A0A5K4FCF4_SCHMA Loading...

C2H2-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FCF4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 307 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.3	Very low	40.7	Very low	242 Å²	242	153.3 Å²	153.3	100%	1.192	84%	0.839	S	S	*	*				0	89.2	0	-77.2	157.1	167.4	0	0	108.1	Q3	M1-Q3 PolarHBondContact O-N 3.33Å
2	T	38.8	Very low	40.6	Very low	144 Å²	144	156.5 Å²	156.5	88%	0.883	84%	0.844	S	S	*	*			trans	-87.2	102	-178.7	26.1	0	0	0	0	109.1	R4	T2-R4 PolarHBondContact O-N 3.47Å
3	Q	40.4	Very low	40.7	Very low	186 Å²	186	150.9 Å²	150.9	87%	0.869	82%	0.818	S	S	*	*			trans	-76.3	122.8	173.2	-67.5	-173.1	5.4	0	0	109.2	M1	M1-Q3 PolarHBondContact O-N 3.33Å
4	R	38.3	Very low	40.8	Very low	243 Å²	243	146.4 Å²	146.4	92%	0.917	80%	0.8	S	S	*	*			trans	-68.7	124.6	177.7	-76.8	177.4	175.3	162.2	-2.3	109.3	T2 T6	T2-R4 PolarHBondContact O-N 3.47Å; R4-T6 PolarHBondContact O-N 2.64Å
5	I	41.3	Very low	40.7	Very low	165 Å²	165	148.5 Å²	148.5	85%	0.846	80%	0.802	S	S	*	*			trans	-68.3	115.7	167.3	-59.1	170.2	0	0	0	106.9	S7	I5-S7 PolarHBondContact O-N 3.21Å; I5-S7 VanDerWaalsContact O-N 3.14Å
6	T	38.3	Very low	41	Very low	137 Å²	137	147.8 Å²	147.8	84%	0.84	78%	0.784	S	S	*	*			trans	-65.7	106	173.5	6.5	0	0	0	0	108.9	R4	R4-T6 PolarHBondContact O-N 2.64Å
7	S	40.6	Very low	40.5	Very low	96 Å²	96	146.6 Å²	146.6	67%	0.671	78%	0.777	S	S	*	*			trans	-64.2	130.6	169.8	49.7	0	0	0	0	110	I5 T9	I5-S7 PolarHBondContact O-N 3.21Å; I5-S7 VanDerWaalsContact O-N 3.14Å; S7-T9 PolarHBondContact O-N 2.73Å
8	C	34	Very low	40.3	Very low	118 Å²	118	140.8 Å²	140.8	80%	0.797	75%	0.75	S	S	*	*			trans	-58.9	105.5	166.6	-68.2	0	0	0	0	109.2	V10	C8-V10 PolarHBondContact O-N 3.45Å
9	T	41.2	Very low	40.2	Very low	125 Å²	125	140.2 Å²	140.2	77%	0.767	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-65.1	119.6	168.8	-56.6	0	0	0	0	108	S7 P11	S7-T9 PolarHBondContact O-N 2.73Å; T9-P11 WeakPolarHBondContact O-CD 3.39Å
10	V	43.8	Very low	40.3	Very low	120 Å²	120	136.3 Å²	136.3	73%	0.727	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-63.4	117.8	169.1	-178.3	0	0	0	0	106.8	C8 E12	C8-V10 PolarHBondContact O-N 3.45Å; V10-E12 PolarHBondContact O-N 3.1Å
11	P	43.6	Very low	40	Very low	110 Å²	110	134.9 Å²	134.9	71%	0.714	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-64.4	134.7	175.5	25.6	-30.2	0	0	0	108.8	T9 V13	T9-P11 WeakPolarHBondContact O-CD 3.39Å; P11-V13 PolarHBondContact O-N 3.42Å
12	E	39.5	Very low	40	Very low	192 Å²	192	129.6 Å²	129.6	90%	0.897	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-49.7	128.6	173.7	-81.2	175.1	127.2	0	0	110	V10 P14	V10-E12 PolarHBondContact O-N 3.1Å; E12-P14 WeakPolarHBondContact O-CD 3.43Å
13	V	42.4	Very low	40	Very low	84 Å²	84	130.1 Å²	130.1	51%	0.509	71%	0.708	S	S	.	*	P	Polyproline II helix	trans	-66.8	119.2	-175.3	178.8	0	0	0	0	108.8	P11 E15 Y86	P11-V13 PolarHBondContact O-N 3.42Å; V13-E15 PolarHBondContact O-N 3.45Å; V13-Y86 HydrophobicContact CG1-CE1 4.48Å
14	P	41.5	Very low	40.1	Very low	88 Å²	88	124.7 Å²	124.7	57%	0.571	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-72.6	121.8	174.2	27.9	-29	0	0	0	108.5	E12 R16	E12-P14 WeakPolarHBondContact O-CD 3.43Å; P14-R16 PolarHBondContact O-N 3.49Å
15	E	39.6	Very low	40.2	Very low	177 Å²	177	119.4 Å²	119.4	83%	0.827	68%	0.684	S	S	*	*			trans	-58.4	107.2	171.3	-68.7	-164.6	152.8	0	0	109.4	V13 I17	V13-E15 PolarHBondContact O-N 3.45Å; E15-I17 PolarHBondContact O-N 2.87Å
16	R	45.3	Very low	39.8	Very low	137 Å²	137	120.1 Å²	120.1	52%	0.517	68%	0.684	S	S	.	*			trans	-96	95	176.3	-64.5	-163.1	-170.5	-166.8	0.9	109.7	P14 C18 S56	P14-R16 PolarHBondContact O-N 3.49Å; R16-C18 PolarHBondContact O-N 3.29Å; R16-S56 PolarHBondContact NH1-O 3.43Å
17	I	33	Very low	39.6	Very low	128 Å²	128	121.2 Å²	121.2	66%	0.656	68%	0.683	S	S	*	*			trans	-81.1	100.6	175.2	-57.3	170.8	0	0	0	108.3	E15 T19	E15-I17 PolarHBondContact O-N 2.87Å; I17-T19 HydrophobicContact CG2-CG2 3.55Å
18	C	36	Very low	39	Very low	43 Å²	43	120.2 Å²	120.2	29%	0.291	68%	0.676	S	S	.	*			trans	-93.6	83	167.5	174.4	0	0	0	0	108.1	R16 S20 C81	R16-C18 PolarHBondContact O-N 3.29Å; C18-S20 PolarHBondContact O-N 3.02Å; C18-C81 HydrophobicContact CB-CB 4.37Å; C18-C81 WeakPolarHBondContact CB-O 3.47Å; C18-C81 WeakPolarHBondContact CB-SG 3.22Å; C18-C81 WeakPolarHBondContact SG-CB 3.33Å; C18-C81 PolarHBondContact SG-O 2.81Å; C18-C81 CovalentContact SG-SG 2.1Å; C18-C81 PolarHBondContact SG-SG 3.15Å
19	T	38.4	Very low	39.1	Very low	129 Å²	129	120 Å²	120	79%	0.791	67%	0.673	S	S	*	*			trans	-85.3	73.7	171.6	43.6	0	0	0	0	110.1	I17	I17-T19 HydrophobicContact CG2-CG2 3.55Å
20	S	42.2	Very low	38.6	Very low	62 Å²	62	122.7 Å²	122.7	43%	0.434	68%	0.675	S	S	.	*			trans	-129.5	96.3	164.3	62.5	0	0	0	0	111	C18	C18-S20 PolarHBondContact O-N 3.02Å
21	S	35.4	Very low	38	Very low	106 Å²	106	121.7 Å²	121.7	74%	0.741	67%	0.669	S	S	*	*			trans	-58.2	133.8	160.9	-70.9	0	0	0	0	109	D23	S21-D23 PolarHBondContact O-N 2.7Å
22	M	45.7	Very low	37.8	Very low	132 Å²	132	124.7 Å²	124.7	65%	0.65	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	3.8	-167.7	-69	-117.1	148.8	0	0	115.7	R78	M22-R78 HydrophobicContact CE-CG 3.98Å
23	D	40.1	Very low	37.7	Very low	154 Å²	154	121.2 Å²	121.2	82%	0.824	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-2.5	-172	-70.3	-47.1	0	0	0	115.4	S21	S21-D23 PolarHBondContact O-N 2.7Å
24	A	41.1	Very low	37.6	Very low	73 Å²	73	121.5 Å²	121.5	60%	0.603	67%	0.669	S	S	*	*	S	Bend	trans	-101.6	2.1	-174.1	0	0	0	0	0	115.8
25	L	41.1	Very low	37.7	Very low	131 Å²	131	122 Å²	122	69%	0.686	68%	0.675	S	S	*	*			trans	-107.4	56.2	-179.8	-68.8	172.5	0	0	0	111.4	L34	L25-L34 HydrophobicContact CD2-CD1 4.43Å
26	Q	33.8	Very low	37.9	Very low	181 Å²	181	120.2 Å²	120.2	85%	0.846	67%	0.671	S	S	*	*			trans	-81	112.9	154.1	-71.1	-142	-34.7	0	0	108	S28	Q26-S28 PolarHBondContact O-N 2.86Å
27	I	32.9	Very low	38.2	Very low	159 Å²	159	121 Å²	121	82%	0.815	68%	0.678	S	S	*	*			trans	-67.1	93.7	179.5	-59.3	161.2	0	0	0	107.6
28	S	28.9	Very low	39	Very low	75 Å²	75	118.7 Å²	118.7	52%	0.524	67%	0.666	S	S	.	*			trans	-85.3	130.5	165	56.2	0	0	0	0	109.2	Q26 F30	Q26-S28 PolarHBondContact O-N 2.86Å; S28-F30 PolarHBondContact O-N 3.18Å; S28-F30 VanDerWaalsContact O-N 3.08Å
29	P	35	Very low	39.9	Very low	115 Å²	115	119.9 Å²	119.9	75%	0.747	68%	0.679	S	S	*	*	S	Bend	trans	-72.7	1.8	-174.1	-14.2	28.4	0	0	0	115.6
30	F	30.6	Very low	41	Very low	181 Å²	181	120 Å²	120	79%	0.794	67%	0.674	S	S	*	*			trans	-147.3	99.1	-175	-74.6	-90.9	0	0	0	109.2	S28	S28-F30 PolarHBondContact O-N 3.18Å; S28-F30 VanDerWaalsContact O-N 3.08Å
31	T	31.1	Very low	42.5	Very low	99 Å²	99	119.1 Å²	119.1	61%	0.607	67%	0.665	S	S	*	*			trans	179	123.8	150	36.5	0	0	0	0	110.6	T33	T31-T33 PolarHBondContact O-N 3.44Å
32	D	39.4	Very low	44.4	Very low	173 Å²	173	114.7 Å²	114.7	93%	0.925	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-62.5	10.3	178.3	-86.3	-48.2	0	0	0	115.6
33	T	38.3	Very low	46.2	Very low	118 Å²	118	116.3 Å²	116.3	72%	0.724	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-90.9	0.3	-174.5	26.7	0	0	0	0	114.8	T31	T31-T33 PolarHBondContact O-N 3.44Å
34	L	40.7	Very low	48.2	Very low	90 Å²	90	112.6 Å²	112.6	47%	0.471	61%	0.612	S	S	.	*	G	3₁₀ helix	trans	-93.4	2.6	-178.4	-155.9	71.6	0	0	0	114.7	L25 N36 I38	L25-L34 HydrophobicContact CD2-CD1 4.43Å; L34-N36 VanDerWaalsContact C-N 3.32Å; L34-N36 PolarHBondContact O-N 3.39Å; L34-I38 HydrophobicContact CD2-CD1 3.95Å; L34-I38 HydrophobicContact CG-CD1 4.04Å; L34-I38 HydrophobicContact CG-CG1 4.43Å
35	S	43.5	Very low	50.2	Low	99 Å²	99	112.4 Å²	112.4	69%	0.692	60%	0.598	S	S	*	*	H	α-helix	trans	-70.4	-27.6	-178.6	-120.2	0	0	0	0	113.3
36	N	44.2	Very low	52	Low	140 Å²	140	113.3 Å²	113.3	75%	0.749	60%	0.599	S	S	*	*	H	α-helix	trans	-88.3	-18	-171.2	-70.3	-23.6	0	0	0	115	L34	L34-N36 VanDerWaalsContact C-N 3.32Å; L34-N36 PolarHBondContact O-N 3.39Å
37	K	50	Low	54.1	Low	153 Å²	153	107.6 Å²	107.6	67%	0.665	58%	0.576	S	S	*	*	H	α-helix	trans	-95.5	-19.5	-179.9	-69.1	-170.7	179.3	-176.3	0	114.1	A39	K37-A39 VanDerWaalsContact C-N 3.32Å
38	I	51.2	Low	56.2	Low	80 Å²	80	108.4 Å²	108.4	41%	0.41	58%	0.577	S	S	.	*	H	α-helix	trans	-77.4	-24.4	175.3	-63.5	172.9	0	0	0	110.6	L34 D40 I41 C42	L34-I38 HydrophobicContact CD2-CD1 3.95Å; L34-I38 HydrophobicContact CG-CD1 4.04Å; L34-I38 HydrophobicContact CG-CG1 4.43Å; I38-D40 VanDerWaalsContact C-N 3.31Å; I38-D40 PolarHBondContact O-N 2.89Å; I38-I41 PolarHBondContact O-N 3.32Å; I38-C42 HydrophobicContact CG2-CB 3.95Å; I38-C42 WeakPolarHBondContact O-CB 3.42Å; I38-C42 PolarHBondContact O-N 2.8Å
39	A	53.4	Low	58.4	Low	67 Å²	67	113.6 Å²	113.6	55%	0.554	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-32.7	-177.9	0	0	0	0	0	113.9	K37 I41	K37-A39 VanDerWaalsContact C-N 3.32Å; A39-I41 VanDerWaalsContact C-N 3.32Å; A39-I41 PolarHBondContact O-N 3.31Å
40	D	62.6	Low	60.6	Low	131 Å²	131	109.9 Å²	109.9	70%	0.701	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-26.4	-179.9	-66.4	-33.8	0	0	0	112.6	I38 S56	I38-D40 VanDerWaalsContact C-N 3.31Å; I38-D40 PolarHBondContact O-N 2.89Å; D40-S56 PolarHBondContact O-OG 3.18Å
41	I	72.5	Confident	63	Low	45 Å²	45	105.6 Å²	105.6	23%	0.231	56%	0.555	C	S	.	*	T	Hydrogen-bonded Turn	trans	-100.1	-23.3	-174.4	-55.4	170.6	0	0	0	111.3	I38 A39 C55 S56 I72	I38-I41 PolarHBondContact O-N 3.32Å; A39-I41 VanDerWaalsContact C-N 3.32Å; A39-I41 PolarHBondContact O-N 3.31Å; I41-C55 WeakPolarHBondContact O-CA 3.35Å; I41-S56 WeakPolarHBondContact CA-OG 3.18Å; I41-S56 PolarHBondContact O-N 3.19Å; I41-S56 PolarHBondContact O-OG 2.89Å; I41-I72 HydrophobicContact CG2-CG2 4.22Å
42	C	76	Confident	65.6	Low	12 Å²	12	101.8 Å²	101.8	8%	0.081	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	127	-171.4	-170.5	0	0	0	0	112.8	I38 I54 F68	I38-C42 HydrophobicContact CG2-CB 3.95Å; I38-C42 WeakPolarHBondContact O-CB 3.42Å; I38-C42 PolarHBondContact O-N 2.8Å; C42-I54 CarbonylContact C-O 3.58Å; C42-I54 WeakPolarHBondContact CA-O 3.5Å; C42-F68 HydrophobicContact CB-CE1 3.62Å; C42-F68 HydrophobicContact CB-CE2 4.22Å; C42-F68 HydrophobicContact CB-CZ 3.35Å; C42-F68 WeakPolarHBondContact SG-CZ 3.41Å
43	R	83.9	Confident	67.8	Low	167 Å²	167	94.2 Å²	94.2	63%	0.63	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.2	163.7	179.8	-177.7	173.9	110	-0.5	108.7	E45 I54	R43-E45 IonicContact NE-OE1 3.66Å; R43-I54 HydrophobicContact CB-CB 4.36Å; R43-I54 PolarHBondContact N-O 3.49Å; R43-I54 WeakPolarHBondContact O-CA 3.46Å; R43-I54 WeakPolarHBondContact O-CB 3.29Å; R43-I54 PolarHBondContact O-N 3.32Å
44	I	81.6	Confident	70	Confident	76 Å²	76	89 Å²	89	39%	0.39	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.9	179.4	-53.6	174.4	0	0	0	108.6	E51 V52 Y53	I44-E51 HydrophobicContact CG2-CB 4.47Å; I44-V52 CarbonylContact C-O 3.59Å; I44-V52 WeakPolarHBondContact CA-O 3.29Å; I44-Y53 HydrophobicContact CD1-CD1 4.17Å; I44-Y53 HydrophobicContact CD1-CE1 3.62Å; I44-Y53 HydrophobicContact CG1-CD1 3.95Å; I44-Y53 HydrophobicContact CG1-CE1 3.9Å
45	E	82.9	Confident	72.2	Confident	68 Å²	68	84.7 Å²	84.7	32%	0.318	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.5	173.5	-69.8	-173.2	171.5	0	0	109.8	R43 V52 I54	R43-E45 IonicContact NE-OE1 3.66Å; E45-V52 PolarHBondContact N-O 2.95Å; E45-V52 PolarHBondContact O-N 3.22Å; E45-I54 HydrophobicContact CB-CD1 4.35Å; E45-I54 HydrophobicContact CG-CD1 3.68Å; E45-I54 WeakPolarHBondContact OE2-CD1 3.42Å
46	H	78.8	Confident	74	Confident	151 Å²	151	82.2 Å²	82.2	70%	0.699	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	112.2	179.1	-69.7	-142.4	0	0	0	108
47	T	78.6	Confident	75.8	Confident	60 Å²	60	76.6 Å²	76.6	37%	0.368	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	162.8	177.5	71.4	0	0	0	0	110.1	F49 G50 V52	T47-F49 PolarHBondContact O-N 3.48Å; T47-F49 PolarHBondContact OG1-N 3.25Å; T47-G50 PolarHBondContact N-O 3.26Å; T47-G50 PolarHBondContact O-N 3.44Å; T47-G50 PolarHBondContact OG1-N 3.3Å; T47-G50 PolarHBondContact OG1-O 2.8Å; T47-V52 HydrophobicContact CG2-CG2 3.85Å
48	Q	77.5	Confident	77.1	Confident	177 Å²	177	69.5 Å²	69.5	83%	0.827	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-15.9	173.8	68.6	-172.8	10.9	0	0	113.8
49	F	75.5	Confident	78.6	Confident	183 Å²	183	70.3 Å²	70.3	80%	0.803	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	2.2	178.1	-57.9	-73.3	0	0	0	113.5	T47	T47-F49 PolarHBondContact O-N 3.48Å; T47-F49 PolarHBondContact OG1-N 3.25Å
50	G	79.8	Confident	80	Confident	38 Å²	38	70 Å²	70	39%	0.392	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	124.5	-173.1	179.3	0	0	0	0	0	114.7	T47	T47-G50 PolarHBondContact N-O 3.26Å; T47-G50 PolarHBondContact O-N 3.44Å; T47-G50 PolarHBondContact OG1-N 3.3Å; T47-G50 PolarHBondContact OG1-O 2.8Å
51	E	82.4	Confident	81.2	Confident	91 Å²	91	70.7 Å²	70.7	43%	0.425	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	122.7	177.8	-61	179.2	167.4	0	0	111.6	I44 Y53 G64	I44-E51 HydrophobicContact CG2-CB 4.47Å; E51-Y53 HydrophobicContact CB-CE2 3.8Å; E51-Y53 PolarHBondContact OE2-OH 2.93Å; E51-G64 PolarHBondContact O-N 2.91Å
52	V	84.8	Confident	81.8	Confident	18 Å²	18	69 Å²	69	11%	0.109	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.2	176	-177.6	0	0	0	0	109.3	I44 E45 T47 I54 K61 C62	I44-V52 CarbonylContact C-O 3.59Å; I44-V52 WeakPolarHBondContact CA-O 3.29Å; E45-V52 PolarHBondContact N-O 2.95Å; E45-V52 PolarHBondContact O-N 3.22Å; T47-V52 HydrophobicContact CG2-CG2 3.85Å; V52-I54 HydrophobicContact CG1-CG1 4.32Å; V52-K61 HydrophobicContact CG1-CB 3.97Å; V52-C62 WeakPolarHBondContact CA-O 3.45Å
