-59	-35.5	-176.8	20.9	-32.1	0	0	0	113.6	E233 K294 R295	E233-P292 HydrophobicContact CB-CB 4.11Å; E233-P292 HydrophobicContact CG-CB 3.69Å; P292-K294 PolarHBondContact O-N 3.11Å; P292-R295 WeakPolarHBondContact O-CB 3.15Å; P292-R295 PolarHBondContact O-N 3.36Å
293	I	95.9	Very high	97.6	Very high	154 Å²	154	56.5 Å²	56.5	79%	0.79	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-68	-21.4	180	-54.4	173.2	0	0	0	111.5	N291	N291-I293 VanDerWaalsContact C-N 3.28Å; N291-I293 PolarHBondContact O-N 3.04Å; N291-I293 WeakPolarHBondContact OD1-CB 3.32Å; N291-I293 PolarHBondContact OD1-N 3.05Å
294	K	97.3	Very high	97.6	Very high	160 Å²	160	57.3 Å²	57.3	70%	0.696	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-97.1	2.2	176	-63.5	-169.4	176.5	-170.3	0	113.4	V289 N291 P292	V289-K294 HydrophobicContact CG1-CB 3.83Å; N291-K294 HydrophobicContact CB-CB 4.28Å; N291-K294 HydrophobicContact CB-CD 4.48Å; N291-K294 HydrophobicContact CB-CG 4.3Å; N291-K294 PolarHBondContact O-N 2.79Å; P292-K294 PolarHBondContact O-N 3.11Å
295	R	97.8	Very high	97.5	Very high	16 Å²	16	65.7 Å²	65.7	6%	0.06	31%	0.31	C	S	.	.	S	Bend	trans	-80.4	138.4	178	-153	175	-67.5	146.1	3.6	109	E222 E233 V236 F287 V289 N291 P292	E222-R295 IonicContact OE1-CZ 2.65Å; E222-R295 IonicContact OE1-NH1 2.71Å; E222-R295 PolarHBondContact OE1-NH1 2.86Å; E222-R295 IonicContact OE1-NH2 2.77Å; E222-R295 PolarHBondContact OE1-NH2 3.16Å; E222-R295 VanDerWaalsContact OE1-NH2 3.16Å; E222-R295 IonicContact OE2-CZ 2.81Å; E222-R295 IonicContact OE2-NH1 3.17Å; E222-R295 IonicContact OE2-NH2 3.85Å; E222-R295 PolarHBondContact OE2-NH2 3.08Å; E233-R295 VanDerWaalsContact C-NH1 3.33Å; E233-R295 WeakPolarHBondContact O-CD 3.28Å; E233-R295 PolarHBondContact O-NH1 3.43Å; V236-R295 HydrophobicContact CG1-CG 3.73Å; F287-R295 WeakPolarHBondContact O-CD 3.29Å; F287-R295 WeakPolarHBondContact O-CG 3.17Å; V289-R295 HydrophobicContact CB-CB 4.21Å; V289-R295 HydrophobicContact CB-CG 4.18Å; V289-R295 HydrophobicContact CG2-CG 4.47Å; V289-R295 PolarHBondContact O-NE 3.3Å; V289-R295 PolarHBondContact O-NH2 3.22Å; N291-R295 PolarHBondContact O-N 3.45Å; P292-R295 WeakPolarHBondContact O-CB 3.15Å; P292-R295 PolarHBondContact O-N 3.36Å
296	G	96.1	Very high	97.6	Very high	9 Å²	9	61 Å²	61	9%	0.093	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-67.2	140.6	-176.4	0	0	0	0	0	112.2	V236 R286 I301	V236-G296 WeakPolarHBondContact CG1-O 3.32Å; R286-G296 PolarHBondContact O-N 3.29Å; G296-I301 WeakPolarHBondContact O-CD1 3.22Å
297	T	96.5	Very high	97.6	Very high	65 Å²	65	57.6 Å²	57.6	40%	0.399	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-73.8	155.1	172.4	74.3	0	0	0	0	110.4	E299 Q300 I301	T297-E299 VanDerWaalsContact C-N 3.27Å; T297-E299 PolarHBondContact O-N 3.27Å; T297-Q300 VanDerWaalsContact N-OE1 3.17Å; T297-Q300 WeakPolarHBondContact O-CB 3.36Å; T297-Q300 PolarHBondContact O-N 3.09Å; T297-Q300 VanDerWaalsContact OG1-CG 3.28Å; T297-Q300 WeakPolarHBondContact OG1-CG 3.37Å; T297-Q300 PolarHBondContact OG1-N 3.37Å; T297-I301 WeakPolarHBondContact O-CG1 3.34Å; T297-I301 PolarHBondContact O-N 3.23Å
298	L	97.9	Very high	97.6	Very high	8 Å²	8	58 Å²	58	4%	0.042	28%	0.28	C	S	.	.	H	α-helix	trans	-61.2	-35.6	-179.4	-67.6	-175	0	0	0	112.7	V163 V166 Q167 V236 L239 F287 Q300 I301 M302	V163-L298 HydrophobicContact CG1-CD2 4.49Å; V166-L298 HydrophobicContact CB-CD1 4.02Å; V166-L298 HydrophobicContact CG1-CD1 3.77Å; Q167-L298 HydrophobicContact CB-CB 3.88Å; Q167-L298 HydrophobicContact CB-CD1 3.95Å; Q167-L298 HydrophobicContact CG-CB 4.04Å; V236-L298 HydrophobicContact CG2-CD2 3.88Å; V236-L298 HydrophobicContact CG2-CG 3.93Å; L239-L298 HydrophobicContact CD1-CD1 4.12Å; L239-L298 HydrophobicContact CD1-CD2 3.78Å; F287-L298 HydrophobicContact CE1-CD2 4.21Å; L298-Q300 VanDerWaalsContact C-N 3.3Å; L298-Q300 PolarHBondContact O-N 3.42Å; L298-I301 HydrophobicContact CD2-CD1 4.34Å; L298-I301 CarbonylContact O-C 3.52Å; L298-I301 PolarHBondContact O-N 2.65Å; L298-M302 VanDerWaalsContact O-CG 3.24Å; L298-M302 WeakPolarHBondContact O-CG 3.5Å; L298-M302 PolarHBondContact O-N 2.79Å
299	E	95.9	Very high	97.5	Very high	114 Å²	114	58.9 Å²	58.9	53%	0.533	29%	0.288	S	S	.	.	H	α-helix	trans	-61.3	-34.7	173.8	-64.4	169.1	-172.3	0	0	113.4	Q167 T297	Q167-E299 HydrophobicContact CG-CG 4.46Å; T297-E299 VanDerWaalsContact C-N 3.27Å; T297-E299 PolarHBondContact O-N 3.27Å
300	Q	97.1	Very high	97.4	Very high	103 Å²	103	60.6 Å²	60.6	48%	0.481	31%	0.312	S	S	.	.	H	α-helix	trans	-76.7	-26.4	174.1	-64.3	168.3	-6.7	0	0	112	R286 T297 L298	R286-Q300 PolarHBondContact NH1-O 2.87Å; R286-Q300 VanDerWaalsContact NH1-O 3.11Å; R286-Q300 VanDerWaalsContact NH2-C 3.29Å; R286-Q300 PolarHBondContact NH2-O 3.27Å; T297-Q300 VanDerWaalsContact N-OE1 3.17Å; T297-Q300 WeakPolarHBondContact O-CB 3.36Å; T297-Q300 PolarHBondContact O-N 3.09Å; T297-Q300 VanDerWaalsContact OG1-CG 3.28Å; T297-Q300 WeakPolarHBondContact OG1-CG 3.37Å; T297-Q300 PolarHBondContact OG1-N 3.37Å; L298-Q300 VanDerWaalsContact C-N 3.3Å; L298-Q300 PolarHBondContact O-N 3.42Å
301	I	97.9	Very high	97.3	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-83.7	-33.6	-179.2	-75.7	165.5	0	0	0	111.4	V236 L283 F287 G296 T297 L298 K303 D304 I307	V236-I301 HydrophobicContact CG1-CD1 4.16Å; L283-I301 HydrophobicContact CD1-CG2 3.99Å; F287-I301 HydrophobicContact CD1-CD1 3.9Å; F287-I301 HydrophobicContact CE1-CD1 3.69Å; F287-I301 HydrophobicContact CE1-CG2 4.2Å; F287-I301 HydrophobicContact CE2-CG2 4.19Å; F287-I301 HydrophobicContact CZ-CD1 4.12Å; F287-I301 HydrophobicContact CZ-CG2 3.62Å; G296-I301 WeakPolarHBondContact O-CD1 3.22Å; T297-I301 WeakPolarHBondContact O-CG1 3.34Å; T297-I301 PolarHBondContact O-N 3.23Å; L298-I301 HydrophobicContact CD2-CD1 4.34Å; L298-I301 CarbonylContact O-C 3.52Å; L298-I301 PolarHBondContact O-N 2.65Å; I301-K303 PolarHBondContact O-N 3.4Å; I301-K303 VanDerWaalsContact O-N 3.15Å; I301-D304 WeakPolarHBondContact O-CB 3.43Å; I301-D304 PolarHBondContact O-N 3Å; I301-I307 WeakPolarHBondContact O-CG1 3.42Å
302	M	98.3	Very high	97	Very high	1 Å²	1	63.1 Å²	63.1	1%	0.005	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-27	172.4	-74.3	168.4	128.5	0	0	112.7	V163 Q167 L298 N308 L316 K317 P318	V163-M302 HydrophobicContact CG1-CG 3.63Å; Q167-M302 HydrophobicContact CB-CE 3.92Å; Q167-M302 HydrophobicContact CB-SD 4.13Å; Q167-M302 HydrophobicContact CG-CE 4.05Å; Q167-M302 HydrophobicContact CG-SD 3.77Å; L298-M302 VanDerWaalsContact O-CG 3.24Å; L298-M302 WeakPolarHBondContact O-CG 3.5Å; L298-M302 PolarHBondContact O-N 2.79Å; M302-N308 PolarHBondContact O-ND2 3.05Å; M302-L316 HydrophobicContact CB-CB 4.33Å; M302-L316 HydrophobicContact CB-CD2 4.32Å; M302-L316 HydrophobicContact CB-CG 4.25Å; M302-L316 HydrophobicContact CE-CD2 4.38Å; M302-L316 HydrophobicContact CE-CG 4.07Å; M302-L316 HydrophobicContact CG-CD2 3.87Å; M302-L316 HydrophobicContact CG-CG 4.01Å; M302-K317 WeakPolarHBondContact CE-O 3.44Å; M302-P318 HydrophobicContact SD-CG 4.34Å
303	K	97.6	Very high	96.7	Very high	154 Å²	154	70.4 Å²	70.4	67%	0.67	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	9.5	175.5	-57.9	178.8	-176.8	-178.5	0	113.8	I301	I301-K303 PolarHBondContact O-N 3.4Å; I301-K303 VanDerWaalsContact O-N 3.15Å
304	D	98.3	Very high	96.7	Very high	17 Å²	17	67.4 Å²	67.4	9%	0.091	34%	0.335	C	S	.	.			trans	-73.9	141.5	-178.4	-165.9	-81.5	0	0	0	112.2	L283 R286 I301 W306 I307 N308	L283-D304 HydrophobicContact CD1-CB 4.07Å; R286-D304 WeakPolarHBondContact CD-OD2 3.29Å; R286-D304 IonicContact CZ-OD2 3.84Å; R286-D304 IonicContact NE-OD2 2.66Å; R286-D304 IonicContact NH1-OD2 2.67Å; R286-D304 PolarHBondContact NH1-OD2 3.16Å; I301-D304 WeakPolarHBondContact O-CB 3.43Å; I301-D304 PolarHBondContact O-N 3Å; D304-W306 PolarHBondContact O-N 3.27Å; D304-W306 PolarHBondContact OD1-N 2.83Å; D304-I307 HydrophobicContact CB-CB 4.3Å; D304-I307 HydrophobicContact CB-CG1 3.99Å; D304-I307 WeakPolarHBondContact O-CB 3.35Å; D304-I307 PolarHBondContact O-N 2.99Å; D304-N308 PolarHBondContact O-N 2.71Å; D304-N308 VanDerWaalsContact O-N 3.11Å
305	R	97.8	Very high	96.6	Very high	176 Å²	176	64 Å²	64	66%	0.664	32%	0.322	S	S	*	.	H	α-helix	trans	-53.7	-39.6	178	-172.2	179.5	-174.3	-138.3	6.6	112.4	D279 I307 A309	D279-R305 VanDerWaalsContact CG-NH1 3.25Å; D279-R305 WeakPolarHBondContact OD1-CD 3.36Å; D279-R305 IonicContact OD1-CZ 4Å; D279-R305 IonicContact OD1-NE 3.15Å; D279-R305 IonicContact OD1-NH1 3.55Å; D279-R305 PolarHBondContact OD1-NH1 3.22Å; D279-R305 IonicContact OD2-CZ 2.66Å; D279-R305 IonicContact OD2-NE 3.37Å; D279-R305 IonicContact OD2-NH1 3.85Å; D279-R305 PolarHBondContact OD2-NH1 2.77Å; R305-I307 VanDerWaalsContact C-N 3.34Å; R305-A309 VanDerWaalsContact O-CB 3.29Å; R305-A309 WeakPolarHBondContact O-CB 3.45Å; R305-A309 PolarHBondContact O-N 3.19Å
306	W	98.5	Very high	96.6	Very high	1 Å²	1	64.3 Å²	64.3	0%	0.004	32%	0.324	C	S	.	.	H	α-helix	trans	-72.6	-26.4	177.7	-169.1	91.1	0	0	0	112.9	E152 A155 R156 F159 L243 V247 D279 C280 L283 D304	E152-W306 HydrophobicContact CB-CZ2 3.88Å; E152-W306 HydrophobicContact CG-CZ2 4.15Å; E152-W306 WeakPolarHBondContact O-CZ2 3.42Å; E152-W306 PolarHBondContact OE2-NE1 2.91Å; A155-W306 HydrophobicContact CB-CH2 4.19Å; R156-W306 HydrophobicContact CB-CH2 3.81Å; R156-W306 HydrophobicContact CB-CZ2 4.24Å; R156-W306 HydrophobicContact CB-CZ3 3.98Å; R156-W306 WeakPolarHBondContact CD-O 3.27Å; R156-W306 HydrophobicContact CG-CZ3 4.4Å; R156-W306 PolarHBondContact NE-O 2.81Å; F159-W306 HydrophobicContact CB-CZ3 4.38Å; F159-W306 HydrophobicContact CD1-CZ3 4.18Å; L243-W306 HydrophobicContact CD1-CE3 4.47Å; L243-W306 HydrophobicContact CD1-CH2 3.51Å; L243-W306 HydrophobicContact CD1-CZ2 4.24Å; L243-W306 HydrophobicContact CD1-CZ3 3.66Å; V247-W306 HydrophobicContact CG1-CZ2 4.29Å; D279-W306 HydrophobicContact CB-CB 4.1Å; D279-W306 HydrophobicContact CB-CG 4.49Å; C280-W306 HydrophobicContact CB-CG 4.36Å; L283-W306 HydrophobicContact CB-CB 4.27Å; L283-W306 HydrophobicContact CD2-CB 3.99Å; L283-W306 HydrophobicContact CD2-CD2 4.02Å; L283-W306 HydrophobicContact CD2-CE3 3.43Å; L283-W306 VanDerWaalsContact CD2-CE3 3.43Å; L283-W306 HydrophobicContact CD2-CG 4.27Å; L283-W306 HydrophobicContact CD2-CZ3 4.22Å; D304-W306 PolarHBondContact O-N 3.27Å; D304-W306 PolarHBondContact OD1-N 2.83Å
307	I	98.4	Very high	96.6	Very high	0 Å²	0	70 Å²	70	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-75	-35.8	177.6	-66.8	-67	0	0	0	111.6	F159 R160 L283 I301 D304 R305 L316	F159-I307 HydrophobicContact CD1-CD1 3.64Å; F159-I307 HydrophobicContact CE1-CD1 4.05Å; R160-I307 WeakPolarHBondContact CD-O 3.24Å; R160-I307 HydrophobicContact CG-CG2 4.11Å; R160-I307 PolarHBondContact NH1-O 2.96Å; L283-I307 HydrophobicContact CD2-CD1 3.9Å; L283-I307 HydrophobicContact CD2-CG1 3.98Å; I301-I307 WeakPolarHBondContact O-CG1 3.42Å; D304-I307 HydrophobicContact CB-CB 4.3Å; D304-I307 HydrophobicContact CB-CG1 3.99Å; D304-I307 WeakPolarHBondContact O-CB 3.35Å; D304-I307 PolarHBondContact O-N 2.99Å; R305-I307 VanDerWaalsContact C-N 3.34Å; I307-L316 HydrophobicContact CG2-CB 3.92Å; I307-L316 HydrophobicContact CG2-CD2 3.65Å; I307-L316 HydrophobicContact CG2-CG 4.45Å
308	N	98.3	Very high	96.7	Very high	10 Å²	10	69.8 Å²	69.8	5%	0.053	35%	0.346	C	S	.	.	H	α-helix	trans	-103.1	-2.6	-175.4	-63.3	-34.1	0	0	0	115	R160 M302 D304 G310 H311 E315 L316	R160-N308 PolarHBondContact NH1-OD1 3.15Å; M302-N308 PolarHBondContact O-ND2 3.05Å; D304-N308 PolarHBondContact O-N 2.71Å; D304-N308 VanDerWaalsContact O-N 3.11Å; N308-G310 PolarHBondContact O-N 3.33Å; N308-G310 VanDerWaalsContact O-N 3.09Å; N308-H311 CarbonylContact O-C 3.58Å; N308-H311 WeakPolarHBondContact O-CA 3.11Å; N308-H311 PolarHBondContact O-N 3.02Å; N308-E315 PolarHBondContact ND2-OE1 3.17Å; N308-L316 PolarHBondContact OD1-N 3.01Å
309	A	97.6	Very high	96.7	Very high	30 Å²	30	71.5 Å²	71.5	25%	0.248	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	113.4	177	0	0	0	0	0	112.7	R156 R305	R156-A309 WeakPolarHBondContact CD-O 3.01Å; R156-A309 PolarHBondContact NH1-O 2.83Å; R305-A309 VanDerWaalsContact O-CB 3.29Å; R305-A309 WeakPolarHBondContact O-CB 3.45Å; R305-A309 PolarHBondContact O-N 3.19Å
310	G	95.9	Very high	96.7	Very high	65 Å²	65	72 Å²	72	67%	0.67	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	13.7	-171.8	0	0	0	0	0	114.7	N308 E312	N308-G310 PolarHBondContact O-N 3.33Å; N308-G310 VanDerWaalsContact O-N 3.09Å; G310-E312 PolarHBondContact N-OE1 2.92Å
311	H	95.4	Very high	96.5	Very high	59 Å²	59	69.8 Å²	69.8	27%	0.273	35%	0.353	S	S	.	.			trans	-137	39.3	175.4	-70.4	-98.9	0	0	0	109.7	N308 E313 D314 E315	N308-H311 CarbonylContact O-C 3.58Å; N308-H311 WeakPolarHBondContact O-CA 3.11Å; N308-H311 PolarHBondContact O-N 3.02Å; H311-E313 PolarHBondContact O-N 2.83Å; H311-D314 HydrophobicContact CB-CB 4.38Å; H311-D314 IonicContact ND1-OD2 3.2Å; H311-D314 PolarHBondContact ND1-OD2 2.83Å; H311-D314 CarbonylContact O-C 3.58Å; H311-D314 PolarHBondContact O-N 2.64Å; H311-E315 PolarHBondContact O-N 3.02Å
312	E	91.1	Very high	96.2	Very high	144 Å²	144	73.8 Å²	73.8	67%	0.673	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-40.4	-175.2	-72.8	117.2	-119	0	0	112.9	G310 D314	G310-E312 PolarHBondContact N-OE1 2.92Å; E312-D314 VanDerWaalsContact C-N 3.26Å; E312-D314 PolarHBondContact O-N 2.93Å
313	E	92	Very high	95.8	Very high	192 Å²	192	82.9 Å²	82.9	90%	0.897	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-12.1	173.6	-53.5	-58.9	146.2	0	0	113.5	H311	H311-E313 PolarHBondContact O-N 2.83Å
314	D	94.1	Very high	95.2	Very high	91 Å²	91	79.1 Å²	79.1	49%	0.487	41%	0.409	S	S	.	.	S	Bend	trans	-128	53.7	-173.4	175.2	52.2	0	0	0	109.5	R160 H311 E312 L316	R160-D314 IonicContact CZ-OD2 3.77Å; R160-D314 PolarHBondContact NH2-O 3.44Å; R160-D314 IonicContact NH2-OD2 3.98Å; R160-D314 PolarHBondContact NH2-OD2 2.91Å; H311-D314 HydrophobicContact CB-CB 4.38Å; H311-D314 IonicContact ND1-OD2 3.2Å; H311-D314 PolarHBondContact ND1-OD2 2.83Å; H311-D314 CarbonylContact O-C 3.58Å; H311-D314 PolarHBondContact O-N 2.64Å; E312-D314 VanDerWaalsContact C-N 3.26Å; E312-D314 PolarHBondContact O-N 2.93Å; D314-L316 PolarHBondContact O-N 2.95Å
315	E	95.9	Very high	94.7	Very high	90 Å²	90	81.7 Å²	81.7	42%	0.421	42%	0.423	S	S	.	.			trans	-57.7	134.4	175.4	-73.3	-152.5	127.2	0	0	111.5	N308 H311 K317	N308-E315 PolarHBondContact ND2-OE1 3.17Å; H311-E315 PolarHBondContact O-N 3.02Å; E315-K317 WeakPolarHBondContact O-CD 3.39Å; E315-K317 WeakPolarHBondContact O-CE 3.33Å; E315-K317 WeakPolarHBondContact O-CG 3.46Å; E315-K317 PolarHBondContact O-N 3.16Å
316	L	97.6	Very high	94.4	Very high	21 Å²	21	75.5 Å²	75.5	11%	0.11	40%	0.402	C	S	.	.			trans	-64.2	124.3	179.6	-171.9	63.7	0	0	0	110	R160 V163 M302 I307 N308 D314	R160-L316 HydrophobicContact CB-CD1 4.46Å; R160-L316 HydrophobicContact CB-CD2 4.25Å; R160-L316 HydrophobicContact CG-CD2 4.29Å; V163-L316 HydrophobicContact CB-CD2 4.23Å; V163-L316 HydrophobicContact CG1-CD2 4Å; M302-L316 HydrophobicContact CB-CB 4.33Å; M302-L316 HydrophobicContact CB-CD2 4.32Å; M302-L316 HydrophobicContact CB-CG 4.25Å; M302-L316 HydrophobicContact CE-CD2 4.38Å; M302-L316 HydrophobicContact CE-CG 4.07Å; M302-L316 HydrophobicContact CG-CD2 3.87Å; M302-L316 HydrophobicContact CG-CG 4.01Å; I307-L316 HydrophobicContact CG2-CB 3.92Å; I307-L316 HydrophobicContact CG2-CD2 3.65Å; I307-L316 HydrophobicContact CG2-CG 4.45Å; N308-L316 PolarHBondContact OD1-N 3.01Å; D314-L316 PolarHBondContact O-N 2.95Å
317	K	97.1	Very high	94.1	Very high	130 Å²	130	79.8 Å²	79.8	57%	0.565	43%	0.433	S	S	*	.			trans	-125.1	156.5	-176.9	-71	149	-170	162.5	0	109.9	M302 E315 F319	M302-K317 WeakPolarHBondContact CE-O 3.44Å; E315-K317 WeakPolarHBondContact O-CD 3.39Å; E315-K317 WeakPolarHBondContact O-CE 3.33Å; E315-K317 WeakPolarHBondContact O-CG 3.46Å; E315-K317 PolarHBondContact O-N 3.16Å; K317-F319 PolarHBondContact O-N 3.32Å
318	P	97.7	Very high	93.9	Very high	59 Å²	59	81.9 Å²	81.9	38%	0.383	44%	0.444	S	S	.	.			trans	-48.5	135.3	171.2	-31.6	38.6	0	0	0	112.7	M302 V320	M302-P318 HydrophobicContact SD-CG 4.34Å; P318-V320 PolarHBondContact O-N 3.07Å
319	F	97.9	Very high	93.8	Very high	45 Å²	45	86 Å²	86	20%	0.197	46%	0.462	C	S	.	.			trans	-74.5	114.6	-178.4	178.9	-99	0	0	0	110.6	H112 P113 Y168 K317 E321	H112-F319 HydrophobicContact CB-CE1 4.43Å; H112-F319 AromaticContact CD2-CD1 3.44Å; H112-F319 VanDerWaalsContact CD2-CD1 3.44Å; H112-F319 WeakPolarHBondContact CD2-CD1 3.36Å; H112-F319 AromaticContact CD2-CD2 3.92Å; H112-F319 AromaticContact CD2-CE1 3.97Å; H112-F319 AromaticContact CD2-CG 3.39Å; H112-F319 WeakPolarHBondContact CD2-CG 3.49Å; H112-F319 AromaticContact NE2-CG 3.79Å; P113-F319 VanDerWaalsContact CD-CZ 3.43Å; P113-F319 HydrophobicContact CG-CE2 3.97Å; P113-F319 HydrophobicContact CG-CZ 4.32Å; Y168-F319 AromaticContact CD2-CD1 3.71Å; Y168-F319 HydrophobicContact CD2-CD1 3.71Å; Y168-F319 HydrophobicContact CD2-CE1 4.49Å; Y168-F319 HydrophobicContact CE2-CD1 4.03Å; Y168-F319 HydrophobicContact CE2-CE1 4.4Å; Y168-F319 HydrophobicContact CG-CD1 4.32Å; K317-F319 PolarHBondContact O-N 3.32Å; F319-E321 HydrophobicContact CE1-CB 4.19Å; F319-E321 HydrophobicContact CE1-CG 4.47Å
320	V	96.6	Very high	93.7	Very high	123 Å²	123	92.1 Å²	92.1	75%	0.745	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-81	121.6	167.7	-177.2	0	0	0	0	107.9	P318	P318-V320 PolarHBondContact O-N 3.07Å
321	E	93.5	Very high	93.7	Very high	57 Å²	57	91 Å²	91	27%	0.266	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-72.2	127.3	178	-171.3	173.5	157.6	0	0	110.5	N111 Y168 K172 F319	N111-E321 VanDerWaalsContact CB-OE1 3.28Å; N111-E321 WeakPolarHBondContact CB-OE1 3.5Å; N111-E321 PolarHBondContact ND2-OE1 3.4Å; Y168-E321 HydrophobicContact CE2-CB 4.24Å; Y168-E321 WeakPolarHBondContact CE2-OE2 3.42Å; Y168-E321 PolarHBondContact OH-OE2 3Å; K172-E321 WeakPolarHBondContact CE-OE2 3.46Å; K172-E321 IonicContact NZ-OE1 2.81Å; K172-E321 IonicContact NZ-OE2 3.48Å; K172-E321 PolarHBondContact NZ-OE2 3.01Å; F319-E321 HydrophobicContact CE1-CB 4.19Å; F319-E321 HydrophobicContact CE1-CG 4.47Å
322	P	91.3	Very high	93.7	Very high	85 Å²	85	88.4 Å²	88.4	55%	0.552	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-70.8	147.6	173.2	30.9	-34.7	0	0	0	110.3
323	E	88.6	Confident	94	Very high	192 Å²	192	85.9 Å²	85.9	90%	0.897	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-57.1	141.9	175.2	-64.6	-174.5	163	0	0	111.3	D325	E323-D325 PolarHBondContact O-N 2.83Å; E323-D325 VanDerWaalsContact O-N 3.07Å
324	L	86.5	Confident	94.2	Very high	74 Å²	74	80.7 Å²	80.7	39%	0.387	42%	0.416	S	S	.	.			trans	-76.7	98.7	179.1	-74.7	170.3	0	0	0	109.6	N111 I326 M352	N111-L324 WeakPolarHBondContact ND2-CD2 3.48Å; L324-I326 PolarHBondContact O-N 3.31Å; L324-M352 HydrophobicContact CB-CE 4.34Å; L324-M352 HydrophobicContact CD1-CE 3.97Å; L324-M352 HydrophobicContact CD1-SD 4.41Å
325	D	87.9	Confident	94.4	Very high	72 Å²	72	76.4 Å²	76.4	39%	0.385	39%	0.393	S	S	.	.			trans	-57.1	98.9	167	160.5	32.6	0	0	0	110.9	E323 S327 D328 R331 Y361	E323-D325 PolarHBondContact O-N 2.83Å; E323-D325 VanDerWaalsContact O-N 3.07Å; D325-S327 PolarHBondContact OD1-N 2.95Å; D325-D328 PolarHBondContact OD1-N 2.81Å; D325-R331 IonicContact OD2-CZ 3.36Å; D325-R331 IonicContact OD2-NH1 3.01Å; D325-R331 PolarHBondContact OD2-NH1 2.92Å; D325-R331 IonicContact OD2-NH2 2.66Å; D325-R331 PolarHBondContact OD2-NH2 3.12Å; D325-Y361 WeakPolarHBondContact O-CE1 3.42Å; D325-Y361 PolarHBondContact O-OH 2.86Å; D325-Y361 PolarHBondContact OD1-OH 2.74Å