53	Y	86.6	Confident	82.2	Confident	14 Å²	14	74.2 Å²	74.2	6%	0.055	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.8	-179.9	-68	-104.9	0	0	0	109.1	I44 E51 C62 G64 K65 F68	I44-Y53 HydrophobicContact CD1-CD1 4.17Å; I44-Y53 HydrophobicContact CD1-CE1 3.62Å; I44-Y53 HydrophobicContact CG1-CD1 3.95Å; I44-Y53 HydrophobicContact CG1-CE1 3.9Å; E51-Y53 HydrophobicContact CB-CE2 3.8Å; E51-Y53 PolarHBondContact OE2-OH 2.93Å; Y53-C62 PolarHBondContact N-O 3.23Å; Y53-C62 PolarHBondContact O-N 2.85Å; Y53-G64 VanDerWaalsContact CD2-C 3.44Å; Y53-K65 HydrophobicContact CE1-CG 3.77Å; Y53-K65 HydrophobicContact CE2-CG 3.84Å; Y53-K65 WeakPolarHBondContact OH-CE 3.34Å; Y53-K65 WeakPolarHBondContact OH-CG 3.46Å; Y53-F68 HydrophobicContact CD1-CB 4.45Å; Y53-F68 HydrophobicContact CD1-CD1 4.27Å; Y53-F68 HydrophobicContact CD1-CG 4.25Å; Y53-F68 HydrophobicContact CG-CB 4.13Å; Y53-F68 HydrophobicContact CG-CG 4.19Å
54	I	84.5	Confident	82.2	Confident	9 Å²	9	67.3 Å²	67.3	5%	0.046	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120.4	-176.7	-52.1	-175.2	0	0	0	108.7	C42 R43 E45 V52 S56 V60 K61	C42-I54 CarbonylContact C-O 3.58Å; C42-I54 WeakPolarHBondContact CA-O 3.5Å; R43-I54 HydrophobicContact CB-CB 4.36Å; R43-I54 PolarHBondContact N-O 3.49Å; R43-I54 WeakPolarHBondContact O-CA 3.46Å; R43-I54 WeakPolarHBondContact O-CB 3.29Å; R43-I54 PolarHBondContact O-N 3.32Å; E45-I54 HydrophobicContact CB-CD1 4.35Å; E45-I54 HydrophobicContact CG-CD1 3.68Å; E45-I54 WeakPolarHBondContact OE2-CD1 3.42Å; V52-I54 HydrophobicContact CG1-CG1 4.32Å; I54-S56 PolarHBondContact O-N 2.83Å; I54-V60 WeakPolarHBondContact CA-O 3.23Å; I54-K61 HydrophobicContact CD1-CD 4.48Å; I54-K61 HydrophobicContact CD1-CG 4.27Å; I54-K61 HydrophobicContact CG1-CG 4.14Å
55	C	85.4	Confident	82.2	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	120.9	175.1	178.7	0	0	0	0	109.9	I41 V57 C58 N59 V60 F68 H71 H77	I41-C55 WeakPolarHBondContact O-CA 3.35Å; C55-V57 VanDerWaalsContact C-N 3.29Å; C55-V57 PolarHBondContact O-N 2.84Å; C55-V57 PolarHBondContact SG-N 3.3Å; C55-C58 HydrophobicContact CB-CB 4.37Å; C55-C58 PolarHBondContact SG-N 3.42Å; C55-C58 VanDerWaalsContact SG-N 3.36Å; C55-N59 WeakPolarHBondContact O-CA 3.42Å; C55-N59 PolarHBondContact O-N 3.45Å; C55-V60 PolarHBondContact N-O 3.42Å; C55-F68 HydrophobicContact CB-CE2 3.88Å; C55-H71 VanDerWaalsContact CB-NE2 3.26Å; C55-H71 WeakPolarHBondContact CB-NE2 3.45Å; C55-H71 PolarHBondContact SG-NE2 3.49Å; C55-H77 PolarHBondContact SG-CE1 2.83Å; C55-H77 PolarHBondContact SG-ND1 2.77Å; C55-H77 VanDerWaalsContact SG-ND1 3.41Å
56	S	82.1	Confident	82.1	Confident	46 Å²	46	71 Å²	71	32%	0.322	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-40.8	177.2	60.6	0	0	0	0	111.1	R16 D40 I41 I54	R16-S56 PolarHBondContact NH1-O 3.43Å; D40-S56 PolarHBondContact O-OG 3.18Å; I41-S56 WeakPolarHBondContact CA-OG 3.18Å; I41-S56 PolarHBondContact O-N 3.19Å; I41-S56 PolarHBondContact O-OG 2.89Å; I54-S56 PolarHBondContact O-N 2.83Å
57	V	81	Confident	82.4	Confident	23 Å²	23	66.3 Å²	66.3	14%	0.139	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-49.4	-177.8	-176.7	0	0	0	0	113	C55 N80 C81	C55-V57 VanDerWaalsContact C-N 3.29Å; C55-V57 PolarHBondContact O-N 2.84Å; C55-V57 PolarHBondContact SG-N 3.3Å; V57-N80 HydrophobicContact CG1-CB 3.96Å; V57-N80 WeakPolarHBondContact CG1-O 3.33Å; V57-C81 HydrophobicContact CG1-CB 4.4Å
58	C	77.6	Confident	82.8	Confident	4 Å²	4	64 Å²	64	3%	0.027	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-6.8	-172.9	-60.4	0	0	0	0	113.6	C55 V60	C55-C58 HydrophobicContact CB-CB 4.37Å; C55-C58 PolarHBondContact SG-N 3.42Å; C55-C58 VanDerWaalsContact SG-N 3.36Å; C58-V60 HydrophobicContact CB-CB 4.47Å; C58-V60 HydrophobicContact CB-CG2 3.8Å; C58-V60 PolarHBondContact O-N 3.08Å; C58-V60 VanDerWaalsContact O-N 3.15Å
59	N	82.9	Confident	83	Confident	97 Å²	97	58.6 Å²	58.6	52%	0.519	33%	0.332	S	S	.	.			trans	52	29.5	-172.1	-149.4	27.9	0	0	0	114.5	C55	C55-N59 WeakPolarHBondContact O-CA 3.42Å; C55-N59 PolarHBondContact O-N 3.45Å
60	V	82.3	Confident	83.5	Confident	59 Å²	59	57 Å²	57	36%	0.358	33%	0.327	S	S	.	.			trans	-89.2	128	179.9	176.5	0	0	0	0	109.6	I54 C55 C58	I54-V60 WeakPolarHBondContact CA-O 3.23Å; C55-V60 PolarHBondContact N-O 3.42Å; C58-V60 HydrophobicContact CB-CB 4.47Å; C58-V60 HydrophobicContact CB-CG2 3.8Å; C58-V60 PolarHBondContact O-N 3.08Å; C58-V60 VanDerWaalsContact O-N 3.15Å
61	K	88.4	Confident	83.8	Confident	146 Å²	146	56.7 Å²	56.7	64%	0.635	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	126.1	173.1	-55.8	-169.9	-178.5	-169.7	0	110.2	V52 I54	V52-K61 HydrophobicContact CG1-CB 3.97Å; I54-K61 HydrophobicContact CD1-CD 4.48Å; I54-K61 HydrophobicContact CD1-CG 4.27Å; I54-K61 HydrophobicContact CG1-CG 4.14Å
62	C	85.6	Confident	83.9	Confident	11 Å²	11	55.2 Å²	55.2	7%	0.074	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.8	178.9	-60.3	0	0	0	0	109.4	V52 Y53 G64 P67 F68	V52-C62 WeakPolarHBondContact CA-O 3.45Å; Y53-C62 PolarHBondContact N-O 3.23Å; Y53-C62 PolarHBondContact O-N 2.85Å; C62-G64 PolarHBondContact O-N 3.46Å; C62-G64 VanDerWaalsContact O-N 3.15Å; C62-P67 HydrophobicContact CB-CB 4.41Å; C62-P67 HydrophobicContact CB-CG 4.35Å; C62-F68 HydrophobicContact CB-CB 3.96Å; C62-F68 HydrophobicContact CB-CD2 4.19Å
63	T	84.8	Confident	83.8	Confident	120 Å²	120	57.6 Å²	57.6	74%	0.736	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	85.9	175.2	44.1	0	0	0	0	109.9	P67	T63-P67 VanDerWaalsContact O-CG 3.28Å; T63-P67 WeakPolarHBondContact O-CG 3.2Å
64	G	82.3	Confident	83.6	Confident	22 Å²	22	58.1 Å²	58.1	23%	0.227	34%	0.337	C	S	.	.	S	Bend	trans	108.2	168.7	176.6	0	0	0	0	0	116.2	E51 Y53 C62 P67 F68	E51-G64 PolarHBondContact O-N 2.91Å; Y53-G64 VanDerWaalsContact CD2-C 3.44Å; C62-G64 PolarHBondContact O-N 3.46Å; C62-G64 VanDerWaalsContact O-N 3.15Å; G64-P67 WeakPolarHBondContact O-CD 3.36Å; G64-P67 WeakPolarHBondContact O-CG 3.45Å; G64-F68 WeakPolarHBondContact O-CB 3.27Å; G64-F68 PolarHBondContact O-N 3.12Å
65	K	81.8	Confident	83.4	Confident	144 Å²	144	61.9 Å²	61.9	63%	0.626	36%	0.364	S	S	*	.	H	α-helix	trans	-67.2	-42.5	-176.4	-67.9	179.9	-177.6	179	0	113.8	Y53 F68 S69	Y53-K65 HydrophobicContact CE1-CG 3.77Å; Y53-K65 HydrophobicContact CE2-CG 3.84Å; Y53-K65 WeakPolarHBondContact OH-CE 3.34Å; Y53-K65 WeakPolarHBondContact OH-CG 3.46Å; K65-F68 PolarHBondContact O-N 2.9Å; K65-S69 WeakPolarHBondContact O-CB 3.35Å; K65-S69 PolarHBondContact O-N 2.84Å
66	A	81.5	Confident	83.1	Confident	78 Å²	78	66.3 Å²	66.3	65%	0.645	38%	0.384	S	S	*	.	H	α-helix	trans	-60.3	-52.2	-178.8	0	0	0	0	0	113.4	F68 S69 Q70	A66-F68 VanDerWaalsContact C-N 3.27Å; A66-F68 PolarHBondContact O-N 2.82Å; A66-S69 PolarHBondContact O-N 3.29Å; A66-Q70 PolarHBondContact O-N 3.5Å; A66-Q70 VanDerWaalsContact O-N 3.09Å
67	P	85.9	Confident	83.1	Confident	52 Å²	52	64.6 Å²	64.6	34%	0.338	37%	0.371	S	S	.	.	H	α-helix	trans	-65.8	-31.3	176.9	24.3	-32.7	0	0	0	112.3	C62 T63 G64 Q70 H71	C62-P67 HydrophobicContact CB-CB 4.41Å; C62-P67 HydrophobicContact CB-CG 4.35Å; T63-P67 VanDerWaalsContact O-CG 3.28Å; T63-P67 WeakPolarHBondContact O-CG 3.2Å; G64-P67 WeakPolarHBondContact O-CD 3.36Å; G64-P67 WeakPolarHBondContact O-CG 3.45Å; P67-Q70 PolarHBondContact O-N 2.99Å; P67-H71 WeakPolarHBondContact O-CB 3.49Å; P67-H71 PolarHBondContact O-N 3.5Å
68	F	86.3	Confident	83	Confident	12 Å²	12	69.8 Å²	69.8	5%	0.053	39%	0.389	C	S	.	.	H	α-helix	trans	-66.2	-42.9	174.8	-172.5	-101.4	0	0	0	112.5	C42 Y53 C55 C62 G64 K65 A66 Q70 H71 I72	C42-F68 HydrophobicContact CB-CE1 3.62Å; C42-F68 HydrophobicContact CB-CE2 4.22Å; C42-F68 HydrophobicContact CB-CZ 3.35Å; C42-F68 WeakPolarHBondContact SG-CZ 3.41Å; Y53-F68 HydrophobicContact CD1-CB 4.45Å; Y53-F68 HydrophobicContact CD1-CD1 4.27Å; Y53-F68 HydrophobicContact CD1-CG 4.25Å; Y53-F68 HydrophobicContact CG-CB 4.13Å; Y53-F68 HydrophobicContact CG-CG 4.19Å; C55-F68 HydrophobicContact CB-CE2 3.88Å; C62-F68 HydrophobicContact CB-CB 3.96Å; C62-F68 HydrophobicContact CB-CD2 4.19Å; G64-F68 WeakPolarHBondContact O-CB 3.27Å; G64-F68 PolarHBondContact O-N 3.12Å; K65-F68 PolarHBondContact O-N 2.9Å; A66-F68 VanDerWaalsContact C-N 3.27Å; A66-F68 PolarHBondContact O-N 2.82Å; F68-Q70 VanDerWaalsContact C-N 3.31Å; F68-Q70 PolarHBondContact O-N 3.32Å; F68-H71 WeakPolarHBondContact O-CB 3.49Å; F68-H71 PolarHBondContact O-N 3.44Å; F68-H71 VanDerWaalsContact O-N 3.14Å; F68-I72 HydrophobicContact CD1-CG2 4.31Å; F68-I72 HydrophobicContact CE1-CG2 3.77Å; F68-I72 HydrophobicContact CE2-CG2 4.37Å; F68-I72 HydrophobicContact CZ-CG2 3.78Å; F68-I72 PolarHBondContact O-N 3.21Å
69	S	82.1	Confident	82.8	Confident	64 Å²	64	75.9 Å²	75.9	45%	0.448	42%	0.415	S	S	.	.	H	α-helix	trans	-61.4	-39.6	174.5	-176.9	0	0	0	0	112.1	K65 A66 I72 S73	K65-S69 WeakPolarHBondContact O-CB 3.35Å; K65-S69 PolarHBondContact O-N 2.84Å; A66-S69 PolarHBondContact O-N 3.29Å; S69-I72 WeakPolarHBondContact O-CG1 3.43Å; S69-S73 WeakPolarHBondContact O-CB 3.4Å; S69-S73 PolarHBondContact O-N 3.46Å; S69-S73 VanDerWaalsContact O-N 3.16Å; S69-S73 PolarHBondContact O-OG 3.4Å
70	Q	85.2	Confident	82.2	Confident	148 Å²	148	71.8 Å²	71.8	69%	0.692	39%	0.393	S	S	*	.	H	α-helix	trans	-67.7	-36.1	173.9	-170.7	174.7	0.4	0	0	112.2	A66 P67 F68 S73 G74	A66-Q70 PolarHBondContact O-N 3.5Å; A66-Q70 VanDerWaalsContact O-N 3.09Å; P67-Q70 PolarHBondContact O-N 2.99Å; F68-Q70 VanDerWaalsContact C-N 3.31Å; F68-Q70 PolarHBondContact O-N 3.32Å; Q70-S73 WeakPolarHBondContact CA-OG 2.85Å; Q70-S73 PolarHBondContact O-OG 2.9Å; Q70-G74 PolarHBondContact O-N 2.78Å; Q70-G74 VanDerWaalsContact O-N 3.09Å
71	H	86.1	Confident	81.8	Confident	33 Å²	33	69.9 Å²	69.9	15%	0.153	38%	0.381	C	S	.	.	H	α-helix	trans	-61.7	-52.4	174.8	168.8	80.5	0	0	0	111.7	C55 P67 F68 S73 G74 H77	C55-H71 VanDerWaalsContact CB-NE2 3.26Å; C55-H71 WeakPolarHBondContact CB-NE2 3.45Å; C55-H71 PolarHBondContact SG-NE2 3.49Å; P67-H71 WeakPolarHBondContact O-CB 3.49Å; P67-H71 PolarHBondContact O-N 3.5Å; F68-H71 WeakPolarHBondContact O-CB 3.49Å; F68-H71 PolarHBondContact O-N 3.44Å; F68-H71 VanDerWaalsContact O-N 3.14Å; H71-S73 VanDerWaalsContact C-N 3.31Å; H71-S73 PolarHBondContact O-N 3.14Å; H71-G74 PolarHBondContact O-N 3.4Å; H71-G74 VanDerWaalsContact O-N 3.1Å; H71-H77 AromaticContact CD2-ND1 3.75Å; H71-H77 AromaticContact NE2-CG 3.98Å; H71-H77 AromaticContact NE2-ND1 3.21Å; H71-H77 PolarHBondContact NE2-ND1 3.42Å; H71-H77 WeakPolarHBondContact O-CB 3.39Å
72	I	84.4	Confident	80.8	Confident	60 Å²	60	68 Å²	68	31%	0.308	38%	0.378	S	S	.	.	H	α-helix	trans	-66	-32.5	-177.1	62.3	176.9	0	0	0	112.8	I41 F68 S69 G74 H77	I41-I72 HydrophobicContact CG2-CG2 4.22Å; F68-I72 HydrophobicContact CD1-CG2 4.31Å; F68-I72 HydrophobicContact CE1-CG2 3.77Å; F68-I72 HydrophobicContact CE2-CG2 4.37Å; F68-I72 HydrophobicContact CZ-CG2 3.78Å; F68-I72 PolarHBondContact O-N 3.21Å; S69-I72 WeakPolarHBondContact O-CG1 3.43Å; I72-G74 VanDerWaalsContact C-N 3.3Å; I72-H77 PolarHBondContact O-CD2 2.95Å; I72-H77 VanDerWaalsContact O-CD2 3.25Å
73	S	83.2	Confident	79.7	Confident	67 Å²	67	71 Å²	71	47%	0.469	40%	0.404	S	S	.	.	H	α-helix	trans	-78.9	-16.2	176.2	55.4	0	0	0	0	113	S69 Q70 H71 R78	S69-S73 WeakPolarHBondContact O-CB 3.4Å; S69-S73 PolarHBondContact O-N 3.46Å; S69-S73 VanDerWaalsContact O-N 3.16Å; S69-S73 PolarHBondContact O-OG 3.4Å; Q70-S73 WeakPolarHBondContact CA-OG 2.85Å; Q70-S73 PolarHBondContact O-OG 2.9Å; H71-S73 VanDerWaalsContact C-N 3.31Å; H71-S73 PolarHBondContact O-N 3.14Å; S73-R78 PolarHBondContact O-NH2 3.06Å
74	G	83	Confident	78.7	Confident	25 Å²	25	70.8 Å²	70.8	26%	0.258	40%	0.399	S	S	.	.	S	Bend	trans	-62.6	147.5	-178.3	0	0	0	0	0	114	Q70 H71 I72 H76 H77 R78	Q70-G74 PolarHBondContact O-N 2.78Å; Q70-G74 VanDerWaalsContact O-N 3.09Å; H71-G74 PolarHBondContact O-N 3.4Å; H71-G74 VanDerWaalsContact O-N 3.1Å; I72-G74 VanDerWaalsContact C-N 3.3Å; G74-H76 PolarHBondContact O-N 2.96Å; G74-H77 PolarHBondContact O-N 3.1Å; G74-R78 PolarHBondContact O-N 3.44Å
75	S	80.6	Confident	78	Confident	89 Å²	89	71.1 Å²	71.1	62%	0.622	40%	0.396	S	S	*	.	H	α-helix	trans	-61.5	-28.9	179.8	62.7	0	0	0	0	113.3	K79	S75-K79 WeakPolarHBondContact O-CG 3.3Å; S75-K79 PolarHBondContact O-N 3.16Å
76	H	77.9	Confident	77.5	Confident	92 Å²	92	67.5 Å²	67.5	43%	0.426	38%	0.379	S	S	.	.	H	α-helix	trans	-69.4	-49.8	176.4	-171.4	-82.5	0	0	0	111.8	G74 R78 K79 N80 F87	G74-H76 PolarHBondContact O-N 2.96Å; H76-R78 VanDerWaalsContact C-N 3.3Å; H76-R78 PolarHBondContact O-N 3.04Å; H76-K79 PolarHBondContact O-N 3.23Å; H76-N80 PolarHBondContact O-N 3.09Å; H76-N80 VanDerWaalsContact O-N 3.13Å; H76-F87 AromaticContact CE1-CE2 3.67Å
77	H	82	Confident	77.3	Confident	11 Å²	11	65.1 Å²	65.1	5%	0.051	35%	0.354	C	S	.	.	H	α-helix	trans	-60.3	-42.5	175.6	-180	94.2	0	0	0	110.9	C55 H71 I72 G74 K79 N80 C81	C55-H77 PolarHBondContact SG-CE1 2.83Å; C55-H77 PolarHBondContact SG-ND1 2.77Å; C55-H77 VanDerWaalsContact SG-ND1 3.41Å; H71-H77 AromaticContact CD2-ND1 3.75Å; H71-H77 AromaticContact NE2-CG 3.98Å; H71-H77 AromaticContact NE2-ND1 3.21Å; H71-H77 PolarHBondContact NE2-ND1 3.42Å; H71-H77 WeakPolarHBondContact O-CB 3.39Å; I72-H77 PolarHBondContact O-CD2 2.95Å; I72-H77 VanDerWaalsContact O-CD2 3.25Å; G74-H77 PolarHBondContact O-N 3.1Å; H77-K79 VanDerWaalsContact C-N 3.3Å; H77-K79 PolarHBondContact O-N 2.06Å; H77-N80 CarbonylContact O-C 3.45Å; H77-N80 PolarHBondContact O-N 3.46Å; H77-N80 VanDerWaalsContact O-N 3.07Å; H77-C81 PolarHBondContact O-N 3.41Å