326	I	91.6	Very high	94.4	Very high	45 Å²	45	75.3 Å²	75.3	23%	0.231	39%	0.392	C	S	.	.			trans	-104.3	8.8	173.1	59.3	170.3	0	0	0	112.7	L324 L349 M352 Y361	L324-I326 PolarHBondContact O-N 3.31Å; I326-L349 HydrophobicContact CB-CB 4.18Å; I326-L349 HydrophobicContact CB-CD1 4.44Å; I326-L349 HydrophobicContact CG2-CB 4.17Å; I326-M352 HydrophobicContact CG2-CE 3.43Å; I326-M352 VanDerWaalsContact CG2-CE 3.43Å; I326-Y361 VanDerWaalsContact CA-OH 3.27Å; I326-Y361 WeakPolarHBondContact CA-OH 3.47Å
327	S	91.7	Very high	94.4	Very high	92 Å²	92	77.7 Å²	77.7	64%	0.643	42%	0.422	S	S	*	.			trans	-125.4	16.4	-172	53.9	0	0	0	0	113.9	D325 Q329 Y361	D325-S327 PolarHBondContact OD1-N 2.95Å; S327-Q329 VanDerWaalsContact C-N 3.31Å; S327-Q329 PolarHBondContact O-N 2.89Å; S327-Y361 PolarHBondContact N-OH 2.78Å
328	D	94.2	Very high	94.3	Very high	44 Å²	44	74.8 Å²	74.8	24%	0.235	41%	0.411	C	S	.	.			trans	-64	91.1	169.1	-174.7	-7.7	0	0	0	110.2	D325 K330 R331 I332 Y361	D325-D328 PolarHBondContact OD1-N 2.81Å; D328-K330 PolarHBondContact O-N 2.99Å; D328-K330 WeakPolarHBondContact OD1-CB 3.37Å; D328-K330 PolarHBondContact OD1-N 3.42Å; D328-K330 VanDerWaalsContact OD1-N 3.1Å; D328-R331 HydrophobicContact CB-CG 4.21Å; D328-R331 PolarHBondContact O-N 3.49Å; D328-R331 IonicContact OD2-CZ 3.1Å; D328-R331 IonicContact OD2-NE 2.79Å; D328-R331 PolarHBondContact OD2-NE 3.27Å; D328-R331 IonicContact OD2-NH2 2.72Å; D328-R331 PolarHBondContact OD2-NH2 2.99Å; D328-I332 PolarHBondContact O-N 3.44Å; D328-Y361 PolarHBondContact N-OH 2.91Å
329	Q	95.2	Very high	94.3	Very high	95 Å²	95	75.1 Å²	75.1	44%	0.444	43%	0.426	S	S	.	.	H	α-helix	trans	-51.1	-30	-179.1	-168.2	61.6	47.2	0	0	112.2	S327 R331 I332 D333	S327-Q329 VanDerWaalsContact C-N 3.31Å; S327-Q329 PolarHBondContact O-N 2.89Å; Q329-R331 PolarHBondContact O-N 3.01Å; Q329-I332 PolarHBondContact O-N 2.98Å; Q329-D333 PolarHBondContact NE2-OD1 2.63Å; Q329-D333 WeakPolarHBondContact O-CB 3.34Å; Q329-D333 PolarHBondContact O-N 2.92Å
330	K	95.6	Very high	94.2	Very high	159 Å²	159	74.5 Å²	74.5	69%	0.691	42%	0.422	S	S	*	.	H	α-helix	trans	-68.8	-33.4	179.2	-59.9	172.9	-177.9	171.3	0	112.4	D328 I334	D328-K330 PolarHBondContact O-N 2.99Å; D328-K330 WeakPolarHBondContact OD1-CB 3.37Å; D328-K330 PolarHBondContact OD1-N 3.42Å; D328-K330 VanDerWaalsContact OD1-N 3.1Å; K330-I334 VanDerWaalsContact O-CD1 3.26Å; K330-I334 WeakPolarHBondContact O-CD1 3.42Å; K330-I334 WeakPolarHBondContact O-CG1 3.44Å; K330-I334 PolarHBondContact O-N 3.19Å
331	R	95.6	Very high	94.2	Very high	43 Å²	43	70.5 Å²	70.5	16%	0.162	40%	0.4	C	S	.	.	H	α-helix	trans	-73.8	-39.7	173.2	-62.3	178.4	-142.4	145.4	17	110.6	D325 D328 Q329 I334 M335 Y361 L364	D325-R331 IonicContact OD2-CZ 3.36Å; D325-R331 IonicContact OD2-NH1 3.01Å; D325-R331 PolarHBondContact OD2-NH1 2.92Å; D325-R331 IonicContact OD2-NH2 2.66Å; D325-R331 PolarHBondContact OD2-NH2 3.12Å; D328-R331 HydrophobicContact CB-CG 4.21Å; D328-R331 PolarHBondContact O-N 3.49Å; D328-R331 IonicContact OD2-CZ 3.1Å; D328-R331 IonicContact OD2-NE 2.79Å; D328-R331 PolarHBondContact OD2-NE 3.27Å; D328-R331 IonicContact OD2-NH2 2.72Å; D328-R331 PolarHBondContact OD2-NH2 2.99Å; Q329-R331 PolarHBondContact O-N 3.01Å; R331-I334 PolarHBondContact O-N 2.84Å; R331-M335 WeakPolarHBondContact O-CG 3.3Å; R331-M335 PolarHBondContact O-N 3.02Å; R331-Y361 HydrophobicContact CB-CD2 3.73Å; R331-Y361 HydrophobicContact CB-CE2 3.61Å; R331-Y361 HydrophobicContact CG-CE2 4.32Å; R331-Y361 PolarHBondContact NH1-OH 3.13Å; R331-L364 HydrophobicContact CB-CB 4.44Å; R331-L364 HydrophobicContact CB-CD1 4.33Å; R331-L364 HydrophobicContact CG-CB 4.04Å
332	I	96.5	Very high	94.3	Very high	4 Å²	4	71.1 Å²	71.1	2%	0.021	40%	0.403	C	S	.	.	H	α-helix	trans	-61.1	-51.8	177.2	-62.7	176	0	0	0	110.2	D328 Q329 I334 M335 V336 I345 Y361	D328-I332 PolarHBondContact O-N 3.44Å; Q329-I332 PolarHBondContact O-N 2.98Å; I332-I334 VanDerWaalsContact C-N 3.28Å; I332-I334 PolarHBondContact O-N 3.44Å; I332-M335 CarbonylContact O-C 3.45Å; I332-M335 WeakPolarHBondContact O-CA 3.45Å; I332-M335 PolarHBondContact O-N 3.5Å; I332-V336 WeakPolarHBondContact O-CG2 3.28Å; I332-V336 PolarHBondContact O-N 2.87Å; I332-I345 HydrophobicContact CG1-CG2 4.26Å; I332-I345 HydrophobicContact CG2-CD1 4.38Å; I332-Y361 HydrophobicContact CG1-CE2 4.22Å
333	D	96.8	Very high	94.6	Very high	91 Å²	91	73.6 Å²	73.6	49%	0.487	41%	0.407	S	S	.	.	H	α-helix	trans	-56.2	-41.1	176.7	-65.1	-20.1	0	0	0	112	Q329 G337	Q329-D333 PolarHBondContact NE2-OD1 2.63Å; Q329-D333 WeakPolarHBondContact O-CB 3.34Å; Q329-D333 PolarHBondContact O-N 2.92Å; D333-G337 PolarHBondContact O-N 2.93Å
334	I	96.8	Very high	95	Very high	83 Å²	83	69 Å²	69	43%	0.426	39%	0.386	S	S	.	.	H	α-helix	trans	-64.6	-41	175.2	-72.4	167.7	0	0	0	111.2	K330 R331 I332 G337 M338 L364	K330-I334 VanDerWaalsContact O-CD1 3.26Å; K330-I334 WeakPolarHBondContact O-CD1 3.42Å; K330-I334 WeakPolarHBondContact O-CG1 3.44Å; K330-I334 PolarHBondContact O-N 3.19Å; R331-I334 PolarHBondContact O-N 2.84Å; I332-I334 VanDerWaalsContact C-N 3.28Å; I332-I334 PolarHBondContact O-N 3.44Å; I334-G337 CarbonylContact O-C 3.51Å; I334-G337 WeakPolarHBondContact O-CA 3.35Å; I334-G337 PolarHBondContact O-N 2.8Å; I334-M338 HydrophobicContact CG2-CE 3.73Å; I334-M338 HydrophobicContact CG2-SD 4.37Å; I334-M338 WeakPolarHBondContact O-CG 3.37Å; I334-M338 PolarHBondContact O-N 3.11Å; I334-L364 HydrophobicContact CB-CD1 4.3Å; I334-L364 HydrophobicContact CG2-CD1 3.79Å; I334-L364 HydrophobicContact CG2-CD2 3.95Å
335	M	97.6	Very high	95.5	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-72.2	-35	179.1	-73.1	175.8	67.6	0	0	113	R331 I332 G337 M338 G339 Y340 I345 I357 T360 Y361 L364	R331-M335 WeakPolarHBondContact O-CG 3.3Å; R331-M335 PolarHBondContact O-N 3.02Å; I332-M335 CarbonylContact O-C 3.45Å; I332-M335 WeakPolarHBondContact O-CA 3.45Å; I332-M335 PolarHBondContact O-N 3.5Å; M335-G337 VanDerWaalsContact C-N 3.29Å; M335-M338 CarbonylContact O-C 3.59Å; M335-M338 WeakPolarHBondContact O-CA 3.35Å; M335-M338 WeakPolarHBondContact O-CB 3.22Å; M335-M338 PolarHBondContact O-N 3.06Å; M335-G339 PolarHBondContact O-N 3.37Å; M335-Y340 HydrophobicContact CB-CD2 4.13Å; M335-Y340 HydrophobicContact CE-CD2 4.13Å; M335-Y340 HydrophobicContact CE-CE2 4.43Å; M335-Y340 PolarHBondContact O-N 3.26Å; M335-I345 HydrophobicContact CB-CD1 3.71Å; M335-I345 HydrophobicContact CB-CG1 4.44Å; M335-I345 HydrophobicContact CE-CG1 4.11Å; M335-I357 HydrophobicContact CE-CB 4.39Å; M335-I357 HydrophobicContact CE-CG2 3.68Å; M335-I357 VanDerWaalsContact CE-O 3.31Å; M335-I357 WeakPolarHBondContact CE-O 3.46Å; M335-T360 HydrophobicContact CE-CG2 4.11Å; M335-T360 HydrophobicContact CG-CG2 3.86Å; M335-T360 HydrophobicContact SD-CG2 4.09Å; M335-Y361 HydrophobicContact SD-CD2 3.99Å; M335-Y361 HydrophobicContact SD-CG 4.33Å; M335-L364 HydrophobicContact CG-CD1 3.68Å; M335-L364 HydrophobicContact SD-CD1 4.15Å
336	V	97.3	Very high	95.9	Very high	68 Å²	68	66.4 Å²	66.4	41%	0.412	37%	0.369	S	S	.	.	H	α-helix	trans	-62.9	-39.7	167.8	175.2	0	0	0	0	110.1	I332 M338 G339 Y340 I345	I332-V336 WeakPolarHBondContact O-CG2 3.28Å; I332-V336 PolarHBondContact O-N 2.87Å; V336-M338 PolarHBondContact O-N 3.39Å; V336-G339 PolarHBondContact O-N 2.86Å; V336-Y340 WeakPolarHBondContact CA-O 3.43Å; V336-I345 HydrophobicContact CG2-CD1 3.96Å
337	G	96.6	Very high	96.1	Very high	71 Å²	71	67.9 Å²	67.9	73%	0.732	38%	0.375	S	S	*	.	H	α-helix	trans	-64.3	-18.2	169.9	0	0	0	0	0	115.3	D333 I334 M335	D333-G337 PolarHBondContact O-N 2.93Å; I334-G337 CarbonylContact O-C 3.51Å; I334-G337 WeakPolarHBondContact O-CA 3.35Å; I334-G337 PolarHBondContact O-N 2.8Å; M335-G337 VanDerWaalsContact C-N 3.29Å
338	M	95.9	Very high	96.4	Very high	68 Å²	68	63.5 Å²	63.5	34%	0.335	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-10.1	171.4	-68.6	170.4	175.6	0	0	113.1	L77 T78 I334 M335 V336 Y340 T360 L364	L77-M338 HydrophobicContact CB-CE 4.29Å; L77-M338 HydrophobicContact CB-SD 4.06Å; L77-M338 VanDerWaalsContact O-CE 3.27Å; L77-M338 WeakPolarHBondContact O-CE 3.43Å; T78-M338 HydrophobicContact CG2-CE 4.47Å; I334-M338 HydrophobicContact CG2-CE 3.73Å; I334-M338 HydrophobicContact CG2-SD 4.37Å; I334-M338 WeakPolarHBondContact O-CG 3.37Å; I334-M338 PolarHBondContact O-N 3.11Å; M335-M338 CarbonylContact O-C 3.59Å; M335-M338 WeakPolarHBondContact O-CA 3.35Å; M335-M338 WeakPolarHBondContact O-CB 3.22Å; M335-M338 PolarHBondContact O-N 3.06Å; V336-M338 PolarHBondContact O-N 3.39Å; M338-Y340 HydrophobicContact CB-CD2 4.29Å; M338-Y340 HydrophobicContact CB-CE2 4.41Å; M338-T360 HydrophobicContact SD-CG2 3.92Å; M338-L364 HydrophobicContact CE-CD2 4.46Å
339	G	95.9	Very high	96.4	Very high	67 Å²	67	61.5 Å²	61.5	69%	0.691	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.1	4	176.4	0	0	0	0	0	116.1	M335 V336	M335-G339 PolarHBondContact O-N 3.37Å; V336-G339 PolarHBondContact O-N 2.86Å
340	Y	96.8	Very high	96.4	Very high	31 Å²	31	60.3 Å²	60.3	12%	0.122	34%	0.336	C	S	.	.			trans	-78.2	144.3	172.8	-62.1	-69	0	0	0	111.2	L77 M335 V336 M338 E356 I357 T360	L77-Y340 HydrophobicContact CD1-CE2 4.08Å; L77-Y340 WeakPolarHBondContact CD1-OH 3.43Å; M335-Y340 HydrophobicContact CB-CD2 4.13Å; M335-Y340 HydrophobicContact CE-CD2 4.13Å; M335-Y340 HydrophobicContact CE-CE2 4.43Å; M335-Y340 PolarHBondContact O-N 3.26Å; V336-Y340 WeakPolarHBondContact CA-O 3.43Å; M338-Y340 HydrophobicContact CB-CD2 4.29Å; M338-Y340 HydrophobicContact CB-CE2 4.41Å; Y340-E356 HydrophobicContact CE1-CG 4.28Å; Y340-E356 PolarHBondContact OH-OE2 3.46Å; Y340-I357 HydrophobicContact CD1-CD1 3.97Å; Y340-I357 HydrophobicContact CD1-CG1 3.79Å; Y340-I357 HydrophobicContact CE1-CD1 4.31Å; Y340-I357 HydrophobicContact CE1-CG1 3.73Å; Y340-I357 HydrophobicContact CG-CG1 4.48Å; Y340-T360 HydrophobicContact CE2-CG2 4.44Å
341	S	97.4	Very high	96.3	Very high	40 Å²	40	59.1 Å²	59.1	28%	0.28	33%	0.331	S	S	.	.			trans	-77.5	155.9	172.8	69.2	0	0	0	0	112.5	E343 E344 I345	S341-E343 PolarHBondContact O-N 3.37Å; S341-E344 VanDerWaalsContact CB-OE2 3.28Å; S341-E344 WeakPolarHBondContact CB-OE2 3.42Å; S341-E344 PolarHBondContact N-OE2 3.24Å; S341-E344 PolarHBondContact O-N 3.07Å; S341-E344 WeakPolarHBondContact OG-CB 3.43Å; S341-E344 WeakPolarHBondContact OG-CG 3.34Å; S341-E344 PolarHBondContact OG-N 2.84Å; S341-E344 PolarHBondContact OG-OE2 2.72Å; S341-I345 WeakPolarHBondContact O-CD1 3.4Å; S341-I345 WeakPolarHBondContact O-CG1 3.11Å; S341-I345 PolarHBondContact O-N 3.44Å; S341-I345 VanDerWaalsContact O-N 3.1Å
342	Q	95.4	Very high	96.2	Very high	69 Å²	69	59.3 Å²	59.3	32%	0.322	33%	0.334	S	S	.	.	H	α-helix	trans	-61	-35.9	177	-176.6	64.1	38	0	0	111.3	Q346	Q342-Q346 WeakPolarHBondContact O-CB 3.33Å; Q342-Q346 PolarHBondContact O-N 3.15Å
343	E	96.4	Very high	96.2	Very high	138 Å²	138	62.7 Å²	62.7	65%	0.645	35%	0.349	S	S	*	.	H	α-helix	trans	-69.1	-46.4	-178.4	-64.9	67.5	-151.8	0	0	111.2	S341 Q346 E347	S341-E343 PolarHBondContact O-N 3.37Å; E343-Q346 PolarHBondContact O-N 3.46Å; E343-E347 WeakPolarHBondContact O-CB 3.47Å; E343-E347 PolarHBondContact O-N 2.9Å
344	E	96.8	Very high	96.2	Very high	96 Å²	96	59.1 Å²	59.1	45%	0.449	33%	0.328	S	S	.	.	H	α-helix	trans	-64.8	-40.5	175.7	-70.4	161.9	137.2	0	0	111.9	S341 E347 S348 I357	S341-E344 VanDerWaalsContact CB-OE2 3.28Å; S341-E344 WeakPolarHBondContact CB-OE2 3.42Å; S341-E344 PolarHBondContact N-OE2 3.24Å; S341-E344 PolarHBondContact O-N 3.07Å; S341-E344 WeakPolarHBondContact OG-CB 3.43Å; S341-E344 WeakPolarHBondContact OG-CG 3.34Å; S341-E344 PolarHBondContact OG-N 2.84Å; S341-E344 PolarHBondContact OG-OE2 2.72Å; E344-E347 PolarHBondContact O-N 3.41Å; E344-S348 VanDerWaalsContact O-CB 3.22Å; E344-S348 WeakPolarHBondContact O-CB 3.35Å; E344-S348 PolarHBondContact O-N 3.19Å; E344-I357 HydrophobicContact CB-CD1 3.81Å
345	I	97.2	Very high	96.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-57.8	-52.6	173.9	-67.6	165	0	0	0	109.8	I332 M335 V336 S341 E347 S348 L349 I357	I332-I345 HydrophobicContact CG1-CG2 4.26Å; I332-I345 HydrophobicContact CG2-CD1 4.38Å; M335-I345 HydrophobicContact CB-CD1 3.71Å; M335-I345 HydrophobicContact CB-CG1 4.44Å; M335-I345 HydrophobicContact CE-CG1 4.11Å; V336-I345 HydrophobicContact CG2-CD1 3.96Å; S341-I345 WeakPolarHBondContact O-CD1 3.4Å; S341-I345 WeakPolarHBondContact O-CG1 3.11Å; S341-I345 PolarHBondContact O-N 3.44Å; S341-I345 VanDerWaalsContact O-N 3.1Å; I345-E347 PolarHBondContact O-N 2.89Å; I345-S348 PolarHBondContact O-N 2.95Å; I345-L349 HydrophobicContact CG2-CD1 3.73Å; I345-L349 HydrophobicContact CG2-CG 4.43Å; I345-L349 WeakPolarHBondContact O-CB 3.41Å; I345-L349 VanDerWaalsContact O-CG 3.28Å; I345-L349 WeakPolarHBondContact O-CG 3.24Å; I345-L349 PolarHBondContact O-N 2.83Å; I345-I357 HydrophobicContact CB-CG2 4.48Å; I345-I357 HydrophobicContact CG1-CG2 4.19Å
346	Q	96	Very high	96.2	Very high	91 Å²	91	61.1 Å²	61.1	43%	0.425	34%	0.337	S	S	.	.	H	α-helix	trans	-65	-41.6	-178.7	-173.6	62.7	18.5	0	0	112.4	Q342 E343 S350	Q342-Q346 WeakPolarHBondContact O-CB 3.33Å; Q342-Q346 PolarHBondContact O-N 3.15Å; E343-Q346 PolarHBondContact O-N 3.46Å; Q346-S350 WeakPolarHBondContact O-CB 3.21Å; Q346-S350 PolarHBondContact O-N 3.05Å; Q346-S350 PolarHBondContact O-OG 3.38Å
347	E	96.5	Very high	96.3	Very high	76 Å²	76	58.7 Å²	58.7	36%	0.355	32%	0.322	S	S	.	.	H	α-helix	trans	-73.8	-26.9	-177.9	-165.9	-97.1	138.2	0	0	112.8	E343 E344 I345 K351 K353	E343-E347 WeakPolarHBondContact O-CB 3.47Å; E343-E347 PolarHBondContact O-N 2.9Å; E344-E347 PolarHBondContact O-N 3.41Å; I345-E347 PolarHBondContact O-N 2.89Å; E347-K351 WeakPolarHBondContact O-CD 3.08Å; E347-K351 WeakPolarHBondContact O-CG 3.09Å; E347-K351 WeakPolarHBondContact OE1-CD 3.46Å; E347-K351 VanDerWaalsContact OE1-CE 3.3Å; E347-K351 WeakPolarHBondContact OE1-CE 3.15Å; E347-K351 IonicContact OE1-NZ 2.7Å; E347-K351 PolarHBondContact OE1-NZ 3.28Å; E347-K353 VanDerWaalsContact OE1-CE 3.22Å; E347-K353 WeakPolarHBondContact OE1-CE 3.29Å; E347-K353 IonicContact OE1-NZ 3.74Å; E347-K353 PolarHBondContact OE1-NZ 2.92Å; E347-K353 VanDerWaalsContact OE1-NZ 3.1Å; E347-K353 IonicContact OE2-NZ 3.44Å; E347-K353 PolarHBondContact OE2-NZ 3.12Å
348	S	97.1	Very high	96.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-76.8	-50.6	170.7	-180	0	0	0	0	112.8	E344 I345 K351 M352 K353 D355 T358	E344-S348 VanDerWaalsContact O-CB 3.22Å; E344-S348 WeakPolarHBondContact O-CB 3.35Å; E344-S348 PolarHBondContact O-N 3.19Å; I345-S348 PolarHBondContact O-N 2.95Å; S348-K351 PolarHBondContact O-N 3.38Å; S348-M352 PolarHBondContact O-N 3.49Å; S348-K353 PolarHBondContact O-N 2.97Å; S348-D355 PolarHBondContact OG-OD1 3Å; S348-D355 PolarHBondContact OG-OD2 3.11Å; S348-T358 PolarHBondContact OG-OG1 3.46Å
349	L	95.6	Very high	96.4	Very high	2 Å²	2	52 Å²	52	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-67.6	-42.3	-176.2	-67.3	177.7	0	0	0	112.6	I326 I345 K351 M352 Y361	I326-L349 HydrophobicContact CB-CB 4.18Å; I326-L349 HydrophobicContact CB-CD1 4.44Å; I326-L349 HydrophobicContact CG2-CB 4.17Å; I345-L349 HydrophobicContact CG2-CD1 3.73Å; I345-L349 HydrophobicContact CG2-CG 4.43Å; I345-L349 WeakPolarHBondContact O-CB 3.41Å; I345-L349 VanDerWaalsContact O-CG 3.28Å; I345-L349 WeakPolarHBondContact O-CG 3.24Å; I345-L349 PolarHBondContact O-N 2.83Å; L349-K351 PolarHBondContact O-N 3.32Å; L349-M352 PolarHBondContact O-N 2.87Å; L349-M352 VanDerWaalsContact O-N 3.14Å; L349-Y361 HydrophobicContact CD1-CD1 4.06Å; L349-Y361 HydrophobicContact CD1-CD2 3.69Å; L349-Y361 HydrophobicContact CD1-CE1 4.27Å; L349-Y361 HydrophobicContact CD1-CE2 3.91Å; L349-Y361 HydrophobicContact CD1-CG 3.77Å; L349-Y361 HydrophobicContact CD2-CD1 3.7Å; L349-Y361 HydrophobicContact CD2-CE1 4.42Å; L349-Y361 HydrophobicContact CD2-CG 3.77Å; L349-Y361 HydrophobicContact CG-CG 4.43Å
350	S	94.4	Very high	96.4	Very high	70 Å²	70	48.9 Å²	48.9	49%	0.49	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.5	177.4	59.2	0	0	0	0	113.5	Q346	Q346-S350 WeakPolarHBondContact O-CB 3.21Å; Q346-S350 PolarHBondContact O-N 3.05Å; Q346-S350 PolarHBondContact O-OG 3.38Å
351	K	94.1	Very high	96.5	Very high	134 Å²	134	47.6 Å²	47.6	58%	0.583	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-6.4	177	-64.3	-179.2	-174	176	0	113.5	E347 S348 L349 K353	E347-K351 WeakPolarHBondContact O-CD 3.08Å; E347-K351 WeakPolarHBondContact O-CG 3.09Å; E347-K351 WeakPolarHBondContact OE1-CD 3.46Å; E347-K351 VanDerWaalsContact OE1-CE 3.3Å; E347-K351 WeakPolarHBondContact OE1-CE 3.15Å; E347-K351 IonicContact OE1-NZ 2.7Å; E347-K351 PolarHBondContact OE1-NZ 3.28Å; S348-K351 PolarHBondContact O-N 3.38Å; L349-K351 PolarHBondContact O-N 3.32Å; K351-K353 HydrophobicContact CB-CG 4.11Å; K351-K353 PolarHBondContact O-N 3.47Å
352	M	94.1	Very high	96.4	Very high	47 Å²	47	46.8 Å²	46.8	23%	0.232	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	43.9	59.9	-171.8	-75.2	-75.6	158.2	0	0	111.7	L324 I326 S348 L349 Y354 T358	L324-M352 HydrophobicContact CB-CE 4.34Å; L324-M352 HydrophobicContact CD1-CE 3.97Å; L324-M352 HydrophobicContact CD1-SD 4.41Å; I326-M352 HydrophobicContact CG2-CE 3.43Å; I326-M352 VanDerWaalsContact CG2-CE 3.43Å; S348-M352 PolarHBondContact O-N 3.49Å; L349-M352 PolarHBondContact O-N 2.87Å; L349-M352 VanDerWaalsContact O-N 3.14Å; M352-Y354 VanDerWaalsContact C-N 3.31Å; M352-Y354 HydrophobicContact CB-CE2 4.2Å; M352-Y354 WeakPolarHBondContact O-CD2 3.44Å; M352-Y354 PolarHBondContact O-N 2.93Å; M352-T358 HydrophobicContact SD-CG2 4.47Å
353	K	95.6	Very high	96.4	Very high	75 Å²	75	43.6 Å²	43.6	33%	0.326	21%	0.21	S	C	.	.			trans	-62.6	-35.9	-174.8	-69.5	-178.7	-176.3	173.7	0	112.7	K108 E347 S348 K351 D355	K108-K353 PolarHBondContact NZ-O 3.41Å; E347-K353 VanDerWaalsContact OE1-CE 3.22Å; E347-K353 WeakPolarHBondContact OE1-CE 3.29Å; E347-K353 IonicContact OE1-NZ 3.74Å; E347-K353 PolarHBondContact OE1-NZ 2.92Å; E347-K353 VanDerWaalsContact OE1-NZ 3.1Å; E347-K353 IonicContact OE2-NZ 3.44Å; E347-K353 PolarHBondContact OE2-NZ 3.12Å; S348-K353 PolarHBondContact O-N 2.97Å; K351-K353 HydrophobicContact CB-CG 4.11Å; K351-K353 PolarHBondContact O-N 3.47Å; K353-D355 VanDerWaalsContact C-N 3.34Å; K353-D355 HydrophobicContact CB-CB 4.24Å; K353-D355 WeakPolarHBondContact CB-OD2 3.28Å; K353-D355 WeakPolarHBondContact CD-OD2 3.28Å
354	Y	97.1	Very high	96.3	Very high	16 Å²	16	38.9 Å²	38.9	6%	0.063	19%	0.189	C	C	.	.			trans	60.7	43.2	-165.9	-63.7	-99.1	0	0	0	112.1	K108 L118 F119 E120 V121 M352 T358	K108-Y354 HydrophobicContact CB-CD2 4.24Å; K108-Y354 HydrophobicContact CB-CE2 3.71Å; K108-Y354 HydrophobicContact CD-CD2 3.46Å; K108-Y354 VanDerWaalsContact CD-CD2 3.46Å; K108-Y354 HydrophobicContact CD-CE2 3.83Å; K108-Y354 HydrophobicContact CD-CG 4.16Å; K108-Y354 HydrophobicContact CG-CD2 3.56Å; K108-Y354 HydrophobicContact CG-CE2 3.54Å; K108-Y354 HydrophobicContact CG-CG 4.09Å; K108-Y354 PolarHBondContact O-OH 2.63Å; L118-Y354 HydrophobicContact CB-CD1 4.33Å; L118-Y354 HydrophobicContact CB-CE1 4.07Å; L118-Y354 HydrophobicContact CD2-CD1 3.85Å; L118-Y354 HydrophobicContact CD2-CE1 4.07Å; L118-Y354 HydrophobicContact CD2-CG 4.35Å; L118-Y354 HydrophobicContact CG-CD1 3.93Å; L118-Y354 HydrophobicContact CG-CE1 4.16Å; F119-Y354 WeakPolarHBondContact O-CD1 3.43Å; E120-Y354 WeakPolarHBondContact CA-O 3.25Å; E120-Y354 WeakPolarHBondContact CG-O 3.41Å; V121-Y354 PolarHBondContact N-O 2.84Å; M352-Y354 VanDerWaalsContact C-N 3.31Å; M352-Y354 HydrophobicContact CB-CE2 4.2Å; M352-Y354 WeakPolarHBondContact O-CD2 3.44Å; M352-Y354 PolarHBondContact O-N 2.93Å; Y354-T358 HydrophobicContact CD1-CG2 4.49Å; Y354-T358 HydrophobicContact CG-CG2 4.4Å; Y354-T358 PolarHBondContact N-OG1 2.86Å; Y354-T358 VanDerWaalsContact N-OG1 3.1Å
355	D	97.4	Very high	96	Very high	42 Å²	42	36.1 Å²	36.1	23%	0.225	19%	0.187	C	C	.	.	S	Bend	trans	-94.9	-176.3	166.3	57.5	10.7	0	0	0	110.6	S348 K353 I357 T358 A359	S348-D355 PolarHBondContact OG-OD1 3Å; S348-D355 PolarHBondContact OG-OD2 3.11Å; K353-D355 VanDerWaalsContact C-N 3.34Å; K353-D355 HydrophobicContact CB-CB 4.24Å; K353-D355 WeakPolarHBondContact CB-OD2 3.28Å; K353-D355 WeakPolarHBondContact CD-OD2 3.28Å; D355-I357 PolarHBondContact O-N 3.48Å; D355-I357 PolarHBondContact OD1-N 3.21Å; D355-T358 PolarHBondContact O-N 2.86Å; D355-T358 WeakPolarHBondContact OD1-CB 3.46Å; D355-T358 PolarHBondContact OD1-N 2.72Å; D355-T358 PolarHBondContact OD1-OG1 3.3Å; D355-A359 WeakPolarHBondContact O-CB 3.36Å; D355-A359 PolarHBondContact O-N 3.31Å
356	E	97.4	Very high	95.5	Very high	83 Å²	83	40 Å²	40	39%	0.388	20%	0.202	S	C	.	.	H	α-helix	trans	-57.8	-29.4	179.6	65.6	175.6	120.5	0	0	114.1	N55 E120 Y340 T360	N55-E356 PolarHBondContact ND2-OE2 2.95Å; E120-E356 WeakPolarHBondContact OE2-CA 3.06Å; Y340-E356 HydrophobicContact CE1-CG 4.28Å; Y340-E356 PolarHBondContact OH-OE2 3.46Å; E356-T360 VanDerWaalsContact O-CB 3.22Å; E356-T360 WeakPolarHBondContact O-CB 3.08Å; E356-T360 PolarHBondContact O-N 2.94Å; E356-T360 PolarHBondContact O-OG1 2.88Å
357	I	97.8	Very high	94.1	Very high	16 Å²	16	45 Å²	45	8%	0.082	22%	0.222	C	C	.	.	H	α-helix	trans	-73.7	-51.7	179.8	-61.3	-176.9	0	0	0	109.2	M335 Y340 E344 I345 D355 A359 T360 Y361	M335-I357 HydrophobicContact CE-CB 4.39Å; M335-I357 HydrophobicContact CE-CG2 3.68Å; M335-I357 VanDerWaalsContact CE-O 3.31Å; M335-I357 WeakPolarHBondContact CE-O 3.46Å; Y340-I357 HydrophobicContact CD1-CD1 3.97Å; Y340-I357 HydrophobicContact CD1-CG1 3.79Å; Y340-I357 HydrophobicContact CE1-CD1 4.31Å; Y340-I357 HydrophobicContact CE1-CG1 3.73Å; Y340-I357 HydrophobicContact CG-CG1 4.48Å; E344-I357 HydrophobicContact CB-CD1 3.81Å; I345-I357 HydrophobicContact CB-CG2 4.48Å; I345-I357 HydrophobicContact CG1-CG2 4.19Å; D355-I357 PolarHBondContact O-N 3.48Å; D355-I357 PolarHBondContact OD1-N 3.21Å; I357-A359 VanDerWaalsContact C-N 3.26Å; I357-A359 PolarHBondContact O-N 3.32Å; I357-T360 PolarHBondContact O-N 2.9Å; I357-Y361 PolarHBondContact O-N 3.35Å
358	T	97.2	Very high	92.1	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-54.4	-46	172.9	-55.3	0	0	0	0	110.4	S348 M352 Y354 D355 L362	S348-T358 PolarHBondContact OG-OG1 3.46Å; M352-T358 HydrophobicContact SD-CG2 4.47Å; Y354-T358 HydrophobicContact CD1-CG2 4.49Å; Y354-T358 HydrophobicContact CG-CG2 4.4Å; Y354-T358 PolarHBondContact N-OG1 2.86Å; Y354-T358 VanDerWaalsContact N-OG1 3.1Å; D355-T358 PolarHBondContact O-N 2.86Å; D355-T358 WeakPolarHBondContact OD1-CB 3.46Å; D355-T358 PolarHBondContact OD1-N 2.72Å; D355-T358 PolarHBondContact OD1-OG1 3.3Å; T358-L362 HydrophobicContact CG2-CD1 3.89Å; T358-L362 HydrophobicContact CG2-CG 4.48Å; T358-L362 WeakPolarHBondContact O-CB 3.4Å; T358-L362 VanDerWaalsContact O-CG 3.25Å; T358-L362 WeakPolarHBondContact O-CG 3.12Å; T358-L362 PolarHBondContact O-N 3.45Å
359	A	97.6	Very high	89.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.3	-46.8	-178	0	0	0	0	0	112.4	Y56 F119 E120 D355 I357 Y361 L362 L363	Y56-A359 WeakPolarHBondContact OH-CB 3.01Å; F119-A359 HydrophobicContact CB-CB 4.09Å; E120-A359 HydrophobicContact CB-CB 3.77Å; E120-A359 HydrophobicContact CG-CB 4Å; E120-A359 WeakPolarHBondContact OE2-CB 3.16Å; D355-A359 WeakPolarHBondContact O-CB 3.36Å; D355-A359 PolarHBondContact O-N 3.31Å; I357-A359 VanDerWaalsContact C-N 3.26Å; I357-A359 PolarHBondContact O-N 3.32Å; A359-Y361 PolarHBondContact O-N 2.86Å; A359-L362 PolarHBondContact O-N 3.4Å; A359-L363 WeakPolarHBondContact O-CB 3.28Å; A359-L363 WeakPolarHBondContact O-CG 3.35Å; A359-L363 PolarHBondContact O-N 3.5Å
360	T	97.6	Very high	87.4	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.5	-47.6	177.9	-64.5	0	0	0	0	111	H75 T78 M335 M338 Y340 E356 I357 L362 L363 L364	H75-T360 PolarHBondContact CE1-OG1 3.08Å; H75-T360 VanDerWaalsContact CE1-OG1 3.31Å; T78-T360 HydrophobicContact CG2-CG2 4.03Å; M335-T360 HydrophobicContact CE-CG2 4.11Å; M335-T360 HydrophobicContact CG-CG2 3.86Å; M335-T360 HydrophobicContact SD-CG2 4.09Å; M338-T360 HydrophobicContact SD-CG2 3.92Å; Y340-T360 HydrophobicContact CE2-CG2 4.44Å; E356-T360 VanDerWaalsContact O-CB 3.22Å; E356-T360 WeakPolarHBondContact O-CB 3.08Å; E356-T360 PolarHBondContact O-N 2.94Å; E356-T360 PolarHBondContact O-OG1 2.88Å; I357-T360 PolarHBondContact O-N 2.9Å; T360-L362 PolarHBondContact O-N 2.79Å; T360-L363 PolarHBondContact O-N 3.02Å; T360-L364 HydrophobicContact CG2-CD1 4.15Å; T360-L364 WeakPolarHBondContact O-CG 3.42Å; T360-L364 PolarHBondContact O-N 3.02Å
361	Y	97	Very high	84.8	Confident	4 Å²	4	58 Å²	58	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-59.7	-47.3	177.1	-176.3	-93.7	0	0	0	112.5	D325 I326 S327 D328 R331 I332 M335 L349 I357 A359 L363 L364 G365	D325-Y361 WeakPolarHBondContact O-CE1 3.42Å; D325-Y361 PolarHBondContact O-OH 2.86Å; D325-Y361 PolarHBondContact OD1-OH 2.74Å; I326-Y361 VanDerWaalsContact CA-OH 3.27Å; I326-Y361 WeakPolarHBondContact CA-OH 3.47Å; S327-Y361 PolarHBondContact N-OH 2.78Å; D328-Y361 PolarHBondContact N-OH 2.91Å; R331-Y361 HydrophobicContact CB-CD2 3.73Å; R331-Y361 HydrophobicContact CB-CE2 3.61Å; R331-Y361 HydrophobicContact CG-CE2 4.32Å; R331-Y361 PolarHBondContact NH1-OH 3.13Å; I332-Y361 HydrophobicContact CG1-CE2 4.22Å; M335-Y361 HydrophobicContact SD-CD2 3.99Å; M335-Y361 HydrophobicContact SD-CG 4.33Å; L349-Y361 HydrophobicContact CD1-CD1 4.06Å; L349-Y361 HydrophobicContact CD1-CD2 3.69Å; L349-Y361 HydrophobicContact CD1-CE1 4.27Å; L349-Y361 HydrophobicContact CD1-CE2 3.91Å; L349-Y361 HydrophobicContact CD1-CG 3.77Å; L349-Y361 HydrophobicContact CD2-CD1 3.7Å; L349-Y361 HydrophobicContact CD2-CE1 4.42Å; L349-Y361 HydrophobicContact CD2-CG 3.77Å; L349-Y361 HydrophobicContact CG-CG 4.43Å; I357-Y361 PolarHBondContact O-N 3.35Å; A359-Y361 PolarHBondContact O-N 2.86Å; Y361-L363 VanDerWaalsContact C-N 3.32Å; Y361-L363 PolarHBondContact O-N 2.77Å; Y361-L364 PolarHBondContact O-N 3.21Å; Y361-G365 PolarHBondContact O-N 3.16Å; Y361-G365 VanDerWaalsContact O-N 3.15Å
362	L	95.6	Very high	82	Confident	24 Å²	24	56.7 Å²	56.7	13%	0.126	29%	0.293	C	S	.	.	H	α-helix	trans	-66.1	-31.1	178.4	-71.7	175.5	0	0	0	113.2	F119 T358 A359 T360	F119-L362 HydrophobicContact CD1-CB 4.01Å; F119-L362 HydrophobicContact CD1-CD1 4.4Å; T358-L362 HydrophobicContact CG2-CD1 3.89Å; T358-L362 HydrophobicContact CG2-CG 4.48Å; T358-L362 WeakPolarHBondContact O-CB 3.4Å; T358-L362 VanDerWaalsContact O-CG 3.25Å; T358-L362 WeakPolarHBondContact O-CG 3.12Å; T358-L362 PolarHBondContact O-N 3.45Å; A359-L362 PolarHBondContact O-N 3.4Å; T360-L362 PolarHBondContact O-N 2.79Å
363	L	96.2	Very high	79.3	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-78.1	-35.3	176.9	-72	171.7	0	0	0	112.5	Y56 H75 T78 R80 V82 F119 A359 T360 Y361 G365 R366	Y56-L363 HydrophobicContact CE1-CD1 4.39Å; H75-L363 HydrophobicContact CB-CD1 3.85Å; T78-L363 HydrophobicContact CG2-CB 4.38Å; R80-L363 HydrophobicContact CB-CD2 4.23Å; V82-L363 HydrophobicContact CG1-CD1 4.33Å; V82-L363 HydrophobicContact CG1-CD2 3.82Å; F119-L363 HydrophobicContact CD1-CD2 4.38Å; F119-L363 HydrophobicContact CD2-CD2 3.73Å; F119-L363 HydrophobicContact CD2-CG 4.37Å; F119-L363 HydrophobicContact CE1-CD2 4.35Å; F119-L363 HydrophobicContact CE2-CD2 3.67Å; F119-L363 HydrophobicContact CG-CD2 4.1Å; F119-L363 HydrophobicContact CG-CG 4.34Å; F119-L363 HydrophobicContact CZ-CD2 4.01Å; A359-L363 WeakPolarHBondContact O-CB 3.28Å; A359-L363 WeakPolarHBondContact O-CG 3.35Å; A359-L363 PolarHBondContact O-N 3.5Å; T360-L363 PolarHBondContact O-N 3.02Å; Y361-L363 VanDerWaalsContact C-N 3.32Å; Y361-L363 PolarHBondContact O-N 2.77Å; L363-G365 VanDerWaalsContact C-N 3.33Å; L363-R366 PolarHBondContact O-N 3.21Å
364	L	95	Very high	76.5	Confident	39 Å²	39	59.9 Å²	59.9	20%	0.204	34%	0.336	C	S	.	.	H	α-helix	trans	-62.7	-39.2	171.7	-74	171.8	0	0	0	111.6	T78 R331 I334 M335 M338 T360 Y361 R366	T78-L364 HydrophobicContact CG2-CD2 3.78Å; T78-L364 HydrophobicContact CG2-CG 3.85Å; R331-L364 HydrophobicContact CB-CB 4.44Å; R331-L364 HydrophobicContact CB-CD1 4.33Å; R331-L364 HydrophobicContact CG-CB 4.04Å; I334-L364 HydrophobicContact CB-CD1 4.3Å; I334-L364 HydrophobicContact CG2-CD1 3.79Å; I334-L364 HydrophobicContact CG2-CD2 3.95Å; M335-L364 HydrophobicContact CG-CD1 3.68Å; M335-L364 HydrophobicContact SD-CD1 4.15Å; M338-L364 HydrophobicContact CE-CD2 4.46Å; T360-L364 HydrophobicContact CG2-CD1 4.15Å; T360-L364 WeakPolarHBondContact O-CG 3.42Å; T360-L364 PolarHBondContact O-N 3.02Å; Y361-L364 PolarHBondContact O-N 3.21Å; L364-R366 PolarHBondContact O-N 3.14Å; L364-R366 VanDerWaalsContact O-N 3.16Å
365	G	90.3	Very high	73.4	Confident	39 Å²	39	64.9 Å²	64.9	40%	0.402	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-8.8	178.7	0	0	0	0	0	115.6	Y361 L363	Y361-G365 PolarHBondContact O-N 3.16Å; Y361-G365 VanDerWaalsContact O-N 3.15Å; L363-G365 VanDerWaalsContact C-N 3.33Å
366	R	85.1	Confident	70.3	Confident	80 Å²	80	68 Å²	68	30%	0.302	39%	0.389	S	S	.	.	S	Bend	trans	-83.9	133.1	176.1	-73.9	-176.3	163.5	-110	-1.9	111	R80 F119 E133 L363 L364	R80-R366 VanDerWaalsContact CZ-O 3.27Å; R80-R366 PolarHBondContact NH1-O 3.02Å; R80-R366 PolarHBondContact NH2-O 3.27Å; F119-R366 VanDerWaalsContact CZ-NE 3.29Å; E133-R366 IonicContact OE1-CZ 3.46Å; E133-R366 IonicContact OE1-NH1 3.73Å; E133-R366 PolarHBondContact OE1-NH1 3.01Å; E133-R366 IonicContact OE1-NH2 3.96Å; E133-R366 PolarHBondContact OE1-NH2 2.83Å; E133-R366 IonicContact OE2-CZ 2.68Å; E133-R366 IonicContact OE2-NH1 3.4Å; E133-R366 IonicContact OE2-NH2 2.66Å; E133-R366 PolarHBondContact OE2-NH2 2.69Å; L363-R366 PolarHBondContact O-N 3.21Å; L364-R366 PolarHBondContact O-N 3.14Å; L364-R366 VanDerWaalsContact O-N 3.16Å
367	K	67.6	Low	67.3	Low	198 Å²	198	68.7 Å²	68.7	86%	0.861	40%	0.402	S	S	*	.			trans	-55.1	144.7	172.6	-66.7	-176.1	178.3	-179.7	0	110.9	R80 S369	R80-K367 PolarHBondContact NH1-O 3.39Å; K367-S369 PolarHBondContact O-N 3Å
368	S	54.8	Low	64.6	Low	53 Å²	53	73.9 Å²	73.9	37%	0.371	44%	0.44	S	S	.	.			trans	-76.5	106	177.2	-168.4	0	0	0	0	109.4
369	S	50.1	Low	61.4	Low	87 Å²	87	79.4 Å²	79.4	61%	0.608	48%	0.479	S	S	*	.			trans	-83.9	120.7	166.3	53.9	0	0	0	0	109	K367	K367-S369 PolarHBondContact O-N 3Å
370	E	44.6	Very low	58.4	Low	151 Å²	151	84.2 Å²	84.2	71%	0.706	51%	0.512	S	S	*	.	S	Bend	trans	79.8	18.3	162.7	-49.2	-170.8	131.6	0	0	119.5
371	L	39.4	Very low	55.4	Low	129 Å²	129	91 Å²	91	68%	0.675	55%	0.549	S	S	*	.	S	Bend	trans	-106.1	-34	171.5	-78.1	172.8	0	0	0	116.5
372	D	34.8	Very low	52.3	Low	106 Å²	106	99.6 Å²	99.6	57%	0.567	59%	0.594	S	S	*	*	S	Bend	trans	-93.8	5.5	-173.1	-53.5	-72.8	0	0	0	114.7	S374 S376	D372-S374 VanDerWaalsContact C-N 3.33Å; D372-S374 PolarHBondContact O-N 3.2Å; D372-S376 PolarHBondContact O-OG 3.09Å
373	A	37.8	Very low	49.2	Very low	98 Å²	98	103.5 Å²	103.5	81%	0.81	62%	0.623	S	S	*	*	S	Bend	trans	-79.3	-7.1	-171.2	0	0	0	0	0	115.1
374	S	35.4	Very low	46.2	Very low	92 Å²	92	111.7 Å²	111.7	64%	0.643	67%	0.666	S	S	*	*	S	Bend	trans	-102.2	-33	176.8	50.1	0	0	0	0	113.9	D372	D372-S374 VanDerWaalsContact C-N 3.33Å; D372-S374 PolarHBondContact O-N 3.2Å
375	D	32.8	Very low	43.2	Very low	121 Å²	121	114.8 Å²	114.8	65%	0.647	70%	0.697	S	S	*	*			trans	-122.5	32.1	-165.2	-64.5	-81.6	0	0	0	113.2	S377	D375-S377 PolarHBondContact O-N 3.45Å
376	S	32.6	Very low	40.4	Very low	107 Å²	107	122.5 Å²	122.5	75%	0.748	72%	0.72	S	S	*	*			trans	-70.4	42.6	173.3	-73.4	0	0	0	0	113.8	D372	D372-S376 PolarHBondContact O-OG 3.09Å
377	S	34.1	Very low	37.8	Very low	97 Å²	97	125.3 Å²	125.3	68%	0.678	75%	0.746	S	S	*	*	S	Bend	trans	-153	108.7	166	60	0	0	0	0	111.3	D375	D375-S377 PolarHBondContact O-N 3.45Å
378	S	41.8	Very low	35.9	Very low	126 Å²	126	126.9 Å²	126.9	88%	0.881	75%	0.746	S	S	*	*			trans	92.9	76	176.5	-38.9	0	0	0	0	116.6
379	S	29.3	Very low	34.8	Very low	116 Å²	116	130.2 Å²	130.2	81%	0.811	77%	0.766	S	S	*	*			trans	-150.2	39.2	169.3	54.4	0	0	0	0	114.1
380	S	34.9	Very low	33.9	Very low	100 Å²	100	131.8 Å²	131.8	70%	0.699	78%	0.777	S	S	*	*			trans	-87.8	149.1	158.7	48.8	0	0	0	0	110.7
381	N	33.7	Very low	33.4	Very low	144 Å²	144	129.8 Å²	129.8	77%	0.77	78%	0.78	S	S	*	*			trans	77.5	92.2	178.9	-47.7	-33.1	0	0	0	116.5
382	L	31.8	Very low	33	Very low	183 Å²	183	130.5 Å²	130.5	96%	0.958	79%	0.785	S	S	*	*			trans	-120.8	61.6	147.9	-149.6	86.6	0	0	0	109.7	L384	L382-L384 PolarHBondContact O-N 3.14Å
383	S	32.3	Very low	33	Very low	106 Å²	106	132.7 Å²	132.7	74%	0.741	80%	0.796	S	S	*	*			trans	-77.2	112.9	178	53.7	0	0	0	0	110.6
384	L	32.9	Very low	32.8	Very low	174 Å²	174	134.7 Å²	134.7	91%	0.911	79%	0.793	S	S	*	*			trans	-59.4	138.6	-179.8	-159.5	72.9	0	0	0	111.5	L382 K386	L382-L384 PolarHBondContact O-N 3.14Å; L384-K386 PolarHBondContact O-N 3.14Å
385	A	31.1	Very low	32.6	Very low	103 Å²	103	136.7 Å²	136.7	85%	0.851	80%	0.796	S	S	*	*			trans	-66.3	130.1	-175.7	0	0	0	0	0	112.1
386	K	31.5	Very low	32.8	Very low	202 Å²	202	135.3 Å²	135.3	88%	0.878	80%	0.796	S	S	*	*			trans	-124.8	135.4	169.6	-165.4	164.1	-174.5	171.2	0	110.3	L384	L384-K386 PolarHBondContact O-N 3.14Å
387	V	30.1	Very low	32.8	Very low	139 Å²	139	137 Å²	137	84%	0.842	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-64.2	139.4	-174.9	179.6	0	0	0	0	111.1
388	R	29.1	Very low	32.6	Very low	230 Å²	230	136.1 Å²	136.1	87%	0.868	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-99.2	134.8	170	-78.1	-178.2	172	162.6	-4.1	111
389	P	31.8	Very low	32.2	Very low	123 Å²	123	139.8 Å²	139.8	80%	0.799	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-80.5	166.3	147	34.7	-30.7	0	0	0	110.7
390	S	30.1	Very low	32.4	Very low	120 Å²	120	139.3 Å²	139.3	84%	0.839	81%	0.808	S	S	*	*			trans	-104.7	141.6	-174.4	-53.5	0	0	0	0	113.1
391	S	33.3	Very low	32.9	Very low	110 Å²	110	139.9 Å²	139.9	77%	0.769	81%	0.81	S	S	*	*			trans	-169.5	106.3	147.7	48.6	0	0	0	0	113.3
392	D	31.3	Very low	32.9	Very low	144 Å²	144	140.6 Å²	140.6	77%	0.77	81%	0.808	S	S	*	*			trans	33.9	129.7	134.1	-60	-61.3	0	0	0	125.5
393	L	36	Very low	33	Very low	151 Å²	151	138.6 Å²	138.6	79%	0.791	79%	0.793	S	S	*	*			trans	84.4	141.4	131.5	-71.1	169.5	0	0	0	124.8
394	N	32.8	Very low	33	Very low	140 Å²	140	142 Å²	142	75%	0.749	80%	0.795	S	S	*	*			trans	79.9	91.6	151.7	-75	-5.9	0	0	0	124.3
395	N	32	Very low	33	Very low	134 Å²	134	140.5 Å²	140.5	72%	0.717	79%	0.793	S	S	*	*				78.7	119	102.9	-162.7	37.8	0	0	0	122.6
396	S	35.7	Very low	33	Very low	92 Å²	92	144.8 Å²	144.8	64%	0.643	80%	0.795	S	S	*	*			trans	63.7	151.8	149.2	74.5	0	0	0	0	118.7
397	T	33.3	Very low	33.2	Very low	144 Å²	144	146.4 Å²	146.4	88%	0.883	80%	0.796	S	S	*	*			cis	-154.5	157.2	0.8	-20.5	0	0	0	0	108.8
398	G	30.9	Very low	33.2	Very low	78 Å²	78	145.6 Å²	145.6	80%	0.804	80%	0.796	S	S	*	*			trans	170.4	129.1	169.3	0	0	0	0	0	115.6
399	Q	31.6	Very low	33.3	Very low	203 Å²	203	141.2 Å²	141.2	95%	0.949	80%	0.795	S	S	*	*			trans	-86.9	157.3	-169.6	-66.2	163.6	-14.5	0	0	114.3
400	S	33.5	Very low	33.2	Very low	105 Å²	105	140.3 Å²	140.3	73%	0.734	79%	0.791	S	S	*	*			trans	-89.4	166.8	165.1	-52.8	0	0	0	0	111
401	P	46.6	Very low	33.3	Very low	113 Å²	113	140 Å²	140	73%	0.734	79%	0.789	S	S	*	*				-149.9	155.2	90.4	37	-18.9	0	0	0	117.8
402	H	32.9	Very low	33.2	Very low	158 Å²	158	140.4 Å²	140.4	73%	0.731	79%	0.792	S	S	*	*			trans	11.1	145.8	136.9	-49.6	-77.6	0	0	0	119.8
403	H	34.7	Very low	33.2	Very low	141 Å²	141	143.1 Å²	143.1	65%	0.653	80%	0.8	S	S	*	*			cis	-173.3	158.4	38	-129	-7.2	0	0	0	114.9
404	K	32.1	Very low	33.1	Very low	178 Å²	178	145.9 Å²	145.9	77%	0.774	81%	0.805	S	S	*	*			trans	51.7	120.5	147.3	-72.1	170.6	-178.2	168.9	0	122
405	V	31.9	Very low	32.9	Very low	143 Å²	143	148.9 Å²	148.9	87%	0.867	82%	0.815	S	S	*	*			trans	-90.3	146.1	162.3	174.5	0	0	0	0	110.9
406	Q	31.9	Very low	33.1	Very low	193 Å²	193	153.7 Å²	153.7	90%	0.902	82%	0.823	S	S	*	*			trans	-142.7	150.8	161.4	-148.9	167.9	3.1	0	0	112
407	R	35.8	Very low	33	Very low	236 Å²	236	160.6 Å²	160.6	89%	0.891	84%	0.835	S	S	*	*			trans	-90.6	151.3	-176.6	-68.9	174.5	170.9	166	-5.1	112.5
408	S	29.7	Very low	32.9	Very low	122 Å²	122	164.2 Å²	164.2	85%	0.853	83%	0.834	S	S	*	*			trans	-150.3	157.3	148.2	53	0	0	0	0	111
409	V	30.7	Very low	33.3	Very low	138 Å²	138	164.7 Å²	164.7	84%	0.836	83%	0.825	S	S	*	*			trans	-143.9	125.5	-170.9	-176.9	0	0	0	0	110.3
410	S	30.4	Very low	33.6	Very low	103 Å²	103	160.8 Å²	160.8	72%	0.72	81%	0.811	S	S	*	*			trans	-169.2	131.6	163.9	51.7	0	0	0	0	108.6
411	S	31.4	Very low	33.6	Very low	115 Å²	115	164 Å²	164	80%	0.804	81%	0.814	S	S	*	*			cis	69.1	97.1	40.4	85	0	0	0	0	113.8
412	S	32.3	Very low	32.9	Very low	117 Å²	117	163.4 Å²	163.4	82%	0.818	82%	0.818	S	S	*	*			trans	-126.9	103.4	-176.2	41.9	0	0	0	0	112.6
413	Q	31.7	Very low	32.6	Very low	201 Å²	201	159.3 Å²	159.3	94%	0.939	82%	0.818	S	S	*	*			trans	-76.6	154.7	156.3	-70.7	176.7	-47.1	0	0	109.3
414	K	32.6	Very low	33.4	Very low	209 Å²	209	158.8 Å²	158.8	91%	0.909	83%	0.828	S	S	*	*			trans	-117.8	136.6	171.1	-79.3	-172.3	173.6	-177.5	0	111.1
415	Q	30.1	Very low	33.4	Very low	203 Å²	203	154.2 Å²	154.2	95%	0.949	82%	0.823	S	S	*	*			trans	-139.3	165.9	167.6	-139	178.3	10.8	0	0	110
416	R	35.3	Very low	33.4	Very low	235 Å²	235	154.8 Å²	154.8	89%	0.887	82%	0.82	S	S	*	*			trans	-82.8	158.5	-165.3	-65.8	174	165.4	-173.6	-5.6	115.4
417	R	34.4	Very low	34.2	Very low	237 Å²	237	151 Å²	151	89%	0.894	81%	0.812	S	S	*	*			trans	-151.8	128.5	133.1	-97.4	165.5	-172.9	-164.3	-0.6	107.4
418	Y	31.1	Very low	34	Very low	220 Å²	220	145 Å²	145	86%	0.863	81%	0.806	S	S	*	*				68.7	140.2	84.5	-90.2	-85.7	0	0	0	113.9
419	S	38.8	Very low	34	Very low	89 Å²	89	145.6 Å²	145.6	62%	0.622	80%	0.804	S	S	*	*			cis	-130.7	-151.3	5.9	51.8	0	0	0	0	111.5
420	D	37.4	Very low	34.1	Very low	121 Å²	121	145.1 Å²	145.1	65%	0.647	80%	0.801	S	S	*	*			cis	-165.9	-179.4	3.9	-133.8	-41.5	0	0	0	114
421	H	34.9	Very low	34.1	Very low	173 Å²	173	143.9 Å²	143.9	80%	0.801	80%	0.797	S	S	*	*			trans	42.9	138.1	158.9	-65.1	100.5	0	0	0	121.6
422	A	31.3	Very low	33.8	Very low	100 Å²	100	149.3 Å²	149.3	83%	0.826	80%	0.802	S	S	*	*			cis	-153.5	170.2	-1.9	0	0	0	0	0	111.8
423	G	26.6	Very low	35	Very low	71 Å²	71	148.5 Å²	148.5	73%	0.732	79%	0.794	S	S	*	*			trans	-117.8	-150.3	-173.8	0	0	0	0	0	115.3
424	P	50.9	Low	35.1	Very low	131 Å²	131	148.1 Å²	148.1	85%	0.851	79%	0.789	S	S	*	*			cis	-95.6	-149.4	5.1	41.3	-37.9	0	0	0	113.6
425	A	31.7	Very low	34.9	Very low	82 Å²	82	148.6 Å²	148.6	68%	0.678	79%	0.785	S	S	*	*			cis	-153.7	169.7	4.4	0	0	0	0	0	109.3
426	I	33.2	Very low	34.9	Very low	155 Å²	155	143 Å²	143	80%	0.795	77%	0.769	S	S	*	*			cis	85.1	134.7	18.4	-55.5	169.8	0	0	0	114.6
427	P	47.3	Very low	34.7	Very low	114 Å²	114	139.5 Å²	139.5	74%	0.74	76%	0.762	S	S	*	*			cis	-113.4	145.5	-3.7	20.5	2.3	0	0	0	115.6
428	S	32.6	Very low	34.5	Very low	108 Å²	108	134.4 Å²	134.4	76%	0.755	76%	0.758	S	S	*	*				87	155.2	92.6	-149.3	0	0	0	0	114.6
429	V	30.4	Very low	34.3	Very low	135 Å²	135	128.3 Å²	128.3	82%	0.818	75%	0.747	S	S	*	*			cis	-152.7	176.1	30.9	-147.9	0	0	0	0	114.5
430	V	32.3	Very low	33.8	Very low	129 Å²	129	130.5 Å²	130.5	78%	0.782	76%	0.757	S	S	*	*			trans	-74.6	155.6	-176.6	169.3	0	0	0	0	115.4
431	A	30.2	Very low	33.5	Very low	77 Å²	77	128.3 Å²	128.3	64%	0.636	76%	0.756	S	S	*	*			cis	116.1	135.2	-3.7	0	0	0	0	0	119.6
432	Y	25.5	Very low	33.2	Very low	229 Å²	229	127.3 Å²	127.3	90%	0.898	76%	0.756	S	S	*	*			trans	64.4	169.7	174.5	-73.7	-58.2	0	0	0	118.2