78	R	79.5	Confident	76.9	Confident	132 Å²	132	62.7 Å²	62.7	50%	0.498	34%	0.338	S	S	.	.	H	α-helix	trans	-58.7	-40	178.5	-167.6	179.5	-50.4	-143.4	1.3	113.3	M22 S73 G74 H76	M22-R78 HydrophobicContact CE-CG 3.98Å; S73-R78 PolarHBondContact O-NH2 3.06Å; G74-R78 PolarHBondContact O-N 3.44Å; H76-R78 VanDerWaalsContact C-N 3.3Å; H76-R78 PolarHBondContact O-N 3.04Å
79	K	73.9	Confident	76.2	Confident	132 Å²	132	65.5 Å²	65.5	57%	0.574	35%	0.354	S	S	*	.	H	α-helix	trans	-64.9	-44.2	174.9	-73.5	173.9	-178	-176.3	0	110.8	S75 H76 H77 N82 T85	S75-K79 WeakPolarHBondContact O-CG 3.3Å; S75-K79 PolarHBondContact O-N 3.16Å; H76-K79 PolarHBondContact O-N 3.23Å; H77-K79 VanDerWaalsContact C-N 3.3Å; H77-K79 PolarHBondContact O-N 2.06Å; K79-N82 WeakPolarHBondContact O-CB 3.24Å; K79-N82 PolarHBondContact O-N 3.16Å; K79-T85 WeakPolarHBondContact O-CG2 3.49Å; K79-T85 PolarHBondContact O-OG1 2.93Å
80	N	70.1	Confident	76.1	Confident	11 Å²	11	67.3 Å²	67.3	6%	0.059	36%	0.355	C	S	.	.	H	α-helix	trans	-73.9	-31	-179.4	-89.2	30.2	0	0	0	115.5	V57 H76 H77 N82 F87 S94	V57-N80 HydrophobicContact CG1-CB 3.96Å; V57-N80 WeakPolarHBondContact CG1-O 3.33Å; H76-N80 PolarHBondContact O-N 3.09Å; H76-N80 VanDerWaalsContact O-N 3.13Å; H77-N80 CarbonylContact O-C 3.45Å; H77-N80 PolarHBondContact O-N 3.46Å; H77-N80 VanDerWaalsContact O-N 3.07Å; N80-N82 PolarHBondContact O-N 2.96Å; N80-F87 WeakPolarHBondContact ND2-CB 3.25Å; N80-F87 WeakPolarHBondContact ND2-CD1 3.39Å; N80-F87 WeakPolarHBondContact ND2-CD2 3.28Å; N80-F87 WeakPolarHBondContact ND2-CE2 3.23Å; N80-F87 WeakPolarHBondContact ND2-CG 3.13Å; N80-F87 WeakPolarHBondContact OD1-CD2 3.36Å; N80-S94 WeakPolarHBondContact OD1-CB 3.21Å
81	C	73.3	Confident	75.5	Confident	18 Å²	18	61.6 Å²	61.6	12%	0.122	33%	0.331	C	S	.	.	H	α-helix	trans	-74.9	-12.2	175.7	-147.6	0	0	0	0	111.3	C18 V57 H77 A83	C18-C81 HydrophobicContact CB-CB 4.37Å; C18-C81 WeakPolarHBondContact CB-O 3.47Å; C18-C81 WeakPolarHBondContact CB-SG 3.22Å; C18-C81 WeakPolarHBondContact SG-CB 3.33Å; C18-C81 PolarHBondContact SG-O 2.81Å; C18-C81 CovalentContact SG-SG 2.1Å; C18-C81 PolarHBondContact SG-SG 3.15Å; V57-C81 HydrophobicContact CG1-CB 4.4Å; H77-C81 PolarHBondContact O-N 3.41Å; C81-A83 PolarHBondContact O-N 2.94Å; C81-A83 VanDerWaalsContact O-N 3.13Å
82	N	67.6	Low	75	Confident	107 Å²	107	65.4 Å²	65.4	57%	0.572	35%	0.353	S	S	*	.	S	Bend	trans	-67.9	117.8	174.1	-137.2	24.2	0	0	0	107.7	K79 N80 N84 T85	K79-N82 WeakPolarHBondContact O-CB 3.24Å; K79-N82 PolarHBondContact O-N 3.16Å; N80-N82 PolarHBondContact O-N 2.96Å; N82-N84 PolarHBondContact O-N 2.97Å; N82-T85 HydrophobicContact CB-CG2 4.46Å; N82-T85 PolarHBondContact O-N 3.35Å; N82-T85 PolarHBondContact O-OG1 2.7Å; N82-T85 VanDerWaalsContact O-OG1 3.09Å
83	A	62.1	Low	74.4	Confident	74 Å²	74	65.1 Å²	65.1	61%	0.612	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-8	-174.1	0	0	0	0	0	114.5	C81	C81-A83 PolarHBondContact O-N 2.94Å; C81-A83 VanDerWaalsContact O-N 3.13Å
84	N	63.6	Low	74.2	Confident	116 Å²	116	64.1 Å²	64.1	62%	0.62	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	15.7	180	-141.9	79.3	0	0	0	113.7	N82	N82-N84 PolarHBondContact O-N 2.97Å
85	T	67.4	Low	74	Confident	28 Å²	28	64.4 Å²	64.4	17%	0.172	34%	0.343	C	S	.	.			trans	-124.1	136.6	177.3	68	0	0	0	0	112	K79 N82 L95	K79-T85 WeakPolarHBondContact O-CG2 3.49Å; K79-T85 PolarHBondContact O-OG1 2.93Å; N82-T85 HydrophobicContact CB-CG2 4.46Å; N82-T85 PolarHBondContact O-N 3.35Å; N82-T85 PolarHBondContact O-OG1 2.7Å; N82-T85 VanDerWaalsContact O-OG1 3.09Å; T85-L95 CarbonylContact C-O 3.6Å; T85-L95 VanDerWaalsContact CA-O 3.23Å; T85-L95 WeakPolarHBondContact CA-O 3.4Å
86	Y	72.4	Confident	73.9	Confident	69 Å²	69	65.4 Å²	65.4	27%	0.271	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.3	-179.3	-62.1	-97.5	0	0	0	108.4	V13 S94 L95 S98 Y101	V13-Y86 HydrophobicContact CG1-CE1 4.48Å; Y86-S94 CarbonylContact O-C 3.51Å; Y86-L95 PolarHBondContact N-O 3.37Å; Y86-L95 PolarHBondContact O-N 2.85Å; Y86-S98 VanDerWaalsContact CZ-CA 3.44Å; Y86-S98 VanDerWaalsContact CZ-CB 3.42Å; Y86-S98 WeakPolarHBondContact OH-CB 3.17Å; Y86-Y101 HydrophobicContact CD1-CG 4.32Å; Y86-Y101 HydrophobicContact CG-CG 4.29Å
87	F	75.9	Confident	73.9	Confident	28 Å²	28	63.1 Å²	63.1	12%	0.123	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.3	-176.1	-178.1	-109.2	0	0	0	111.9	H76 N80 N89 N92 T93	H76-F87 AromaticContact CE1-CE2 3.67Å; N80-F87 WeakPolarHBondContact ND2-CB 3.25Å; N80-F87 WeakPolarHBondContact ND2-CD1 3.39Å; N80-F87 WeakPolarHBondContact ND2-CD2 3.28Å; N80-F87 WeakPolarHBondContact ND2-CE2 3.23Å; N80-F87 WeakPolarHBondContact ND2-CG 3.13Å; N80-F87 WeakPolarHBondContact OD1-CD2 3.36Å; F87-N89 WeakPolarHBondContact CD1-OD1 2.94Å; F87-N89 WeakPolarHBondContact CE1-OD1 3.48Å; F87-N92 HydrophobicContact CZ-CB 4.32Å; F87-T93 WeakPolarHBondContact CA-O 3.49Å; F87-T93 WeakPolarHBondContact CD2-O 3.46Å
88	C	78.6	Confident	73.8	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.007	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	114.7	171.4	179.6	0	0	0	0	109.8	C91 N92 T93 Y101 H104 H110	C88-C91 HydrophobicContact CB-CB 4.19Å; C88-C91 PolarHBondContact SG-N 2.7Å; C88-C91 VanDerWaalsContact SG-N 3.42Å; C88-N92 VanDerWaalsContact O-CA 3.23Å; C88-N92 WeakPolarHBondContact O-CA 3.29Å; C88-N92 PolarHBondContact O-N 2.65Å; C88-T93 PolarHBondContact N-O 2.91Å; C88-T93 PolarHBondContact O-N 2.86Å; C88-Y101 HydrophobicContact CB-CE2 3.9Å; C88-H104 VanDerWaalsContact CB-NE2 3.32Å; C88-H104 WeakPolarHBondContact CB-NE2 3.36Å; C88-H104 PolarHBondContact SG-NE2 2.92Å; C88-H110 PolarHBondContact SG-CE1 3.06Å; C88-H110 PolarHBondContact SG-ND1 3.34Å
89	N	71.9	Confident	73.8	Confident	71 Å²	71	65.6 Å²	65.6	38%	0.38	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-37.4	178.5	-68.5	-20.7	0	0	0	112.6	F87 C91 N92	F87-N89 WeakPolarHBondContact CD1-OD1 2.94Å; F87-N89 WeakPolarHBondContact CE1-OD1 3.48Å; N89-C91 VanDerWaalsContact C-N 3.35Å; N89-N92 PolarHBondContact O-OD1 3.46Å
90	E	78.4	Confident	74.2	Confident	101 Å²	101	64 Å²	64	47%	0.472	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-29.4	-176.1	-63.9	167.8	141.2	0	0	112.2	H110 T114	E90-H110 IonicContact OE2-CE1 3.65Å; E90-H110 PolarHBondContact OE2-CE1 3.18Å; E90-H110 IonicContact OE2-ND1 3.14Å; E90-H110 IonicContact OE2-NE2 2.7Å; E90-H110 PolarHBondContact OE2-NE2 3.47Å; E90-H110 VanDerWaalsContact OE2-NE2 3.14Å; E90-T114 HydrophobicContact CB-CG2 4.5Å; E90-T114 HydrophobicContact CG-CG2 4.41Å; E90-T114 VanDerWaalsContact OE1-CG2 3.31Å; E90-T114 WeakPolarHBondContact OE1-CG2 3.33Å; E90-T114 WeakPolarHBondContact OE2-CG2 3.14Å
91	C	73.3	Confident	74.7	Confident	28 Å²	28	66.6 Å²	66.6	19%	0.189	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-2.3	178.7	-65.2	0	0	0	0	113.5	C88 N89 T93 H104 H110	C88-C91 HydrophobicContact CB-CB 4.19Å; C88-C91 PolarHBondContact SG-N 2.7Å; C88-C91 VanDerWaalsContact SG-N 3.42Å; N89-C91 VanDerWaalsContact C-N 3.35Å; C91-T93 PolarHBondContact O-N 3.38Å; C91-T93 PolarHBondContact O-OG1 3.25Å; C91-H104 VanDerWaalsContact CB-CE1 3.47Å; C91-H104 WeakPolarHBondContact CB-CE1 3.34Å; C91-H104 WeakPolarHBondContact CB-NE2 3.15Å; C91-H104 VanDerWaalsContact SG-CE1 3.54Å; C91-H104 PolarHBondContact SG-NE2 2.62Å; C91-H110 PolarHBondContact SG-ND1 3.34Å
92	N	76.1	Confident	75.1	Confident	113 Å²	113	68.3 Å²	68.3	60%	0.604	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.3	47.6	-172	-71.1	-51.3	0	0	0	113.4	F87 C88 N89	F87-N92 HydrophobicContact CZ-CB 4.32Å; C88-N92 VanDerWaalsContact O-CA 3.23Å; C88-N92 WeakPolarHBondContact O-CA 3.29Å; C88-N92 PolarHBondContact O-N 2.65Å; N89-N92 PolarHBondContact O-OD1 3.46Å
93	T	72	Confident	75.8	Confident	55 Å²	55	68.6 Å²	68.6	34%	0.337	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	129.3	-174.8	-60	0	0	0	0	111	F87 C88 C91 L95	F87-T93 WeakPolarHBondContact CA-O 3.49Å; F87-T93 WeakPolarHBondContact CD2-O 3.46Å; C88-T93 PolarHBondContact N-O 2.91Å; C88-T93 PolarHBondContact O-N 2.86Å; C91-T93 PolarHBondContact O-N 3.38Å; C91-T93 PolarHBondContact O-OG1 3.25Å; T93-L95 HydrophobicContact CG2-CD2 4.18Å; T93-L95 HydrophobicContact CG2-CG 4.33Å
94	S	77.5	Confident	76.9	Confident	46 Å²	46	67 Å²	67	32%	0.322	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	129.9	172.2	62.7	0	0	0	0	110.9	N80 Y86	N80-S94 WeakPolarHBondContact OD1-CB 3.21Å; Y86-S94 CarbonylContact O-C 3.51Å
95	L	80.5	Confident	77.8	Confident	31 Å²	31	62.8 Å²	62.8	16%	0.162	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	151.7	179.5	-63	168.5	0	0	0	109.6	T85 Y86 T93 Q100 Y101 H104	T85-L95 CarbonylContact C-O 3.6Å; T85-L95 VanDerWaalsContact CA-O 3.23Å; T85-L95 WeakPolarHBondContact CA-O 3.4Å; Y86-L95 PolarHBondContact N-O 3.37Å; Y86-L95 PolarHBondContact O-N 2.85Å; T93-L95 HydrophobicContact CG2-CD2 4.18Å; T93-L95 HydrophobicContact CG2-CG 4.33Å; L95-Q100 HydrophobicContact CB-CB 4.47Å; L95-Y101 HydrophobicContact CD1-CD2 4.12Å; L95-H104 HydrophobicContact CD1-CB 3.36Å
96	N	78.2	Confident	78.5	Confident	110 Å²	110	65.4 Å²	65.4	59%	0.588	36%	0.357	S	S	*	.	S	Bend	trans	-98.5	-3.2	-170.8	-63.7	-30.6	0	0	0	113.7
97	S	78.4	Confident	78.9	Confident	43 Å²	43	63.3 Å²	63.3	30%	0.301	36%	0.356	S	S	.	.	S	Bend	trans	-143	145	-177.1	170.7	0	0	0	0	111	E99 Q100 Y101	S97-E99 VanDerWaalsContact C-N 3.27Å; S97-E99 PolarHBondContact O-N 3.5Å; S97-E99 PolarHBondContact OG-N 3.07Å; S97-Q100 PolarHBondContact O-N 2.99Å; S97-Y101 PolarHBondContact O-N 3.37Å
98	S	79.3	Confident	78.9	Confident	53 Å²	53	66.6 Å²	66.6	37%	0.371	38%	0.383	S	S	.	.	H	α-helix	trans	-58.9	-42.1	176.7	-170.5	0	0	0	0	111	Y86 Q100 Y101 A102	Y86-S98 VanDerWaalsContact CZ-CA 3.44Å; Y86-S98 VanDerWaalsContact CZ-CB 3.42Å; Y86-S98 WeakPolarHBondContact OH-CB 3.17Å; S98-Q100 PolarHBondContact O-N 3.21Å; S98-Y101 WeakPolarHBondContact O-CB 3.4Å; S98-Y101 PolarHBondContact O-N 2.89Å; S98-Y101 VanDerWaalsContact O-N 3.12Å; S98-A102 PolarHBondContact O-N 3.28Å
99	E	80.3	Confident	78.9	Confident	142 Å²	142	74.9 Å²	74.9	66%	0.664	42%	0.419	S	S	*	.	H	α-helix	trans	-65.4	-40.8	179.8	-171.9	175.4	-169.4	0	0	111.2	S97 Y101 A102 L103	S97-E99 VanDerWaalsContact C-N 3.27Å; S97-E99 PolarHBondContact O-N 3.5Å; S97-E99 PolarHBondContact OG-N 3.07Å; E99-Y101 VanDerWaalsContact C-N 3.28Å; E99-Y101 PolarHBondContact O-N 3.1Å; E99-A102 PolarHBondContact O-N 3.33Å; E99-L103 HydrophobicContact CG-CD1 4.3Å; E99-L103 WeakPolarHBondContact O-CB 3.41Å; E99-L103 VanDerWaalsContact O-CG 3.27Å; E99-L103 WeakPolarHBondContact O-CG 3.3Å; E99-L103 PolarHBondContact O-N 3.13Å
100	Q	80.6	Confident	79.3	Confident	99 Å²	99	72 Å²	72	46%	0.463	40%	0.403	S	S	.	.	H	α-helix	trans	-63.9	-35.6	174	-69.8	179.1	-14.8	0	0	111.8	L95 S97 S98 H104	L95-Q100 HydrophobicContact CB-CB 4.47Å; S97-Q100 PolarHBondContact O-N 2.99Å; S98-Q100 PolarHBondContact O-N 3.21Å; Q100-H104 VanDerWaalsContact O-CB 3.24Å; Q100-H104 WeakPolarHBondContact O-CB 3.49Å; Q100-H104 PolarHBondContact O-N 3.47Å
101	Y	80.9	Confident	79.2	Confident	65 Å²	65	70.7 Å²	70.7	26%	0.255	40%	0.398	S	S	.	.	H	α-helix	trans	-68.3	-45.5	175.2	-177.5	-97.7	0	0	0	112.3	Y86 C88 L95 S97 S98 E99 L103 H104 C105	Y86-Y101 HydrophobicContact CD1-CG 4.32Å; Y86-Y101 HydrophobicContact CG-CG 4.29Å; C88-Y101 HydrophobicContact CB-CE2 3.9Å; L95-Y101 HydrophobicContact CD1-CD2 4.12Å; S97-Y101 PolarHBondContact O-N 3.37Å; S98-Y101 WeakPolarHBondContact O-CB 3.4Å; S98-Y101 PolarHBondContact O-N 2.89Å; S98-Y101 VanDerWaalsContact O-N 3.12Å; E99-Y101 VanDerWaalsContact C-N 3.28Å; E99-Y101 PolarHBondContact O-N 3.1Å; Y101-L103 VanDerWaalsContact C-N 3.34Å; Y101-L103 PolarHBondContact O-N 3.41Å; Y101-H104 WeakPolarHBondContact O-CB 3.04Å; Y101-H104 PolarHBondContact O-N 3.06Å; Y101-H104 VanDerWaalsContact O-N 3.14Å; Y101-C105 VanDerWaalsContact CZ-SG 3.55Å; Y101-C105 PolarHBondContact O-N 3.39Å; Y101-C105 PolarHBondContact O-SG 3.37Å
102	A	81.2	Confident	79.1	Confident	54 Å²	54	76.2 Å²	76.2	45%	0.446	42%	0.415	S	S	.	.	H	α-helix	trans	-60.9	-42.6	174.7	0	0	0	0	0	111.9	S98 E99 H104 C105 S106	S98-A102 PolarHBondContact O-N 3.28Å; E99-A102 PolarHBondContact O-N 3.33Å; A102-H104 VanDerWaalsContact C-N 3.34Å; A102-C105 PolarHBondContact O-N 2.86Å; A102-S106 WeakPolarHBondContact O-CB 3.5Å; A102-S106 PolarHBondContact O-N 3.42Å; A102-S106 PolarHBondContact O-OG 2.77Å
103	L	84.1	Confident	78.4	Confident	113 Å²	113	74.3 Å²	74.3	59%	0.592	40%	0.404	S	S	*	.	H	α-helix	trans	-65.6	-35.1	173.8	-71.3	172.6	0	0	0	112.7	E99 Y101 S106 G107	E99-L103 HydrophobicContact CG-CD1 4.3Å; E99-L103 WeakPolarHBondContact O-CB 3.41Å; E99-L103 VanDerWaalsContact O-CG 3.27Å; E99-L103 WeakPolarHBondContact O-CG 3.3Å; E99-L103 PolarHBondContact O-N 3.13Å; Y101-L103 VanDerWaalsContact C-N 3.34Å; Y101-L103 PolarHBondContact O-N 3.41Å; L103-S106 WeakPolarHBondContact CA-OG 3.48Å; L103-S106 PolarHBondContact O-OG 3.23Å; L103-G107 PolarHBondContact O-N 2.59Å
104	H	84.8	Confident	78	Confident	41 Å²	41	73 Å²	73	19%	0.19	40%	0.397	C	S	.	.	H	α-helix	trans	-64.7	-49.7	173.4	169.2	88	0	0	0	111.7	C88 C91 L95 Q100 Y101 A102 G107 H110	C88-H104 VanDerWaalsContact CB-NE2 3.32Å; C88-H104 WeakPolarHBondContact CB-NE2 3.36Å; C88-H104 PolarHBondContact SG-NE2 2.92Å; C91-H104 VanDerWaalsContact CB-CE1 3.47Å; C91-H104 WeakPolarHBondContact CB-CE1 3.34Å; C91-H104 WeakPolarHBondContact CB-NE2 3.15Å; C91-H104 VanDerWaalsContact SG-CE1 3.54Å; C91-H104 PolarHBondContact SG-NE2 2.62Å; L95-H104 HydrophobicContact CD1-CB 3.36Å; Q100-H104 VanDerWaalsContact O-CB 3.24Å; Q100-H104 WeakPolarHBondContact O-CB 3.49Å; Q100-H104 PolarHBondContact O-N 3.47Å; Y101-H104 WeakPolarHBondContact O-CB 3.04Å; Y101-H104 PolarHBondContact O-N 3.06Å; Y101-H104 VanDerWaalsContact O-N 3.14Å; A102-H104 VanDerWaalsContact C-N 3.34Å; H104-G107 PolarHBondContact O-N 3.31Å; H104-G107 VanDerWaalsContact O-N 3.08Å; H104-H110 AromaticContact CD2-ND1 3.87Å; H104-H110 AromaticContact NE2-ND1 3.55Å; H104-H110 WeakPolarHBondContact O-CB 3.37Å
105	C	81.2	Confident	77.1	Confident	27 Å²	27	77.5 Å²	77.5	18%	0.182	42%	0.415	C	S	.	.	H	α-helix	trans	-66.6	-36.4	-179.2	-64.6	0	0	0	0	112	Y101 A102 G107 H110 M111	Y101-C105 VanDerWaalsContact CZ-SG 3.55Å; Y101-C105 PolarHBondContact O-N 3.39Å; Y101-C105 PolarHBondContact O-SG 3.37Å; A102-C105 PolarHBondContact O-N 2.86Å; C105-G107 PolarHBondContact O-N 2.76Å; C105-H110 PolarHBondContact O-CD2 3.48Å; C105-M111 WeakPolarHBondContact O-CE 3.2Å
106	S	82.1	Confident	75.8	Confident	84 Å²	84	80.3 Å²	80.3	59%	0.587	44%	0.438	S	S	*	.	H	α-helix	trans	-76.9	-9.7	173	56.6	0	0	0	0	113.7	A102 L103	A102-S106 WeakPolarHBondContact O-CB 3.5Å; A102-S106 PolarHBondContact O-N 3.42Å; A102-S106 PolarHBondContact O-OG 2.77Å; L103-S106 WeakPolarHBondContact CA-OG 3.48Å; L103-S106 PolarHBondContact O-OG 3.23Å
107	G	81.9	Confident	74.8	Confident	24 Å²	24	79.5 Å²	79.5	25%	0.247	44%	0.441	C	S	.	.	S	Bend	trans	-72.5	142.7	-179.2	0	0	0	0	0	113.2	L103 H104 C105 K109 H110 M111	L103-G107 PolarHBondContact O-N 2.59Å; H104-G107 PolarHBondContact O-N 3.31Å; H104-G107 VanDerWaalsContact O-N 3.08Å; C105-G107 PolarHBondContact O-N 2.76Å; G107-K109 PolarHBondContact O-N 3.34Å; G107-H110 PolarHBondContact O-N 3.07Å; G107-M111 PolarHBondContact O-N 3.29Å
108	S	75.8	Confident	73.3	Confident	98 Å²	98	83.3 Å²	83.3	69%	0.685	46%	0.458	S	S	*	.	H	α-helix	trans	-57.6	-23.8	-178.8	-44.3	0	0	0	0	114.4	R112	S108-R112 PolarHBondContact O-N 3.43Å
109	K	79.1	Confident	71.5	Confident	175 Å²	175	87.9 Å²	87.9	76%	0.761	48%	0.478	S	S	*	.	H	α-helix	trans	-71.6	-39.1	177.1	-69.3	-176.4	-179.5	177.6	0	112.5	G107	G107-K109 PolarHBondContact O-N 3.34Å
110	H	80.6	Confident	69.7	Low	11 Å²	11	85 Å²	85	5%	0.051	47%	0.474	C	S	.	.	H	α-helix	trans	-72.2	-49.5	178.5	173	93.8	0	0	0	110	C88 E90 C91 H104 C105 G107 R112 N113 T114	C88-H110 PolarHBondContact SG-CE1 3.06Å; C88-H110 PolarHBondContact SG-ND1 3.34Å; E90-H110 IonicContact OE2-CE1 3.65Å; E90-H110 PolarHBondContact OE2-CE1 3.18Å; E90-H110 IonicContact OE2-ND1 3.14Å; E90-H110 IonicContact OE2-NE2 2.7Å; E90-H110 PolarHBondContact OE2-NE2 3.47Å; E90-H110 VanDerWaalsContact OE2-NE2 3.14Å; C91-H110 PolarHBondContact SG-ND1 3.34Å; H104-H110 AromaticContact CD2-ND1 3.87Å; H104-H110 AromaticContact NE2-ND1 3.55Å; H104-H110 WeakPolarHBondContact O-CB 3.37Å; C105-H110 PolarHBondContact O-CD2 3.48Å; G107-H110 PolarHBondContact O-N 3.07Å; H110-R112 PolarHBondContact O-N 2.74Å; H110-R112 VanDerWaalsContact O-N 3.12Å; H110-N113 WeakPolarHBondContact O-CA 3.29Å; H110-N113 WeakPolarHBondContact O-CB 3.23Å; H110-N113 PolarHBondContact O-N 3.29Å; H110-T114 WeakPolarHBondContact O-CG2 3.43Å; H110-T114 PolarHBondContact O-N 3.33Å; H110-T114 VanDerWaalsContact O-N 3.13Å
111	M	74.6	Confident	68.1	Low	72 Å²	72	87.4 Å²	87.4	36%	0.355	49%	0.488	S	S	.	.	H	α-helix	trans	-54.7	-33.5	177	-68.6	-73.4	98.2	0	0	114.2	C105 G107 N113 T114 I115	C105-M111 WeakPolarHBondContact O-CE 3.2Å; G107-M111 PolarHBondContact O-N 3.29Å; M111-N113 VanDerWaalsContact C-N 3.3Å; M111-N113 PolarHBondContact O-N 3.14Å; M111-T114 HydrophobicContact CE-CG2 4.25Å; M111-T114 PolarHBondContact O-OG1 3.37Å; M111-T114 VanDerWaalsContact O-OG1 3.13Å; M111-I115 VanDerWaalsContact O-CD1 3.3Å; M111-I115 WeakPolarHBondContact O-CD1 3.32Å; M111-I115 VanDerWaalsContact O-CG1 3.26Å; M111-I115 WeakPolarHBondContact O-CG1 3.07Å; M111-I115 PolarHBondContact O-N 2.84Å
112	R	72.3	Confident	66	Low	144 Å²	144	89.9 Å²	89.9	54%	0.543	51%	0.512	S	S	.	.	H	α-helix	trans	-65.5	-34.2	175.1	-174.6	177	-66.6	144.4	-0.8	112.7	S108 H110 S116	S108-R112 PolarHBondContact O-N 3.43Å; H110-R112 PolarHBondContact O-N 2.74Å; H110-R112 VanDerWaalsContact O-N 3.12Å; R112-S116 PolarHBondContact O-OG 2.92Å; R112-S116 VanDerWaalsContact O-OG 3.08Å
113	N	61.6	Low	63.8	Low	73 Å²	73	96 Å²	96	39%	0.39	53%	0.532	S	S	.	.	H	α-helix	trans	-81.8	-30.7	-178	-67.3	-4.5	0	0	0	112.1	H110 M111 S117	H110-N113 WeakPolarHBondContact O-CA 3.29Å; H110-N113 WeakPolarHBondContact O-CB 3.23Å; H110-N113 PolarHBondContact O-N 3.29Å; M111-N113 VanDerWaalsContact C-N 3.3Å; M111-N113 PolarHBondContact O-N 3.14Å; N113-S117 PolarHBondContact O-OG 3.41Å; N113-S117 VanDerWaalsContact O-OG 3.1Å
114	T	62.8	Low	61.8	Low	29 Å²	29	98.6 Å²	98.6	18%	0.178	54%	0.541	C	S	.	.	H	α-helix	trans	-72.4	-41.2	-179.6	66.3	0	0	0	0	112.4	E90 H110 M111 S116 S117	E90-T114 HydrophobicContact CB-CG2 4.5Å; E90-T114 HydrophobicContact CG-CG2 4.41Å; E90-T114 VanDerWaalsContact OE1-CG2 3.31Å; E90-T114 WeakPolarHBondContact OE1-CG2 3.33Å; E90-T114 WeakPolarHBondContact OE2-CG2 3.14Å; H110-T114 WeakPolarHBondContact O-CG2 3.43Å; H110-T114 PolarHBondContact O-N 3.33Å; H110-T114 VanDerWaalsContact O-N 3.13Å; M111-T114 HydrophobicContact CE-CG2 4.25Å; M111-T114 PolarHBondContact O-OG1 3.37Å; M111-T114 VanDerWaalsContact O-OG1 3.13Å; T114-S116 PolarHBondContact O-N 2.99Å; T114-S116 VanDerWaalsContact O-N 3.17Å; T114-S117 PolarHBondContact O-N 3.09Å
115	I	58.7	Low	59.5	Low	139 Å²	139	104.2 Å²	104.2	71%	0.713	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-22	-179.9	-62.2	165.6	0	0	0	112.3	M111	M111-I115 VanDerWaalsContact O-CD1 3.3Å; M111-I115 WeakPolarHBondContact O-CD1 3.32Å; M111-I115 VanDerWaalsContact O-CG1 3.26Å; M111-I115 WeakPolarHBondContact O-CG1 3.07Å; M111-I115 PolarHBondContact O-N 2.84Å
116	S	54	Low	57.2	Low	91 Å²	91	106.2 Å²	106.2	64%	0.636	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-5.3	-175.2	-52.4	0	0	0	0	114.2	R112 T114	R112-S116 PolarHBondContact O-OG 2.92Å; R112-S116 VanDerWaalsContact O-OG 3.08Å; T114-S116 PolarHBondContact O-N 2.99Å; T114-S116 VanDerWaalsContact O-N 3.17Å
117	S	56	Low	54.9	Low	93 Å²	93	108.8 Å²	108.8	65%	0.65	61%	0.609	S	S	*	*			trans	-109.8	-6.1	-167.3	-56.1	0	0	0	0	115	N113 T114 N119	N113-S117 PolarHBondContact O-OG 3.41Å; N113-S117 VanDerWaalsContact O-OG 3.1Å; T114-S117 PolarHBondContact O-N 3.09Å; S117-N119 PolarHBondContact O-N 3.47Å; S117-N119 VanDerWaalsContact O-N 3.16Å
118	D	46.8	Very low	52.5	Low	123 Å²	123	115.6 Å²	115.6	66%	0.658	63%	0.634	S	S	*	*			trans	-88.8	73.4	176.1	-160.3	-2.9	0	0	0	110.9	S120	D118-S120 PolarHBondContact O-N 2.97Å; D118-S120 PolarHBondContact OD1-OG 3.38Å
119	N	41.6	Very low	50.8	Low	148 Å²	148	119 Å²	119	79%	0.791	64%	0.639	S	S	*	*			trans	-85.4	69.7	164.9	-85.2	-28.1	0	0	0	108.9	S117	S117-N119 PolarHBondContact O-N 3.47Å; S117-N119 VanDerWaalsContact O-N 3.16Å
120	S	43.7	Very low	48.9	Very low	83 Å²	83	118.8 Å²	118.8	58%	0.58	64%	0.641	S	S	*	*			trans	-121.9	103.5	159.7	58.8	0	0	0	0	107.5	D118 P122	D118-S120 PolarHBondContact O-N 2.97Å; D118-S120 PolarHBondContact OD1-OG 3.38Å; S120-P122 VanDerWaalsContact O-CD 3.25Å; S120-P122 WeakPolarHBondContact O-CD 3.43Å
121	I	45.8	Very low	47	Very low	148 Å²	148	126.2 Å²	126.2	76%	0.759	67%	0.673	S	S	*	*			trans	-91.8	114.2	-176.8	-56.9	168.9	0	0	0	107.8
122	P	37.2	Very low	45.2	Very low	117 Å²	117	129.9 Å²	129.9	76%	0.76	69%	0.694	S	S	*	*			trans	-89.7	112.7	146.9	-2.6	20.9	0	0	0	107.4	S120 Q124	S120-P122 VanDerWaalsContact O-CD 3.25Å; S120-P122 WeakPolarHBondContact O-CD 3.43Å; P122-Q124 PolarHBondContact O-N 3.01Å
123	E	34.5	Very low	43.7	Very low	183 Å²	183	132.4 Å²	132.4	86%	0.855	71%	0.709	S	S	*	*			trans	-62.4	89.3	174	-175.1	169.2	174.4	0	0	110.5
124	Q	42.2	Very low	42.7	Very low	168 Å²	168	134.2 Å²	134.2	79%	0.785	73%	0.728	S	S	*	*			trans	-152.7	108.6	162.7	-101	-175.8	-79.3	0	0	111.5	P122	P122-Q124 PolarHBondContact O-N 3.01Å
125	L	37.6	Very low	41.8	Very low	158 Å²	158	139.7 Å²	139.7	83%	0.827	76%	0.756	S	S	*	*			trans	54.8	107.9	133.2	-61.5	157.8	0	0	0	118.3
126	G	31.7	Very low	41.5	Very low	70 Å²	70	139.5 Å²	139.5	72%	0.722	76%	0.757	S	S	*	*			trans	90.1	87	134.6	0	0	0	0	0	118.4
127	V	33.6	Very low	41.7	Very low	138 Å²	138	138.4 Å²	138.4	84%	0.836	75%	0.746	S	S	*	*				46	101.1	126.3	-169.6	0	0	0	0	117.7
128	E	32.2	Very low	42.3	Very low	166 Å²	166	137.5 Å²	137.5	78%	0.776	74%	0.737	S	S	*	*				173.7	91.7	121.6	-94.3	-172.7	102.2	0	0	108.7	Q130	E128-Q130 VanDerWaalsContact C-N 3.32Å; E128-Q130 PolarHBondContact O-N 2.9Å
129	Q	40.3	Very low	43.8	Very low	171 Å²	171	135.1 Å²	135.1	80%	0.799	72%	0.72	S	S	*	*			trans	-70.2	97.2	160.8	-77.4	178.2	8.1	0	0	107.1	F131	Q129-F131 HydrophobicContact CB-CD2 4.21Å; Q129-F131 PolarHBondContact O-N 2.96Å
130	Q	38.2	Very low	45.6	Very low	169 Å²	169	133.3 Å²	133.3	79%	0.79	71%	0.705	S	S	*	*			trans	-62.9	78.2	163.2	-73.5	179.2	5	0	0	108.8	E128 N132	E128-Q130 VanDerWaalsContact C-N 3.32Å; E128-Q130 PolarHBondContact O-N 2.9Å; Q130-N132 PolarHBondContact O-N 3.43Å; Q130-N132 VanDerWaalsContact O-N 3.16Å
131	F	41.3	Very low	47.4	Very low	167 Å²	167	129.4 Å²	129.4	73%	0.732	68%	0.678	S	S	*	*			trans	-60.8	113.7	155.1	-96.3	-96.6	0	0	0	106.3	Q129 K133	Q129-F131 HydrophobicContact CB-CD2 4.21Å; Q129-F131 PolarHBondContact O-N 2.96Å; F131-K133 PolarHBondContact O-N 2.95Å
132	N	38	Very low	48.9	Very low	150 Å²	150	127.5 Å²	127.5	80%	0.802	67%	0.668	S	S	*	*			trans	-47	112	173	-81.4	-35.3	0	0	0	109	Q130 S134	Q130-N132 PolarHBondContact O-N 3.43Å; Q130-N132 VanDerWaalsContact O-N 3.16Å; N132-S134 PolarHBondContact O-N 3.43Å
133	K	39.7	Very low	50.9	Low	196 Å²	196	123.8 Å²	123.8	85%	0.852	64%	0.644	S	S	*	*	S	Bend	trans	-55.6	85.8	167.4	-83.3	170.1	172.7	168.7	0	108.5	F131	F131-K133 PolarHBondContact O-N 2.95Å
134	S	41	Very low	53	Low	112 Å²	112	116.8 Å²	116.8	78%	0.783	62%	0.615	S	S	*	*			trans	-138.3	66.2	152.3	-144.1	0	0	0	0	107.2	N132 N136	N132-S134 PolarHBondContact O-N 3.43Å; S134-N136 PolarHBondContact O-N 2.98Å
135	N	42.9	Very low	54.8	Low	143 Å²	143	110 Å²	110	77%	0.765	59%	0.59	S	S	*	*			trans	-76.7	76.2	-175.5	-75	-29.3	0	0	0	111.4
136	N	53	Low	56.7	Low	136 Å²	136	106.5 Å²	106.5	73%	0.727	57%	0.572	S	S	*	*			trans	-151.3	54	164.6	-143.7	-80.9	0	0	0	113.5	S134	S134-N136 PolarHBondContact O-N 2.98Å
137	V	58	Low	59.1	Low	67 Å²	67	106.8 Å²	106.8	41%	0.406	56%	0.563	S	S	.	*			trans	-123	83.4	163.7	-160.2	0	0	0	0	108.8	Y139 C148	V137-Y139 PolarHBondContact O-N 2.87Å; V137-C148 WeakPolarHBondContact CG1-O 3.28Å
138	P	69.1	Low	61.2	Low	74 Å²	74	100.9 Å²	100.9	48%	0.481	53%	0.527	S	S	.	.			trans	-70.8	-6.3	-173.1	19.6	-24.1	0	0	0	114.6
139	Y	79.2	Confident	63.5	Low	73 Å²	73	97.4 Å²	97.4	29%	0.286	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	118.2	-171.6	-56.9	-70.2	0	0	0	111.1	V137 C148 S150 K151 L154	V137-Y139 PolarHBondContact O-N 2.87Å; Y139-C148 PolarHBondContact O-N 2.95Å; Y139-S150 WeakPolarHBondContact CD2-O 3.33Å; Y139-S150 VanDerWaalsContact CE2-C 3.49Å; Y139-K151 HydrophobicContact CD1-CB 4.36Å; Y139-K151 HydrophobicContact CD1-CG 4.49Å; Y139-K151 VanDerWaalsContact CD2-N 3.33Å; Y139-K151 HydrophobicContact CE1-CB 3.69Å; Y139-K151 HydrophobicContact CE1-CG 3.83Å; Y139-K151 HydrophobicContact CE2-CB 3.93Å; Y139-K151 VanDerWaalsContact CZ-CB 3.46Å; Y139-L154 HydrophobicContact CD1-CD2 3.95Å; Y139-L154 HydrophobicContact CG-CB 4.41Å; Y139-L154 HydrophobicContact CG-CD2 4.31Å
140	F	78.7	Confident	65.5	Low	111 Å²	111	90.8 Å²	90.8	49%	0.487	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	141.5	179.3	178.3	-101	0	0	0	111	I142 L146	F140-I142 HydrophobicContact CD1-CG1 3.88Å; F140-I142 HydrophobicContact CE1-CB 4.22Å; F140-I142 HydrophobicContact CE1-CG1 3.84Å; F140-L146 CarbonylContact C-O 3.6Å; F140-L146 WeakPolarHBondContact CA-O 3.28Å; F140-L146 VanDerWaalsContact CD2-O 3.31Å; F140-L146 WeakPolarHBondContact CD2-O 3.35Å
141	C	81.5	Confident	67.6	Low	1 Å²	1	87.9 Å²	87.9	1%	0.007	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	106.1	175	175.6	0	0	0	0	110.6	P143 C144 G145 L146 L154 H157 F158 H163	C141-P143 VanDerWaalsContact SG-CD 3.59Å; C141-C144 HydrophobicContact CB-CB 4.31Å; C141-C144 PolarHBondContact O-N 2.67Å; C141-G145 WeakPolarHBondContact O-CA 3.27Å; C141-G145 PolarHBondContact O-N 3.31Å; C141-L146 PolarHBondContact N-O 3.34Å; C141-L146 PolarHBondContact O-N 3.39Å; C141-L154 HydrophobicContact CB-CD1 3.99Å; C141-H157 WeakPolarHBondContact CB-NE2 3.45Å; C141-H157 PolarHBondContact SG-NE2 3.37Å; C141-F158 HydrophobicContact CB-CE1 3.98Å; C141-H163 PolarHBondContact SG-CE1 3.1Å; C141-H163 PolarHBondContact SG-ND1 2.88Å
142	I	77.5	Confident	69.7	Low	108 Å²	108	86 Å²	86	55%	0.554	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-46	180	-53.6	170.3	0	0	0	112.3	F140 C144 G145 Y170	F140-I142 HydrophobicContact CD1-CG1 3.88Å; F140-I142 HydrophobicContact CE1-CB 4.22Å; F140-I142 HydrophobicContact CE1-CG1 3.84Å; I142-C144 PolarHBondContact O-N 3.23Å; I142-C144 VanDerWaalsContact O-N 3.16Å; I142-G145 PolarHBondContact O-N 2.98Å; I142-Y170 HydrophobicContact CG2-CE1 4.48Å; I142-Y170 VanDerWaalsContact CG2-OH 3.27Å; I142-Y170 WeakPolarHBondContact CG2-OH 3.47Å