433	P	57.5	Low	33.3	Very low	100 Å²	100	127.5 Å²	127.5	65%	0.649	75%	0.752	S	S	*	*			cis	-142.4	179.6	-45	41.5	-24.4	0	0	0	117.5
434	K	32.5	Very low	33.7	Very low	192 Å²	192	130.2 Å²	130.2	84%	0.835	75%	0.749	S	S	*	*			trans	82.1	122.2	141.2	-90	174.3	-179.3	174.5	0	125.9
435	R	28.3	Very low	33	Very low	219 Å²	219	130.4 Å²	130.4	83%	0.826	74%	0.743	S	S	*	*				90.5	141.9	118	-156	-154.7	-177.7	178.8	-0.2	123.4
436	S	31	Very low	33.3	Very low	87 Å²	87	133.3 Å²	133.3	61%	0.608	74%	0.74	S	S	*	*			trans	76	158.9	153.6	11	0	0	0	0	119
437	Q	30.6	Very low	33.4	Very low	161 Å²	161	133.3 Å²	133.3	75%	0.752	74%	0.737	S	S	*	*			cis	-171.5	166.6	-23.4	-122.6	177	-26.6	0	0	110.5
438	T	29.4	Very low	32.7	Very low	130 Å²	130	135.6 Å²	135.6	80%	0.798	74%	0.742	S	S	*	*			trans	61.6	161.5	157.4	43.4	0	0	0	0	119.5
439	S	28.2	Very low	32.7	Very low	91 Å²	91	132.8 Å²	132.8	64%	0.636	73%	0.731	S	S	*	*			cis	-172.2	178.2	-24.1	53.9	0	0	0	0	110.9
440	T	28.6	Very low	33	Very low	135 Å²	135	134.4 Å²	134.4	83%	0.828	73%	0.733	S	S	*	*			trans	64.9	157	162.1	49.1	0	0	0	0	119.6
441	A	30.7	Very low	32.9	Very low	76 Å²	76	133.7 Å²	133.7	63%	0.628	73%	0.734	S	S	*	*			cis	-170.7	170.8	-26.2	0	0	0	0	0	112.3
442	D	28.5	Very low	33.1	Very low	151 Å²	151	134.9 Å²	134.9	81%	0.807	74%	0.737	S	S	*	*			trans	73.5	131.9	152.6	-54.6	-23.7	0	0	0	126.3
443	S	33.3	Very low	33.4	Very low	105 Å²	105	135 Å²	135	73%	0.734	74%	0.736	S	S	*	*			trans	64	148.5	136.5	-78.9	0	0	0	0	123.6
444	D	34.5	Very low	32.3	Very low	127 Å²	127	139.4 Å²	139.4	68%	0.679	75%	0.745	S	S	*	*			cis	-165.9	167.7	-9.9	-134.2	-57	0	0	0	114.7
445	L	37.1	Very low	32.4	Very low	136 Å²	136	134.8 Å²	134.8	71%	0.712	74%	0.737	S	S	*	*			trans	64.4	170.9	168.7	-56.3	-174.2	0	0	0	116.4
446	K	37.3	Very low	32.6	Very low	143 Å²	143	130 Å²	130	62%	0.622	74%	0.737	S	S	*	*			cis	-171.4	178.8	-18.7	-105.9	-177.9	-178.9	-68.3	0	106.6
447	E	35.5	Very low	32.7	Very low	155 Å²	155	129.1 Å²	129.1	72%	0.724	74%	0.742	S	S	*	*			cis	-176.2	149.7	-37.4	-105.5	167.6	-153.7	0	0	105.6
448	D	33.1	Very low	32.9	Very low	161 Å²	161	127.8 Å²	127.8	86%	0.861	75%	0.75	S	S	*	*			cis	-137.1	-126.9	-13.9	-172.2	30.1	0	0	0	107.2
449	G	31.7	Very low	33.2	Very low	49 Å²	49	125.8 Å²	125.8	51%	0.505	75%	0.747	S	S	.	*			cis	169	155.7	-8.7	0	0	0	0	0	115.1
450	I	36.8	Very low	33.5	Very low	170 Å²	170	128.4 Å²	128.4	87%	0.872	76%	0.759	S	S	*	*			trans	66	131.5	161.3	-58.8	176.4	0	0	0	117
451	S	30.5	Very low	33.6	Very low	114 Å²	114	125.5 Å²	125.5	80%	0.797	76%	0.756	S	S	*	*			cis	-151.7	175.1	4.3	-147.7	0	0	0	0	113.1
452	S	33.5	Very low	33.6	Very low	102 Å²	102	126 Å²	126	71%	0.713	77%	0.768	S	S	*	*			trans	-154.8	159.1	176	67	0	0	0	0	115
453	R	32.4	Very low	33.9	Very low	230 Å²	230	129.5 Å²	129.5	87%	0.868	78%	0.776	S	S	*	*			trans	-170.7	133.3	158	-94.9	135	-163.8	-126.9	4	108.9
454	K	35.3	Very low	33.7	Very low	193 Å²	193	127.7 Å²	127.7	84%	0.839	77%	0.774	S	S	*	*				81.2	143	58	-76.3	-172	177.1	-174.1	0	113.3
455	S	34.1	Very low	33.7	Very low	95 Å²	95	130.2 Å²	130.2	66%	0.664	79%	0.786	S	S	*	*			cis	-175.3	176.2	-8.2	49.8	0	0	0	0	112.7
456	S	33.4	Very low	33.6	Very low	119 Å²	119	127.8 Å²	127.8	83%	0.832	79%	0.785	S	S	*	*			trans	67.1	152.3	152.5	44	0	0	0	0	120.6
457	G	31.9	Very low	33.9	Very low	68 Å²	68	126.7 Å²	126.7	70%	0.701	79%	0.793	S	S	*	*			cis	161	153.9	-11.6	0	0	0	0	0	116
458	S	36.1	Very low	33.7	Very low	134 Å²	134	123.9 Å²	123.9	94%	0.937	80%	0.796	S	S	*	*			trans	69.1	163	167.5	-51.8	0	0	0	0	117.7
459	A	34.1	Very low	33.9	Very low	88 Å²	88	122 Å²	122	73%	0.727	80%	0.796	S	S	*	*			cis	-152.3	170.3	7.8	0	0	0	0	0	114
460	V	34.4	Very low	34.3	Very low	146 Å²	146	125.4 Å²	125.4	89%	0.885	81%	0.808	S	S	*	*			trans	16.2	140.9	150.8	-175.3	0	0	0	0	120.2
461	G	31.4	Very low	34	Very low	74 Å²	74	125.9 Å²	125.9	76%	0.763	81%	0.809	S	S	*	*			cis	140.9	140.8	-0	0	0	0	0	0	113
462	G	30.7	Very low	34.2	Very low	85 Å²	85	128.6 Å²	128.6	88%	0.876	81%	0.814	S	S	*	*			trans	152.3	141.7	172.9	0	0	0	0	0	117.9
463	K	34.5	Very low	34	Very low	225 Å²	225	126.9 Å²	126.9	98%	0.978	81%	0.812	S	S	*	*			trans	-58.9	150.1	-174.4	-58.3	169.3	177	175.8	0	116.7
464	G	29.7	Very low	33.9	Very low	68 Å²	68	124.1 Å²	124.1	70%	0.701	82%	0.815	S	S	*	*			trans	142.5	105.4	132.2	0	0	0	0	0	120.8
465	I	34.8	Very low	33.9	Very low	180 Å²	180	119.5 Å²	119.5	92%	0.923	81%	0.812	S	S	*	*			trans	67.6	150	146.9	-55	177	0	0	0	118
466	A	33.5	Very low	33.9	Very low	84 Å²	84	120.5 Å²	120.5	69%	0.694	82%	0.82	S	S	*	*			trans	-98.9	173.8	-178.4	0	0	0	0	0	111
467	P	44.2	Very low	34	Very low	121 Å²	121	121.7 Å²	121.7	79%	0.786	82%	0.817	S	S	*	*			cis	-147.4	-168.3	22.5	45	-24.3	0	0	0	117.5
468	A	30.7	Very low	34.5	Very low	96 Å²	96	123.9 Å²	123.9	79%	0.793	82%	0.818	S	S	*	*			trans	76.3	143	157.4	0	0	0	0	0	119.5
469	S	37.9	Very low	34.4	Very low	122 Å²	122	124.9 Å²	124.9	85%	0.853	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-92.6	143.1	-175.8	-45.4	0	0	0	0	112.5
470	P	40.2	Very low	34.3	Very low	119 Å²	119	129.7 Å²	129.7	77%	0.773	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-87.7	151.3	166.4	34.8	-32.6	0	0	0	112
471	M	31.6	Very low	34.3	Very low	181 Å²	181	126.7 Å²	126.7	89%	0.892	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-100.2	145.5	160.3	-68.6	-143.3	73.5	0	0	110.4
472	L	34.8	Very low	34.6	Very low	170 Å²	170	130.6 Å²	130.6	89%	0.89	81%	0.812	S	S	*	*			trans	-105.5	151.1	163.1	-65.2	167.1	0	0	0	107.8
473	G	29.3	Very low	35	Very low	66 Å²	66	132.6 Å²	132.6	68%	0.68	80%	0.801	S	S	*	*			cis	153.1	113.3	0.4	0	0	0	0	0	109.1
474	N	30.1	Very low	35.4	Very low	173 Å²	173	128.1 Å²	128.1	93%	0.925	80%	0.795	S	S	*	*			trans	-83	144	-170.9	-71.8	4.9	0	0	0	113.1
475	A	34.6	Very low	35.7	Very low	95 Å²	95	133.2 Å²	133.2	79%	0.785	80%	0.801	S	S	*	*			trans	-146.7	151.9	154.8	0	0	0	0	0	107.3
476	S	34.9	Very low	35.6	Very low	117 Å²	117	135.3 Å²	135.3	82%	0.818	80%	0.797	S	S	*	*			cis	177.9	130.5	-17	-92.5	0	0	0	0	103.1
477	N	35.2	Very low	35.5	Very low	144 Å²	144	139.3 Å²	139.3	77%	0.77	80%	0.799	S	S	*	*			trans	-108.4	134.5	-170.2	174.6	46.7	0	0	0	112.3
478	P	42.3	Very low	35.1	Very low	113 Å²	113	143.2 Å²	143.2	73%	0.734	80%	0.803	S	S	*	*			trans	-126.1	88.7	165.6	36.9	-21.3	0	0	0	113.3
479	N	33.5	Very low	35	Very low	155 Å²	155	143.8 Å²	143.8	83%	0.829	80%	0.801	S	S	*	*			trans	-164.8	149.6	131	-109.2	-28.3	0	0	0	112.3
480	K	31.3	Very low	34.6	Very low	189 Å²	189	142.7 Å²	142.7	82%	0.822	79%	0.794	S	S	*	*			trans	-150.7	100.8	-172.2	-178.3	-161.4	172.4	-170.6	0	112.4
481	A	34.7	Very low	34.2	Very low	84 Å²	84	143.1 Å²	143.1	69%	0.694	79%	0.794	S	S	*	*			trans	-161.5	138.2	161.6	0	0	0	0	0	105.7
482	D	37.3	Very low	34.5	Very low	156 Å²	156	140.1 Å²	140.1	83%	0.834	79%	0.786	S	S	*	*			cis	-132.8	173.6	6.5	-76	-60.2	0	0	0	112.1
483	I	39.5	Very low	34.9	Very low	127 Å²	127	138.1 Å²	138.1	65%	0.651	78%	0.783	S	S	*	*			trans	-136.5	136.5	173.9	-55.9	171.3	0	0	0	108.6	E485	I483-E485 HydrophobicContact CG2-CG 4.21Å
484	P	43.3	Very low	35	Very low	131 Å²	131	140 Å²	140	85%	0.851	79%	0.786	S	S	*	*				-121.3	141.2	128.6	-5.4	25.7	0	0	0	113.1
485	E	36.1	Very low	35.1	Very low	174 Å²	174	137.5 Å²	137.5	81%	0.813	78%	0.782	S	S	*	*			trans	-83.9	164.6	179.7	-49.1	-177.5	145.3	0	0	113.6	I483	I483-E485 HydrophobicContact CG2-CG 4.21Å
486	R	32.1	Very low	35	Very low	224 Å²	224	140.1 Å²	140.1	85%	0.845	78%	0.783	S	S	*	*			trans	-160.6	123.4	130.6	-117.6	172.3	-176.7	-166.8	0.9	115.5
487	K	32.9	Very low	34.7	Very low	169 Å²	169	140.9 Å²	140.9	74%	0.735	78%	0.782	S	S	*	*			trans	50	119.9	149.5	-66.7	-179.7	178.2	-173.4	0	118.1
488	K	34.4	Very low	34.4	Very low	203 Å²	203	138.8 Å²	138.8	88%	0.883	79%	0.786	S	S	*	*				55.9	130.9	82.4	-67.7	-173	176.9	-176.5	0	112.6
489	S	28.5	Very low	33.9	Very low	107 Å²	107	139.6 Å²	139.6	75%	0.748	79%	0.794	S	S	*	*			cis	-154.8	170.6	30.4	52.4	0	0	0	0	115.7
490	S	31	Very low	33.7	Very low	100 Å²	100	135.9 Å²	135.9	70%	0.699	79%	0.792	S	S	*	*			trans	-3.6	156.1	152.3	64.8	0	0	0	0	120.6
491	T	31.4	Very low	33.7	Very low	128 Å²	128	130.9 Å²	130.9	79%	0.785	79%	0.794	S	S	*	*			cis	-156.9	164.1	27.3	-32.1	0	0	0	0	111.8
492	V	36.5	Very low	33.5	Very low	118 Å²	118	135 Å²	135	72%	0.715	80%	0.801	S	S	*	*			trans	-112.9	146.7	168.7	-173.8	0	0	0	0	109.6
493	P	43.5	Very low	33.2	Very low	128 Å²	128	134 Å²	134	83%	0.831	80%	0.801	S	S	*	*				-134.5	150.5	128.4	37	-27.7	0	0	0	113.3
494	S	31.6	Very low	32.9	Very low	106 Å²	106	138.9 Å²	138.9	74%	0.741	81%	0.811	S	S	*	*			trans	-102.9	153.8	-179.1	-50.3	0	0	0	0	112.3
495	S	33	Very low	32.3	Very low	120 Å²	120	143.9 Å²	143.9	84%	0.839	81%	0.813	S	S	*	*			trans	-164.9	159.1	144	44.4	0	0	0	0	113.1
496	N	31.1	Very low	31.9	Very low	150 Å²	150	141.3 Å²	141.3	80%	0.802	81%	0.805	S	S	*	*			trans	-70.8	165.4	-177.1	-54.3	-36.6	0	0	0	111
497	T	30	Very low	31.9	Very low	132 Å²	132	136.3 Å²	136.3	81%	0.81	80%	0.799	S	S	*	*				-173.1	159.4	63.4	44	0	0	0	0	115.4
498	A	28.1	Very low	31.8	Very low	101 Å²	101	138.1 Å²	138.1	84%	0.835	80%	0.803	S	S	*	*			trans	74.7	145.9	142.3	0	0	0	0	0	121.4
499	S	32	Very low	31.6	Very low	130 Å²	130	134 Å²	134	91%	0.909	80%	0.795	S	S	*	*			trans	-82.9	149.8	-171.7	-47.2	0	0	0	0	114.3
500	G	28.4	Very low	31.6	Very low	77 Å²	77	134.8 Å²	134.8	79%	0.794	80%	0.799	S	S	*	*			trans	-144.6	117.3	161.5	0	0	0	0	0	110.1
501	G	32.6	Very low	31.5	Very low	83 Å²	83	135 Å²	135	86%	0.856	80%	0.8	S	S	*	*			trans	-81.2	134.5	-178.6	0	0	0	0	0	112.2
502	M	30.9	Very low	31.4	Very low	170 Å²	170	137.7 Å²	137.7	84%	0.837	80%	0.804	S	S	*	*			trans	-138.9	112.2	176.8	-165.4	64.1	166.4	0	0	111.4	R504	M502-R504 PolarHBondContact O-N 2.88Å
503	T	31.2	Very low	31.1	Very low	137 Å²	137	143.7 Å²	143.7	84%	0.84	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-69.4	120.2	177.7	35.7	0	0	0	0	110.9
504	R	32.2	Very low	30.4	Very low	229 Å²	229	143.9 Å²	143.9	86%	0.864	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-82.6	124.3	-177.9	-69.3	-172.9	175	-165.1	-1.7	111.4	M502	M502-R504 PolarHBondContact O-N 2.88Å
505	R	30	Very low	30.3	Very low	235 Å²	235	145.3 Å²	145.3	89%	0.887	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-78.2	122.9	165.1	-66.1	179.1	174.1	115.4	-4.7	109	T507	R505-T507 PolarHBondContact O-N 3.27Å
506	N	28.9	Very low	30.3	Very low	121 Å²	121	144.4 Å²	144.4	65%	0.647	82%	0.817	S	S	*	*			trans	-93	96.5	174.8	-80.2	-8.2	0	0	0	111.2	Y508	N506-Y508 HydrophobicContact CB-CD2 4.4Å; N506-Y508 HydrophobicContact CB-CE2 4.11Å
507	T	32.1	Very low	30.3	Very low	119 Å²	119	144.3 Å²	144.3	73%	0.73	82%	0.817	S	S	*	*			trans	-120	91.4	164.4	-46	0	0	0	0	108.2	R505 V509	R505-T507 PolarHBondContact O-N 3.27Å; T507-V509 PolarHBondContact O-N 3.32Å
508	Y	30.7	Very low	30.4	Very low	207 Å²	207	150 Å²	150	81%	0.812	82%	0.823	S	S	*	*			trans	-76.7	89.2	-177.6	-78.3	-78.1	0	0	0	111.7	N506	N506-Y508 HydrophobicContact CB-CD2 4.4Å; N506-Y508 HydrophobicContact CB-CE2 4.11Å
509	V	30.2	Very low	30.4	Very low	117 Å²	117	153.5 Å²	153.5	71%	0.709	82%	0.822	S	S	*	*			trans	-81.8	132	157.4	179.3	0	0	0	0	107.7	T507 S511	T507-V509 PolarHBondContact O-N 3.32Å; V509-S511 PolarHBondContact O-N 3.21Å
510	C	27.5	Very low	30.4	Very low	123 Å²	123	152.6 Å²	152.6	83%	0.831	82%	0.815	S	S	*	*			trans	-80.3	100.5	173.7	-168	0	0	0	0	108.9	E512	C510-E512 PolarHBondContact O-N 3.13Å
511	S	29.7	Very low	30.5	Very low	105 Å²	105	154.5 Å²	154.5	73%	0.734	81%	0.811	S	S	*	*			trans	-64.6	124.7	177	-56.6	0	0	0	0	111.1	V509	V509-S511 PolarHBondContact O-N 3.21Å
512	E	29	Very low	30.4	Very low	184 Å²	184	157.4 Å²	157.4	86%	0.86	81%	0.806	S	S	*	*			trans	-65.9	153.6	167.6	-63.3	-179.1	127.4	0	0	110.5	C510	C510-E512 PolarHBondContact O-N 3.13Å
513	R	30.6	Very low	30.4	Very low	244 Å²	244	157.3 Å²	157.3	92%	0.921	80%	0.803	S	S	*	*			trans	-132.5	96.1	177	-153.1	179.9	-162.2	-161.6	4.2	109.3
514	T	29.6	Very low	30.3	Very low	132 Å²	132	158.7 Å²	158.7	81%	0.81	81%	0.806	S	S	*	*			trans	-83.8	140.9	177.7	41.8	0	0	0	0	111.3
515	T	28.9	Very low	30.2	Very low	135 Å²	135	151.1 Å²	151.1	83%	0.828	80%	0.799	S	S	*	*			trans	-152.5	103.2	170.5	50.7	0	0	0	0	110.9
516	A	31.8	Very low	30.2	Very low	102 Å²	102	148.6 Å²	148.6	84%	0.843	79%	0.794	S	S	*	*			trans	173.1	112.2	148.9	0	0	0	0	0	110.4
517	D	31.8	Very low	30.3	Very low	148 Å²	148	149.4 Å²	149.4	79%	0.791	79%	0.794	S	S	*	*			trans	-82.5	158.9	175.6	-61.5	-80.2	0	0	0	113.6
518	R	31.4	Very low	30.2	Very low	250 Å²	250	150.5 Å²	150.5	94%	0.943	80%	0.796	S	S	*	*			trans	-158.6	151.5	139.2	-110	164.2	-171.8	-163.4	-0.3	111.7
519	H	29.8	Very low	30.2	Very low	175 Å²	175	145.5 Å²	145.5	81%	0.81	79%	0.791	S	S	*	*			trans	-102.1	141.1	-159.9	-63.9	-108	0	0	0	115.7
520	S	30.4	Very low	30.2	Very low	111 Å²	111	146.6 Å²	146.6	78%	0.776	80%	0.798	S	S	*	*			trans	-169.2	114.3	138.2	51.3	0	0	0	0	108.1
521	V	30.3	Very low	30.6	Very low	117 Å²	117	148.2 Å²	148.2	71%	0.709	80%	0.797	S	S	*	*				83.8	121.8	59.7	171.9	0	0	0	0	112.9
522	I	32.5	Very low	31.4	Very low	144 Å²	144	149 Å²	149	74%	0.738	80%	0.799	S	S	*	*			trans	72.3	138.5	168.5	-73.4	168.1	0	0	0	115.4
523	Q	30.1	Very low	31.5	Very low	168 Å²	168	146.1 Å²	146.1	79%	0.785	79%	0.79	S	S	*	*			cis	-156.1	-174.6	-5.8	-121.9	175.7	10	0	0	113.9
524	N	28.1	Very low	31.6	Very low	166 Å²	166	140.5 Å²	140.5	89%	0.888	77%	0.774	S	S	*	*			trans	-54.7	160.7	-174.6	-68.9	-22.6	0	0	0	120.4
525	G	30.1	Very low	31.7	Very low	70 Å²	70	144.7 Å²	144.7	72%	0.722	78%	0.775	S	S	*	*			trans	148	125	163.1	0	0	0	0	0	110.1
526	K	31	Very low	31.8	Very low	183 Å²	183	144.2 Å²	144.2	80%	0.796	77%	0.772	S	S	*	*			cis	53.4	126.2	37.7	-77.3	-169.1	161.3	-138.1	0	112.4
527	E	30.1	Very low	32.4	Very low	138 Å²	138	144.9 Å²	144.9	65%	0.645	77%	0.768	S	S	*	*			cis	-156.8	-178.5	12.4	-132.3	154.8	-144.4	0	0	113.1
528	N	30	Very low	32.4	Very low	141 Å²	141	144.3 Å²	144.3	75%	0.754	77%	0.77	S	S	*	*			trans	-11.4	129.2	168.1	-62.2	-20.4	0	0	0	118.3
529	S	31.2	Very low	32.5	Very low	103 Å²	103	136 Å²	136	72%	0.72	75%	0.754	S	S	*	*				63.5	110	73.5	-172.8	0	0	0	0	115.8
530	T	31	Very low	32.8	Very low	139 Å²	139	132.9 Å²	132.9	85%	0.853	75%	0.752	S	S	*	*				-178.3	162.1	125.3	23	0	0	0	0	112.5
531	I	35.8	Very low	32.9	Very low	158 Å²	158	132.6 Å²	132.6	81%	0.81	75%	0.746	S	S	*	*			trans	-115.3	136.5	174.1	-64.4	162.6	0	0	0	107.6
532	P	45.3	Very low	33.3	Very low	120 Å²	120	134.7 Å²	134.7	78%	0.779	75%	0.747	S	S	*	*				-144.7	115.1	120.4	32	-14.7	0	0	0	112.3
533	D	31	Very low	33.5	Very low	124 Å²	124	133 Å²	133	66%	0.663	75%	0.749	S	S	*	*				83.8	142.6	87	-164.1	33.6	0	0	0	116.3
534	Q	32.5	Very low	33.8	Very low	126 Å²	126	132.6 Å²	132.6	59%	0.589	75%	0.75	S	S	*	*			trans	77.3	130.8	155.2	-99	176.6	85.3	0	0	124.8
535	R	32.1	Very low	34	Very low	220 Å²	220	129.6 Å²	129.6	83%	0.83	74%	0.742	S	S	*	*			trans	96.9	121.5	145.8	-67.3	167.8	-164.4	-146.6	0.5	121.6
536	T	32.2	Very low	34.1	Very low	125 Å²	125	131.5 Å²	131.5	77%	0.767	75%	0.745	S	S	*	*			trans	-77.4	161	158.8	50.6	0	0	0	0	110.5
537	P	43.4	Very low	34.1	Very low	117 Å²	117	127.6 Å²	127.6	76%	0.76	75%	0.746	S	S	*	*				-132.7	167.8	73.2	16.3	9.7	0	0	0	112.9
538	V	31.8	Very low	34.2	Very low	136 Å²	136	125.7 Å²	125.7	82%	0.824	75%	0.754	S	S	*	*				63.8	123.5	54.9	-171.7	0	0	0	0	112.4
539	A	33.8	Very low	34.8	Very low	75 Å²	75	125.6 Å²	125.6	62%	0.62	76%	0.759	S	S	*	*			cis	-167.8	174.8	-12.9	0	0	0	0	0	110.9
540	S	35.3	Very low	35.5	Very low	109 Å²	109	127 Å²	127	76%	0.762	77%	0.765	S	S	*	*			trans	65.3	159	152.6	46.1	0	0	0	0	119
541	T	34.4	Very low	35.7	Very low	105 Å²	105	127.1 Å²	127.1	64%	0.644	76%	0.761	S	S	*	*			cis	-157.1	-172.7	-1.4	5.8	0	0	0	0	111.6
542	H	38	Very low	35.7	Very low	161 Å²	161	129 Å²	129	75%	0.745	76%	0.758	S	S	*	*			trans	85.3	125.6	164.7	-41.4	-71.1	0	0	0	114.8
543	S	36.7	Very low	35.3	Very low	110 Å²	110	129.3 Å²	129.3	77%	0.769	75%	0.752	S	S	*	*			cis	76.7	135.2	33.4	-44	0	0	0	0	112.3
544	I	36.6	Very low	35.4	Very low	159 Å²	159	135 Å²	135	82%	0.815	76%	0.764	S	S	*	*			cis	-143.2	163.7	27.2	-70.4	175	0	0	0	112.1
545	S	32.8	Very low	35.6	Very low	103 Å²	103	138.3 Å²	138.3	72%	0.72	78%	0.777	S	S	*	*			trans	-20.8	166.4	161	-42.5	0	0	0	0	119.9
546	S	31.8	Very low	36.5	Very low	110 Å²	110	133.8 Å²	133.8	77%	0.769	78%	0.776	S	S	*	*			cis	-167.1	163.9	36.6	-43.8	0	0	0	0	116.4
547	A	30.4	Very low	36.8	Very low	100 Å²	100	139.9 Å²	139.9	83%	0.826	79%	0.785	S	S	*	*			trans	81.8	156	138.1	0	0	0	0	0	123.6
548	A	31.4	Very low	36.4	Very low	98 Å²	98	137.7 Å²	137.7	81%	0.81	78%	0.783	S	S	*	*			trans	90.3	106.8	161	0	0	0	0	0	120.6
549	T	42.5	Very low	36.5	Very low	139 Å²	139	138 Å²	138	85%	0.853	79%	0.785	S	S	*	*			trans	-105.5	143.1	152.7	50	0	0	0	0	110.2
550	P	47.8	Very low	36.5	Very low	133 Å²	133	138.3 Å²	138.3	86%	0.864	79%	0.788	S	S	*	*			trans	-134.5	-170.5	139.4	37.6	-24.9	0	0	0	112.8
551	D	34.4	Very low	36.4	Very low	142 Å²	142	138.6 Å²	138.6	76%	0.759	79%	0.79	S	S	*	*			trans	-128.2	164.3	-154.7	-172.7	24.1	0	0	0	114.3
552	R	34.7	Very low	36.4	Very low	198 Å²	198	145.1 Å²	145.1	75%	0.747	80%	0.803	S	S	*	*			trans	69.4	125.5	154.2	-89.7	174.7	151.8	-144.6	-6.6	124.3
553	I	37.2	Very low	36.2	Very low	126 Å²	126	142 Å²	142	65%	0.646	80%	0.799	S	S	*	*			trans	76.3	122.5	134.4	-61.3	161.6	0	0	0	120.9
554	R	33.5	Very low	36	Very low	243 Å²	243	142.8 Å²	142.8	92%	0.917	80%	0.8	S	S	*	*				-164.9	155.7	121.7	-107.5	175.6	-167.1	-156.5	3.2	114.3
555	F	36.9	Very low	35.7	Very low	196 Å²	196	143.1 Å²	143.1	86%	0.86	80%	0.795	S	S	*	*			trans	-110.6	170.7	172.1	-88.4	-82.3	0	0	0	110.4
556	P	49.9	Very low	36	Very low	125 Å²	125	146.6 Å²	146.6	81%	0.812	80%	0.8	S	S	*	*				-135	171.7	112.5	37.1	-27.1	0	0	0	115.6
557	R	39.3	Very low	35.8	Very low	253 Å²	253	144.7 Å²	144.7	96%	0.955	80%	0.797	S	S	*	*			trans	-80.3	163.6	175	-71.7	168.4	162.5	155.1	-8.3	111.2
558	G	34.3	Very low	35.9	Very low	70 Å²	70	149 Å²	149	72%	0.722	80%	0.801	S	S	*	*			cis	-169.2	-151	2.2	0	0	0	0	0	108.6
559	T	35.4	Very low	37.1	Very low	142 Å²	142	149.4 Å²	149.4	87%	0.871	80%	0.795	S	S	*	*			cis	-152	-164.1	0.2	53.1	0	0	0	0	106.8
560	A	33.4	Very low	36.7	Very low	83 Å²	83	153.4 Å²	153.4	69%	0.686	79%	0.794	S	S	*	*			cis	-155.7	155.9	2.4	0	0	0	0	0	112.9
561	S	33.8	Very low	36.1	Very low	115 Å²	115	153.4 Å²	153.4	80%	0.804	78%	0.783	S	S	*	*			trans	39	131.1	142.1	-56.7	0	0	0	0	125.9
562	R	34.1	Very low	35.9	Very low	242 Å²	242	157.1 Å²	157.1	91%	0.913	79%	0.786	S	S	*	*			trans	82.9	111.5	169.6	-62	-170	172.6	-152.1	-2.5	115.3
563	S	33.7	Very low	35.7	Very low	95 Å²	95	158.6 Å²	158.6	66%	0.664	79%	0.791	S	S	*	*			cis	67.8	130.7	24.3	-153.1	0	0	0	0	113.5
564	T	32.5	Very low	35.3	Very low	127 Å²	127	158.8 Å²	158.8	78%	0.779	80%	0.799	S	S	*	*			cis	-122.7	159.5	33.9	58.1	0	0	0	0	113.8
565	F	30.7	Very low	35.2	Very low	165 Å²	165	151.1 Å²	151.1	72%	0.724	79%	0.787	S	S	*	*			cis	69	141.4	39.5	-100	-120.2	0	0	0	114.4
566	H	37.9	Very low	34.9	Very low	177 Å²	177	147.8 Å²	147.8	82%	0.819	78%	0.783	S	S	*	*			cis	-113.8	-161.6	3.7	-63.1	-120	0	0	0	110.5
567	G	28.5	Very low	33.9	Very low	69 Å²	69	151.8 Å²	151.8	71%	0.711	78%	0.784	S	S	*	*			cis	-173.4	168.5	-1.8	0	0	0	0	0	112.1
568	Q	32.4	Very low	33.5	Very low	192 Å²	192	146.4 Å²	146.4	90%	0.897	77%	0.774	S	S	*	*			trans	-124.6	-146.8	179.3	-67.6	-155.6	3.6	0	0	114.2
569	P	56.7	Low	33.4	Very low	105 Å²	105	145.9 Å²	145.9	68%	0.682	77%	0.769	S	S	*	*				-127.1	167.1	-108.3	40.1	-23.1	0	0	0	116
570	R	34.6	Very low	34.6	Very low	223 Å²	223	145.1 Å²	145.1	84%	0.842	77%	0.766	S	S	*	*			trans	-174.8	137.8	147.6	-113	173.5	163.9	135.8	2	119.4