143	P	79.5	Confident	71.8	Confident	39 Å²	39	83.8 Å²	83.8	25%	0.253	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-23.6	179.3	-25.9	35.1	0	0	0	115.1	C141 C167 Y170	C141-P143 VanDerWaalsContact SG-CD 3.59Å; P143-C167 WeakPolarHBondContact CB-SG 3.31Å; P143-C167 VanDerWaalsContact CG-SG 3.5Å; P143-Y170 HydrophobicContact CB-CD2 4.21Å; P143-Y170 HydrophobicContact CB-CG 4.05Å; P143-Y170 HydrophobicContact CG-CD1 4.42Å; P143-Y170 HydrophobicContact CG-CG 4.42Å
144	C	78.5	Confident	73.9	Confident	35 Å²	35	75.3 Å²	75.3	24%	0.236	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-12.3	-176.4	-63.2	0	0	0	0	113.7	C141 I142 L146 H157	C141-C144 HydrophobicContact CB-CB 4.31Å; C141-C144 PolarHBondContact O-N 2.67Å; I142-C144 PolarHBondContact O-N 3.23Å; I142-C144 VanDerWaalsContact O-N 3.16Å; C144-L146 HydrophobicContact CB-CB 4.29Å; C144-L146 HydrophobicContact CB-CD1 3.86Å; C144-L146 HydrophobicContact CB-CG 4Å; C144-L146 PolarHBondContact O-N 3.35Å; C144-H157 PolarHBondContact SG-CE1 3.09Å; C144-H157 PolarHBondContact SG-NE2 3.16Å
145	G	80.6	Confident	76	Confident	27 Å²	27	73.3 Å²	73.3	28%	0.278	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	62	26.9	-172.8	0	0	0	0	0	113.4	C141 I142	C141-G145 WeakPolarHBondContact O-CA 3.27Å; C141-G145 PolarHBondContact O-N 3.31Å; I142-G145 PolarHBondContact O-N 2.98Å
146	L	76.9	Confident	77.9	Confident	84 Å²	84	70.6 Å²	70.6	44%	0.44	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	126	-175.2	-73.2	171.8	0	0	0	110.5	F140 C141 C144 H157	F140-L146 CarbonylContact C-O 3.6Å; F140-L146 WeakPolarHBondContact CA-O 3.28Å; F140-L146 VanDerWaalsContact CD2-O 3.31Å; F140-L146 WeakPolarHBondContact CD2-O 3.35Å; C141-L146 PolarHBondContact N-O 3.34Å; C141-L146 PolarHBondContact O-N 3.39Å; C144-L146 HydrophobicContact CB-CB 4.29Å; C144-L146 HydrophobicContact CB-CD1 3.86Å; C144-L146 HydrophobicContact CB-CG 4Å; C144-L146 PolarHBondContact O-N 3.35Å; L146-H157 VanDerWaalsContact CD1-CE1 3.48Å; L146-H157 WeakPolarHBondContact CD1-CE1 3.37Å
147	S	81.1	Confident	79.5	Confident	76 Å²	76	65.6 Å²	65.6	53%	0.531	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	129.1	169.4	59.4	0	0	0	0	109.5
148	C	77.5	Confident	80.8	Confident	13 Å²	13	66.5 Å²	66.5	9%	0.088	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.2	-178.4	-66	0	0	0	0	109.9	V137 Y139 S150 Q153 L154	V137-C148 WeakPolarHBondContact CG1-O 3.28Å; Y139-C148 PolarHBondContact O-N 2.95Å; C148-S150 VanDerWaalsContact C-N 3.35Å; C148-Q153 HydrophobicContact CB-CB 4.04Å; C148-L154 HydrophobicContact CB-CB 4.09Å; C148-L154 HydrophobicContact CB-CD1 4.4Å
149	S	81.4	Confident	81.5	Confident	93 Å²	93	70.3 Å²	70.3	65%	0.65	38%	0.38	S	S	*	.	S	Bend	trans	-81.3	-14.9	-176.7	-53.7	0	0	0	0	113.4
150	S	81.6	Confident	81.8	Confident	32 Å²	32	68 Å²	68	22%	0.224	38%	0.379	C	S	.	.	S	Bend	trans	-141.9	162.5	178.6	93.6	0	0	0	0	112.2	Y139 C148 E152 Q153 L154	Y139-S150 WeakPolarHBondContact CD2-O 3.33Å; Y139-S150 VanDerWaalsContact CE2-C 3.49Å; C148-S150 VanDerWaalsContact C-N 3.35Å; S150-E152 VanDerWaalsContact C-N 3.33Å; S150-E152 VanDerWaalsContact CB-OE2 3.22Å; S150-E152 WeakPolarHBondContact CB-OE2 3.25Å; S150-E152 PolarHBondContact OG-N 2.96Å; S150-E152 PolarHBondContact OG-OE2 2.83Å; S150-Q153 PolarHBondContact O-N 2.67Å; S150-Q153 WeakPolarHBondContact OG-CG 3.5Å; S150-Q153 PolarHBondContact OG-N 3.2Å; S150-L154 PolarHBondContact O-N 3.26Å
151	K	83.4	Confident	82.1	Confident	108 Å²	108	71.6 Å²	71.6	47%	0.47	39%	0.394	S	S	.	.	H	α-helix	trans	-63.3	-43.3	178.3	-170.7	-179.2	170.2	-176.3	0	110.6	Y139 Q153 L154 D155	Y139-K151 HydrophobicContact CD1-CB 4.36Å; Y139-K151 HydrophobicContact CD1-CG 4.49Å; Y139-K151 VanDerWaalsContact CD2-N 3.33Å; Y139-K151 HydrophobicContact CE1-CB 3.69Å; Y139-K151 HydrophobicContact CE1-CG 3.83Å; Y139-K151 HydrophobicContact CE2-CB 3.93Å; Y139-K151 VanDerWaalsContact CZ-CB 3.46Å; K151-Q153 VanDerWaalsContact C-N 3.27Å; K151-Q153 PolarHBondContact O-N 3.4Å; K151-L154 CarbonylContact O-C 3.59Å; K151-L154 WeakPolarHBondContact O-CA 3.49Å; K151-L154 WeakPolarHBondContact O-CB 3.5Å; K151-L154 PolarHBondContact O-N 3.15Å; K151-D155 PolarHBondContact O-N 3.17Å
152	E	84.8	Confident	82.2	Confident	129 Å²	129	80.1 Å²	80.1	60%	0.603	43%	0.431	S	S	*	.	H	α-helix	trans	-63	-36.4	-178.8	-55.4	70.2	-148.9	0	0	111	S150 S156	S150-E152 VanDerWaalsContact C-N 3.33Å; S150-E152 VanDerWaalsContact CB-OE2 3.22Å; S150-E152 WeakPolarHBondContact CB-OE2 3.25Å; S150-E152 PolarHBondContact OG-N 2.96Å; S150-E152 PolarHBondContact OG-OE2 2.83Å; E152-S156 WeakPolarHBondContact O-CB 3.47Å; E152-S156 PolarHBondContact O-N 3.01Å
153	Q	82.4	Confident	82.5	Confident	102 Å²	102	76.2 Å²	76.2	48%	0.477	41%	0.41	S	S	.	.	H	α-helix	trans	-65.9	-39.2	173.7	-71.7	179.6	5.2	0	0	111.8	C148 S150 K151 H157	C148-Q153 HydrophobicContact CB-CB 4.04Å; S150-Q153 PolarHBondContact O-N 2.67Å; S150-Q153 WeakPolarHBondContact OG-CG 3.5Å; S150-Q153 PolarHBondContact OG-N 3.2Å; K151-Q153 VanDerWaalsContact C-N 3.27Å; K151-Q153 PolarHBondContact O-N 3.4Å; Q153-H157 WeakPolarHBondContact O-CB 3.47Å; Q153-H157 PolarHBondContact O-N 3.25Å
154	L	84.1	Confident	82.7	Confident	18 Å²	18	81.3 Å²	81.3	9%	0.094	43%	0.429	C	S	.	.	H	α-helix	trans	-70.8	-42.7	177.1	-172	69.7	0	0	0	111.7	Y139 C141 C148 S150 K151 H157 F158	Y139-L154 HydrophobicContact CD1-CD2 3.95Å; Y139-L154 HydrophobicContact CG-CB 4.41Å; Y139-L154 HydrophobicContact CG-CD2 4.31Å; C141-L154 HydrophobicContact CB-CD1 3.99Å; C148-L154 HydrophobicContact CB-CB 4.09Å; C148-L154 HydrophobicContact CB-CD1 4.4Å; S150-L154 PolarHBondContact O-N 3.26Å; K151-L154 CarbonylContact O-C 3.59Å; K151-L154 WeakPolarHBondContact O-CA 3.49Å; K151-L154 WeakPolarHBondContact O-CB 3.5Å; K151-L154 PolarHBondContact O-N 3.15Å; L154-H157 CarbonylContact O-C 3.54Å; L154-H157 WeakPolarHBondContact O-CA 3.37Å; L154-H157 VanDerWaalsContact O-CB 3.31Å; L154-H157 WeakPolarHBondContact O-CB 3.42Å; L154-H157 PolarHBondContact O-N 3.1Å; L154-H157 VanDerWaalsContact O-N 3.17Å; L154-F158 HydrophobicContact CD1-CE1 3.9Å; L154-F158 HydrophobicContact CD1-CE2 4.29Å; L154-F158 HydrophobicContact CD1-CZ 3.76Å; L154-F158 HydrophobicContact CD2-CE2 3.78Å; L154-F158 HydrophobicContact CD2-CZ 3.78Å; L154-F158 HydrophobicContact CG-CD2 4.24Å; L154-F158 HydrophobicContact CG-CE1 4.2Å; L154-F158 HydrophobicContact CG-CE2 3.69Å; L154-F158 HydrophobicContact CG-CZ 3.66Å; L154-F158 WeakPolarHBondContact O-CG 2.87Å; L154-F158 PolarHBondContact O-N 3.47Å
155	D	83.5	Confident	82.8	Confident	71 Å²	71	86.9 Å²	86.9	38%	0.38	45%	0.449	S	S	.	.	H	α-helix	trans	-63	-45.1	176.6	-72.5	-20.5	0	0	0	110.8	K151 H157 F158 L159	K151-D155 PolarHBondContact O-N 3.17Å; D155-H157 VanDerWaalsContact C-N 3.31Å; D155-H157 PolarHBondContact O-N 2.83Å; D155-F158 PolarHBondContact O-N 3.14Å; D155-L159 WeakPolarHBondContact O-CG 3.34Å; D155-L159 PolarHBondContact O-N 3.26Å
156	S	84.7	Confident	82.6	Confident	85 Å²	85	90 Å²	90	59%	0.594	46%	0.456	S	S	*	.	H	α-helix	trans	-63	-37.4	173.2	-174.1	0	0	0	0	112.1	E152 L159 G160	E152-S156 WeakPolarHBondContact O-CB 3.47Å; E152-S156 PolarHBondContact O-N 3.01Å; S156-L159 PolarHBondContact O-N 3.23Å; S156-G160 PolarHBondContact O-N 2.88Å; S156-G160 VanDerWaalsContact O-N 3.07Å
157	H	85.9	Confident	82.7	Confident	32 Å²	32	88.3 Å²	88.3	15%	0.148	45%	0.451	C	S	.	.	H	α-helix	trans	-61.2	-45.5	172.8	167.6	74.5	0	0	0	111.9	C141 C144 L146 Q153 L154 D155 L159 G160 H163	C141-H157 WeakPolarHBondContact CB-NE2 3.45Å; C141-H157 PolarHBondContact SG-NE2 3.37Å; C144-H157 PolarHBondContact SG-CE1 3.09Å; C144-H157 PolarHBondContact SG-NE2 3.16Å; L146-H157 VanDerWaalsContact CD1-CE1 3.48Å; L146-H157 WeakPolarHBondContact CD1-CE1 3.37Å; Q153-H157 WeakPolarHBondContact O-CB 3.47Å; Q153-H157 PolarHBondContact O-N 3.25Å; L154-H157 CarbonylContact O-C 3.54Å; L154-H157 WeakPolarHBondContact O-CA 3.37Å; L154-H157 VanDerWaalsContact O-CB 3.31Å; L154-H157 WeakPolarHBondContact O-CB 3.42Å; L154-H157 PolarHBondContact O-N 3.1Å; L154-H157 VanDerWaalsContact O-N 3.17Å; D155-H157 VanDerWaalsContact C-N 3.31Å; D155-H157 PolarHBondContact O-N 2.83Å; H157-L159 VanDerWaalsContact C-N 3.34Å; H157-L159 PolarHBondContact O-N 3.45Å; H157-G160 PolarHBondContact O-N 3.41Å; H157-H163 AromaticContact CD2-ND1 3.77Å; H157-H163 AromaticContact CE1-ND1 3.93Å; H157-H163 AromaticContact NE2-CG 3.7Å; H157-H163 AromaticContact NE2-ND1 3.07Å; H157-H163 PolarHBondContact NE2-ND1 3.08Å; H157-H163 WeakPolarHBondContact O-CB 3.21Å
158	F	84.9	Confident	82.5	Confident	85 Å²	85	93 Å²	93	37%	0.373	46%	0.462	S	S	.	.	H	α-helix	trans	-64.4	-36.4	178	-69	-24.9	0	0	0	112.8	C141 L154 D155 G160 H163	C141-F158 HydrophobicContact CB-CE1 3.98Å; L154-F158 HydrophobicContact CD1-CE1 3.9Å; L154-F158 HydrophobicContact CD1-CE2 4.29Å; L154-F158 HydrophobicContact CD1-CZ 3.76Å; L154-F158 HydrophobicContact CD2-CE2 3.78Å; L154-F158 HydrophobicContact CD2-CZ 3.78Å; L154-F158 HydrophobicContact CG-CD2 4.24Å; L154-F158 HydrophobicContact CG-CE1 4.2Å; L154-F158 HydrophobicContact CG-CE2 3.69Å; L154-F158 HydrophobicContact CG-CZ 3.66Å; L154-F158 WeakPolarHBondContact O-CG 2.87Å; L154-F158 PolarHBondContact O-N 3.47Å; D155-F158 PolarHBondContact O-N 3.14Å; F158-G160 PolarHBondContact O-N 3.09Å; F158-H163 AromaticContact CD1-CD2 3.93Å; F158-H163 AromaticContact CD1-CE1 3.37Å; F158-H163 WeakPolarHBondContact CD1-CE1 3.45Å; F158-H163 AromaticContact CD1-ND1 3.79Å; F158-H163 AromaticContact CD1-NE2 3.47Å; F158-H163 WeakPolarHBondContact CD1-NE2 3.36Å; F158-H163 AromaticContact CE1-CE1 3.63Å; F158-H163 PolarHBondContact O-CD2 3.4Å
159	L	84.9	Confident	82.2	Confident	155 Å²	155	100.2 Å²	100.2	81%	0.812	49%	0.491	S	S	*	.	H	α-helix	trans	-71.3	-17.6	173.1	-68.1	167.1	0	0	0	113	D155 S156 H157	D155-L159 WeakPolarHBondContact O-CG 3.34Å; D155-L159 PolarHBondContact O-N 3.26Å; S156-L159 PolarHBondContact O-N 3.23Å; H157-L159 VanDerWaalsContact C-N 3.34Å; H157-L159 PolarHBondContact O-N 3.45Å
160	G	85.3	Confident	81.7	Confident	25 Å²	25	101.1 Å²	101.1	26%	0.258	48%	0.481	S	S	.	.	S	Bend	trans	-65.3	136.9	-177.8	0	0	0	0	0	114	S156 H157 F158 K162 H163 K164	S156-G160 PolarHBondContact O-N 2.88Å; S156-G160 VanDerWaalsContact O-N 3.07Å; H157-G160 PolarHBondContact O-N 3.41Å; F158-G160 PolarHBondContact O-N 3.09Å; G160-K162 PolarHBondContact O-N 3.37Å; G160-H163 PolarHBondContact O-N 2.75Å; G160-H163 VanDerWaalsContact O-N 3.08Å; G160-K164 PolarHBondContact O-N 2.75Å
161	K	84.7	Confident	80.5	Confident	185 Å²	185	108.8 Å²	108.8	80%	0.804	51%	0.511	S	S	*	.	H	α-helix	trans	-53.9	-28.4	174.7	-64.4	179.9	-177.3	175.4	0	113.2	K165	K161-K165 WeakPolarHBondContact O-CG 3.37Å; K161-K165 PolarHBondContact O-N 3.27Å
162	K	83.3	Confident	79.2	Confident	181 Å²	181	106 Å²	106	79%	0.787	50%	0.503	S	S	*	.	H	α-helix	trans	-68.8	-48	177.7	-67.3	-177.5	-179.7	177.7	0	111.7	G160 K165 Q166	G160-K162 PolarHBondContact O-N 3.37Å; K162-K165 PolarHBondContact O-N 2.82Å; K162-Q166 PolarHBondContact O-N 3.33Å; K162-Q166 VanDerWaalsContact O-N 3.09Å
163	H	84.2	Confident	77.1	Confident	25 Å²	25	109.5 Å²	109.5	12%	0.116	52%	0.517	C	S	.	.	H	α-helix	trans	-61	-48.1	178	178.1	80.5	0	0	0	111.2	C141 H157 F158 G160 K165 Q166 C167	C141-H163 PolarHBondContact SG-CE1 3.1Å; C141-H163 PolarHBondContact SG-ND1 2.88Å; H157-H163 AromaticContact CD2-ND1 3.77Å; H157-H163 AromaticContact CE1-ND1 3.93Å; H157-H163 AromaticContact NE2-CG 3.7Å; H157-H163 AromaticContact NE2-ND1 3.07Å; H157-H163 PolarHBondContact NE2-ND1 3.08Å; H157-H163 WeakPolarHBondContact O-CB 3.21Å; F158-H163 AromaticContact CD1-CD2 3.93Å; F158-H163 AromaticContact CD1-CE1 3.37Å; F158-H163 WeakPolarHBondContact CD1-CE1 3.45Å; F158-H163 AromaticContact CD1-ND1 3.79Å; F158-H163 AromaticContact CD1-NE2 3.47Å; F158-H163 WeakPolarHBondContact CD1-NE2 3.36Å; F158-H163 AromaticContact CE1-CE1 3.63Å; F158-H163 PolarHBondContact O-CD2 3.4Å; G160-H163 PolarHBondContact O-N 2.75Å; G160-H163 VanDerWaalsContact O-N 3.08Å; H163-K165 PolarHBondContact O-N 3.16Å; H163-K165 VanDerWaalsContact O-N 3.14Å; H163-Q166 PolarHBondContact O-N 3.33Å; H163-C167 PolarHBondContact CE1-SG 3.07Å; H163-C167 PolarHBondContact NE2-SG 2.8Å; H163-C167 WeakPolarHBondContact O-CB 3.48Å; H163-C167 PolarHBondContact O-N 2.76Å
164	K	82.6	Confident	75.1	Confident	147 Å²	147	109 Å²	109	64%	0.639	52%	0.52	S	S	*	.	H	α-helix	trans	-56.2	-33.5	177.7	-169.3	171.8	-174.8	171.4	0	113.5	G160 K168	G160-K164 PolarHBondContact O-N 2.75Å; K164-K168 WeakPolarHBondContact O-CG 3.14Å
165	K	81.9	Confident	72.9	Confident	151 Å²	151	112.8 Å²	112.8	66%	0.657	55%	0.549	S	S	*	.	H	α-helix	trans	-74.9	-41.5	174.8	-75	-178	-180	-174.6	0	112.3	K161 K162 H163	K161-K165 WeakPolarHBondContact O-CG 3.37Å; K161-K165 PolarHBondContact O-N 3.27Å; K162-K165 PolarHBondContact O-N 2.82Å; H163-K165 PolarHBondContact O-N 3.16Å; H163-K165 VanDerWaalsContact O-N 3.14Å
166	Q	75.9	Confident	70.5	Confident	93 Å²	93	116.3 Å²	116.3	44%	0.435	57%	0.568	S	S	.	*	H	α-helix	trans	-71.1	-39.9	179.8	-67.5	-66.2	53.1	0	0	112.5	K162 H163 K168 K169 Y170	K162-Q166 PolarHBondContact O-N 3.33Å; K162-Q166 VanDerWaalsContact O-N 3.09Å; H163-Q166 PolarHBondContact O-N 3.33Å; Q166-K168 PolarHBondContact O-N 3.4Å; Q166-K169 PolarHBondContact O-N 3.05Å; Q166-Y170 PolarHBondContact O-N 3.36Å