571	E	33.3	Very low	35.3	Very low	134 Å²	134	146.9 Å²	146.9	63%	0.626	77%	0.77	S	S	*	*			trans	34.1	117.4	133.5	-66.8	-178.4	88.1	0	0	125.3
572	R	30.6	Very low	35.2	Very low	219 Å²	219	146 Å²	146	83%	0.826	77%	0.77	S	S	*	*				76.2	109.1	111.2	-163.3	-174.3	-162.5	-159.3	5.4	122.6
573	R	30.4	Very low	35.1	Very low	229 Å²	229	139.9 Å²	139.9	86%	0.864	77%	0.765	S	S	*	*			trans	168.9	126.5	138.4	-94.3	169.3	178.4	-174.2	-0.2	109.7
574	T	29.3	Very low	35.7	Very low	130 Å²	130	141.5 Å²	141.5	80%	0.798	77%	0.773	S	S	*	*				55.4	133.6	84.8	64.5	0	0	0	0	115
575	A	31.8	Very low	35.5	Very low	82 Å²	82	140.7 Å²	140.7	68%	0.678	77%	0.772	S	S	*	*			cis	-165	172.2	13.8	0	0	0	0	0	116
576	T	29.7	Very low	35.6	Very low	127 Å²	127	140 Å²	140	78%	0.779	78%	0.775	S	S	*	*			trans	70.5	139.4	143.2	39.5	0	0	0	0	125.2
577	Y	30.1	Very low	35.1	Very low	208 Å²	208	137.4 Å²	137.4	82%	0.816	78%	0.777	S	S	*	*			trans	68.3	142.5	153.5	-94.2	-137.2	0	0	0	117.9
578	N	30	Very low	35.3	Very low	141 Å²	141	140.6 Å²	140.6	75%	0.754	77%	0.773	S	S	*	*			cis	-151.2	179	12.7	-149	-7.7	0	0	0	113
579	G	31.7	Very low	35	Very low	59 Å²	59	139.1 Å²	139.1	61%	0.608	77%	0.766	S	S	*	*			trans	-92.4	-174.8	-172.4	0	0	0	0	0	118.8
580	P	60.5	Low	33.8	Very low	125 Å²	125	137.1 Å²	137.1	81%	0.812	76%	0.758	S	S	*	*			trans	-91.7	-174.9	-170.4	39.8	-38.8	0	0	0	114.1
581	P	49.1	Very low	33.8	Very low	120 Å²	120	132.8 Å²	132.8	78%	0.779	76%	0.757	S	S	*	*				-152.7	166.5	104.9	41.1	-25	0	0	0	118.4
582	A	32.2	Very low	34.6	Very low	97 Å²	97	131.8 Å²	131.8	80%	0.802	76%	0.762	S	S	*	*			trans	68.6	144.5	142	0	0	0	0	0	123.7
583	S	32	Very low	34.5	Very low	114 Å²	114	128.2 Å²	128.2	80%	0.797	76%	0.759	S	S	*	*			trans	-115.7	160	161.8	-43.2	0	0	0	0	109.9
584	P	45	Very low	34.4	Very low	129 Å²	129	121.6 Å²	121.6	84%	0.838	75%	0.748	S	S	*	*			trans	-117.4	179.8	152.2	36.8	-27.1	0	0	0	112.6
585	S	28.3	Very low	34.5	Very low	110 Å²	110	123.4 Å²	123.4	77%	0.769	75%	0.747	S	S	*	*			trans	-125.1	153.4	-162.9	-55.4	0	0	0	0	115
586	L	32.4	Very low	34.3	Very low	150 Å²	150	125.3 Å²	125.3	79%	0.785	75%	0.75	S	S	*	*			trans	40.1	136.6	144	-68.5	167.8	0	0	0	122.4
587	S	28	Very low	34.3	Very low	122 Å²	122	130.3 Å²	130.3	85%	0.853	76%	0.755	S	S	*	*			trans	-151.1	162.4	154.4	60.8	0	0	0	0	112.8
588	H	32.1	Very low	34.3	Very low	136 Å²	136	125.2 Å²	125.2	63%	0.63	75%	0.75	S	S	*	*			trans	-155.3	156.8	-157	-82.6	-107.3	0	0	0	110.3
589	E	27.6	Very low	34.7	Very low	161 Å²	161	129.7 Å²	129.7	75%	0.752	76%	0.756	S	S	*	*			cis	-161.7	156.3	-12.1	-129.3	-173.9	-72.7	0	0	113.5
590	A	31.7	Very low	34.7	Very low	63 Å²	63	130 Å²	130	52%	0.521	76%	0.759	S	S	.	*			trans	47.3	127.4	136.8	0	0	0	0	0	125.6
591	T	33.8	Very low	33.5	Very low	132 Å²	132	129.1 Å²	129.1	81%	0.81	76%	0.756	S	S	*	*			trans	65.3	-171.5	135.2	64.9	0	0	0	0	118.1
592	P	49.5	Very low	32.9	Very low	113 Å²	113	129.2 Å²	129.2	73%	0.734	76%	0.755	S	S	*	*			cis	-106.4	-150.2	-23.6	14.4	10.3	0	0	0	111.8
593	L	29.9	Very low	33	Very low	145 Å²	145	130.4 Å²	130.4	76%	0.759	75%	0.747	S	S	*	*			cis	-130.4	176.3	6.8	-85.7	89.6	0	0	0	109.4
594	S	28.1	Very low	33.1	Very low	90 Å²	90	132.3 Å²	132.3	63%	0.629	75%	0.748	S	S	*	*			cis	84.7	137.9	36.2	126.1	0	0	0	0	115.7
595	Q	31.2	Very low	32.5	Very low	168 Å²	168	134.7 Å²	134.7	79%	0.785	75%	0.745	S	S	*	*			cis	-169	-169.9	-2.6	-132.9	-173.8	47.3	0	0	113.4
596	T	27.7	Very low	32.5	Very low	121 Å²	121	134.7 Å²	134.7	74%	0.742	75%	0.745	S	S	*	*			trans	86.4	148.2	166.7	84.3	0	0	0	0	117.2
597	R	29	Very low	32.6	Very low	233 Å²	233	137 Å²	137	88%	0.879	75%	0.749	S	S	*	*			cis	-155.9	152.2	5.8	-144.1	169.6	-170.9	-172.4	3.8	113.3
598	S	31.1	Very low	32.7	Very low	101 Å²	101	139.2 Å²	139.2	71%	0.706	75%	0.75	S	S	*	*			trans	66.7	128.5	161.9	-173.4	0	0	0	0	116.9
599	R	37.7	Very low	32.6	Very low	234 Å²	234	138.7 Å²	138.7	88%	0.883	76%	0.757	S	S	*	*			cis	-159.1	171.5	5.6	-123.6	173.9	178	156.7	-1.7	107.6
600	G	31.8	Very low	32.7	Very low	65 Å²	65	137 Å²	137	67%	0.67	76%	0.763	S	S	*	*			cis	98.6	112.6	6.3	0	0	0	0	0	112.4
601	S	35.7	Very low	32.6	Very low	108 Å²	108	143.6 Å²	143.6	76%	0.755	78%	0.78	S	S	*	*			cis	-141.3	-154.6	12.8	62.8	0	0	0	0	110.7
602	T	35.7	Very low	32.3	Very low	122 Å²	122	145.5 Å²	145.5	75%	0.748	78%	0.784	S	S	*	*			cis	-129.7	-171.3	37.7	56	0	0	0	0	113.7
603	N	34	Very low	31.3	Very low	121 Å²	121	146.1 Å²	146.1	65%	0.647	79%	0.786	S	S	*	*			trans	-134.9	-169.9	175	-58	-63.9	0	0	0	108.7	F605	N603-F605 HydrophobicContact CB-CD2 4.19Å
604	L	35.3	Very low	31.4	Very low	155 Å²	155	150.8 Å²	150.8	81%	0.812	79%	0.794	S	S	*	*			cis	-141.1	152.7	35.7	-85.7	84.2	0	0	0	110.3
605	F	31.4	Very low	31.4	Very low	178 Å²	178	158.2 Å²	158.2	78%	0.781	81%	0.808	S	S	*	*				59.3	142.8	66.9	-67	-69	0	0	0	114.4	N603	N603-F605 HydrophobicContact CB-CD2 4.19Å
606	S	29.5	Very low	31.2	Very low	110 Å²	110	157.6 Å²	157.6	77%	0.769	81%	0.81	S	S	*	*			cis	-150.6	-179.7	23.2	63.8	0	0	0	0	114.5
607	K	34.5	Very low	31.2	Very low	199 Å²	199	160.1 Å²	160.1	87%	0.865	82%	0.816	S	S	*	*			trans	-95.2	157.3	171.9	-61	173.4	-179.7	173	0	111
608	L	29.2	Very low	31	Very low	168 Å²	168	153.6 Å²	153.6	88%	0.88	81%	0.806	S	S	*	*			trans	-152.2	160.9	150.6	-118.8	157.4	0	0	0	112
609	T	31	Very low	30.7	Very low	126 Å²	126	156.8 Å²	156.8	77%	0.773	81%	0.807	S	S	*	*			trans	-138.6	147.1	-176.1	54.2	0	0	0	0	110.5
610	S	28.9	Very low	30.2	Very low	126 Å²	126	155.6 Å²	155.6	88%	0.881	80%	0.803	S	S	*	*			trans	-165.4	169.1	159.7	55.7	0	0	0	0	111
611	K	30.5	Very low	29.9	Very low	201 Å²	201	162.9 Å²	162.9	87%	0.874	82%	0.816	S	S	*	*			trans	-110.7	151.3	-175.6	-52.8	166.1	-176.9	170.3	0	109.8
612	L	27.1	Very low	29.4	Very low	171 Å²	171	164.5 Å²	164.5	90%	0.895	82%	0.815	S	S	*	*			trans	-147.4	174.1	140	-150.2	47.9	0	0	0	112.2
613	T	27.9	Very low	29	Very low	127 Å²	127	168.5 Å²	168.5	78%	0.779	82%	0.822	S	S	*	*			trans	-103.1	163	-150.6	30.9	0	0	0	0	115.5
614	R	31.6	Very low	28.7	Very low	242 Å²	242	174 Å²	174	91%	0.913	83%	0.834	S	S	*	*			trans	-56.6	142.5	165.3	-63.2	177.7	177.2	-179.6	-1.8	111
615	R	29	Very low	28.2	Very low	246 Å²	246	174.5 Å²	174.5	93%	0.928	84%	0.836	S	S	*	*			trans	-138.4	121	148.4	-116.7	176	175.5	147	-0.7	109.3
616	N	26	Very low	28.8	Very low	155 Å²	155	171 Å²	171	83%	0.829	83%	0.831	S	S	*	*			trans	-75.9	137.2	165.4	-87.9	-4.6	0	0	0	108.4
617	M	27.6	Very low	28.5	Very low	174 Å²	174	172.8 Å²	172.8	86%	0.857	84%	0.838	S	S	*	*			trans	-134.9	124.7	142.5	-75.1	-60.3	-84.5	0	0	108
618	S	25.2	Very low	28.2	Very low	96 Å²	96	170.8 Å²	170.8	67%	0.671	83%	0.832	S	S	*	*			trans	-98.1	147.3	163.8	178.5	0	0	0	0	107.5
619	F	26.1	Very low	28.1	Very low	168 Å²	168	172.5 Å²	172.5	74%	0.737	83%	0.828	S	S	*	*			trans	-179.7	109.7	142.4	-85.1	-51.9	0	0	0	107.9
620	R	26	Very low	28	Very low	210 Å²	210	173.5 Å²	173.5	79%	0.792	82%	0.824	S	S	*	*				60.2	97.7	101.8	-70.5	-170.8	-177.2	171.3	-0.9	114.7
621	F	25.3	Very low	28	Very low	218 Å²	218	176.9 Å²	176.9	96%	0.956	82%	0.817	S	S	*	*			trans	-59	141.3	157	-100.8	-102.5	0	0	0	111
622	I	26.1	Very low	27.8	Very low	142 Å²	142	174.6 Å²	174.6	73%	0.728	81%	0.814	S	S	*	*			trans	-117.4	124.8	167.4	-66.8	178	0	0	0	108.1
623	K	27.9	Very low	27.8	Very low	206 Å²	206	169.6 Å²	169.6	90%	0.896	81%	0.805	S	S	*	*			trans	-74.8	137.1	166.9	-79.7	-174.6	170.8	-173.1	0	109.8
624	R	26	Very low	27.8	Very low	236 Å²	236	175.1 Å²	175.1	89%	0.891	81%	0.811	S	S	*	*			trans	-144.1	139.6	153.7	-79.1	-162.8	173.2	178	-2.3	112.6
625	L	25.2	Very low	27.6	Very low	166 Å²	166	173.7 Å²	173.7	87%	0.869	81%	0.807	S	S	*	*			trans	-174.6	158.6	172.1	-100.6	165	0	0	0	104
626	P	44	Very low	27.6	Very low	104 Å²	104	171.2 Å²	171.2	68%	0.675	81%	0.806	S	S	*	*			cis	-126.1	-173.2	-12.3	42.4	-28	0	0	0	112.7
627	T	24.3	Very low	27.6	Very low	148 Å²	148	167.2 Å²	167.2	91%	0.908	80%	0.802	S	S	*	*			trans	-159.9	162.9	151.7	16.1	0	0	0	0	110.4
628	E	27.3	Very low	27.6	Very low	156 Å²	156	164.7 Å²	164.7	73%	0.729	80%	0.801	S	S	*	*			trans	-126.5	-177.7	-165.6	-60.9	179	109.1	0	0	114.2
629	Y	27.7	Very low	27.7	Very low	204 Å²	204	164.4 Å²	164.4	80%	0.8	80%	0.799	S	S	*	*			trans	70.9	150.3	165.9	-65.1	-70.9	0	0	0	117.4
630	E	27.7	Very low	27.9	Very low	147 Å²	147	167 Å²	167	69%	0.687	80%	0.804	S	S	*	*			cis	-145.5	144.2	-7	-110.7	-163.2	123	0	0	107.3
631	R	29.7	Very low	27.9	Very low	197 Å²	197	164.4 Å²	164.4	74%	0.743	81%	0.806	S	S	*	*				88.3	132.2	76	-160.1	-175.1	-174	174.2	5	116.7
632	N	26.8	Very low	28.2	Very low	153 Å²	153	160.5 Å²	160.5	82%	0.818	80%	0.8	S	S	*	*			trans	70.1	149.8	175.5	-55.9	-30.3	0	0	0	117.5
633	G	27	Very low	28.3	Very low	67 Å²	67	159.4 Å²	159.4	69%	0.691	80%	0.804	S	S	*	*			cis	158.6	138.2	-17.4	0	0	0	0	0	115.9
634	R	28.1	Very low	28.4	Very low	242 Å²	242	154.4 Å²	154.4	91%	0.913	80%	0.802	S	S	*	*			trans	72.8	155.7	170.7	-54.7	-166.8	171.1	-176.4	-2.8	117.5
635	Y	27.4	Very low	28.9	Very low	212 Å²	212	152.5 Å²	152.5	83%	0.831	80%	0.803	S	S	*	*			cis	-158.2	-179.6	-29.6	-128.5	-93.8	0	0	0	109.4
636	E	27.2	Very low	29.4	Very low	194 Å²	194	153.9 Å²	153.9	91%	0.907	81%	0.805	S	S	*	*			trans	73.6	145	174.6	-52.2	-168.7	147	0	0	117.3
637	G	26.2	Very low	29	Very low	71 Å²	71	158.6 Å²	158.6	73%	0.732	82%	0.815	S	S	*	*			cis	173.7	124.3	-12.5	0	0	0	0	0	114.9
638	S	27.4	Very low	29.6	Very low	122 Å²	122	159.2 Å²	159.2	85%	0.853	81%	0.812	S	S	*	*			trans	66	151.3	174	-103.1	0	0	0	0	117.9
639	S	27.8	Very low	30.1	Very low	89 Å²	89	161.4 Å²	161.4	62%	0.622	82%	0.823	S	S	*	*			cis	-158.7	147.6	-7.6	-125.1	0	0	0	0	114.3
640	R	29.7	Very low	30.6	Very low	223 Å²	223	157.6 Å²	157.6	84%	0.842	82%	0.816	S	S	*	*			trans	63.4	100.6	150.5	-66.1	178.1	175.3	178.6	-2.1	122.1
641	N	27.6	Very low	31.6	Very low	155 Å²	155	160 Å²	160	83%	0.829	83%	0.825	S	S	*	*				42.7	115.7	123	-53.5	11.5	0	0	0	121.7
642	V	31.6	Very low	32.9	Very low	137 Å²	137	156.6 Å²	156.6	83%	0.83	82%	0.817	S	S	*	*				-142.5	143.7	115.4	177.9	0	0	0	0	109.2
643	S	28.1	Very low	35.1	Very low	118 Å²	118	151.9 Å²	151.9	83%	0.825	80%	0.799	S	S	*	*			trans	-14.4	129.2	176.5	-47.7	0	0	0	0	120.1
644	A	29.8	Very low	37.9	Very low	102 Å²	102	155.8 Å²	155.8	84%	0.843	80%	0.797	S	S	*	*			trans	-132.9	57.9	173.1	0	0	0	0	0	113
645	E	36.9	Very low	40.8	Very low	195 Å²	195	145.1 Å²	145.1	91%	0.911	76%	0.76	S	S	*	*			trans	-121.2	64.6	176	-71	-165.2	134.2	0	0	112.2
646	Q	34.6	Very low	43.7	Very low	196 Å²	196	139.5 Å²	139.5	92%	0.916	74%	0.737	S	S	*	*			trans	-157.3	50.4	170.4	-139.2	174.2	52.4	0	0	113.6
647	K	36.8	Very low	46.4	Very low	203 Å²	203	133.9 Å²	133.9	88%	0.883	72%	0.719	S	S	*	*			trans	-150.1	38.2	-174.4	-142.4	177.2	-176.7	177.8	0	118.8
648	D	35.8	Very low	48.8	Very low	160 Å²	160	132.5 Å²	132.5	86%	0.856	70%	0.695	S	S	*	*	S	Bend	trans	-140.2	6.4	165.9	-118.4	-35.4	0	0	0	116.6	N650	D648-N650 PolarHBondContact O-N 3.49Å
649	E	38.2	Very low	50.9	Low	202 Å²	202	133.1 Å²	133.1	94%	0.944	68%	0.678	S	S	*	*			trans	-93.1	40.1	173.2	-72.6	-147.6	115.6	0	0	113.8
650	N	39.3	Very low	53	Low	125 Å²	125	129.6 Å²	129.6	67%	0.668	65%	0.652	S	S	*	*			trans	-137.3	44.2	176.9	-145.1	-2.7	0	0	0	114.4	D648 E652	D648-N650 PolarHBondContact O-N 3.49Å; N650-E652 PolarHBondContact O-N 2.85Å
651	K	48	Very low	54.9	Low	198 Å²	198	120.1 Å²	120.1	86%	0.861	62%	0.618	S	S	*	*	S	Bend	trans	-58.4	118.2	146.7	-77.8	177.1	-179.7	167.4	0	107.2	A653	K651-A653 PolarHBondContact O-N 3.37Å
652	E	57.9	Low	57.2	Low	125 Å²	125	117.5 Å²	117.5	58%	0.584	60%	0.597	S	S	*	*			trans	-54.8	99.4	174.2	-64.6	179.1	137.5	0	0	110.3	N650 K654	N650-E652 PolarHBondContact O-N 2.85Å; E652-K654 PolarHBondContact O-N 3.28Å; E652-K654 WeakPolarHBondContact OE2-CE 3.34Å; E652-K654 IonicContact OE2-NZ 3.11Å; E652-K654 PolarHBondContact OE2-NZ 3.2Å
653	A	72.8	Confident	59.4	Low	54 Å²	54	112.2 Å²	112.2	45%	0.446	57%	0.566	S	S	.	*			trans	-59.6	126.3	164.6	0	0	0	0	0	107.4	K651 F696	K651-A653 PolarHBondContact O-N 3.37Å; A653-F696 WeakPolarHBondContact O-CE2 3.23Å; A653-F696 VanDerWaalsContact O-CZ 3.32Å; A653-F696 WeakPolarHBondContact O-CZ 3.19Å
654	K	84.9	Confident	61.7	Low	148 Å²	148	114.4 Å²	114.4	64%	0.643	57%	0.565	S	S	*	*			trans	-107.1	151.7	-175.3	-76.8	162.6	-171	179.5	0	109.9	E652 R656 F696	E652-K654 PolarHBondContact O-N 3.28Å; E652-K654 WeakPolarHBondContact OE2-CE 3.34Å; E652-K654 IonicContact OE2-NZ 3.11Å; E652-K654 PolarHBondContact OE2-NZ 3.2Å; K654-R656 PolarHBondContact O-N 3.44Å; K654-F696 VanDerWaalsContact C-CE2 3.48Å
655	P	88.9	Confident	64.2	Low	19 Å²	19	115.5 Å²	115.5	12%	0.123	55%	0.551	C	S	.	*			trans	-50.3	138.1	174.4	-30.6	37.2	0	0	0	112.2	S657 P672 F696 V717 K719	P655-S657 PolarHBondContact O-N 3.37Å; P655-P672 HydrophobicContact CG-CB 3.58Å; P655-P672 HydrophobicContact CG-CG 3.33Å; P655-F696 HydrophobicContact CG-CD2 4.2Å; P655-F696 HydrophobicContact CG-CE2 4.16Å; P655-F696 HydrophobicContact CG-CG 4.39Å; P655-F696 HydrophobicContact CG-CZ 4.33Å; P655-V717 WeakPolarHBondContact CB-O 3.16Å; P655-V717 HydrophobicContact CG-CG1 4.48Å; P655-K719 HydrophobicContact CB-CB 4.26Å
656	R	88	Confident	66.6	Low	94 Å²	94	106.5 Å²	106.5	36%	0.355	51%	0.509	S	S	.	.			trans	-61.7	135	174.8	-71.2	-164.8	-74.4	-126.5	-10.3	109.7	K654 L658 E694 E716 C718 K719	K654-R656 PolarHBondContact O-N 3.44Å; R656-L658 HydrophobicContact CB-CD1 4.37Å; R656-L658 HydrophobicContact CB-CD2 4.18Å; R656-L658 HydrophobicContact CB-CG 3.9Å; R656-L658 PolarHBondContact O-N 2.96Å; R656-E694 IonicContact CZ-OE1 2.68Å; R656-E694 VanDerWaalsContact CZ-OE1 3.27Å; R656-E694 IonicContact CZ-OE2 3.67Å; R656-E694 IonicContact NE-OE2 3.4Å; R656-E694 IonicContact NH1-OE1 2.77Å; R656-E694 PolarHBondContact NH1-OE1 2.83Å; R656-E694 IonicContact NH1-OE2 2.71Å; R656-E694 PolarHBondContact NH1-OE2 3.42Å; R656-E694 IonicContact NH2-OE1 3.71Å; R656-E694 PolarHBondContact NH2-OE1 3.05Å; R656-E694 IonicContact NH2-OE2 3.36Å; R656-E694 PolarHBondContact NH2-OE2 2.91Å; R656-E716 IonicContact CZ-OE1 3.52Å; R656-E716 IonicContact NE-OE1 3.86Å; R656-E716 PolarHBondContact NE-OE1 2.76Å; R656-E716 VanDerWaalsContact NH2-CD 3.32Å; R656-E716 IonicContact NH2-OE1 2.95Å; R656-E716 PolarHBondContact NH2-OE1 2.79Å; R656-E716 IonicContact NH2-OE2 2.65Å; R656-C718 CarbonylContact O-C 3.59Å; R656-C718 WeakPolarHBondContact O-CA 3.37Å; R656-K719 PolarHBondContact O-N 2.66Å
657	S	84.8	Confident	69.2	Low	76 Å²	76	98.2 Å²	98.2	53%	0.531	47%	0.472	S	S	.	.	B	Isolated β-bridge	trans	-82.2	88.7	173.8	174.9	0	0	0	0	109.1	P655	P655-S657 PolarHBondContact O-N 3.37Å
658	L	77.1	Confident	71.8	Confident	42 Å²	42	89 Å²	89	22%	0.22	43%	0.433	C	S	.	.			trans	-106.6	140.7	-177.1	-62.1	-174.7	0	0	0	111.7	R656 F660 P721	R656-L658 HydrophobicContact CB-CD1 4.37Å; R656-L658 HydrophobicContact CB-CD2 4.18Å; R656-L658 HydrophobicContact CB-CG 3.9Å; R656-L658 PolarHBondContact O-N 2.96Å; L658-F660 HydrophobicContact CB-CD1 4.13Å; L658-F660 WeakPolarHBondContact O-CD1 3.29Å; L658-F660 PolarHBondContact O-N 2.86Å; L658-P721 WeakPolarHBondContact O-CD 3.38Å
659	R	70.5	Confident	74.5	Confident	134 Å²	134	86.5 Å²	86.5	51%	0.506	43%	0.429	S	S	.	.			trans	-86.1	105.4	166.3	-177.2	174.4	173.5	-166.7	-6.5	108.8	A188 D189	A188-R659 WeakPolarHBondContact O-CD 3.39Å; A188-R659 PolarHBondContact O-NE 3.48Å; A188-R659 PolarHBondContact O-NH1 3.33Å; D189-R659 IonicContact OD1-CZ 2.7Å; D189-R659 IonicContact OD1-NH1 2.89Å; D189-R659 PolarHBondContact OD1-NH1 3.39Å; D189-R659 IonicContact OD1-NH2 3.21Å; D189-R659 PolarHBondContact OD1-NH2 3.26Å
660	F	72.6	Confident	77	Confident	15 Å²	15	79.6 Å²	79.6	7%	0.066	40%	0.397	C	S	.	.			trans	-144.3	175.8	178.2	74	-80	0	0	0	111.7	L658 W662 C718 L720 R729	L658-F660 HydrophobicContact CB-CD1 4.13Å; L658-F660 WeakPolarHBondContact O-CD1 3.29Å; L658-F660 PolarHBondContact O-N 2.86Å; F660-W662 HydrophobicContact CD2-CB 4.46Å; F660-W662 HydrophobicContact CE2-CB 3.84Å; F660-W662 HydrophobicContact CZ-CB 3.95Å; F660-W662 PolarHBondContact O-N 3.16Å; F660-C718 HydrophobicContact CD1-CB 4.19Å; F660-C718 HydrophobicContact CE1-CB 3.4Å; F660-C718 HydrophobicContact CZ-CB 4Å; F660-L720 HydrophobicContact CD1-CD2 4.44Å; F660-L720 HydrophobicContact CE1-CD2 3.47Å; F660-L720 VanDerWaalsContact CE1-CD2 3.47Å; F660-L720 HydrophobicContact CZ-CD2 3.63Å; F660-R729 HydrophobicContact CD2-CB 3.72Å; F660-R729 HydrophobicContact CD2-CG 3.72Å; F660-R729 HydrophobicContact CE1-CB 4.41Å; F660-R729 HydrophobicContact CE2-CB 3.56Å; F660-R729 HydrophobicContact CE2-CG 4.1Å; F660-R729 HydrophobicContact CG-CB 4.22Å; F660-R729 HydrophobicContact CG-CG 4.08Å; F660-R729 HydrophobicContact CZ-CB 3.93Å
661	T	68.3	Low	79.6	Confident	24 Å²	24	78.4 Å²	78.4	15%	0.147	39%	0.391	C	S	.	.			trans	-73.3	87.7	175.9	37.8	0	0	0	0	111.8	Y143 H147 M190	Y143-T661 HydrophobicContact CD2-CG2 3.41Å; Y143-T661 VanDerWaalsContact CD2-CG2 3.41Å; Y143-T661 HydrophobicContact CE2-CG2 4.04Å; Y143-T661 HydrophobicContact CG-CG2 4.1Å; H147-T661 VanDerWaalsContact CE1-C 3.49Å; H147-T661 VanDerWaalsContact CE1-CB 3.48Å; H147-T661 WeakPolarHBondContact CE1-CB 3.47Å; M190-T661 HydrophobicContact CE-CG2 3.44Å; M190-T661 VanDerWaalsContact CE-CG2 3.44Å; M190-T661 HydrophobicContact SD-CG2 4.49Å
662	W	76.4	Confident	81.7	Confident	101 Å²	101	69.7 Å²	69.7	38%	0.383	35%	0.354	S	S	.	.			trans	-95.5	140.7	179.9	63.5	-91.1	0	0	0	112.7	H147 F660 M664 T667 L720 L723	H147-W662 PolarHBondContact NE2-O 3.45Å; H147-W662 VanDerWaalsContact NE2-O 3.12Å; F660-W662 HydrophobicContact CD2-CB 4.46Å; F660-W662 HydrophobicContact CE2-CB 3.84Å; F660-W662 HydrophobicContact CZ-CB 3.95Å; F660-W662 PolarHBondContact O-N 3.16Å; W662-M664 HydrophobicContact CZ3-CG 4.07Å; W662-T667 HydrophobicContact CE3-CG2 4.42Å; W662-L720 HydrophobicContact CB-CD1 4.08Å; W662-L720 HydrophobicContact CB-CD2 3.66Å; W662-L720 HydrophobicContact CD2-CD1 3.84Å; W662-L720 HydrophobicContact CE3-CD1 4.07Å; W662-L720 HydrophobicContact CG-CD1 3.83Å; W662-L720 HydrophobicContact CG-CD2 3.8Å; W662-L720 HydrophobicContact CG-CG 4.46Å; W662-L723 HydrophobicContact CD2-CD1 4.49Å; W662-L723 HydrophobicContact CH2-CD1 3.67Å; W662-L723 HydrophobicContact CZ2-CD1 3.61Å; W662-L723 HydrophobicContact CZ3-CD1 4.13Å
663	S	77.5	Confident	83.5	Confident	25 Å²	25	65.2 Å²	65.2	18%	0.175	34%	0.341	C	S	.	.			trans	-106.6	145.9	177	-163.8	0	0	0	0	110.8	A146 K665 T666 T667	A146-S663 PolarHBondContact O-OG 3.06Å; S663-K665 PolarHBondContact O-N 2.69Å; S663-T666 PolarHBondContact O-N 2.91Å; S663-T666 PolarHBondContact O-OG1 2.76Å; S663-T667 WeakPolarHBondContact O-CB 3.37Å; S663-T667 PolarHBondContact O-N 3.32Å; S663-T667 PolarHBondContact O-OG1 2.95Å
664	M	77.4	Confident	84.5	Confident	164 Å²	164	65.7 Å²	65.7	81%	0.808	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-58.8	-27	173.4	-71.7	178.8	66.9	0	0	112.5	W662 T666	W662-M664 HydrophobicContact CZ3-CG 4.07Å; M664-T666 PolarHBondContact O-N 2.68Å
665	K	82.1	Confident	85.1	Confident	125 Å²	125	58.7 Å²	58.7	54%	0.543	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-65.9	-24.5	175.4	-65.6	-175.9	176	-177.4	0	114	S663 N749	S663-K665 PolarHBondContact O-N 2.69Å; K665-N749 PolarHBondContact NZ-OD1 2.97Å
666	T	86.7	Confident	85.5	Confident	6 Å²	6	57.9 Å²	57.9	4%	0.037	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-122.1	20.7	-171.6	62.7	0	0	0	0	111.9	S663 M664 G727 V728 F730 A748 L751	S663-T666 PolarHBondContact O-N 2.91Å; S663-T666 PolarHBondContact O-OG1 2.76Å; M664-T666 PolarHBondContact O-N 2.68Å; T666-G727 CarbonylContact O-C 3.6Å; T666-G727 WeakPolarHBondContact O-CA 3.45Å; T666-V728 PolarHBondContact O-N 3.06Å; T666-V728 PolarHBondContact OG1-O 2.68Å; T666-F730 HydrophobicContact CG2-CE2 4.11Å; T666-A748 HydrophobicContact CG2-CB 3.78Å; T666-L751 HydrophobicContact CG2-CD1 4.34Å