167	C	78.5	Confident	68.4	Low	48 Å²	48	121.2 Å²	121.2	32%	0.324	58%	0.581	S	S	.	*	H	α-helix	trans	-58.6	-34.5	175.6	-82	0	0	0	0	113.5	P143 H163 K169 Y170	P143-C167 WeakPolarHBondContact CB-SG 3.31Å; P143-C167 VanDerWaalsContact CG-SG 3.5Å; H163-C167 PolarHBondContact CE1-SG 3.07Å; H163-C167 PolarHBondContact NE2-SG 2.8Å; H163-C167 WeakPolarHBondContact O-CB 3.48Å; H163-C167 PolarHBondContact O-N 2.76Å; C167-K169 VanDerWaalsContact C-N 3.28Å; C167-K169 PolarHBondContact O-N 2.99Å; C167-Y170 PolarHBondContact O-N 2.72Å
168	K	76.3	Confident	66.2	Low	175 Å²	175	128.4 Å²	128.4	76%	0.761	62%	0.62	S	S	*	*	H	α-helix	trans	-67.6	-28.6	175.4	-72.2	-178	178.1	-164.7	0	113.3	K164 Q166	K164-K168 WeakPolarHBondContact O-CG 3.14Å; Q166-K168 PolarHBondContact O-N 3.4Å
169	K	72.3	Confident	63.7	Low	164 Å²	164	130.3 Å²	130.3	71%	0.713	64%	0.644	S	S	*	*	H	α-helix	trans	-90.9	-18.1	179.5	-66.1	-175.9	177.6	-172.6	0	112.8	Q166 C167 K171	Q166-K169 PolarHBondContact O-N 3.05Å; C167-K169 VanDerWaalsContact C-N 3.28Å; C167-K169 PolarHBondContact O-N 2.99Å; K169-K171 VanDerWaalsContact C-N 3.33Å; K169-K171 PolarHBondContact O-N 3.43Å
170	Y	70.9	Confident	61.2	Low	112 Å²	112	125.5 Å²	125.5	44%	0.439	63%	0.631	S	S	.	*			trans	-70.8	89.5	-179	-167.1	-97.9	0	0	0	109.8	I142 P143 Q166 C167	I142-Y170 HydrophobicContact CG2-CE1 4.48Å; I142-Y170 VanDerWaalsContact CG2-OH 3.27Å; I142-Y170 WeakPolarHBondContact CG2-OH 3.47Å; P143-Y170 HydrophobicContact CB-CD2 4.21Å; P143-Y170 HydrophobicContact CB-CG 4.05Å; P143-Y170 HydrophobicContact CG-CD1 4.42Å; P143-Y170 HydrophobicContact CG-CG 4.42Å; Q166-Y170 PolarHBondContact O-N 3.36Å; C167-Y170 PolarHBondContact O-N 2.72Å
171	K	56.1	Low	58.6	Low	194 Å²	194	135.6 Å²	135.6	84%	0.843	66%	0.663	S	S	*	*			trans	-97.4	111.9	170.1	-139.3	177.1	-171.6	174.7	0	106.3	K169 F173	K169-K171 VanDerWaalsContact C-N 3.33Å; K169-K171 PolarHBondContact O-N 3.43Å; K171-F173 PolarHBondContact O-N 3Å
172	P	55.3	Low	56.1	Low	48 Å²	48	133.2 Å²	133.2	31%	0.312	66%	0.664	S	S	.	*			trans	-62.4	123.2	176.6	23.7	-30.9	0	0	0	109.1	V174	P172-V174 HydrophobicContact CB-CG2 4.07Å; P172-V174 WeakPolarHBondContact O-CG2 3.5Å; P172-V174 PolarHBondContact O-N 3.21Å
173	F	41.6	Very low	53.6	Low	204 Å²	204	129.8 Å²	129.8	90%	0.895	66%	0.663	S	S	*	*			trans	-69	99.1	177.1	-153.3	-90	0	0	0	107.8	K171	K171-F173 PolarHBondContact O-N 3Å
174	V	40.5	Very low	51	Low	90 Å²	90	135.8 Å²	135.8	55%	0.545	70%	0.696	S	S	.	*			trans	-151.4	54.3	175.3	-110.6	0	0	0	0	109.3	P172 K218	P172-V174 HydrophobicContact CB-CG2 4.07Å; P172-V174 WeakPolarHBondContact O-CG2 3.5Å; P172-V174 PolarHBondContact O-N 3.21Å; V174-K218 HydrophobicContact CB-CD 3.62Å; V174-K218 HydrophobicContact CG2-CD 3.25Å; V174-K218 VanDerWaalsContact CG2-NZ 3.3Å; V174-K218 WeakPolarHBondContact O-CE 3.48Å; V174-K218 PolarHBondContact O-NZ 3.07Å
175	S	36.6	Very low	48.6	Very low	98 Å²	98	137.5 Å²	137.5	69%	0.685	71%	0.706	S	S	*	*			trans	-113.6	123.2	158.8	-63.2	0	0	0	0	101.7
176	D	34.6	Very low	46.5	Very low	146 Å²	146	139.5 Å²	139.5	78%	0.781	72%	0.718	S	S	*	*	S	Bend		174.3	84.8	56	-173.4	24.2	0	0	0	106.4
177	Q	41	Very low	44.5	Very low	188 Å²	188	140.5 Å²	140.5	88%	0.879	74%	0.735	S	S	*	*	S	Bend	trans	-152.3	14	175.9	-76.2	-151.2	29.4	0	0	115.8
178	L	38.7	Very low	42.6	Very low	183 Å²	183	145.5 Å²	145.5	96%	0.958	76%	0.759	S	S	*	*			trans	-127.6	72.3	169.3	-87.2	98.6	0	0	0	110.6
179	S	32.8	Very low	40.7	Very low	125 Å²	125	146 Å²	146	87%	0.874	76%	0.764	S	S	*	*			trans	-128.9	80.1	160.5	170.9	0	0	0	0	106.8
180	G	31.1	Very low	38.9	Very low	54 Å²	54	143.6 Å²	143.6	56%	0.557	77%	0.765	S	S	*	*			trans	-162.1	138.4	174.2	0	0	0	0	0	106.1
181	Y	31.3	Very low	37.1	Very low	236 Å²	236	147 Å²	147	93%	0.925	79%	0.788	S	S	*	*	S	Bend	trans	90	112.9	-172.8	-46.9	-67.9	0	0	0	115.5
182	V	32.1	Very low	35.9	Very low	136 Å²	136	141.3 Å²	141.3	82%	0.824	79%	0.786	S	S	*	*	S	Bend	trans	102.1	83.7	158	-162.3	0	0	0	0	115.9
183	S	31.2	Very low	35	Very low	109 Å²	109	148 Å²	148	76%	0.762	81%	0.813	S	S	*	*			trans	135.1	74.6	133.1	-53.4	0	0	0	0	113.5
184	N	29.5	Very low	34.9	Very low	151 Å²	151	142.6 Å²	142.6	81%	0.807	80%	0.798	S	S	*	*			trans	-74.2	136.5	133.7	-126.3	5.7	0	0	0	103.4
185	E	32.8	Very low	34.4	Very low	182 Å²	182	144.8 Å²	144.8	85%	0.85	81%	0.807	S	S	*	*				-159.7	145.1	61.6	-42.5	-158.7	114.8	0	0	109.5
186	Q	36.9	Very low	34.3	Very low	194 Å²	194	148.6 Å²	148.6	91%	0.907	81%	0.811	S	S	*	*			trans	-107.5	117.8	-176.2	-170.9	171.5	7.7	0	0	107.2
187	S	34.7	Very low	34.2	Very low	114 Å²	114	150.2 Å²	150.2	80%	0.797	81%	0.811	S	S	*	*			trans	-165.1	151.8	157.2	57.4	0	0	0	0	111.3
188	D	38.9	Very low	33.9	Very low	153 Å²	153	146.8 Å²	146.8	82%	0.818	81%	0.808	S	S	*	*			trans	-76.9	166.5	-155.8	-61.4	-84.9	0	0	0	117.1
189	Q	36.9	Very low	33.6	Very low	186 Å²	186	143.9 Å²	143.9	87%	0.869	80%	0.801	S	S	*	*			trans	93.8	130	154.7	-58.1	-159.8	-61.9	0	0	119.8
190	P	32.8	Very low	33.7	Very low	113 Å²	113	145.8 Å²	145.8	73%	0.734	80%	0.799	S	S	*	*			trans	-98.7	148.4	175	37.6	-29.6	0	0	0	111.7
191	I	33.1	Very low	33.8	Very low	182 Å²	182	148.4 Å²	148.4	93%	0.933	81%	0.806	S	S	*	*			trans	-173.6	129	152	-87	135.9	0	0	0	108.4
192	G	32.1	Very low	33.6	Very low	76 Å²	76	143.5 Å²	143.5	78%	0.784	80%	0.801	S	S	*	*			trans	97	99.4	147.9	0	0	0	0	0	120.1
193	Q	36.4	Very low	33.5	Very low	189 Å²	189	144.2 Å²	144.2	88%	0.883	80%	0.799	S	S	*	*			trans	-56.7	178.5	157.4	-96.2	178.6	-83.4	0	0	114.7
194	P	38.5	Very low	33.4	Very low	89 Å²	89	147.6 Å²	147.6	58%	0.578	80%	0.801	S	S	*	*			cis	-145.6	-176.8	-24.7	38.4	-17.8	0	0	0	116.1
195	D	31	Very low	33.3	Very low	137 Å²	137	147.7 Å²	147.7	73%	0.733	80%	0.801	S	S	*	*			trans	70.6	115	148.2	-55.7	-36.5	0	0	0	123.2
196	F	33.3	Very low	33	Very low	178 Å²	178	145.4 Å²	145.4	78%	0.781	80%	0.8	S	S	*	*				172.2	142.7	108.5	-119.5	-101.7	0	0	0	113
197	F	33.7	Very low	32.6	Very low	179 Å²	179	140.1 Å²	140.1	79%	0.785	79%	0.789	S	S	*	*			trans	92.6	76.9	171	-61.4	-77.1	0	0	0	120
198	S	33.1	Very low	32.5	Very low	116 Å²	116	140 Å²	140	81%	0.811	79%	0.789	S	S	*	*				40.7	146.5	125.3	-47.1	0	0	0	0	124.2
199	P	34.1	Very low	31.9	Very low	123 Å²	123	141.2 Å²	141.2	80%	0.799	79%	0.789	S	S	*	*			trans	-114.5	157.2	-151.9	32	-13.4	0	0	0	116
200	I	34.4	Very low	31.6	Very low	165 Å²	165	139.9 Å²	139.9	85%	0.846	79%	0.788	S	S	*	*			trans	-107.5	139.3	167	-63.7	175.6	0	0	0	108.8
201	P	32.1	Very low	31.6	Very low	108 Å²	108	138.7 Å²	138.7	70%	0.701	78%	0.783	S	S	*	*			trans	-78	135.4	-154	-11.3	27.5	0	0	0	114.6	L203	P201-L203 PolarHBondContact O-N 2.83Å
202	T	28.3	Very low	31.5	Very low	133 Å²	133	135.6 Å²	135.6	82%	0.816	77%	0.772	S	S	*	*			trans	-64.9	110.8	156.8	-48.3	0	0	0	0	109.4
203	L	30.8	Very low	32	Very low	151 Å²	151	138.7 Å²	138.7	79%	0.791	77%	0.771	S	S	*	*			trans	-127.7	139.7	163	-80.7	173.4	0	0	0	108.3	P201	P201-L203 PolarHBondContact O-N 2.83Å
204	F	27.2	Very low	32.1	Very low	180 Å²	180	138.7 Å²	138.7	79%	0.789	77%	0.768	S	S	*	*			trans	86.7	60.6	-172.2	-75.7	-92	0	0	0	117.1
205	N	27.6	Very low	32.2	Very low	154 Å²	154	138.5 Å²	138.5	82%	0.824	76%	0.756	S	S	*	*	S	Bend	trans	-130.8	64.9	143.1	-106.5	0.3	0	0	0	108.6
206	T	26.6	Very low	32.7	Very low	133 Å²	133	137 Å²	137	82%	0.816	74%	0.743	S	S	*	*			trans	-168.8	87.1	163.1	44.2	0	0	0	0	108
207	A	29.8	Very low	33.6	Very low	83 Å²	83	133.8 Å²	133.8	69%	0.686	74%	0.74	S	S	*	*			trans	-141.6	96.7	154.5	0	0	0	0	0	105.8	E209	A207-E209 PolarHBondContact O-N 2.85Å
208	S	31.6	Very low	34.6	Very low	112 Å²	112	129.7 Å²	129.7	78%	0.783	72%	0.722	S	S	*	*			trans	-36.3	131.8	164	51.3	0	0	0	0	111.2	N210	S208-N210 PolarHBondContact O-N 3.17Å; S208-N210 VanDerWaalsContact O-N 3.1Å
209	E	27.5	Very low	35.7	Very low	178 Å²	178	127.6 Å²	127.6	83%	0.832	70%	0.7	S	S	*	*	S	Bend	trans	8.5	94.5	137.7	-60.2	177.9	176	0	0	113.7	A207	A207-E209 PolarHBondContact O-N 2.85Å
210	N	30	Very low	36.9	Very low	159 Å²	159	124.6 Å²	124.6	85%	0.85	68%	0.68	S	S	*	*				169.9	138.7	128.4	-83.7	-37.7	0	0	0	111	S208	S208-N210 PolarHBondContact O-N 3.17Å; S208-N210 VanDerWaalsContact O-N 3.1Å
211	S	31.8	Very low	38.2	Very low	88 Å²	88	120.2 Å²	120.2	62%	0.615	66%	0.662	S	S	*	*	S	Bend	trans	83	87.8	163.7	-145.8	0	0	0	0	117.3	N213	S211-N213 PolarHBondContact O-N 3.48Å
212	T	32.4	Very low	39.8	Very low	117 Å²	117	118.6 Å²	118.6	72%	0.718	65%	0.652	S	S	*	*			trans	62.4	49.2	136.2	63.6	0	0	0	0	118
213	N	41.2	Very low	41.5	Very low	141 Å²	141	112.3 Å²	112.3	75%	0.754	61%	0.614	S	S	*	*			trans	-106.4	70.7	159.6	-70.9	-52	0	0	0	109.6	S211 W215	S211-N213 PolarHBondContact O-N 3.48Å; N213-W215 VanDerWaalsContact C-N 3.27Å; N213-W215 PolarHBondContact O-N 3.41Å; N213-W215 VanDerWaalsContact O-N 3.16Å
214	F	38.5	Very low	43.4	Very low	189 Å²	189	111.9 Å²	111.9	83%	0.829	61%	0.606	S	S	*	*			trans	-88.1	70.1	175.1	-133.9	-89.3	0	0	0	109.2
215	W	41.3	Very low	45.4	Very low	85 Å²	85	107.9 Å²	107.9	32%	0.322	59%	0.593	S	S	.	*			trans	-84.1	122.1	172.9	-91.1	17.8	0	0	0	110.5	N213 I223 G281 I284 L285	N213-W215 VanDerWaalsContact C-N 3.27Å; N213-W215 PolarHBondContact O-N 3.41Å; N213-W215 VanDerWaalsContact O-N 3.16Å; W215-I223 HydrophobicContact CD2-CD1 3.74Å; W215-I223 HydrophobicContact CE3-CD1 3.55Å; W215-I223 HydrophobicContact CH2-CB 4.03Å; W215-I223 HydrophobicContact CH2-CD1 3.46Å; W215-I223 VanDerWaalsContact CH2-CD1 3.46Å; W215-I223 HydrophobicContact CH2-CG1 4.09Å; W215-I223 HydrophobicContact CH2-CG2 3.17Å; W215-I223 HydrophobicContact CZ2-CD1 3.48Å; W215-I223 VanDerWaalsContact CZ2-CD1 3.48Å; W215-I223 HydrophobicContact CZ2-CG1 4.38Å; W215-I223 HydrophobicContact CZ2-CG2 4.15Å; W215-I223 HydrophobicContact CZ3-CB 3.94Å; W215-I223 HydrophobicContact CZ3-CD1 3.46Å; W215-I223 VanDerWaalsContact CZ3-CD1 3.46Å; W215-I223 HydrophobicContact CZ3-CG1 4.22Å; W215-I223 HydrophobicContact CZ3-CG2 3.38Å; W215-G281 WeakPolarHBondContact CZ2-O 3.3Å; W215-I284 HydrophobicContact CH2-CD1 4.48Å; W215-L285 HydrophobicContact CZ2-CD1 4.07Å; W215-L285 HydrophobicContact CZ2-CG 4.32Å
216	F	41.3	Very low	47.5	Very low	105 Å²	105	102.6 Å²	102.6	46%	0.461	56%	0.564	S	S	.	*			trans	-60.8	136.5	176.3	-72.1	-88.2	0	0	0	109.8	K218 M219	F216-K218 PolarHBondContact O-N 3.27Å; F216-M219 HydrophobicContact CB-CG 4.45Å; F216-M219 PolarHBondContact O-N 3.08Å
217	P	52.6	Low	49.5	Very low	111 Å²	111	98.5 Å²	98.5	72%	0.721	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-30.7	179.8	-26.7	32.7	0	0	0	113.6	M219 V220	P217-M219 PolarHBondContact O-N 3.03Å; P217-V220 PolarHBondContact O-N 3.31Å
218	K	54.6	Low	51.4	Low	93 Å²	93	99 Å²	99	40%	0.404	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-20.7	-178.6	-60	-176	-178.8	170.8	0	114.6	V174 F216	V174-K218 HydrophobicContact CB-CD 3.62Å; V174-K218 HydrophobicContact CG2-CD 3.25Å; V174-K218 VanDerWaalsContact CG2-NZ 3.3Å; V174-K218 WeakPolarHBondContact O-CE 3.48Å; V174-K218 PolarHBondContact O-NZ 3.07Å; F216-K218 PolarHBondContact O-N 3.27Å
219	M	56.2	Low	53.1	Low	71 Å²	71	96.5 Å²	96.5	35%	0.35	50%	0.502	S	S	.	.	H	α-helix	trans	-88.5	-17.4	177.2	-61.8	-141.5	-76.8	0	0	112.2	F216 P217 C222 I223 L285	F216-M219 HydrophobicContact CB-CG 4.45Å; F216-M219 PolarHBondContact O-N 3.08Å; P217-M219 PolarHBondContact O-N 3.03Å; M219-C222 PolarHBondContact O-N 3.08Å; M219-I223 HydrophobicContact CB-CD1 3.63Å; M219-I223 HydrophobicContact CB-CG1 4.32Å; M219-I223 WeakPolarHBondContact O-CB 3.46Å; M219-I223 WeakPolarHBondContact O-CD1 3.42Å; M219-I223 WeakPolarHBondContact O-CG1 3.13Å; M219-I223 PolarHBondContact O-N 3.46Å; M219-L285 HydrophobicContact CE-CD1 4.13Å; M219-L285 HydrophobicContact CE-CD2 4.05Å; M219-L285 HydrophobicContact SD-CD2 4.19Å
220	V	58.3	Low	55.1	Low	60 Å²	60	89.2 Å²	89.2	36%	0.364	47%	0.468	S	S	.	.	H	α-helix	trans	-55.7	-44.1	-179.4	-177.5	0	0	0	0	112.6	P217 I223 K224	P217-V220 PolarHBondContact O-N 3.31Å; V220-I223 PolarHBondContact O-N 2.79Å; V220-K224 WeakPolarHBondContact O-CG 3.17Å; V220-K224 PolarHBondContact O-N 2.81Å
221	P	63	Low	56.9	Low	74 Å²	74	83.7 Å²	83.7	48%	0.481	44%	0.442	S	S	.	.	H	α-helix	trans	-67.2	-45.2	176.2	-18.8	32.4	0	0	0	112.5	I223 K224 N225	P221-I223 PolarHBondContact O-N 3.18Å; P221-K224 PolarHBondContact O-N 3.34Å; P221-N225 PolarHBondContact O-N 3.39Å
222	C	65	Low	58.7	Low	73 Å²	73	83.5 Å²	83.5	49%	0.493	43%	0.43	S	S	.	.	H	α-helix	trans	-58.9	-41.2	177.8	-63.7	0	0	0	0	111.1	M219 N225 I226	M219-C222 PolarHBondContact O-N 3.08Å; C222-N225 WeakPolarHBondContact O-CB 3.48Å; C222-N225 PolarHBondContact O-N 3.14Å; C222-I226 WeakPolarHBondContact O-CD1 3.31Å; C222-I226 WeakPolarHBondContact O-CG1 3.41Å; C222-I226 PolarHBondContact O-N 3.46Å
223	I	65.2	Low	60.3	Low	2 Å²	2	79.1 Å²	79.1	1%	0.01	40%	0.402	C	S	.	.	H	α-helix	trans	-73.7	-36.6	-178.8	-61.4	161.2	0	0	0	110.5	W215 M219 V220 P221 N225 I226 I227 I284 L285	W215-I223 HydrophobicContact CD2-CD1 3.74Å; W215-I223 HydrophobicContact CE3-CD1 3.55Å; W215-I223 HydrophobicContact CH2-CB 4.03Å; W215-I223 HydrophobicContact CH2-CD1 3.46Å; W215-I223 VanDerWaalsContact CH2-CD1 3.46Å; W215-I223 HydrophobicContact CH2-CG1 4.09Å; W215-I223 HydrophobicContact CH2-CG2 3.17Å; W215-I223 HydrophobicContact CZ2-CD1 3.48Å; W215-I223 VanDerWaalsContact CZ2-CD1 3.48Å; W215-I223 HydrophobicContact CZ2-CG1 4.38Å; W215-I223 HydrophobicContact CZ2-CG2 4.15Å; W215-I223 HydrophobicContact CZ3-CB 3.94Å; W215-I223 HydrophobicContact CZ3-CD1 3.46Å; W215-I223 VanDerWaalsContact CZ3-CD1 3.46Å; W215-I223 HydrophobicContact CZ3-CG1 4.22Å; W215-I223 HydrophobicContact CZ3-CG2 3.38Å; M219-I223 HydrophobicContact CB-CD1 3.63Å; M219-I223 HydrophobicContact CB-CG1 4.32Å; M219-I223 WeakPolarHBondContact O-CB 3.46Å; M219-I223 WeakPolarHBondContact O-CD1 3.42Å; M219-I223 WeakPolarHBondContact O-CG1 3.13Å; M219-I223 PolarHBondContact O-N 3.46Å; V220-I223 PolarHBondContact O-N 2.79Å; P221-I223 PolarHBondContact O-N 3.18Å; I223-N225 VanDerWaalsContact C-N 3.31Å; I223-N225 PolarHBondContact O-N 2.83Å; I223-I226 PolarHBondContact O-N 3.37Å; I223-I227 HydrophobicContact CG2-CD1 3.81Å; I223-I227 HydrophobicContact CG2-CG1 4.21Å; I223-I227 WeakPolarHBondContact O-CB 3.35Å; I223-I227 WeakPolarHBondContact O-CD1 3.49Å; I223-I227 WeakPolarHBondContact O-CG1 3.47Å; I223-I227 PolarHBondContact O-N 2.79Å; I223-I284 HydrophobicContact CG2-CD1 4.11Å; I223-I284 HydrophobicContact CG2-CG2 3.94Å; I223-L285 HydrophobicContact CD1-CD2 4.36Å
224	K	69.8	Low	61.4	Low	142 Å²	142	74 Å²	74	62%	0.617	38%	0.376	S	S	*	.	H	α-helix	trans	-57.2	-46	168.6	-78.7	-175.4	178	-174.4	0	111.4	V220 P221 I226 I227 E228	V220-K224 WeakPolarHBondContact O-CG 3.17Å; V220-K224 PolarHBondContact O-N 2.81Å; P221-K224 PolarHBondContact O-N 3.34Å; K224-I226 PolarHBondContact O-N 3.1Å; K224-I227 PolarHBondContact O-N 2.99Å; K224-E228 WeakPolarHBondContact O-CB 3.46Å; K224-E228 PolarHBondContact O-N 3.16Å
225	N	69.2	Low	62.5	Low	96 Å²	96	72.3 Å²	72.3	51%	0.513	38%	0.375	S	S	.	.	H	α-helix	trans	-62.8	-41.9	176.6	-71	-11.4	0	0	0	111.9	P221 C222 I223 E228 L229	P221-N225 PolarHBondContact O-N 3.39Å; C222-N225 WeakPolarHBondContact O-CB 3.48Å; C222-N225 PolarHBondContact O-N 3.14Å; I223-N225 VanDerWaalsContact C-N 3.31Å; I223-N225 PolarHBondContact O-N 2.83Å; N225-E228 PolarHBondContact O-N 3.4Å; N225-L229 WeakPolarHBondContact O-CB 3.42Å; N225-L229 VanDerWaalsContact O-CG 3.27Å; N225-L229 WeakPolarHBondContact O-CG 3.38Å; N225-L229 PolarHBondContact O-N 3.08Å
226	I	71.6	Confident	63.5	Low	42 Å²	42	71.5 Å²	71.5	22%	0.215	38%	0.379	C	S	.	.	H	α-helix	trans	-65.1	-43.8	176.7	-66.5	154.6	0	0	0	110.6	C222 I223 K224 E228 L229 E230 I284 S288	C222-I226 WeakPolarHBondContact O-CD1 3.31Å; C222-I226 WeakPolarHBondContact O-CG1 3.41Å; C222-I226 PolarHBondContact O-N 3.46Å; I223-I226 PolarHBondContact O-N 3.37Å; K224-I226 PolarHBondContact O-N 3.1Å; I226-E228 VanDerWaalsContact C-N 3.28Å; I226-E228 PolarHBondContact O-N 3.21Å; I226-L229 PolarHBondContact O-N 3.09Å; I226-E230 HydrophobicContact CG2-CG 4.2Å; I226-E230 WeakPolarHBondContact CG2-OE1 3.41Å; I226-E230 WeakPolarHBondContact O-CB 3.45Å; I226-E230 VanDerWaalsContact O-CG 3.23Å; I226-E230 WeakPolarHBondContact O-CG 3.48Å; I226-E230 PolarHBondContact O-N 3.15Å; I226-I284 HydrophobicContact CB-CG2 4.06Å; I226-I284 HydrophobicContact CG2-CG2 3.49Å; I226-I284 VanDerWaalsContact CG2-CG2 3.49Å; I226-S288 VanDerWaalsContact CD1-OG 3.22Å; I226-S288 WeakPolarHBondContact CD1-OG 3.26Å
227	I	68.3	Low	64.3	Low	47 Å²	47	71.5 Å²	71.5	24%	0.241	38%	0.384	C	S	.	.	H	α-helix	trans	-59.9	-41.9	175.7	-68.6	162.8	0	0	0	110.2	I223 K224 E230 S231 I284	I223-I227 HydrophobicContact CG2-CD1 3.81Å; I223-I227 HydrophobicContact CG2-CG1 4.21Å; I223-I227 WeakPolarHBondContact O-CB 3.35Å; I223-I227 WeakPolarHBondContact O-CD1 3.49Å; I223-I227 WeakPolarHBondContact O-CG1 3.47Å; I223-I227 PolarHBondContact O-N 2.79Å; K224-I227 PolarHBondContact O-N 2.99Å; I227-E230 PolarHBondContact O-N 3.44Å; I227-S231 WeakPolarHBondContact O-CB 3.38Å; I227-S231 PolarHBondContact O-N 3.45Å; I227-I284 HydrophobicContact CD1-CD1 3.7Å; I227-I284 HydrophobicContact CG1-CD1 3.48Å; I227-I284 VanDerWaalsContact CG1-CD1 3.48Å; I227-I284 HydrophobicContact CG1-CG1 4.29Å
228	E	71	Confident	64.6	Low	93 Å²	93	74.3 Å²	74.3	44%	0.435	39%	0.385	S	S	.	.	H	α-helix	trans	-66.5	-44.2	177.5	-164.1	-175.5	150.4	0	0	111.4	K224 N225 I226 E230 S231 K232	K224-E228 WeakPolarHBondContact O-CB 3.46Å; K224-E228 PolarHBondContact O-N 3.16Å; N225-E228 PolarHBondContact O-N 3.4Å; I226-E228 VanDerWaalsContact C-N 3.28Å; I226-E228 PolarHBondContact O-N 3.21Å; E228-E230 VanDerWaalsContact C-N 3.34Å; E228-E230 PolarHBondContact O-N 3.17Å; E228-S231 WeakPolarHBondContact CA-OG 3.17Å; E228-S231 PolarHBondContact O-N 2.87Å; E228-S231 PolarHBondContact O-OG 3.15Å; E228-K232 WeakPolarHBondContact O-CG 3.22Å; E228-K232 PolarHBondContact O-N 2.81Å; E228-K232 VanDerWaalsContact OE1-CE 3.29Å; E228-K232 WeakPolarHBondContact OE1-CE 3.11Å; E228-K232 IonicContact OE1-NZ 2.76Å; E228-K232 PolarHBondContact OE1-NZ 3.29Å
229	L	66.7	Low	64.7	Low	61 Å²	61	72.1 Å²	72.1	32%	0.319	38%	0.375	S	S	.	.	H	α-helix	trans	-61.5	-41.5	174.7	-73.8	175	0	0	0	112	N225 I226 S231 K232 L233 V302 L306	N225-L229 WeakPolarHBondContact O-CB 3.42Å; N225-L229 VanDerWaalsContact O-CG 3.27Å; N225-L229 WeakPolarHBondContact O-CG 3.38Å; N225-L229 PolarHBondContact O-N 3.08Å; I226-L229 PolarHBondContact O-N 3.09Å; L229-S231 VanDerWaalsContact C-N 3.33Å; L229-K232 PolarHBondContact O-N 2.99Å; L229-L233 WeakPolarHBondContact O-CB 3.48Å; L229-L233 WeakPolarHBondContact O-CG 3.45Å; L229-L233 PolarHBondContact O-N 3.36Å; L229-V302 HydrophobicContact CD2-CG1 3.82Å; L229-L306 HydrophobicContact CD2-CD1 4Å
230	E	68.9	Low	64.7	Low	25 Å²	25	71 Å²	71	12%	0.117	37%	0.373	C	S	.	.	H	α-helix	trans	-66.2	-36	175.2	-73.2	175.1	173.4	0	0	111.9	I226 I227 E228 K232 L233 T234 F277 R287	I226-E230 HydrophobicContact CG2-CG 4.2Å; I226-E230 WeakPolarHBondContact CG2-OE1 3.41Å; I226-E230 WeakPolarHBondContact O-CB 3.45Å; I226-E230 VanDerWaalsContact O-CG 3.23Å; I226-E230 WeakPolarHBondContact O-CG 3.48Å; I226-E230 PolarHBondContact O-N 3.15Å; I227-E230 PolarHBondContact O-N 3.44Å; E228-E230 VanDerWaalsContact C-N 3.34Å; E228-E230 PolarHBondContact O-N 3.17Å; E230-K232 VanDerWaalsContact C-N 3.33Å; E230-L233 PolarHBondContact O-N 2.85Å; E230-T234 WeakPolarHBondContact O-CB 3.18Å; E230-T234 PolarHBondContact O-N 2.9Å; E230-T234 PolarHBondContact O-OG1 2.9Å; E230-F277 HydrophobicContact CB-CD2 4.36Å; E230-F277 HydrophobicContact CG-CD2 4.49Å; E230-R287 IonicContact OE1-CZ 3.19Å; E230-R287 VanDerWaalsContact OE1-CZ 3.28Å; E230-R287 IonicContact OE1-NH1 2.7Å; E230-R287 PolarHBondContact OE1-NH1 3.28Å; E230-R287 IonicContact OE1-NH2 2.83Å; E230-R287 IonicContact OE2-CZ 3.54Å; E230-R287 IonicContact OE2-NH1 3.28Å; E230-R287 PolarHBondContact OE2-NH1 3.05Å; E230-R287 IonicContact OE2-NH2 2.73Å; E230-R287 PolarHBondContact OE2-NH2 3.43Å
231	S	68.8	Low	64.7	Low	43 Å²	43	73.8 Å²	73.8	30%	0.301	39%	0.392	S	S	.	.	H	α-helix	trans	-66.1	-36.1	173.2	77.5	0	0	0	0	112	I227 E228 L229 T234 L235	I227-S231 WeakPolarHBondContact O-CB 3.38Å; I227-S231 PolarHBondContact O-N 3.45Å; E228-S231 WeakPolarHBondContact CA-OG 3.17Å; E228-S231 PolarHBondContact O-N 2.87Å; E228-S231 PolarHBondContact O-OG 3.15Å; L229-S231 VanDerWaalsContact C-N 3.33Å; S231-T234 VanDerWaalsContact CA-OG1 3.29Å; S231-T234 WeakPolarHBondContact CA-OG1 3.49Å; S231-T234 PolarHBondContact O-OG1 2.89Å; S231-L235 PolarHBondContact O-N 3.13Å
232	K	69.9	Low	64.4	Low	84 Å²	84	73.3 Å²	73.3	37%	0.365	38%	0.383	S	S	.	.	H	α-helix	trans	-70.9	-41.1	174.4	-70.9	174.2	-176.2	168.9	0	111.5	E228 L229 E230 L235 T236 L306	E228-K232 WeakPolarHBondContact O-CG 3.22Å; E228-K232 PolarHBondContact O-N 2.81Å; E228-K232 VanDerWaalsContact OE1-CE 3.29Å; E228-K232 WeakPolarHBondContact OE1-CE 3.11Å; E228-K232 IonicContact OE1-NZ 2.76Å; E228-K232 PolarHBondContact OE1-NZ 3.29Å; L229-K232 PolarHBondContact O-N 2.99Å; E230-K232 VanDerWaalsContact C-N 3.33Å; K232-L235 WeakPolarHBondContact O-CB 3.03Å; K232-L235 PolarHBondContact O-N 2.74Å; K232-T236 PolarHBondContact O-N 3.4Å; K232-T236 VanDerWaalsContact O-N 3.08Å; K232-L306 HydrophobicContact CB-CD2 4.32Å; K232-L306 HydrophobicContact CD-CD2 4.29Å
233	L	65.2	Low	64	Low	24 Å²	24	70.4 Å²	70.4	13%	0.126	36%	0.362	C	S	.	.	H	α-helix	trans	-66	-38.5	176.4	-76.7	162.3	0	0	0	112.7	L229 E230 L235 T236 N237 F239 L243	L229-L233 WeakPolarHBondContact O-CB 3.48Å; L229-L233 WeakPolarHBondContact O-CG 3.45Å; L229-L233 PolarHBondContact O-N 3.36Å; E230-L233 PolarHBondContact O-N 2.85Å; L233-L235 PolarHBondContact O-N 3.42Å; L233-T236 PolarHBondContact O-N 2.94Å; L233-T236 PolarHBondContact O-OG1 2.9Å; L233-N237 PolarHBondContact O-N 3.16Å; L233-F239 HydrophobicContact CB-CE1 3.91Å; L233-F239 HydrophobicContact CB-CZ 4.37Å; L233-L243 HydrophobicContact CD1-CD1 4.12Å
234	T	64.4	Low	63.6	Low	33 Å²	33	72.9 Å²	72.9	20%	0.202	38%	0.384	C	S	.	.	H	α-helix	trans	-66.7	-27.7	173.2	36.3	0	0	0	0	112.2	E230 S231 F239 F277	E230-T234 WeakPolarHBondContact O-CB 3.18Å; E230-T234 PolarHBondContact O-N 2.9Å; E230-T234 PolarHBondContact O-OG1 2.9Å; S231-T234 VanDerWaalsContact CA-OG1 3.29Å; S231-T234 WeakPolarHBondContact CA-OG1 3.49Å; S231-T234 PolarHBondContact O-OG1 2.89Å; T234-F239 HydrophobicContact CG2-CE2 4.45Å; T234-F239 HydrophobicContact CG2-CZ 3.76Å; T234-F277 HydrophobicContact CG2-CD2 4.03Å; T234-F277 HydrophobicContact CG2-CE2 4.32Å
235	L	61.2	Low	63.2	Low	155 Å²	155	70.5 Å²	70.5	81%	0.812	38%	0.384	S	S	*	.	H	α-helix	trans	-75.9	-36.5	175.2	-133.3	101.1	0	0	0	113.3	S231 K232 L233 N237	S231-L235 PolarHBondContact O-N 3.13Å; K232-L235 WeakPolarHBondContact O-CB 3.03Å; K232-L235 PolarHBondContact O-N 2.74Å; L233-L235 PolarHBondContact O-N 3.42Å; L235-N237 VanDerWaalsContact C-N 3.31Å; L235-N237 PolarHBondContact O-N 3.03Å
236	T	62.7	Low	62.8	Low	67 Å²	67	66.9 Å²	66.9	41%	0.411	37%	0.366	S	S	.	.	H	α-helix	trans	-80.8	-10.4	-175.9	57.3	0	0	0	0	113.8	K232 L233 K238	K232-T236 PolarHBondContact O-N 3.4Å; K232-T236 VanDerWaalsContact O-N 3.08Å; L233-T236 PolarHBondContact O-N 2.94Å; L233-T236 PolarHBondContact O-OG1 2.9Å; T236-K238 PolarHBondContact O-N 3.35Å
237	N	58	Low	62.2	Low	105 Å²	105	69.3 Å²	69.3	56%	0.561	38%	0.383	S	S	*	.			trans	52.7	8.6	-175	-122.2	-18.8	0	0	0	114.3	L233 L235 F239	L233-N237 PolarHBondContact O-N 3.16Å; L235-N237 VanDerWaalsContact C-N 3.31Å; L235-N237 PolarHBondContact O-N 3.03Å; N237-F239 PolarHBondContact O-N 3.22Å
238	K	58.2	Low	61.8	Low	170 Å²	170	72.1 Å²	72.1	74%	0.739	40%	0.404	S	S	*	.			trans	-97.6	77.7	178.8	-74.3	-175.8	-178.5	-178.9	0	107.8	T236 P240	T236-K238 PolarHBondContact O-N 3.35Å; K238-P240 VanDerWaalsContact O-CD 3.28Å; K238-P240 WeakPolarHBondContact O-CD 3.23Å
239	F	56.5	Low	61.6	Low	48 Å²	48	68.2 Å²	68.2	21%	0.211	39%	0.387	C	S	.	.			trans	-81	117.3	169.9	-76.8	-67.8	0	0	0	109.4	L233 T234 N237 L243 F277	L233-F239 HydrophobicContact CB-CE1 3.91Å; L233-F239 HydrophobicContact CB-CZ 4.37Å; T234-F239 HydrophobicContact CG2-CE2 4.45Å; T234-F239 HydrophobicContact CG2-CZ 3.76Å; N237-F239 PolarHBondContact O-N 3.22Å; F239-L243 HydrophobicContact CB-CB 4.43Å; F239-L243 HydrophobicContact CD1-CB 3.78Å; F239-L243 HydrophobicContact CD1-CD1 3.69Å; F239-L243 HydrophobicContact CD1-CG 4.38Å; F239-L243 HydrophobicContact CE1-CD1 4.11Å; F239-F277 HydrophobicContact CD1-CE2 4.27Å; F239-F277 AromaticContact CD1-CZ 3.95Å; F239-F277 HydrophobicContact CD1-CZ 3.95Å; F239-F277 HydrophobicContact CE1-CD2 4.48Å; F239-F277 AromaticContact CE1-CE2 3.27Å; F239-F277 HydrophobicContact CE1-CE2 3.27Å; F239-F277 AromaticContact CE1-CZ 3.37Å; F239-F277 HydrophobicContact CE1-CZ 3.37Å; F239-F277 AromaticContact CZ-CE2 3.61Å; F239-F277 HydrophobicContact CZ-CE2 3.61Å; F239-F277 AromaticContact CZ-CZ 3.96Å; F239-F277 HydrophobicContact CZ-CZ 3.96Å
240	P	57.8	Low	61.3	Low	47 Å²	47	68.7 Å²	68.7	31%	0.305	40%	0.395	S	S	.	.			trans	-54.9	140.9	163.2	23.2	-34.1	0	0	0	108.7	K238 F242 L243	K238-P240 VanDerWaalsContact O-CD 3.28Å; K238-P240 WeakPolarHBondContact O-CD 3.23Å; P240-F242 HydrophobicContact CB-CD1 3.69Å; P240-F242 HydrophobicContact CB-CE1 3.75Å; P240-F242 HydrophobicContact CG-CD1 3.76Å; P240-F242 HydrophobicContact CG-CE1 3.32Å; P240-F242 HydrophobicContact CG-CZ 4.24Å; P240-F242 PolarHBondContact O-N 3.25Å; P240-L243 HydrophobicContact CG-CD1 3.97Å; P240-L243 HydrophobicContact CG-CG 4.22Å; P240-L243 PolarHBondContact O-N 3.37Å
241	P	57.7	Low	60.6	Low	118 Å²	118	72 Å²	72	77%	0.766	41%	0.408	S	S	*	.	H	α-helix	trans	-56.4	-23.6	-169.1	17.3	-30.3	0	0	0	113.7	L243 A244	P241-L243 VanDerWaalsContact C-N 3.32Å; P241-L243 PolarHBondContact O-N 3.29Å; P241-A244 WeakPolarHBondContact O-CB 3.4Å; P241-A244 PolarHBondContact O-N 3.13Å
242	F	56.8	Low	59.9	Low	64 Å²	64	74.6 Å²	74.6	28%	0.281	42%	0.415	S	S	.	.	H	α-helix	trans	-65.9	-31.5	175.2	89.7	-92.5	0	0	0	112.9	P240 A244 S245 V291 F298	P240-F242 HydrophobicContact CB-CD1 3.69Å; P240-F242 HydrophobicContact CB-CE1 3.75Å; P240-F242 HydrophobicContact CG-CD1 3.76Å; P240-F242 HydrophobicContact CG-CE1 3.32Å; P240-F242 HydrophobicContact CG-CZ 4.24Å; P240-F242 PolarHBondContact O-N 3.25Å; F242-A244 VanDerWaalsContact C-N 3.3Å; F242-A244 PolarHBondContact O-N 3.28Å; F242-S245 PolarHBondContact O-N 3.42Å; F242-S245 PolarHBondContact O-OG 3.23Å; F242-V291 HydrophobicContact CE2-CB 4.31Å; F242-V291 HydrophobicContact CE2-CG2 3.51Å; F242-V291 HydrophobicContact CZ-CB 4.48Å; F242-V291 HydrophobicContact CZ-CG1 4.45Å; F242-V291 HydrophobicContact CZ-CG2 3.77Å; F242-F298 HydrophobicContact CE1-CD2 4.3Å; F242-F298 AromaticContact CE1-CE2 3.54Å; F242-F298 HydrophobicContact CE1-CE2 3.54Å; F242-F298 HydrophobicContact CE1-CZ 4.36Å; F242-F298 HydrophobicContact CZ-CD2 4.14Å; F242-F298 AromaticContact CZ-CE2 3.34Å; F242-F298 HydrophobicContact CZ-CE2 3.34Å; F242-F298 AromaticContact CZ-CZ 3.87Å; F242-F298 HydrophobicContact CZ-CZ 3.87Å