667	T	90.3	Very high	85.9	Confident	22 Å²	22	61 Å²	61	14%	0.135	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	130.1	-176.6	-64.1	0	0	0	0	109.9	W662 S663 L720 L725 N726	W662-T667 HydrophobicContact CE3-CG2 4.42Å; S663-T667 WeakPolarHBondContact O-CB 3.37Å; S663-T667 PolarHBondContact O-N 3.32Å; S663-T667 PolarHBondContact O-OG1 2.95Å; T667-L720 HydrophobicContact CG2-CD1 3.42Å; T667-L720 VanDerWaalsContact CG2-CD1 3.42Å; T667-L725 HydrophobicContact CG2-CB 3.96Å; T667-L725 HydrophobicContact CG2-CD1 3.79Å; T667-N726 CarbonylContact C-O 3.59Å; T667-N726 WeakPolarHBondContact CA-O 3.41Å
668	S	91.1	Very high	86.5	Confident	10 Å²	10	58.8 Å²	58.8	7%	0.07	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	161	-172.9	-179.5	0	0	0	0	113.8	M670 N726 L753	S668-M670 VanDerWaalsContact OG-CB 3.28Å; S668-M670 WeakPolarHBondContact OG-CB 3.5Å; S668-M670 PolarHBondContact OG-N 2.93Å; S668-N726 PolarHBondContact N-O 2.75Å; S668-N726 PolarHBondContact O-N 3.03Å; S668-L753 WeakPolarHBondContact CB-OXT 3.46Å; S668-L753 PolarHBondContact OG-OXT 3.36Å
669	S	90.9	Very high	87.4	Confident	108 Å²	108	56.8 Å²	56.8	76%	0.755	28%	0.283	S	S	*	.	S	Bend	trans	-90.2	0.5	166.4	55.6	0	0	0	0	113.8
670	M	91.3	Very high	88.7	Confident	57 Å²	57	53.5 Å²	53.5	28%	0.281	27%	0.271	S	S	.	.	S	Bend	trans	-60.8	152.8	175.3	-172.1	-172.1	-63.3	0	0	111.6	S668 D674 M675 N726 L753	S668-M670 VanDerWaalsContact OG-CB 3.28Å; S668-M670 WeakPolarHBondContact OG-CB 3.5Å; S668-M670 PolarHBondContact OG-N 2.93Å; M670-D674 HydrophobicContact CG-CB 3.99Å; M670-D674 VanDerWaalsContact SD-C 3.57Å; M670-D674 HydrophobicContact SD-CB 3.82Å; M670-M675 HydrophobicContact CB-CG 3.9Å; M670-M675 HydrophobicContact CG-CG 4.08Å; M670-M675 HydrophobicContact SD-CG 3.94Å; M670-M675 PolarHBondContact SD-N 2.66Å; M670-N726 PolarHBondContact O-ND2 3.41Å; M670-L753 HydrophobicContact CE-CD2 4.38Å; M670-L753 HydrophobicContact SD-CD2 4.3Å
671	D	93.3	Very high	89.9	Confident	100 Å²	100	58 Å²	58	54%	0.535	29%	0.29	S	S	.	.			trans	-60.7	134.4	171.6	-176.1	-93.5	0	0	0	111.3	G673 D674 M675	D671-G673 PolarHBondContact O-N 3.15Å; D671-G673 VanDerWaalsContact O-N 3.14Å; D671-G673 WeakPolarHBondContact OD1-CA 3.27Å; D671-G673 PolarHBondContact OD1-N 3.27Å; D671-D674 PolarHBondContact O-N 2.82Å; D671-M675 WeakPolarHBondContact O-CG 3.41Å; D671-M675 PolarHBondContact O-N 3.17Å
672	P	93.7	Very high	91.3	Very high	15 Å²	15	57.1 Å²	57.1	10%	0.097	29%	0.285	C	S	.	.	H	α-helix	trans	-54.1	-30.5	178.9	-30.3	37.3	0	0	0	115.9	P655 M676 F696 V717 N726	P655-P672 HydrophobicContact CG-CB 3.58Å; P655-P672 HydrophobicContact CG-CG 3.33Å; P672-M676 VanDerWaalsContact O-CG 3.26Å; P672-M676 WeakPolarHBondContact O-CG 3.46Å; P672-M676 PolarHBondContact O-N 2.66Å; P672-F696 HydrophobicContact CB-CD1 3.77Å; P672-F696 HydrophobicContact CB-CE1 3.38Å; P672-F696 HydrophobicContact CB-CZ 4.05Å; P672-V717 HydrophobicContact CB-CG1 4.07Å; P672-N726 WeakPolarHBondContact CG-ND2 3.32Å
673	G	94.3	Very high	92.3	Very high	30 Å²	30	52.3 Å²	52.3	31%	0.309	27%	0.267	S	S	.	.	H	α-helix	trans	-68.7	-38	176.1	0	0	0	0	0	112.8	D671 R677	D671-G673 PolarHBondContact O-N 3.15Å; D671-G673 VanDerWaalsContact O-N 3.14Å; D671-G673 WeakPolarHBondContact OD1-CA 3.27Å; D671-G673 PolarHBondContact OD1-N 3.27Å; G673-R677 PolarHBondContact O-N 3.13Å; G673-R677 VanDerWaalsContact O-N 3.11Å
674	D	95.4	Very high	93.2	Very high	65 Å²	65	55.4 Å²	55.4	35%	0.348	28%	0.281	S	S	.	.	H	α-helix	trans	-78.9	-32.2	174.8	-73.9	-38.2	0	0	0	112.3	M670 D671 M676 R677 E678	M670-D674 HydrophobicContact CG-CB 3.99Å; M670-D674 VanDerWaalsContact SD-C 3.57Å; M670-D674 HydrophobicContact SD-CB 3.82Å; D671-D674 PolarHBondContact O-N 2.82Å; D674-M676 VanDerWaalsContact C-N 3.29Å; D674-M676 PolarHBondContact O-N 2.99Å; D674-R677 WeakPolarHBondContact O-CA 3.3Å; D674-R677 VanDerWaalsContact O-CB 3.28Å; D674-R677 WeakPolarHBondContact O-CB 3.45Å; D674-R677 PolarHBondContact O-N 2.88Å; D674-R677 IonicContact OD1-CZ 3.31Å; D674-R677 IonicContact OD1-NE 3.19Å; D674-R677 PolarHBondContact OD1-NE 2.76Å; D674-R677 IonicContact OD1-NH2 2.72Å; D674-R677 PolarHBondContact OD1-NH2 3.29Å; D674-E678 PolarHBondContact O-N 3.28Å
675	M	96.1	Very high	94.2	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-57.1	-45.3	167	-63.7	-174.3	74.6	0	0	110.9	M670 D671 R677 E678 I679 V717 N726 V728 L753	M670-M675 HydrophobicContact CB-CG 3.9Å; M670-M675 HydrophobicContact CG-CG 4.08Å; M670-M675 HydrophobicContact SD-CG 3.94Å; M670-M675 PolarHBondContact SD-N 2.66Å; D671-M675 WeakPolarHBondContact O-CG 3.41Å; D671-M675 PolarHBondContact O-N 3.17Å; M675-R677 VanDerWaalsContact C-N 3.26Å; M675-R677 PolarHBondContact O-N 3.01Å; M675-E678 PolarHBondContact O-N 3.04Å; M675-I679 WeakPolarHBondContact O-CB 3.4Å; M675-I679 WeakPolarHBondContact O-CD1 3.37Å; M675-I679 WeakPolarHBondContact O-CG1 3.46Å; M675-I679 PolarHBondContact O-N 3.22Å; M675-V717 HydrophobicContact CB-CG1 4.41Å; M675-V717 HydrophobicContact CB-CG2 4.03Å; M675-V717 HydrophobicContact CE-CG1 4.32Å; M675-V717 HydrophobicContact SD-CG1 3.8Å; M675-N726 HydrophobicContact CE-CB 4.27Å; M675-N726 HydrophobicContact SD-CB 3.5Å; M675-N726 VanDerWaalsContact SD-CB 3.5Å; M675-V728 HydrophobicContact CE-CG2 3.98Å; M675-L753 HydrophobicContact CB-CD2 4.02Å; M675-L753 HydrophobicContact CE-CD1 3.99Å; M675-L753 HydrophobicContact CE-CD2 4.17Å; M675-L753 HydrophobicContact CG-CD2 4.01Å
676	M	97.1	Very high	94.8	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-27.9	174.4	-72.1	-69.3	-72.8	0	0	113	P672 D674 I679 R680 F696 L698 V717	P672-M676 VanDerWaalsContact O-CG 3.26Å; P672-M676 WeakPolarHBondContact O-CG 3.46Å; P672-M676 PolarHBondContact O-N 2.66Å; D674-M676 VanDerWaalsContact C-N 3.29Å; D674-M676 PolarHBondContact O-N 2.99Å; M676-I679 HydrophobicContact SD-CD1 4.28Å; M676-R680 WeakPolarHBondContact O-CG 3.28Å; M676-R680 VanDerWaalsContact O-CZ 3.32Å; M676-R680 PolarHBondContact O-N 3.3Å; M676-R680 PolarHBondContact O-NE 2.95Å; M676-R680 PolarHBondContact O-NH2 2.95Å; M676-F696 HydrophobicContact CG-CD1 4.03Å; M676-L698 HydrophobicContact CE-CD1 4.49Å; M676-L698 HydrophobicContact CE-CD2 3.59Å; M676-L698 HydrophobicContact CE-CG 3.75Å; M676-V717 HydrophobicContact CG-CG2 4Å; M676-V717 HydrophobicContact SD-CB 4.47Å; M676-V717 HydrophobicContact SD-CG2 3.76Å
677	R	96.5	Very high	95.2	Very high	159 Å²	159	51.9 Å²	51.9	60%	0.6	28%	0.282	S	S	*	.	H	α-helix	trans	-70.3	-46.5	174.7	-163.6	-165	-52.2	-91.4	2.1	111.3	G673 D674 M675 R680 K681	G673-R677 PolarHBondContact O-N 3.13Å; G673-R677 VanDerWaalsContact O-N 3.11Å; D674-R677 WeakPolarHBondContact O-CA 3.3Å; D674-R677 VanDerWaalsContact O-CB 3.28Å; D674-R677 WeakPolarHBondContact O-CB 3.45Å; D674-R677 PolarHBondContact O-N 2.88Å; D674-R677 IonicContact OD1-CZ 3.31Å; D674-R677 IonicContact OD1-NE 3.19Å; D674-R677 PolarHBondContact OD1-NE 2.76Å; D674-R677 IonicContact OD1-NH2 2.72Å; D674-R677 PolarHBondContact OD1-NH2 3.29Å; M675-R677 VanDerWaalsContact C-N 3.26Å; M675-R677 PolarHBondContact O-N 3.01Å; R677-R680 PolarHBondContact O-N 3.17Å; R677-K681 WeakPolarHBondContact O-CB 3.47Å; R677-K681 PolarHBondContact O-N 3.2Å; R677-K681 VanDerWaalsContact O-N 3.15Å
678	E	97.4	Very high	95.5	Very high	29 Å²	29	51.1 Å²	51.1	14%	0.136	28%	0.277	C	S	.	.	H	α-helix	trans	-67.9	-37.4	177.1	-170.2	63.2	-167.5	0	0	111.7	D674 M675 K681 V682 L751 K752 L753	D674-E678 PolarHBondContact O-N 3.28Å; M675-E678 PolarHBondContact O-N 3.04Å; E678-K681 PolarHBondContact O-N 3.19Å; E678-K681 IonicContact OE1-NZ 3.69Å; E678-K681 PolarHBondContact OE1-NZ 3.44Å; E678-K681 IonicContact OE2-NZ 2.72Å; E678-K681 PolarHBondContact OE2-NZ 2.77Å; E678-V682 HydrophobicContact CG-CG2 4.48Å; E678-V682 WeakPolarHBondContact O-CG2 3.18Å; E678-V682 PolarHBondContact O-N 3.16Å; E678-L751 HydrophobicContact CG-CD2 4.39Å; E678-K752 HydrophobicContact CG-CB 4.42Å; E678-L753 HydrophobicContact CB-CD2 4.24Å; E678-L753 HydrophobicContact CG-CD2 4.5Å
679	I	97.3	Very high	95.7	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-56.8	-51.7	173.8	-72	163	0	0	0	111.6	M675 M676 V682 L683 L698 M715 V717 V728 L751	M675-I679 WeakPolarHBondContact O-CB 3.4Å; M675-I679 WeakPolarHBondContact O-CD1 3.37Å; M675-I679 WeakPolarHBondContact O-CG1 3.46Å; M675-I679 PolarHBondContact O-N 3.22Å; M676-I679 HydrophobicContact SD-CD1 4.28Å; I679-V682 PolarHBondContact O-N 3.27Å; I679-L683 HydrophobicContact CG2-CD1 3.77Å; I679-L683 HydrophobicContact CG2-CG 4.47Å; I679-L683 WeakPolarHBondContact O-CG 3.5Å; I679-L683 PolarHBondContact O-N 3.33Å; I679-L698 HydrophobicContact CG2-CD1 3.67Å; I679-M715 HydrophobicContact CG1-CE 4.2Å; I679-M715 HydrophobicContact CG2-CE 3.63Å; I679-M715 HydrophobicContact CG2-SD 4.27Å; I679-V717 HydrophobicContact CD1-CG2 3.55Å; I679-V728 HydrophobicContact CD1-CG1 3.89Å; I679-V728 HydrophobicContact CD1-CG2 3.81Å; I679-V728 HydrophobicContact CG1-CG2 4.39Å; I679-L751 HydrophobicContact CB-CD2 4.36Å; I679-L751 HydrophobicContact CG1-CD2 3.71Å
680	R	98.1	Very high	96	Very high	65 Å²	65	55 Å²	55	25%	0.245	28%	0.283	C	S	.	.	H	α-helix	trans	-59	-49.8	178.5	-74.8	-176.1	-64.9	-103.3	-10.7	111.4	M676 R677 V682 L683 D684 Y690 L698	M676-R680 WeakPolarHBondContact O-CG 3.28Å; M676-R680 VanDerWaalsContact O-CZ 3.32Å; M676-R680 PolarHBondContact O-N 3.3Å; M676-R680 PolarHBondContact O-NE 2.95Å; M676-R680 PolarHBondContact O-NH2 2.95Å; R677-R680 PolarHBondContact O-N 3.17Å; R680-V682 VanDerWaalsContact C-N 3.28Å; R680-V682 PolarHBondContact O-N 3.14Å; R680-L683 CarbonylContact O-C 3.49Å; R680-L683 WeakPolarHBondContact O-CA 3.39Å; R680-L683 WeakPolarHBondContact O-CB 3.41Å; R680-L683 PolarHBondContact O-N 3.34Å; R680-D684 PolarHBondContact O-N 3.3Å; R680-D684 VanDerWaalsContact O-OD2 3.04Å; R680-Y690 HydrophobicContact CB-CE1 4.49Å; R680-Y690 HydrophobicContact CB-CE2 4.16Å; R680-Y690 HydrophobicContact CG-CD2 4.21Å; R680-Y690 HydrophobicContact CG-CE2 3.54Å; R680-L698 HydrophobicContact CG-CD1 3.92Å
681	K	97.7	Very high	96.2	Very high	109 Å²	109	57 Å²	57	47%	0.474	29%	0.292	S	S	.	.	H	α-helix	trans	-55.7	-36.6	176.8	165.6	167.3	158.2	-81.8	0	114	R677 E678 D684 A685	R677-K681 WeakPolarHBondContact O-CB 3.47Å; R677-K681 PolarHBondContact O-N 3.2Å; R677-K681 VanDerWaalsContact O-N 3.15Å; E678-K681 PolarHBondContact O-N 3.19Å; E678-K681 IonicContact OE1-NZ 3.69Å; E678-K681 PolarHBondContact OE1-NZ 3.44Å; E678-K681 IonicContact OE2-NZ 2.72Å; E678-K681 PolarHBondContact OE2-NZ 2.77Å; K681-D684 WeakPolarHBondContact CA-OD2 3.45Å; K681-A685 WeakPolarHBondContact O-CB 3.38Å; K681-A685 PolarHBondContact O-N 2.94Å
682	V	97.3	Very high	96.3	Very high	7 Å²	7	56.5 Å²	56.5	4%	0.042	29%	0.286	C	S	.	.	H	α-helix	trans	-76.4	-35.2	175.1	173.8	0	0	0	0	111.6	E678 I679 R680 A685 N686 I747 E750 L751	E678-V682 HydrophobicContact CG-CG2 4.48Å; E678-V682 WeakPolarHBondContact O-CG2 3.18Å; E678-V682 PolarHBondContact O-N 3.16Å; I679-V682 PolarHBondContact O-N 3.27Å; R680-V682 VanDerWaalsContact C-N 3.28Å; R680-V682 PolarHBondContact O-N 3.14Å; V682-A685 PolarHBondContact O-N 2.96Å; V682-N686 WeakPolarHBondContact O-CB 3.46Å; V682-N686 PolarHBondContact O-N 3.44Å; V682-N686 VanDerWaalsContact O-N 3.16Å; V682-N686 PolarHBondContact O-ND2 2.96Å; V682-I747 HydrophobicContact CG1-CB 4.38Å; V682-I747 HydrophobicContact CG1-CG1 4.45Å; V682-I747 HydrophobicContact CG1-CG2 3.97Å; V682-E750 HydrophobicContact CG1-CB 3.88Å; V682-L751 HydrophobicContact CB-CD2 4.31Å; V682-L751 HydrophobicContact CG2-CD2 4.19Å
683	L	97.5	Very high	96.1	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.3	-44.8	172.7	-70.5	164.1	0	0	0	111.7	I679 R680 A685 N686 N687 C688 Y690 L698 C700 W713 M715 I747	I679-L683 HydrophobicContact CG2-CD1 3.77Å; I679-L683 HydrophobicContact CG2-CG 4.47Å; I679-L683 WeakPolarHBondContact O-CG 3.5Å; I679-L683 PolarHBondContact O-N 3.33Å; R680-L683 CarbonylContact O-C 3.49Å; R680-L683 WeakPolarHBondContact O-CA 3.39Å; R680-L683 WeakPolarHBondContact O-CB 3.41Å; R680-L683 PolarHBondContact O-N 3.34Å; L683-A685 PolarHBondContact O-N 3.45Å; L683-N686 CarbonylContact O-C 3.46Å; L683-N686 WeakPolarHBondContact O-CA 3.47Å; L683-N686 PolarHBondContact O-N 3Å; L683-N687 PolarHBondContact O-N 3.31Å; L683-C688 HydrophobicContact CB-CB 4.04Å; L683-C688 HydrophobicContact CD2-CB 3.58Å; L683-C688 HydrophobicContact CG-CB 4.44Å; L683-C688 PolarHBondContact O-N 3.09Å; L683-Y690 HydrophobicContact CB-CD1 3.61Å; L683-Y690 HydrophobicContact CB-CE1 3.75Å; L683-Y690 HydrophobicContact CD1-CD1 3.74Å; L683-Y690 HydrophobicContact CD1-CE1 4.37Å; L683-Y690 HydrophobicContact CD1-CG 4.05Å; L683-Y690 HydrophobicContact CG-CD1 4.27Å; L683-L698 HydrophobicContact CD1-CD1 3.61Å; L683-C700 HydrophobicContact CD2-CB 4.34Å; L683-W713 HydrophobicContact CD2-CZ2 3.95Å; L683-M715 HydrophobicContact CD1-SD 4.26Å; L683-M715 HydrophobicContact CD2-SD 4.04Å; L683-M715 HydrophobicContact CG-SD 4.47Å; L683-I747 HydrophobicContact CD2-CD1 3.7Å
684	D	96.9	Very high	95.9	Very high	90 Å²	90	62.9 Å²	62.9	48%	0.481	30%	0.302	S	S	.	.	H	α-helix	trans	-55.4	-50.3	175.1	-57.2	-40.1	0	0	0	110.6	R680 K681 N686 N687 Y690	R680-D684 PolarHBondContact O-N 3.3Å; R680-D684 VanDerWaalsContact O-OD2 3.04Å; K681-D684 WeakPolarHBondContact CA-OD2 3.45Å; D684-N686 PolarHBondContact O-N 3.34Å; D684-N686 VanDerWaalsContact O-N 3.14Å; D684-N687 PolarHBondContact O-N 3.27Å; D684-N687 VanDerWaalsContact O-N 3.16Å; D684-Y690 WeakPolarHBondContact OD1-CE1 3.31Å; D684-Y690 PolarHBondContact OD1-OH 3.05Å
685	A	96.8	Very high	95.8	Very high	72 Å²	72	65.8 Å²	65.8	60%	0.595	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-9.6	178	0	0	0	0	0	114.4	K681 V682 L683	K681-A685 WeakPolarHBondContact O-CB 3.38Å; K681-A685 PolarHBondContact O-N 2.94Å; V682-A685 PolarHBondContact O-N 2.96Å; L683-A685 PolarHBondContact O-N 3.45Å
686	N	95.1	Very high	95.7	Very high	4 Å²	4	66.8 Å²	66.8	2%	0.021	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	11.2	177.1	-83.6	-86.3	0	0	0	113.2	V682 L683 D684 C688 K746 E750	V682-N686 WeakPolarHBondContact O-CB 3.46Å; V682-N686 PolarHBondContact O-N 3.44Å; V682-N686 VanDerWaalsContact O-N 3.16Å; V682-N686 PolarHBondContact O-ND2 2.96Å; L683-N686 CarbonylContact O-C 3.46Å; L683-N686 WeakPolarHBondContact O-CA 3.47Å; L683-N686 PolarHBondContact O-N 3Å; D684-N686 PolarHBondContact O-N 3.34Å; D684-N686 VanDerWaalsContact O-N 3.14Å; N686-C688 PolarHBondContact O-N 2.75Å; N686-C688 PolarHBondContact O-SG 2.81Å; N686-C688 VanDerWaalsContact O-SG 3.39Å; N686-K746 WeakPolarHBondContact OD1-CD 3.45Å; N686-K746 WeakPolarHBondContact OD1-CE 3.19Å; N686-K746 PolarHBondContact OD1-NZ 3.1Å; N686-E750 PolarHBondContact ND2-OE2 2.79Å
687	N	95	Very high	95.6	Very high	145 Å²	145	66.7 Å²	66.7	78%	0.775	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	39.6	-176.7	-59.9	102.2	0	0	0	112.5	L683 D684	L683-N687 PolarHBondContact O-N 3.31Å; D684-N687 PolarHBondContact O-N 3.27Å; D684-N687 VanDerWaalsContact O-N 3.16Å
688	C	95.9	Very high	95.6	Very high	5 Å²	5	59.1 Å²	59.1	3%	0.034	28%	0.284	C	S	.	.			trans	-100.7	119.3	176.4	-61.3	0	0	0	0	109.6	L683 N686 Y690 V701 W713	L683-C688 HydrophobicContact CB-CB 4.04Å; L683-C688 HydrophobicContact CD2-CB 3.58Å; L683-C688 HydrophobicContact CG-CB 4.44Å; L683-C688 PolarHBondContact O-N 3.09Å; N686-C688 PolarHBondContact O-N 2.75Å; N686-C688 PolarHBondContact O-SG 2.81Å; N686-C688 VanDerWaalsContact O-SG 3.39Å; C688-Y690 WeakPolarHBondContact O-CD1 3.48Å; C688-V701 CarbonylContact C-O 3.54Å; C688-V701 WeakPolarHBondContact CA-O 3.43Å; C688-W713 HydrophobicContact CB-CH2 4.29Å
689	D	96	Very high	95.6	Very high	123 Å²	123	58.6 Å²	58.6	66%	0.658	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	145.4	170.6	-61.5	-51.3	0	0	0	110.1	C700 V701	D689-C700 CarbonylContact O-C 3.36Å; D689-C700 WeakPolarHBondContact O-CA 3.4Å; D689-V701 HydrophobicContact CB-CB 4.41Å; D689-V701 PolarHBondContact N-O 3.24Å; D689-V701 PolarHBondContact O-N 2.98Å
690	Y	96.8	Very high	95.5	Very high	78 Å²	78	58.6 Å²	58.6	31%	0.306	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	148.8	174.8	55.8	-92.8	0	0	0	114.6	R680 L683 D684 C688 L698 F699	R680-Y690 HydrophobicContact CB-CE1 4.49Å; R680-Y690 HydrophobicContact CB-CE2 4.16Å; R680-Y690 HydrophobicContact CG-CD2 4.21Å; R680-Y690 HydrophobicContact CG-CE2 3.54Å; L683-Y690 HydrophobicContact CB-CD1 3.61Å; L683-Y690 HydrophobicContact CB-CE1 3.75Å; L683-Y690 HydrophobicContact CD1-CD1 3.74Å; L683-Y690 HydrophobicContact CD1-CE1 4.37Å; L683-Y690 HydrophobicContact CD1-CG 4.05Å; L683-Y690 HydrophobicContact CG-CD1 4.27Å; D684-Y690 WeakPolarHBondContact OD1-CE1 3.31Å; D684-Y690 PolarHBondContact OD1-OH 3.05Å; C688-Y690 WeakPolarHBondContact O-CD1 3.48Å; Y690-L698 HydrophobicContact CD2-CD1 4.26Å; Y690-L698 HydrophobicContact CD2-CD2 4.48Å; Y690-L698 HydrophobicContact CG-CD1 4.37Å; Y690-F699 CarbonylContact C-O 3.42Å; Y690-F699 VanDerWaalsContact CA-O 3.26Å; Y690-F699 WeakPolarHBondContact CA-O 3.2Å
691	E	96.1	Very high	95.4	Very high	99 Å²	99	56.8 Å²	56.8	46%	0.463	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124.9	175.2	177.1	-165.2	-167.8	0	0	108.2	R693 L698 F699	E691-R693 HydrophobicContact CG-CG 4.13Å; E691-R693 IonicContact OE1-NE 3.75Å; E691-R693 IonicContact OE2-CZ 3.92Å; E691-R693 IonicContact OE2-NE 3.88Å; E691-R693 PolarHBondContact OE2-NE 2.99Å; E691-R693 IonicContact OE2-NH2 2.86Å; E691-R693 PolarHBondContact OE2-NH2 2.94Å; E691-L698 CarbonylContact O-C 3.59Å; E691-L698 WeakPolarHBondContact O-CA 3.39Å; E691-F699 HydrophobicContact CB-CB 4.5Å; E691-F699 PolarHBondContact N-O 3.1Å; E691-F699 PolarHBondContact O-N 2.93Å
692	Q	94.8	Very high	95.2	Very high	88 Å²	88	54.6 Å²	54.6	41%	0.411	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	116	174.3	-178.5	154.6	-1	0	0	110.7	E694 R695 L698	Q692-E694 VanDerWaalsContact CG-O 3.3Å; Q692-E694 WeakPolarHBondContact CG-O 3.14Å; Q692-E694 PolarHBondContact NE2-O 3.04Å; Q692-R695 PolarHBondContact NE2-O 3.28Å; Q692-L698 HydrophobicContact CB-CD2 3.6Å; Q692-L698 HydrophobicContact CG-CD2 3.82Å
693	R	89.6	Confident	94.8	Very high	105 Å²	105	55.9 Å²	55.9	40%	0.396	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-29.5	-174.9	-68.6	-169.5	178.5	145.8	8.7	115	E691 L697 F699	E691-R693 HydrophobicContact CG-CG 4.13Å; E691-R693 IonicContact OE1-NE 3.75Å; E691-R693 IonicContact OE2-CZ 3.92Å; E691-R693 IonicContact OE2-NE 3.88Å; E691-R693 PolarHBondContact OE2-NE 2.99Å; E691-R693 IonicContact OE2-NH2 2.86Å; E691-R693 PolarHBondContact OE2-NH2 2.94Å; R693-L697 HydrophobicContact CB-CD2 4.35Å; R693-L697 PolarHBondContact N-O 3.39Å; R693-F699 HydrophobicContact CG-CB 4.48Å; R693-F699 VanDerWaalsContact NH1-CG 3.31Å
694	E	91.4	Very high	93.6	Very high	74 Å²	74	59.8 Å²	59.8	35%	0.346	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	167.7	170.2	-51.4	175.4	-148.6	0	0	108.3	R656 Q692 F696 L697	R656-E694 IonicContact CZ-OE1 2.68Å; R656-E694 VanDerWaalsContact CZ-OE1 3.27Å; R656-E694 IonicContact CZ-OE2 3.67Å; R656-E694 IonicContact NE-OE2 3.4Å; R656-E694 IonicContact NH1-OE1 2.77Å; R656-E694 PolarHBondContact NH1-OE1 2.83Å; R656-E694 IonicContact NH1-OE2 2.71Å; R656-E694 PolarHBondContact NH1-OE2 3.42Å; R656-E694 IonicContact NH2-OE1 3.71Å; R656-E694 PolarHBondContact NH2-OE1 3.05Å; R656-E694 IonicContact NH2-OE2 3.36Å; R656-E694 PolarHBondContact NH2-OE2 2.91Å; Q692-E694 VanDerWaalsContact CG-O 3.3Å; Q692-E694 WeakPolarHBondContact CG-O 3.14Å; Q692-E694 PolarHBondContact NE2-O 3.04Å; E694-F696 PolarHBondContact O-N 2.8Å; E694-L697 HydrophobicContact CB-CB 3.66Å; E694-L697 HydrophobicContact CG-CB 3.88Å; E694-L697 HydrophobicContact CG-CD2 3.93Å; E694-L697 PolarHBondContact N-O 3.3Å; E694-L697 PolarHBondContact O-N 2.91Å; E694-L697 VanDerWaalsContact O-N 3.11Å; E694-L697 WeakPolarHBondContact OE1-CD2 3.48Å
695	R	91.7	Very high	91.9	Very high	127 Å²	127	59.3 Å²	59.3	48%	0.479	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-27.2	178.6	-171.4	176.4	176.4	147.2	-9.6	113.5	Q692	Q692-R695 PolarHBondContact NE2-O 3.28Å
696	F	95.9	Very high	90.3	Very high	20 Å²	20	62.2 Å²	62.2	9%	0.088	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	15.3	179.6	-52.4	-63.3	0	0	0	114.4	A653 K654 P655 P672 M676 E694 E716 V717	A653-F696 WeakPolarHBondContact O-CE2 3.23Å; A653-F696 VanDerWaalsContact O-CZ 3.32Å; A653-F696 WeakPolarHBondContact O-CZ 3.19Å; K654-F696 VanDerWaalsContact C-CE2 3.48Å; P655-F696 HydrophobicContact CG-CD2 4.2Å; P655-F696 HydrophobicContact CG-CE2 4.16Å; P655-F696 HydrophobicContact CG-CG 4.39Å; P655-F696 HydrophobicContact CG-CZ 4.33Å; P672-F696 HydrophobicContact CB-CD1 3.77Å; P672-F696 HydrophobicContact CB-CE1 3.38Å; P672-F696 HydrophobicContact CB-CZ 4.05Å; M676-F696 HydrophobicContact CG-CD1 4.03Å; E694-F696 PolarHBondContact O-N 2.8Å; F696-E716 CarbonylContact O-C 3.55Å; F696-E716 VanDerWaalsContact O-CA 3.27Å; F696-E716 WeakPolarHBondContact O-CA 3.03Å; F696-V717 HydrophobicContact CB-CB 4.17Å; F696-V717 PolarHBondContact O-N 2.84Å
697	L	94.9	Very high	88.6	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.01	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	120.3	-179.1	-176.5	71.1	0	0	0	110.8	R693 E694 E714 M715 E716	R693-L697 HydrophobicContact CB-CD2 4.35Å; R693-L697 PolarHBondContact N-O 3.39Å; E694-L697 HydrophobicContact CB-CB 3.66Å; E694-L697 HydrophobicContact CG-CB 3.88Å; E694-L697 HydrophobicContact CG-CD2 3.93Å; E694-L697 PolarHBondContact N-O 3.3Å; E694-L697 PolarHBondContact O-N 2.91Å; E694-L697 VanDerWaalsContact O-N 3.11Å; E694-L697 WeakPolarHBondContact OE1-CD2 3.48Å; L697-E714 HydrophobicContact CD1-CB 4.04Å; L697-E714 HydrophobicContact CD1-CG 4.41Å; L697-M715 WeakPolarHBondContact CA-O 3.45Å; L697-E716 HydrophobicContact CD1-CB 3.7Å; L697-E716 HydrophobicContact CD1-CG 3.88Å
698	L	96.6	Very high	87.1	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	147.1	165.9	-53.9	-175.4	0	0	0	110.3	M676 I679 R680 L683 Y690 E691 Q692 E714 M715	M676-L698 HydrophobicContact CE-CD1 4.49Å; M676-L698 HydrophobicContact CE-CD2 3.59Å; M676-L698 HydrophobicContact CE-CG 3.75Å; I679-L698 HydrophobicContact CG2-CD1 3.67Å; R680-L698 HydrophobicContact CG-CD1 3.92Å; L683-L698 HydrophobicContact CD1-CD1 3.61Å; Y690-L698 HydrophobicContact CD2-CD1 4.26Å; Y690-L698 HydrophobicContact CD2-CD2 4.48Å; Y690-L698 HydrophobicContact CG-CD1 4.37Å; E691-L698 CarbonylContact O-C 3.59Å; E691-L698 WeakPolarHBondContact O-CA 3.39Å; Q692-L698 HydrophobicContact CB-CD2 3.6Å; Q692-L698 HydrophobicContact CG-CD2 3.82Å; L698-E714 WeakPolarHBondContact O-CA 3.21Å; L698-M715 PolarHBondContact N-O 3.24Å; L698-M715 PolarHBondContact O-N 3.07Å
699	F	96.1	Very high	86	Confident	17 Å²	17	70.5 Å²	70.5	8%	0.075	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.2	161.2	173.7	-99.8	0	0	0	108.4	Y690 E691 R693 V701 Q712 W713 E714 I733	Y690-F699 CarbonylContact C-O 3.42Å; Y690-F699 VanDerWaalsContact CA-O 3.26Å; Y690-F699 WeakPolarHBondContact CA-O 3.2Å; E691-F699 HydrophobicContact CB-CB 4.5Å; E691-F699 PolarHBondContact N-O 3.1Å; E691-F699 PolarHBondContact O-N 2.93Å; R693-F699 HydrophobicContact CG-CB 4.48Å; R693-F699 VanDerWaalsContact NH1-CG 3.31Å; F699-V701 HydrophobicContact CD1-CG2 4.46Å; F699-V701 HydrophobicContact CE1-CG2 3.89Å; F699-V701 HydrophobicContact CZ-CG2 4.49Å; F699-Q712 HydrophobicContact CE2-CB 4.03Å; F699-Q712 HydrophobicContact CZ-CB 3.79Å; F699-Q712 HydrophobicContact CZ-CG 4.25Å; F699-W713 WeakPolarHBondContact CA-O 3.49Å; F699-E714 HydrophobicContact CD2-CG 4.5Å; F699-I733 HydrophobicContact CE2-CB 4.37Å; F699-I733 HydrophobicContact CE2-CG1 4.36Å; F699-I733 HydrophobicContact CE2-CG2 4.25Å
700	C	96.5	Very high	85.6	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	150.6	-169.4	-52	0	0	0	0	111.4	L683 D689 Q712 W713	L683-C700 HydrophobicContact CD2-CB 4.34Å; D689-C700 CarbonylContact O-C 3.36Å; D689-C700 WeakPolarHBondContact O-CA 3.4Å; C700-Q712 WeakPolarHBondContact O-CA 3.41Å; C700-W713 HydrophobicContact CB-CD2 3.79Å; C700-W713 VanDerWaalsContact CB-CE2 3.42Å; C700-W713 HydrophobicContact CB-CE3 4.15Å; C700-W713 HydrophobicContact CB-CG 4.36Å; C700-W713 HydrophobicContact CB-CH2 3.9Å; C700-W713 HydrophobicContact CB-CZ2 3.49Å; C700-W713 VanDerWaalsContact CB-CZ2 3.49Å; C700-W713 HydrophobicContact CB-CZ3 4.21Å; C700-W713 PolarHBondContact N-O 3.27Å; C700-W713 PolarHBondContact O-N 3.37Å
701	V	95.1	Very high	85.4	Confident	27 Å²	27	63.8 Å²	63.8	16%	0.164	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	140.7	178.8	-173.3	0	0	0	0	109.6	C688 D689 F699 L710 V711 Q712	C688-V701 CarbonylContact C-O 3.54Å; C688-V701 WeakPolarHBondContact CA-O 3.43Å; D689-V701 HydrophobicContact CB-CB 4.41Å; D689-V701 PolarHBondContact N-O 3.24Å; D689-V701 PolarHBondContact O-N 2.98Å; F699-V701 HydrophobicContact CD1-CG2 4.46Å; F699-V701 HydrophobicContact CE1-CG2 3.89Å; F699-V701 HydrophobicContact CZ-CG2 4.49Å; V701-L710 HydrophobicContact CG1-CD1 3.7Å; V701-V711 WeakPolarHBondContact CA-O 3.46Å; V701-Q712 HydrophobicContact CG1-CG 4.23Å; V701-Q712 HydrophobicContact CG2-CG 4.07Å
702	H	93.9	Very high	85.3	Confident	64 Å²	64	60.7 Å²	60.7	30%	0.296	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	148.5	174.7	169	-80.7	0	0	0	110.3	V711 W713 I743	H702-V711 PolarHBondContact N-O 3.01Å; H702-V711 VanDerWaalsContact N-O 3.14Å; H702-V711 PolarHBondContact O-N 3.16Å; H702-W713 HydrophobicContact CB-CH2 3.63Å; H702-W713 HydrophobicContact CB-CZ3 3.69Å; H702-I743 HydrophobicContact CB-CG1 4.18Å
703	G	87.6	Confident	85.2	Confident	34 Å²	34	56.5 Å²	56.5	35%	0.351	31%	0.308	S	S	.	.	S	Bend	trans	121.7	154.9	179.1	0	0	0	0	0	111.3
704	D	72.6	Confident	85.4	Confident	81 Å²	81	51.7 Å²	51.7	43%	0.433	29%	0.29	S	S	.	.			trans	-67.4	163.4	166.5	55.4	-22.2	0	0	0	110.8	H706 N709	D704-H706 PolarHBondContact O-N 3.36Å; D704-H706 IonicContact OD2-CD2 2.76Å; D704-H706 PolarHBondContact OD2-CD2 3.25Å; D704-N709 WeakPolarHBondContact OD1-CB 3.46Å; D704-N709 PolarHBondContact OD1-ND2 2.9Å
705	G	60.9	Low	85.6	Confident	80 Å²	80	48.2 Å²	48.2	83%	0.825	27%	0.274	S	S	*	.	S	Bend	trans	-64.4	8.1	-175.1	0	0	0	0	0	115.8
706	H	63.6	Low	85.7	Confident	134 Å²	134	42.4 Å²	42.4	62%	0.62	25%	0.252	S	S	*	.	S	Bend	trans	-85.8	123.7	173.9	-65.4	-43.9	0	0	0	110.4	D704 E708 N709 L710	D704-H706 PolarHBondContact O-N 3.36Å; D704-H706 IonicContact OD2-CD2 2.76Å; D704-H706 PolarHBondContact OD2-CD2 3.25Å; H706-E708 PolarHBondContact O-N 3.2Å; H706-N709 PolarHBondContact O-N 3.15Å; H706-N709 VanDerWaalsContact O-N 3.07Å; H706-L710 PolarHBondContact O-N 2.91Å
707	A	60.5	Low	85.6	Confident	90 Å²	90	41.5 Å²	41.5	74%	0.744	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-11	-165.7	0	0	0	0	0	116.3
708	E	62.7	Low	85.5	Confident	157 Å²	157	41.4 Å²	41.4	73%	0.734	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-29.4	177.6	-59.2	-172.4	169.4	0	0	112.4	H706 T736	H706-E708 PolarHBondContact O-N 3.2Å; E708-T736 PolarHBondContact O-OG1 3.34Å
709	N	72.6	Confident	85.2	Confident	81 Å²	81	46.1 Å²	46.1	43%	0.433	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-25.7	-179.1	-69.7	-20.5	0	0	0	113.6	D704 H706 V711	D704-N709 WeakPolarHBondContact OD1-CB 3.46Å; D704-N709 PolarHBondContact OD1-ND2 2.9Å; H706-N709 PolarHBondContact O-N 3.15Å; H706-N709 VanDerWaalsContact O-N 3.07Å; N709-V711 PolarHBondContact O-N 2.67Å
710	L	88.2	Confident	84.6	Confident	59 Å²	59	45.4 Å²	45.4	31%	0.309	27%	0.265	S	S	.	.			trans	-68.9	115.1	-176.5	-176.5	64.8	0	0	0	111.8	V701 H706 G735	V701-L710 HydrophobicContact CG1-CD1 3.7Å; H706-L710 PolarHBondContact O-N 2.91Å; L710-G735 WeakPolarHBondContact O-CA 3.49Å
711	V	91.9	Very high	83.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	142.7	178.5	-174.4	0	0	0	0	110.3	V701 H702 N709 W713 S734 A739 F740	V701-V711 WeakPolarHBondContact CA-O 3.46Å; H702-V711 PolarHBondContact N-O 3.01Å; H702-V711 VanDerWaalsContact N-O 3.14Å; H702-V711 PolarHBondContact O-N 3.16Å; N709-V711 PolarHBondContact O-N 2.67Å; V711-W713 HydrophobicContact CB-CE3 4.32Å; V711-W713 HydrophobicContact CB-CZ3 4.39Å; V711-W713 HydrophobicContact CG1-CE3 3.85Å; V711-W713 HydrophobicContact CG1-CZ3 4.37Å; V711-S734 WeakPolarHBondContact CG1-O 3.44Å; V711-A739 HydrophobicContact CG2-CB 3.43Å; V711-A739 VanDerWaalsContact CG2-CB 3.43Å; V711-F740 HydrophobicContact CG1-CB 3.78Å; V711-F740 HydrophobicContact CG1-CD2 3.91Å; V711-F740 HydrophobicContact CG1-CG 4.3Å
712	Q	93.4	Very high	82.2	Confident	34 Å²	34	59.2 Å²	59.2	16%	0.159	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	134.3	169.5	-52.8	-169.6	-31.6	0	0	109.6	F699 C700 V701 I733 S734	F699-Q712 HydrophobicContact CE2-CB 4.03Å; F699-Q712 HydrophobicContact CZ-CB 3.79Å; F699-Q712 HydrophobicContact CZ-CG 4.25Å; C700-Q712 WeakPolarHBondContact O-CA 3.41Å; V701-Q712 HydrophobicContact CG1-CG 4.23Å; V701-Q712 HydrophobicContact CG2-CG 4.07Å; Q712-I733 WeakPolarHBondContact O-CA 2.97Å; Q712-I733 WeakPolarHBondContact O-CB 3.35Å; Q712-I733 PolarHBondContact O-N 3Å; Q712-S734 WeakPolarHBondContact CB-OG 3.41Å; Q712-S734 WeakPolarHBondContact CG-OG 3.2Å; Q712-S734 PolarHBondContact N-O 3.01Å; Q712-S734 PolarHBondContact O-N 3.26Å
713	W	94.1	Very high	81	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	164	-177.5	70.8	101.7	0	0	0	112.5	L683 C688 F699 C700 H702 V711 M715 K731 F740 I743 I747	L683-W713 HydrophobicContact CD2-CZ2 3.95Å; C688-W713 HydrophobicContact CB-CH2 4.29Å; F699-W713 WeakPolarHBondContact CA-O 3.49Å; C700-W713 HydrophobicContact CB-CD2 3.79Å; C700-W713 VanDerWaalsContact CB-CE2 3.42Å; C700-W713 HydrophobicContact CB-CE3 4.15Å; C700-W713 HydrophobicContact CB-CG 4.36Å; C700-W713 HydrophobicContact CB-CH2 3.9Å; C700-W713 HydrophobicContact CB-CZ2 3.49Å; C700-W713 VanDerWaalsContact CB-CZ2 3.49Å; C700-W713 HydrophobicContact CB-CZ3 4.21Å; C700-W713 PolarHBondContact N-O 3.27Å; C700-W713 PolarHBondContact O-N 3.37Å; H702-W713 HydrophobicContact CB-CH2 3.63Å; H702-W713 HydrophobicContact CB-CZ3 3.69Å; V711-W713 HydrophobicContact CB-CE3 4.32Å; V711-W713 HydrophobicContact CB-CZ3 4.39Å; V711-W713 HydrophobicContact CG1-CE3 3.85Å; V711-W713 HydrophobicContact CG1-CZ3 4.37Å; W713-M715 VanDerWaalsContact NE1-CG 3.3Å; W713-M715 PolarHBondContact NE1-SD 3.03Å; W713-M715 VanDerWaalsContact NE1-SD 3.44Å; W713-K731 CarbonylContact C-O 3.55Å; W713-K731 VanDerWaalsContact CA-O 3.29Å; W713-K731 WeakPolarHBondContact CA-O 3.2Å; W713-K731 VanDerWaalsContact CB-O 3.28Å; W713-K731 WeakPolarHBondContact CB-O 3.46Å; W713-F740 HydrophobicContact CB-CD2 3.98Å; W713-F740 HydrophobicContact CB-CE2 3.53Å; W713-F740 HydrophobicContact CB-CZ 4.49Å; W713-F740 HydrophobicContact CD2-CE2 4.4Å; W713-F740 HydrophobicContact CG-CD2 4.22Å; W713-F740 AromaticContact CG-CE2 3.72Å; W713-F740 HydrophobicContact CG-CE2 3.72Å; W713-I743 HydrophobicContact CH2-CG1 3.94Å; W713-I743 HydrophobicContact CH2-CG2 4.19Å; W713-I743 HydrophobicContact CZ2-CG1 4.33Å; W713-I743 HydrophobicContact CZ3-CG2 4.2Å; W713-I747 HydrophobicContact CH2-CD1 4.44Å; W713-I747 HydrophobicContact CZ2-CD1 3.64Å
714	E	93.6	Very high	80.6	Confident	5 Å²	5	63.1 Å²	63.1	2%	0.023	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	140.5	167.9	-67.4	-174.5	132.4	0	0	110	K60 L697 L698 F699 F730 K731 I733	K60-E714 VanDerWaalsContact CD-OE1 3.32Å; K60-E714 WeakPolarHBondContact CD-OE1 3.22Å; K60-E714 WeakPolarHBondContact CE-OE1 3.48Å; K60-E714 IonicContact NZ-OE1 2.89Å; K60-E714 PolarHBondContact NZ-OE1 3.4Å; K60-E714 IonicContact NZ-OE2 3.02Å; K60-E714 PolarHBondContact NZ-OE2 2.99Å; L697-E714 HydrophobicContact CD1-CB 4.04Å; L697-E714 HydrophobicContact CD1-CG 4.41Å; L698-E714 WeakPolarHBondContact O-CA 3.21Å; F699-E714 HydrophobicContact CD2-CG 4.5Å; E714-F730 WeakPolarHBondContact O-CA 3.19Å; E714-K731 HydrophobicContact CB-CB 4.45Å; E714-K731 PolarHBondContact N-O 2.75Å; E714-K731 PolarHBondContact O-N 3.07Å; E714-I733 HydrophobicContact CG-CD1 4Å; E714-I733 HydrophobicContact CG-CG1 3.96Å
715	M	94.6	Very high	81.4	Confident	1 Å²	1	62 Å²	62	1%	0.005	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	123.8	165.9	-69.8	-174.2	62.3	0	0	109.5	I679 L683 L697 L698 W713 V728 R729 F730 I747	I679-M715 HydrophobicContact CG1-CE 4.2Å; I679-M715 HydrophobicContact CG2-CE 3.63Å; I679-M715 HydrophobicContact CG2-SD 4.27Å; L683-M715 HydrophobicContact CD1-SD 4.26Å; L683-M715 HydrophobicContact CD2-SD 4.04Å; L683-M715 HydrophobicContact CG-SD 4.47Å; L697-M715 WeakPolarHBondContact CA-O 3.45Å; L698-M715 PolarHBondContact N-O 3.24Å; L698-M715 PolarHBondContact O-N 3.07Å; W713-M715 VanDerWaalsContact NE1-CG 3.3Å; W713-M715 PolarHBondContact NE1-SD 3.03Å; W713-M715 VanDerWaalsContact NE1-SD 3.44Å; M715-V728 HydrophobicContact CE-CG1 3.78Å; M715-R729 WeakPolarHBondContact CA-O 3.47Å; M715-F730 HydrophobicContact CE-CD1 4.24Å; M715-F730 HydrophobicContact CE-CE1 3.49Å; M715-F730 VanDerWaalsContact CE-CE1 3.49Å; M715-F730 HydrophobicContact CE-CE2 4.32Å; M715-F730 HydrophobicContact CE-CZ 3.54Å; M715-F730 HydrophobicContact CG-CD1 3.96Å; M715-F730 HydrophobicContact CG-CE1 4.12Å; M715-F730 HydrophobicContact SD-CD1 4.13Å; M715-F730 HydrophobicContact SD-CE1 3.71Å; M715-F730 HydrophobicContact SD-CZ 4.38Å; M715-I747 HydrophobicContact CE-CG2 3.96Å; M715-I747 HydrophobicContact SD-CG2 4.37Å
716	E	94.4	Very high	82.9	Confident	5 Å²	5	59.2 Å²	59.2	2%	0.023	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	128.6	-174.5	-163.8	-178.5	173.8	0	0	111.1	R656 F696 L697 C718 V728 R729	R656-E716 IonicContact CZ-OE1 3.52Å; R656-E716 IonicContact NE-OE1 3.86Å; R656-E716 PolarHBondContact NE-OE1 2.76Å; R656-E716 VanDerWaalsContact NH2-CD 3.32Å; R656-E716 IonicContact NH2-OE1 2.95Å; R656-E716 PolarHBondContact NH2-OE1 2.79Å; R656-E716 IonicContact NH2-OE2 2.65Å; F696-E716 CarbonylContact O-C 3.55Å; F696-E716 VanDerWaalsContact O-CA 3.27Å; F696-E716 WeakPolarHBondContact O-CA 3.03Å; L697-E716 HydrophobicContact CD1-CB 3.7Å; L697-E716 HydrophobicContact CD1-CG 3.88Å; E716-C718 VanDerWaalsContact CD-SG 3.56Å; E716-C718 VanDerWaalsContact CG-SG 3.58Å; E716-V728 CarbonylContact O-C 3.55Å; E716-V728 WeakPolarHBondContact O-CA 3.14Å; E716-R729 HydrophobicContact CB-CB 4.26Å; E716-R729 PolarHBondContact N-O 3.39Å; E716-R729 PolarHBondContact O-N 3.27Å
717	V	94.7	Very high	84.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	115.4	167.2	178.5	0	0	0	0	108.3	P655 P672 M675 M676 I679 F696 N726 V728	P655-V717 WeakPolarHBondContact CB-O 3.16Å; P655-V717 HydrophobicContact CG-CG1 4.48Å; P672-V717 HydrophobicContact CB-CG1 4.07Å; M675-V717 HydrophobicContact CB-CG1 4.41Å; M675-V717 HydrophobicContact CB-CG2 4.03Å; M675-V717 HydrophobicContact CE-CG1 4.32Å; M675-V717 HydrophobicContact SD-CG1 3.8Å; M676-V717 HydrophobicContact CG-CG2 4Å; M676-V717 HydrophobicContact SD-CB 4.47Å; M676-V717 HydrophobicContact SD-CG2 3.76Å; I679-V717 HydrophobicContact CD1-CG2 3.55Å; F696-V717 HydrophobicContact CB-CB 4.17Å; F696-V717 PolarHBondContact O-N 2.84Å; V717-N726 HydrophobicContact CG1-CB 4.14Å; V717-V728 HydrophobicContact CG2-CG2 4.49Å
718	C	91.9	Very high	85.8	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	145.3	-173.3	-64.1	0	0	0	0	110.6	R656 F660 E716 N726 G727	R656-C718 CarbonylContact O-C 3.59Å; R656-C718 WeakPolarHBondContact O-CA 3.37Å; F660-C718 HydrophobicContact CD1-CB 4.19Å; F660-C718 HydrophobicContact CE1-CB 3.4Å; F660-C718 HydrophobicContact CZ-CB 4Å; E716-C718 VanDerWaalsContact CD-SG 3.56Å; E716-C718 VanDerWaalsContact CG-SG 3.58Å; C718-N726 CarbonylContact O-C 3.59Å; C718-N726 WeakPolarHBondContact O-CA 3.27Å; C718-G727 PolarHBondContact N-O 3.01Å; C718-G727 PolarHBondContact O-N 2.88Å
719	K	90	Very high	87	Confident	99 Å²	99	42.4 Å²	42.4	43%	0.43	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	129.8	169.9	-175.4	174.1	-176.5	176.7	0	109.6	P655 R656 P721	P655-K719 HydrophobicContact CB-CB 4.26Å; R656-K719 PolarHBondContact O-N 2.66Å; K719-P721 WeakPolarHBondContact O-CD 3.47Å
720	L	83.8	Confident	87.9	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-84.6	119.8	178.8	-59.7	-175.2	0	0	0	111	F660 W662 T667 L723 L725	F660-L720 HydrophobicContact CD1-CD2 4.44Å; F660-L720 HydrophobicContact CE1-CD2 3.47Å; F660-L720 VanDerWaalsContact CE1-CD2 3.47Å; F660-L720 HydrophobicContact CZ-CD2 3.63Å; W662-L720 HydrophobicContact CB-CD1 4.08Å; W662-L720 HydrophobicContact CB-CD2 3.66Å; W662-L720 HydrophobicContact CD2-CD1 3.84Å; W662-L720 HydrophobicContact CE3-CD1 4.07Å; W662-L720 HydrophobicContact CG-CD1 3.83Å; W662-L720 HydrophobicContact CG-CD2 3.8Å; W662-L720 HydrophobicContact CG-CG 4.46Å; T667-L720 HydrophobicContact CG2-CD1 3.42Å; T667-L720 VanDerWaalsContact CG2-CD1 3.42Å; L720-L723 HydrophobicContact CB-CB 4.28Å; L720-L723 HydrophobicContact CB-CD1 4.41Å; L720-L723 HydrophobicContact CD1-CD1 3.97Å; L720-L723 PolarHBondContact O-N 2.67Å; L720-L725 WeakPolarHBondContact CB-O 3.4Å; L720-L725 PolarHBondContact N-O 3.05Å
721	P	70.2	Confident	87.8	Confident	61 Å²	61	38.3 Å²	38.3	40%	0.396	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	142	173.4	-24.9	34.9	0	0	0	111.6	L658 K719 L723	L658-P721 WeakPolarHBondContact O-CD 3.38Å; K719-P721 WeakPolarHBondContact O-CD 3.47Å; P721-L723 PolarHBondContact O-N 2.81Å; P721-L723 VanDerWaalsContact O-N 3.07Å
722	R	70.5	Confident	87.7	Confident	256 Å²	256	40.2 Å²	40.2	97%	0.966	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.6	-16.5	178.4	-48.7	174.6	-178.3	171.8	-0	117.2
723	L	69.9	Low	87.5	Confident	79 Å²	79	38.8 Å²	38.8	41%	0.414	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-21.4	179	-67.2	179.9	0	0	0	114.4	W662 L720 P721 L725	W662-L723 HydrophobicContact CD2-CD1 4.49Å; W662-L723 HydrophobicContact CH2-CD1 3.67Å; W662-L723 HydrophobicContact CZ2-CD1 3.61Å; W662-L723 HydrophobicContact CZ3-CD1 4.13Å; L720-L723 HydrophobicContact CB-CB 4.28Å; L720-L723 HydrophobicContact CB-CD1 4.41Å; L720-L723 HydrophobicContact CD1-CD1 3.97Å; L720-L723 PolarHBondContact O-N 2.67Å; P721-L723 PolarHBondContact O-N 2.81Å; P721-L723 VanDerWaalsContact O-N 3.07Å; L723-L725 HydrophobicContact CB-CB 4.27Å; L723-L725 HydrophobicContact CB-CD1 4.49Å; L723-L725 HydrophobicContact CB-CG 4.26Å; L723-L725 PolarHBondContact O-N 3.32Å; L723-L725 VanDerWaalsContact O-N 3.15Å
724	S	79.5	Confident	87.2	Confident	102 Å²	102	39.7 Å²	39.7	71%	0.713	19%	0.193	S	C	*	.			trans	58.4	16.9	-170.1	-61.1	0	0	0	0	114.6
725	L	89.4	Confident	86.8	Confident	56 Å²	56	40.5 Å²	40.5	29%	0.293	20%	0.203	S	C	.	.			trans	-101.8	165.4	173.1	-60.6	179.8	0	0	0	110.5	T667 L720 L723	T667-L725 HydrophobicContact CG2-CB 3.96Å; T667-L725 HydrophobicContact CG2-CD1 3.79Å; L720-L725 WeakPolarHBondContact CB-O 3.4Å; L720-L725 PolarHBondContact N-O 3.05Å; L723-L725 HydrophobicContact CB-CB 4.27Å; L723-L725 HydrophobicContact CB-CD1 4.49Å; L723-L725 HydrophobicContact CB-CG 4.26Å; L723-L725 PolarHBondContact O-N 3.32Å; L723-L725 VanDerWaalsContact O-N 3.15Å
726	N	91.8	Very high	86.1	Confident	23 Å²	23	43 Å²	43	12%	0.123	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	152.7	170.5	-58.1	-56.9	0	0	0	109.5	T667 S668 M670 P672 M675 V717 C718	T667-N726 CarbonylContact C-O 3.59Å; T667-N726 WeakPolarHBondContact CA-O 3.41Å; S668-N726 PolarHBondContact N-O 2.75Å; S668-N726 PolarHBondContact O-N 3.03Å; M670-N726 PolarHBondContact O-ND2 3.41Å; P672-N726 WeakPolarHBondContact CG-ND2 3.32Å; M675-N726 HydrophobicContact CE-CB 4.27Å; M675-N726 HydrophobicContact SD-CB 3.5Å; M675-N726 VanDerWaalsContact SD-CB 3.5Å; V717-N726 HydrophobicContact CG1-CB 4.14Å; C718-N726 CarbonylContact O-C 3.59Å; C718-N726 WeakPolarHBondContact O-CA 3.27Å
727	G	91.5	Very high	85.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	146.9	177.4	0	0	0	0	0	112.7	T666 C718	T666-G727 CarbonylContact O-C 3.6Å; T666-G727 WeakPolarHBondContact O-CA 3.45Å; C718-G727 PolarHBondContact N-O 3.01Å; C718-G727 PolarHBondContact O-N 2.88Å
728	V	92.9	Very high	84.6	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.012	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	116	177.8	-165.8	0	0	0	0	109.8	T666 M675 I679 M715 E716 V717 F730 L751 L753	T666-V728 PolarHBondContact O-N 3.06Å; T666-V728 PolarHBondContact OG1-O 2.68Å; M675-V728 HydrophobicContact CE-CG2 3.98Å; I679-V728 HydrophobicContact CD1-CG1 3.89Å; I679-V728 HydrophobicContact CD1-CG2 3.81Å; I679-V728 HydrophobicContact CG1-CG2 4.39Å; M715-V728 HydrophobicContact CE-CG1 3.78Å; E716-V728 CarbonylContact O-C 3.55Å; E716-V728 WeakPolarHBondContact O-CA 3.14Å; V717-V728 HydrophobicContact CG2-CG2 4.49Å; V728-F730 HydrophobicContact CB-CE2 4.23Å; V728-F730 HydrophobicContact CG1-CD2 4.38Å; V728-F730 HydrophobicContact CG1-CE2 3.92Å; V728-F730 HydrophobicContact CG1-CZ 4.39Å; V728-L751 HydrophobicContact CG2-CD1 4.47Å; V728-L753 HydrophobicContact CG2-CD1 3.57Å
729	R	89.2	Confident	84.3	Confident	25 Å²	25	48.6 Å²	48.6	9%	0.094	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	134.1	168.3	-177.5	-174.1	-173.1	-179.2	11.4	109.3	S136 F660 M715 E716	S136-R729 PolarHBondContact O-NH2 3.41Å; F660-R729 HydrophobicContact CD2-CB 3.72Å; F660-R729 HydrophobicContact CD2-CG 3.72Å; F660-R729 HydrophobicContact CE1-CB 4.41Å; F660-R729 HydrophobicContact CE2-CB 3.56Å; F660-R729 HydrophobicContact CE2-CG 4.1Å; F660-R729 HydrophobicContact CG-CB 4.22Å; F660-R729 HydrophobicContact CG-CG 4.08Å; F660-R729 HydrophobicContact CZ-CB 3.93Å; M715-R729 WeakPolarHBondContact CA-O 3.47Å; E716-R729 HydrophobicContact CB-CB 4.26Å; E716-R729 PolarHBondContact N-O 3.39Å; E716-R729 PolarHBondContact O-N 3.27Å
730	F	90.5	Very high	84.2	Confident	35 Å²	35	44 Å²	44	15%	0.154	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	144.3	164.8	-62.8	-110.5	0	0	0	107.9	T666 E714 M715 V728 F740 A744 I747 A748 L751	T666-F730 HydrophobicContact CG2-CE2 4.11Å; E714-F730 WeakPolarHBondContact O-CA 3.19Å; M715-F730 HydrophobicContact CE-CD1 4.24Å; M715-F730 HydrophobicContact CE-CE1 3.49Å; M715-F730 VanDerWaalsContact CE-CE1 3.49Å; M715-F730 HydrophobicContact CE-CE2 4.32Å; M715-F730 HydrophobicContact CE-CZ 3.54Å; M715-F730 HydrophobicContact CG-CD1 3.96Å; M715-F730 HydrophobicContact CG-CE1 4.12Å; M715-F730 HydrophobicContact SD-CD1 4.13Å; M715-F730 HydrophobicContact SD-CE1 3.71Å; M715-F730 HydrophobicContact SD-CZ 4.38Å; V728-F730 HydrophobicContact CB-CE2 4.23Å; V728-F730 HydrophobicContact CG1-CD2 4.38Å; V728-F730 HydrophobicContact CG1-CE2 3.92Å; V728-F730 HydrophobicContact CG1-CZ 4.39Å; F730-F740 HydrophobicContact CB-CZ 4.01Å; F730-A744 HydrophobicContact CD1-CB 3.83Å; F730-A744 HydrophobicContact CE1-CB 4.24Å; F730-A744 HydrophobicContact CG-CB 4.47Å; F730-I747 HydrophobicContact CE1-CB 4.26Å; F730-I747 HydrophobicContact CE1-CG2 3.95Å; F730-I747 HydrophobicContact CZ-CG2 4Å; F730-A748 HydrophobicContact CE2-CB 4.25Å; F730-A748 HydrophobicContact CZ-CB 4.06Å; F730-L751 HydrophobicContact CZ-CD1 4.18Å
731	K	86.9	Confident	84.1	Confident	19 Å²	19	46.3 Å²	46.3	8%	0.083	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	121.4	175	179.4	-168.1	169.5	-171.6	0	110.7	W713 E714	W713-K731 CarbonylContact C-O 3.55Å; W713-K731 VanDerWaalsContact CA-O 3.29Å; W713-K731 WeakPolarHBondContact CA-O 3.2Å; W713-K731 VanDerWaalsContact CB-O 3.28Å; W713-K731 WeakPolarHBondContact CB-O 3.46Å; E714-K731 HydrophobicContact CB-CB 4.45Å; E714-K731 PolarHBondContact N-O 2.75Å; E714-K731 PolarHBondContact O-N 3.07Å
732	R	89.8	Confident	84.9	Confident	40 Å²	40	48.1 Å²	48.1	15%	0.151	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	145.3	177.2	-161.6	174.9	63.5	91.5	-1.1	111.6	E139 D142 G735 S737 F740	E139-R732 IonicContact OE1-CZ 3.59Å; E139-R732 IonicContact OE1-NE 3.51Å; E139-R732 PolarHBondContact OE1-NE 2.79Å; E139-R732 IonicContact OE1-NH2 2.78Å; E139-R732 PolarHBondContact OE1-NH2 3.1Å; E139-R732 IonicContact OE2-CZ 3.27Å; E139-R732 IonicContact OE2-NE 2.88Å; E139-R732 PolarHBondContact OE2-NE 3.2Å; E139-R732 IonicContact OE2-NH2 2.82Å; E139-R732 PolarHBondContact OE2-NH2 3.06Å; D142-R732 PolarHBondContact OD2-N 3.19Å; R732-G735 PolarHBondContact NH1-O 3.45Å; R732-S737 VanDerWaalsContact CZ-OG 3.3Å; R732-S737 PolarHBondContact NE-OG 3.46Å; R732-F740 HydrophobicContact CB-CD1 3.87Å; R732-F740 HydrophobicContact CB-CD2 4.31Å; R732-F740 HydrophobicContact CB-CE1 3.95Å; R732-F740 HydrophobicContact CB-CE2 4.39Å; R732-F740 HydrophobicContact CB-CG 4.05Å; R732-F740 HydrophobicContact CB-CZ 4.21Å; R732-F740 HydrophobicContact CG-CB 4.09Å; R732-F740 HydrophobicContact CG-CD1 4.09Å; R732-F740 HydrophobicContact CG-CD2 4.25Å; R732-F740 HydrophobicContact CG-CG 3.87Å
733	I	88.5	Confident	85.9	Confident	5 Å²	5	36.3 Å²	36.3	3%	0.026	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	-37	174.7	-58.6	-66	0	0	0	111.2	G63 K64 F699 Q712 E714	G63-I733 CarbonylContact C-O 3.54Å; G63-I733 WeakPolarHBondContact CA-O 3.46Å; K64-I733 HydrophobicContact CG-CG2 4.35Å; K64-I733 PolarHBondContact N-O 2.88Å; F699-I733 HydrophobicContact CE2-CB 4.37Å; F699-I733 HydrophobicContact CE2-CG1 4.36Å; F699-I733 HydrophobicContact CE2-CG2 4.25Å; Q712-I733 WeakPolarHBondContact O-CA 2.97Å; Q712-I733 WeakPolarHBondContact O-CB 3.35Å; Q712-I733 PolarHBondContact O-N 3Å; E714-I733 HydrophobicContact CG-CD1 4Å; E714-I733 HydrophobicContact CG-CG1 3.96Å
734	S	87.7	Confident	86.9	Confident	18 Å²	18	32.7 Å²	32.7	13%	0.126	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	174.1	170.4	69.5	0	0	0	0	112	V711 Q712	V711-S734 WeakPolarHBondContact CG1-O 3.44Å; Q712-S734 WeakPolarHBondContact CB-OG 3.41Å; Q712-S734 WeakPolarHBondContact CG-OG 3.2Å; Q712-S734 PolarHBondContact N-O 3.01Å; Q712-S734 PolarHBondContact O-N 3.26Å
735	G	84.6	Confident	87.3	Confident	23 Å²	23	29.5 Å²	29.5	24%	0.237	16%	0.162	C	C	.	.	S	Bend	trans	88.8	167.6	-173.6	0	0	0	0	0	112.5	L710 R732	L710-G735 WeakPolarHBondContact O-CA 3.49Å; R732-G735 PolarHBondContact NH1-O 3.45Å
736	T	80.9	Confident	87.3	Confident	54 Å²	54	31.4 Å²	31.4	33%	0.331	17%	0.168	S	C	.	.			trans	-69.6	143.7	-177.6	67	0	0	0	0	111.4	E708 I738 A739 F740	E708-T736 PolarHBondContact O-OG1 3.34Å; T736-I738 VanDerWaalsContact C-N 3.26Å; T736-I738 PolarHBondContact O-N 3.2Å; T736-A739 PolarHBondContact O-N 3.16Å; T736-A739 VanDerWaalsContact OG1-CB 3.22Å; T736-A739 WeakPolarHBondContact OG1-CB 3.37Å; T736-A739 PolarHBondContact OG1-N 2.96Å; T736-F740 PolarHBondContact O-N 3.06Å
737	S	77.8	Confident	87.4	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.014	16%	0.162	C	C	.	.	H	α-helix	trans	-64.4	-30.2	179.3	-80.7	0	0	0	0	112.9	F141 E182 R732 F740 K741	F141-S737 WeakPolarHBondContact CE1-O 3.26Å; F141-S737 VanDerWaalsContact CZ-O 3.28Å; F141-S737 WeakPolarHBondContact CZ-O 3.45Å; E182-S737 WeakPolarHBondContact CG-OG 3.49Å; R732-S737 VanDerWaalsContact CZ-OG 3.3Å; R732-S737 PolarHBondContact NE-OG 3.46Å; S737-F740 PolarHBondContact O-N 3.23Å; S737-K741 WeakPolarHBondContact O-CB 3.39Å; S737-K741 PolarHBondContact O-N 3.05Å
738	I	79.7	Confident	87.4	Confident	100 Å²	100	31.2 Å²	31.2	51%	0.513	17%	0.169	S	C	.	.	H	α-helix	trans	-67.2	-42.2	172.6	-172.8	58.7	0	0	0	112.6	T736 K741 N742	T736-I738 VanDerWaalsContact C-N 3.26Å; T736-I738 PolarHBondContact O-N 3.2Å; I738-K741 WeakPolarHBondContact O-CB 3.4Å; I738-K741 PolarHBondContact O-N 3.12Å; I738-N742 PolarHBondContact O-N 2.81Å; I738-N742 VanDerWaalsContact O-N 3.13Å; I738-N742 PolarHBondContact O-ND2 3.23Å; I738-N742 PolarHBondContact O-OD1 3.41Å
739	A	84.4	Confident	87.3	Confident	20 Å²	20	35.9 Å²	35.9	17%	0.165	19%	0.194	C	C	.	.	H	α-helix	trans	-65.3	-42.2	174.7	0	0	0	0	0	111.2	V711 T736 K741 N742 I743	V711-A739 HydrophobicContact CG2-CB 3.43Å; V711-A739 VanDerWaalsContact CG2-CB 3.43Å; T736-A739 PolarHBondContact O-N 3.16Å; T736-A739 VanDerWaalsContact OG1-CB 3.22Å; T736-A739 WeakPolarHBondContact OG1-CB 3.37Å; T736-A739 PolarHBondContact OG1-N 2.96Å; A739-K741 PolarHBondContact O-N 3.26Å; A739-N742 PolarHBondContact O-N 2.78Å; A739-I743 PolarHBondContact O-N 3.4Å; A739-I743 VanDerWaalsContact O-N 3.14Å
740	F	87.8	Confident	87.5	Confident	3 Å²	3	38.3 Å²	38.3	1%	0.013	21%	0.206	C	C	.	.	H	α-helix	trans	-59.4	-45.5	173.9	175.6	-114.6	0	0	0	112.3	D142 V711 W713 F730 R732 T736 S737 N742 I743 A744	D142-F740 WeakPolarHBondContact OD1-CE1 3.37Å; V711-F740 HydrophobicContact CG1-CB 3.78Å; V711-F740 HydrophobicContact CG1-CD2 3.91Å; V711-F740 HydrophobicContact CG1-CG 4.3Å; W713-F740 HydrophobicContact CB-CD2 3.98Å; W713-F740 HydrophobicContact CB-CE2 3.53Å; W713-F740 HydrophobicContact CB-CZ 4.49Å; W713-F740 HydrophobicContact CD2-CE2 4.4Å; W713-F740 HydrophobicContact CG-CD2 4.22Å; W713-F740 AromaticContact CG-CE2 3.72Å; W713-F740 HydrophobicContact CG-CE2 3.72Å; F730-F740 HydrophobicContact CB-CZ 4.01Å; R732-F740 HydrophobicContact CB-CD1 3.87Å; R732-F740 HydrophobicContact CB-CD2 4.31Å; R732-F740 HydrophobicContact CB-CE1 3.95Å; R732-F740 HydrophobicContact CB-CE2 4.39Å; R732-F740 HydrophobicContact CB-CG 4.05Å; R732-F740 HydrophobicContact CB-CZ 4.21Å; R732-F740 HydrophobicContact CG-CB 4.09Å; R732-F740 HydrophobicContact CG-CD1 4.09Å; R732-F740 HydrophobicContact CG-CD2 4.25Å; R732-F740 HydrophobicContact CG-CG 3.87Å; T736-F740 PolarHBondContact O-N 3.06Å; S737-F740 PolarHBondContact O-N 3.23Å; F740-N742 VanDerWaalsContact C-N 3.27Å; F740-N742 PolarHBondContact O-N 3.2Å; F740-I743 PolarHBondContact O-N 2.69Å; F740-A744 HydrophobicContact CD2-CB 4.24Å; F740-A744 HydrophobicContact CE2-CB 3.89Å; F740-A744 HydrophobicContact CZ-CB 4.09Å; F740-A744 WeakPolarHBondContact O-CB 3.41Å; F740-A744 PolarHBondContact O-N 3.08Å
741	K	82.9	Confident	87.6	Confident	50 Å²	50	37.3 Å²	37.3	22%	0.217	20%	0.203	C	C	.	.	H	α-helix	trans	-53.5	-46.4	174.6	-178.8	165.5	-176.7	174.1	0	111.4	F141 V145 G249 S737 I738 A739 S745	F141-K741 HydrophobicContact CE1-CB 3.86Å; F141-K741 HydrophobicContact CE1-CD 4.34Å; F141-K741 HydrophobicContact CZ-CB 3.95Å; F141-K741 HydrophobicContact CZ-CD 3.91Å; V145-K741 HydrophobicContact CG1-CB 4.49Å; V145-K741 HydrophobicContact CG1-CG 4.25Å; V145-K741 HydrophobicContact CG2-CB 3.79Å; V145-K741 HydrophobicContact CG2-CD 4.28Å; V145-K741 HydrophobicContact CG2-CG 3.88Å; G249-K741 PolarHBondContact O-NZ 3.1Å; S737-K741 WeakPolarHBondContact O-CB 3.39Å; S737-K741 PolarHBondContact O-N 3.05Å; I738-K741 WeakPolarHBondContact O-CB 3.4Å; I738-K741 PolarHBondContact O-N 3.12Å; A739-K741 PolarHBondContact O-N 3.26Å; K741-S745 WeakPolarHBondContact O-CB 3.23Å; K741-S745 PolarHBondContact O-N 3.43Å; K741-S745 PolarHBondContact O-OG 3.24Å
742	N	87.2	Confident	87.9	Confident	99 Å²	99	44 Å²	44	53%	0.529	23%	0.232	S	C	.	.	H	α-helix	trans	-65.4	-51.4	-175.4	-66.2	-15.9	0	0	0	111.4	I738 A739 F740 K746	I738-N742 PolarHBondContact O-N 2.81Å; I738-N742 VanDerWaalsContact O-N 3.13Å; I738-N742 PolarHBondContact O-ND2 3.23Å; I738-N742 PolarHBondContact O-OD1 3.41Å; A739-N742 PolarHBondContact O-N 2.78Å; F740-N742 VanDerWaalsContact C-N 3.27Å; F740-N742 PolarHBondContact O-N 3.2Å; N742-K746 WeakPolarHBondContact O-CB 3.22Å; N742-K746 PolarHBondContact O-N 3.16Å; N742-K746 VanDerWaalsContact O-N 3.09Å
743	I	91.3	Very high	87.8	Confident	7 Å²	7	44.9 Å²	44.9	4%	0.036	24%	0.239	C	C	.	.	H	α-helix	trans	-70.8	-43.6	-178.5	-168.3	57.2	0	0	0	112.5	H702 W713 A739 F740 S745 K746 I747	H702-I743 HydrophobicContact CB-CG1 4.18Å; W713-I743 HydrophobicContact CH2-CG1 3.94Å; W713-I743 HydrophobicContact CH2-CG2 4.19Å; W713-I743 HydrophobicContact CZ2-CG1 4.33Å; W713-I743 HydrophobicContact CZ3-CG2 4.2Å; A739-I743 PolarHBondContact O-N 3.4Å; A739-I743 VanDerWaalsContact O-N 3.14Å; F740-I743 PolarHBondContact O-N 2.69Å; I743-S745 PolarHBondContact O-N 2.93Å; I743-K746 PolarHBondContact O-N 3.48Å; I743-I747 HydrophobicContact CD1-CD1 4.23Å; I743-I747 HydrophobicContact CD1-CG1 4.46Å; I743-I747 HydrophobicContact CG1-CD1 3.91Å; I743-I747 WeakPolarHBondContact O-CG1 3.39Å; I743-I747 PolarHBondContact O-N 2.96Å
744	A	90.4	Very high	87.8	Confident	3 Å²	3	46.9 Å²	46.9	3%	0.025	25%	0.249	C	C	.	.	H	α-helix	trans	-65	-39	178.5	0	0	0	0	0	112	V145 F730 F740 A748	V145-A744 HydrophobicContact CG1-CB 4.27Å; F730-A744 HydrophobicContact CD1-CB 3.83Å; F730-A744 HydrophobicContact CE1-CB 4.24Å; F730-A744 HydrophobicContact CG-CB 4.47Å; F740-A744 HydrophobicContact CD2-CB 4.24Å; F740-A744 HydrophobicContact CE2-CB 3.89Å; F740-A744 HydrophobicContact CZ-CB 4.09Å; F740-A744 WeakPolarHBondContact O-CB 3.41Å; F740-A744 PolarHBondContact O-N 3.08Å; A744-A748 WeakPolarHBondContact O-CB 3.2Å; A744-A748 PolarHBondContact O-N 3.37Å
745	S	87.4	Confident	87.8	Confident	36 Å²	36	48.4 Å²	48.4	25%	0.252	26%	0.256	S	S	.	.	H	α-helix	trans	-66.5	-36.2	174.7	-59.3	0	0	0	0	112.4	K741 I743 N749	K741-S745 WeakPolarHBondContact O-CB 3.23Å; K741-S745 PolarHBondContact O-N 3.43Å; K741-S745 PolarHBondContact O-OG 3.24Å; I743-S745 PolarHBondContact O-N 2.93Å; S745-N749 PolarHBondContact O-N 3.37Å; S745-N749 PolarHBondContact O-ND2 3.28Å
746	K	90.6	Very high	88	Confident	96 Å²	96	49.8 Å²	49.8	42%	0.417	26%	0.257	S	S	.	.	H	α-helix	trans	-64	-55	176.8	-172.4	-179.7	175.7	-148.7	0	110.5	N686 N742 I743 A748 N749 E750	N686-K746 WeakPolarHBondContact OD1-CD 3.45Å; N686-K746 WeakPolarHBondContact OD1-CE 3.19Å; N686-K746 PolarHBondContact OD1-NZ 3.1Å; N742-K746 WeakPolarHBondContact O-CB 3.22Å; N742-K746 PolarHBondContact O-N 3.16Å; N742-K746 VanDerWaalsContact O-N 3.09Å; I743-K746 PolarHBondContact O-N 3.48Å; K746-A748 VanDerWaalsContact C-N 3.32Å; K746-A748 PolarHBondContact O-N 3.11Å; K746-N749 PolarHBondContact O-N 2.91Å; K746-E750 WeakPolarHBondContact CE-OE1 3.42Å; K746-E750 VanDerWaalsContact CG-OE1 3.28Å; K746-E750 WeakPolarHBondContact CG-OE1 3.33Å; K746-E750 PolarHBondContact O-N 2.99Å; K746-E750 VanDerWaalsContact O-N 3.17Å
747	I	93.9	Very high	88.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-54.9	-47.2	176.1	-65.3	162.6	0	0	0	110.8	V682 L683 W713 M715 F730 I743 N749 E750 L751	V682-I747 HydrophobicContact CG1-CB 4.38Å; V682-I747 HydrophobicContact CG1-CG1 4.45Å; V682-I747 HydrophobicContact CG1-CG2 3.97Å; L683-I747 HydrophobicContact CD2-CD1 3.7Å; W713-I747 HydrophobicContact CH2-CD1 4.44Å; W713-I747 HydrophobicContact CZ2-CD1 3.64Å; M715-I747 HydrophobicContact CE-CG2 3.96Å; M715-I747 HydrophobicContact SD-CG2 4.37Å; F730-I747 HydrophobicContact CE1-CB 4.26Å; F730-I747 HydrophobicContact CE1-CG2 3.95Å; F730-I747 HydrophobicContact CZ-CG2 4Å; I743-I747 HydrophobicContact CD1-CD1 4.23Å; I743-I747 HydrophobicContact CD1-CG1 4.46Å; I743-I747 HydrophobicContact CG1-CD1 3.91Å; I743-I747 WeakPolarHBondContact O-CG1 3.39Å; I743-I747 PolarHBondContact O-N 2.96Å; I747-N749 PolarHBondContact O-N 3.27Å; I747-N749 VanDerWaalsContact O-N 3.15Å; I747-E750 PolarHBondContact O-N 2.98Å; I747-L751 HydrophobicContact CG2-CD1 4.11Å; I747-L751 HydrophobicContact CG2-CG 4.19Å; I747-L751 WeakPolarHBondContact O-CG 2.88Å; I747-L751 PolarHBondContact O-N 3.24Å
748	A	90.8	Very high	89.1	Confident	18 Å²	18	52.5 Å²	52.5	15%	0.149	27%	0.267	C	S	.	.	H	α-helix	trans	-68.2	-8.2	179.5	0	0	0	0	0	115.4	T666 F730 A744 K746	T666-A748 HydrophobicContact CG2-CB 3.78Å; F730-A748 HydrophobicContact CE2-CB 4.25Å; F730-A748 HydrophobicContact CZ-CB 4.06Å; A744-A748 WeakPolarHBondContact O-CB 3.2Å; A744-A748 PolarHBondContact O-N 3.37Å; K746-A748 VanDerWaalsContact C-N 3.32Å; K746-A748 PolarHBondContact O-N 3.11Å
749	N	90.2	Very high	89.7	Confident	101 Å²	101	49.3 Å²	49.3	54%	0.54	25%	0.251	S	S	.	.	H	α-helix	trans	-98.8	-21.7	169.5	-68.5	-37.3	0	0	0	112.8	K665 S745 K746 I747	K665-N749 PolarHBondContact NZ-OD1 2.97Å; S745-N749 PolarHBondContact O-N 3.37Å; S745-N749 PolarHBondContact O-ND2 3.28Å; K746-N749 PolarHBondContact O-N 2.91Å; I747-N749 PolarHBondContact O-N 3.27Å; I747-N749 VanDerWaalsContact O-N 3.15Å
750	E	94	Very high	90.1	Very high	76 Å²	76	51.4 Å²	51.4	36%	0.355	26%	0.257	S	S	.	.	H	α-helix	trans	-97.2	-20.6	-175.4	-70.9	174.3	-164.6	0	0	113.1	V682 N686 K746 I747 K752	V682-E750 HydrophobicContact CG1-CB 3.88Å; N686-E750 PolarHBondContact ND2-OE2 2.79Å; K746-E750 WeakPolarHBondContact CE-OE1 3.42Å; K746-E750 VanDerWaalsContact CG-OE1 3.28Å; K746-E750 WeakPolarHBondContact CG-OE1 3.33Å; K746-E750 PolarHBondContact O-N 2.99Å; K746-E750 VanDerWaalsContact O-N 3.17Å; I747-E750 PolarHBondContact O-N 2.98Å; E750-K752 PolarHBondContact O-N 3.32Å
751	L	93.4	Very high	90.2	Very high	14 Å²	14	55.2 Å²	55.2	7%	0.073	28%	0.276	C	S	.	.			trans	-56.5	122.1	170.5	-80.3	171.9	0	0	0	112.3	T666 E678 I679 V682 V728 F730 I747 L753	T666-L751 HydrophobicContact CG2-CD1 4.34Å; E678-L751 HydrophobicContact CG-CD2 4.39Å; I679-L751 HydrophobicContact CB-CD2 4.36Å; I679-L751 HydrophobicContact CG1-CD2 3.71Å; V682-L751 HydrophobicContact CB-CD2 4.31Å; V682-L751 HydrophobicContact CG2-CD2 4.19Å; V728-L751 HydrophobicContact CG2-CD1 4.47Å; F730-L751 HydrophobicContact CZ-CD1 4.18Å; I747-L751 HydrophobicContact CG2-CD1 4.11Å; I747-L751 HydrophobicContact CG2-CG 4.19Å; I747-L751 WeakPolarHBondContact O-CG 2.88Å; I747-L751 PolarHBondContact O-N 3.24Å; L751-L753 HydrophobicContact CB-CD1 4.02Å; L751-L753 HydrophobicContact CB-CG 4.11Å; L751-L753 HydrophobicContact CD1-CD1 4.04Å; L751-L753 HydrophobicContact CD2-CD1 4.28Å; L751-L753 HydrophobicContact CD2-CG 4.42Å; L751-L753 HydrophobicContact CG-CD1 4.34Å
752	K	92.1	Very high	90.8	Very high	160 Å²	160	55.6 Å²	55.6	70%	0.696	28%	0.281	S	S	*	.			trans	-103.7	77.4	176.9	-64.4	174.6	-174.1	177.2	0	110	E678 E750	E678-K752 HydrophobicContact CG-CB 4.42Å; E750-K752 PolarHBondContact O-N 3.32Å
753	L	88.8	Confident	91.2	Very high	57 Å²	57	51.6 Å²	51.6	30%	0.298	26%	0.258	S	S	.	.			trans	-104.3	0	-175.7	-60.2	171.8	0	0	0	111.4	S668 M670 M675 E678 V728 L751	S668-L753 WeakPolarHBondContact CB-OXT 3.46Å; S668-L753 PolarHBondContact OG-OXT 3.36Å; M670-L753 HydrophobicContact CE-CD2 4.38Å; M670-L753 HydrophobicContact SD-CD2 4.3Å; M675-L753 HydrophobicContact CB-CD2 4.02Å; M675-L753 HydrophobicContact CE-CD1 3.99Å; M675-L753 HydrophobicContact CE-CD2 4.17Å; M675-L753 HydrophobicContact CG-CD2 4.01Å; E678-L753 HydrophobicContact CB-CD2 4.24Å; E678-L753 HydrophobicContact CG-CD2 4.5Å; V728-L753 HydrophobicContact CG2-CD1 3.57Å; L751-L753 HydrophobicContact CB-CD1 4.02Å; L751-L753 HydrophobicContact CB-CG 4.11Å; L751-L753 HydrophobicContact CD1-CD1 4.04Å; L751-L753 HydrophobicContact CD2-CD1 4.28Å; L751-L753 HydrophobicContact CD2-CG 4.42Å; L751-L753 HydrophobicContact CG-CD1 4.34Å

Retrieved 753 of 753 residues in 1408.9 ms (Link to these results)

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