243	L	55.9	Low	58.8	Low	12 Å²	12	76.1 Å²	76.1	6%	0.063	42%	0.423	C	S	.	.	H	α-helix	trans	-73	-24	177.2	-75.7	178.4	0	0	0	112.7	L233 F239 P240 P241 S245 V246 F277 V291	L233-L243 HydrophobicContact CD1-CD1 4.12Å; F239-L243 HydrophobicContact CB-CB 4.43Å; F239-L243 HydrophobicContact CD1-CB 3.78Å; F239-L243 HydrophobicContact CD1-CD1 3.69Å; F239-L243 HydrophobicContact CD1-CG 4.38Å; F239-L243 HydrophobicContact CE1-CD1 4.11Å; P240-L243 HydrophobicContact CG-CD1 3.97Å; P240-L243 HydrophobicContact CG-CG 4.22Å; P240-L243 PolarHBondContact O-N 3.37Å; P241-L243 VanDerWaalsContact C-N 3.32Å; P241-L243 PolarHBondContact O-N 3.29Å; L243-S245 PolarHBondContact O-N 2.97Å; L243-V246 HydrophobicContact CD2-CG2 3.95Å; L243-V246 WeakPolarHBondContact O-CB 3.47Å; L243-V246 WeakPolarHBondContact O-CG2 3.44Å; L243-V246 PolarHBondContact O-N 3.27Å; L243-F277 HydrophobicContact CB-CZ 4.32Å; L243-F277 HydrophobicContact CD1-CZ 4.44Å; L243-F277 HydrophobicContact CD2-CZ 4.38Å; L243-V291 HydrophobicContact CD2-CG2 4.03Å
244	A	58.1	Low	57.8	Low	55 Å²	55	83.6 Å²	83.6	46%	0.455	45%	0.45	S	S	.	.	H	α-helix	trans	-69.3	-21	173.2	0	0	0	0	0	112.6	P241 F242	P241-A244 WeakPolarHBondContact O-CB 3.4Å; P241-A244 PolarHBondContact O-N 3.13Å; F242-A244 VanDerWaalsContact C-N 3.3Å; F242-A244 PolarHBondContact O-N 3.28Å
245	S	60.8	Low	57	Low	91 Å²	91	86.4 Å²	86.4	64%	0.636	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-0.6	179.6	75.4	0	0	0	0	114.2	F242 L243 T247	F242-S245 PolarHBondContact O-N 3.42Å; F242-S245 PolarHBondContact O-OG 3.23Å; L243-S245 PolarHBondContact O-N 2.97Å; S245-T247 PolarHBondContact O-N 3.02Å
246	V	60.7	Low	56.2	Low	21 Å²	21	83.9 Å²	83.9	13%	0.127	46%	0.455	C	S	.	.	S	Bend	trans	-62.2	127.4	179.3	172.7	0	0	0	0	109.5	L243 R287	L243-V246 HydrophobicContact CD2-CG2 3.95Å; L243-V246 WeakPolarHBondContact O-CB 3.47Å; L243-V246 WeakPolarHBondContact O-CG2 3.44Å; L243-V246 PolarHBondContact O-N 3.27Å; V246-R287 VanDerWaalsContact CG1-CD 3.48Å; V246-R287 HydrophobicContact CG1-CG 3.32Å; V246-R287 HydrophobicContact CG2-CG 4.41Å
247	T	58.2	Low	55.4	Low	92 Å²	92	87.9 Å²	87.9	56%	0.564	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-53.8	133.4	178	17.3	0	0	0	0	110.6	S245	S245-T247 PolarHBondContact O-N 3.02Å
248	P	60.1	Low	54.8	Low	107 Å²	107	91.8 Å²	91.8	70%	0.695	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-52.4	148.8	173.2	-22.6	31.5	0	0	0	110.6	S250	P248-S250 PolarHBondContact O-N 3Å; P248-S250 VanDerWaalsContact O-N 3.1Å
249	C	68.1	Low	54	Low	10 Å²	10	88.4 Å²	88.4	7%	0.068	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-55.6	117	175	178	0	0	0	0	111.1	Y251 Q252 C278 H280 C283	C249-Y251 PolarHBondContact O-N 3.25Å; C249-Y251 VanDerWaalsContact O-N 3.13Å; C249-Y251 VanDerWaalsContact SG-CB 3.57Å; C249-Y251 PolarHBondContact SG-N 2.95Å; C249-Q252 HydrophobicContact CB-CB 3.99Å; C249-Q252 VanDerWaalsContact O-CB 3.23Å; C249-Q252 WeakPolarHBondContact O-CB 3.45Å; C249-Q252 PolarHBondContact O-N 3.49Å; C249-Q252 PolarHBondContact SG-N 3.35Å; C249-C278 HydrophobicContact CB-CB 3.61Å; C249-C278 WeakPolarHBondContact CB-SG 3.18Å; C249-C278 VanDerWaalsContact SG-CB 3.55Å; C249-C278 VanDerWaalsContact SG-SG 3.66Å; C249-H280 VanDerWaalsContact SG-CE1 3.55Å; C249-H280 PolarHBondContact SG-ND1 3.21Å; C249-C283 PolarHBondContact SG-SG 3.02Å
250	S	59.2	Low	52.8	Low	71 Å²	71	92.6 Å²	92.6	50%	0.497	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-15.5	175.4	-166.7	0	0	0	0	113.1	P248	P248-S250 PolarHBondContact O-N 3Å; P248-S250 VanDerWaalsContact O-N 3.1Å
251	Y	55.4	Low	51.7	Low	96 Å²	96	97.9 Å²	97.9	38%	0.376	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-24.5	169	-72.5	-92.4	0	0	0	113.1	C249 E253 R254 T255 H280	C249-Y251 PolarHBondContact O-N 3.25Å; C249-Y251 VanDerWaalsContact O-N 3.13Å; C249-Y251 VanDerWaalsContact SG-CB 3.57Å; C249-Y251 PolarHBondContact SG-N 2.95Å; Y251-E253 VanDerWaalsContact C-N 3.32Å; Y251-R254 PolarHBondContact O-N 3.21Å; Y251-T255 PolarHBondContact O-N 2.85Å; Y251-H280 VanDerWaalsContact CB-CE1 3.48Å; Y251-H280 WeakPolarHBondContact CB-CE1 3.44Å; Y251-H280 HydrophobicContact CD2-CB 4.5Å
252	Q	53.5	Low	50.4	Low	97 Å²	97	98.1 Å²	98.1	45%	0.453	54%	0.536	S	S	.	.	H	α-helix	trans	-65.5	-40.4	172.7	-146.1	102.5	15.8	0	0	110.2	C249 R254 T255 D256	C249-Q252 HydrophobicContact CB-CB 3.99Å; C249-Q252 VanDerWaalsContact O-CB 3.23Å; C249-Q252 WeakPolarHBondContact O-CB 3.45Å; C249-Q252 PolarHBondContact O-N 3.49Å; C249-Q252 PolarHBondContact SG-N 3.35Å; Q252-R254 PolarHBondContact O-N 3.24Å; Q252-R254 VanDerWaalsContact O-N 3.07Å; Q252-T255 PolarHBondContact O-N 3.42Å; Q252-T255 PolarHBondContact O-OG1 3.05Å; Q252-D256 PolarHBondContact O-N 3.3Å
253	E	45.8	Very low	49.3	Very low	116 Å²	116	102.8 Å²	102.8	54%	0.542	56%	0.563	S	S	.	*	H	α-helix	trans	-59.9	-23.5	176	-66.7	-177.4	148	0	0	112.7	Y251 L257	Y251-E253 VanDerWaalsContact C-N 3.32Å; E253-L257 WeakPolarHBondContact O-CD1 2.98Å
254	R	44.8	Very low	48	Very low	180 Å²	180	110.1 Å²	110.1	68%	0.679	60%	0.602	S	S	*	*	H	α-helix	trans	-89.4	-19.1	177.7	-71.3	-167.9	-168.1	157.5	6.1	114.3	Y251 Q252	Y251-R254 PolarHBondContact O-N 3.21Å; Q252-R254 PolarHBondContact O-N 3.24Å; Q252-R254 VanDerWaalsContact O-N 3.07Å
255	T	47.7	Very low	47	Very low	92 Å²	92	115.9 Å²	115.9	56%	0.564	62%	0.62	S	S	*	*	H	α-helix	trans	-82.9	-30.5	173.8	48.5	0	0	0	0	111.8	Y251 Q252 L257 K258	Y251-T255 PolarHBondContact O-N 2.85Å; Q252-T255 PolarHBondContact O-N 3.42Å; Q252-T255 PolarHBondContact O-OG1 3.05Å; T255-L257 VanDerWaalsContact C-N 3.3Å; T255-L257 PolarHBondContact O-N 3.36Å; T255-K258 PolarHBondContact O-N 3.41Å
256	D	45.2	Very low	45.5	Very low	103 Å²	103	120.2 Å²	120.2	55%	0.551	63%	0.627	S	S	*	*	H	α-helix	trans	-75.7	-19.1	-178.6	-59.7	-23.8	0	0	0	112.9	Q252 K258 S259	Q252-D256 PolarHBondContact O-N 3.3Å; D256-K258 VanDerWaalsContact C-N 3.29Å; D256-K258 PolarHBondContact O-N 3.12Å; D256-S259 PolarHBondContact O-OG 3.41Å
257	L	45.9	Very low	44.1	Very low	150 Å²	150	125.8 Å²	125.8	79%	0.785	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	1.3	177.5	-100.6	110.9	0	0	0	115.1	E253 T255	E253-L257 WeakPolarHBondContact O-CD1 2.98Å; T255-L257 VanDerWaalsContact C-N 3.3Å; T255-L257 PolarHBondContact O-N 3.36Å
258	K	45.1	Very low	42.8	Very low	188 Å²	188	129.5 Å²	129.5	82%	0.817	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	0.1	177.4	-94.3	-174.7	176.9	-178.3	0	115.4	T255 D256 D260	T255-K258 PolarHBondContact O-N 3.41Å; D256-K258 VanDerWaalsContact C-N 3.29Å; D256-K258 PolarHBondContact O-N 3.12Å; K258-D260 PolarHBondContact O-N 3.13Å
259	S	40	Very low	41.6	Very low	98 Å²	98	133.8 Å²	133.8	69%	0.685	68%	0.675	S	S	*	*	S	Bend	trans	-92.5	93.6	166	52.5	0	0	0	0	109.2	D256	D256-S259 PolarHBondContact O-OG 3.41Å
260	D	31.5	Very low	39.9	Very low	137 Å²	137	140.2 Å²	140.2	73%	0.733	71%	0.709	S	S	*	*			trans	-50.6	138.6	170.5	-79.1	-56.3	0	0	0	112.1	K258	K258-D260 PolarHBondContact O-N 3.13Å
261	L	35.3	Very low	38.9	Very low	158 Å²	158	142.4 Å²	142.4	83%	0.827	72%	0.724	S	S	*	*			trans	35.4	94.7	149.7	-82.6	75.7	0	0	0	116.4
262	S	31.5	Very low	38.3	Very low	122 Å²	122	142.3 Å²	142.3	85%	0.853	74%	0.737	S	S	*	*			trans	-153.7	116.6	146.7	-71.7	0	0	0	0	110.4
263	L	33.7	Very low	38	Very low	162 Å²	162	144.8 Å²	144.8	85%	0.848	75%	0.749	S	S	*	*			trans	-41.4	136.1	170.6	-111.6	67.1	0	0	0	113.6	Q265	L263-Q265 PolarHBondContact O-N 3.27Å; L263-Q265 VanDerWaalsContact O-N 3.14Å
264	N	28.2	Very low	38.1	Very low	167 Å²	167	141.6 Å²	141.6	89%	0.893	74%	0.738	S	S	*	*			trans	12.5	87.5	142.5	-90.1	-43.5	0	0	0	116.4
265	Q	36.3	Very low	38.6	Very low	176 Å²	176	141.9 Å²	141.9	82%	0.822	74%	0.739	S	S	*	*			trans	-133.7	130.6	149.8	-92.7	179.1	12.9	0	0	108.6	L263	L263-Q265 PolarHBondContact O-N 3.27Å; L263-Q265 VanDerWaalsContact O-N 3.14Å
266	K	29.3	Very low	39.3	Very low	181 Å²	181	145.5 Å²	145.5	79%	0.787	75%	0.75	S	S	*	*			trans	24.1	118.2	135.9	-71.6	169	168.9	177.2	0	114.9
267	D	31.6	Very low	40.4	Very low	139 Å²	139	142.6 Å²	142.6	74%	0.743	73%	0.732	S	S	*	*				-165.8	133.6	92.4	-93.6	-39.1	0	0	0	111.4	R269	D267-R269 PolarHBondContact O-N 3.14Å
268	N	31.1	Very low	41.8	Very low	169 Å²	169	136.3 Å²	136.3	90%	0.904	70%	0.701	S	S	*	*			trans	-44.6	101.6	153.2	-100.4	-46	0	0	0	108.7
269	R	34	Very low	43	Very low	198 Å²	198	136.6 Å²	136.6	75%	0.747	70%	0.697	S	S	*	*			trans	-100.9	94.9	155.5	-68	-169.7	-143	-177.7	7.5	107.3	D267 S271	D267-R269 PolarHBondContact O-N 3.14Å; R269-S271 PolarHBondContact O-N 2.76Å; R269-S271 VanDerWaalsContact O-N 3.1Å; R269-S271 PolarHBondContact O-OG 3.4Å; R269-S271 VanDerWaalsContact O-OG 3.09Å
270	D	32.9	Very low	44.6	Very low	144 Å²	144	135.6 Å²	135.6	77%	0.77	68%	0.681	S	S	*	*			trans	-39.7	115.6	157.4	-167.8	8.9	0	0	0	108	S272	D270-S272 PolarHBondContact O-N 3.27Å
271	S	37.3	Very low	46.3	Very low	117 Å²	117	129.9 Å²	129.9	82%	0.818	65%	0.654	S	S	*	*	S	Bend	trans	-83.7	37.3	-153.5	-54.8	0	0	0	0	113.2	R269 E273	R269-S271 PolarHBondContact O-N 2.76Å; R269-S271 VanDerWaalsContact O-N 3.1Å; R269-S271 PolarHBondContact O-OG 3.4Å; R269-S271 VanDerWaalsContact O-OG 3.09Å; S271-E273 VanDerWaalsContact C-N 3.35Å
272	S	44.6	Very low	47.9	Very low	94 Å²	94	127.5 Å²	127.5	66%	0.657	64%	0.639	S	S	*	*			trans	-84.6	2.2	-177.7	58.8	0	0	0	0	114.7	D270	D270-S272 PolarHBondContact O-N 3.27Å
273	E	45.8	Very low	49.8	Very low	150 Å²	150	122.3 Å²	122.3	70%	0.701	60%	0.603	S	S	*	*	S	Bend	trans	-81.4	125.3	174.6	-97.5	-172.5	133.6	0	0	111.4	S271 R275	S271-E273 VanDerWaalsContact C-N 3.35Å; E273-R275 PolarHBondContact O-N 3.06Å
274	P	49.1	Very low	51.7	Low	48 Å²	48	114.7 Å²	114.7	31%	0.312	56%	0.563	S	S	.	*			trans	-61	129.9	179.2	25.1	-31.9	0	0	0	108.9	Q276	P274-Q276 PolarHBondContact O-N 2.64Å
275	R	55.1	Low	53.7	Low	187 Å²	187	108.8 Å²	108.8	71%	0.706	53%	0.531	S	S	*	.			trans	-57.3	100.9	174.9	-71.1	-176.3	-168.7	-136.5	-0.8	108.7	E273 F277	E273-R275 PolarHBondContact O-N 3.06Å; R275-F277 PolarHBondContact O-N 3.36Å
276	Q	62.5	Low	55.3	Low	168 Å²	168	104.3 Å²	104.3	79%	0.785	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-73.1	120.5	173.9	-65.9	-160.4	-4.3	0	0	108.3	P274	P274-Q276 PolarHBondContact O-N 2.64Å
277	F	67.4	Low	57.4	Low	42 Å²	42	96 Å²	96	18%	0.184	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-71	144	173.4	-59.3	-74.4	0	0	0	111.5	E230 T234 F239 L243 R275 R279 R287	E230-F277 HydrophobicContact CB-CD2 4.36Å; E230-F277 HydrophobicContact CG-CD2 4.49Å; T234-F277 HydrophobicContact CG2-CD2 4.03Å; T234-F277 HydrophobicContact CG2-CE2 4.32Å; F239-F277 HydrophobicContact CD1-CE2 4.27Å; F239-F277 AromaticContact CD1-CZ 3.95Å; F239-F277 HydrophobicContact CD1-CZ 3.95Å; F239-F277 HydrophobicContact CE1-CD2 4.48Å; F239-F277 AromaticContact CE1-CE2 3.27Å; F239-F277 HydrophobicContact CE1-CE2 3.27Å; F239-F277 AromaticContact CE1-CZ 3.37Å; F239-F277 HydrophobicContact CE1-CZ 3.37Å; F239-F277 AromaticContact CZ-CE2 3.61Å; F239-F277 HydrophobicContact CZ-CE2 3.61Å; F239-F277 AromaticContact CZ-CZ 3.96Å; F239-F277 HydrophobicContact CZ-CZ 3.96Å; L243-F277 HydrophobicContact CB-CZ 4.32Å; L243-F277 HydrophobicContact CD1-CZ 4.44Å; L243-F277 HydrophobicContact CD2-CZ 4.38Å; R275-F277 PolarHBondContact O-N 3.36Å; F277-R279 PolarHBondContact O-N 3.47Å; F277-R287 VanDerWaalsContact CB-CZ 3.47Å
278	C	75.5	Confident	59.2	Low	18 Å²	18	90 Å²	90	12%	0.122	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-56.7	132.2	168.8	46.2	0	0	0	0	111.7	C249 H280 C283 R287	C249-C278 HydrophobicContact CB-CB 3.61Å; C249-C278 WeakPolarHBondContact CB-SG 3.18Å; C249-C278 VanDerWaalsContact SG-CB 3.55Å; C249-C278 VanDerWaalsContact SG-SG 3.66Å; C278-H280 WeakPolarHBondContact CB-ND1 3.39Å; C278-H280 PolarHBondContact O-N 2.82Å; C278-C283 HydrophobicContact CB-CB 4.08Å; C278-C283 WeakPolarHBondContact CB-SG 3.12Å; C278-C283 WeakPolarHBondContact SG-CB 3.42Å; C278-C283 CovalentContact SG-SG 2.06Å; C278-C283 PolarHBondContact SG-SG 3.15Å; C278-R287 PolarHBondContact O-NH2 3.08Å
279	R	70.7	Confident	60.9	Low	194 Å²	194	87.3 Å²	87.3	73%	0.732	43%	0.43	S	S	*	.			trans	-80.5	12.5	173.5	-65.7	-171.1	170.7	-145	-2.5	114	F277	F277-R279 PolarHBondContact O-N 3.47Å
280	H	73.3	Confident	62.4	Low	76 Å²	76	81.8 Å²	81.8	35%	0.352	41%	0.412	S	S	.	.			trans	-66.8	140.2	177.6	-58.2	120.3	0	0	0	110.6	C249 Y251 C278 E282 C283 I284	C249-H280 VanDerWaalsContact SG-CE1 3.55Å; C249-H280 PolarHBondContact SG-ND1 3.21Å; Y251-H280 VanDerWaalsContact CB-CE1 3.48Å; Y251-H280 WeakPolarHBondContact CB-CE1 3.44Å; Y251-H280 HydrophobicContact CD2-CB 4.5Å; C278-H280 WeakPolarHBondContact CB-ND1 3.39Å; C278-H280 PolarHBondContact O-N 2.82Å; H280-E282 PolarHBondContact O-N 3.42Å; H280-C283 HydrophobicContact CB-CB 3.96Å; H280-C283 VanDerWaalsContact O-CB 3.25Å; H280-C283 WeakPolarHBondContact O-CB 2.96Å; H280-C283 PolarHBondContact O-N 2.86Å; H280-C283 VanDerWaalsContact O-N 3.15Å; H280-I284 WeakPolarHBondContact O-CD1 3.42Å; H280-I284 VanDerWaalsContact O-CG1 3.3Å; H280-I284 WeakPolarHBondContact O-CG1 3.36Å; H280-I284 PolarHBondContact O-N 3.27Å
281	G	66.6	Low	63.6	Low	17 Å²	17	75.7 Å²	75.7	18%	0.175	38%	0.38	C	S	.	.	H	α-helix	trans	-58.6	-49.3	-177.4	0	0	0	0	0	113.9	W215 C283 I284 L285	W215-G281 WeakPolarHBondContact CZ2-O 3.3Å; G281-C283 VanDerWaalsContact C-N 3.31Å; G281-C283 PolarHBondContact O-N 3.48Å; G281-I284 PolarHBondContact O-N 2.75Å; G281-I284 VanDerWaalsContact O-N 3.16Å; G281-L285 PolarHBondContact O-N 3.33Å
282	E	69.2	Low	64.4	Low	108 Å²	108	73.8 Å²	73.8	51%	0.505	36%	0.363	S	S	.	.	H	α-helix	trans	-62.7	-38	176.8	-64.7	-167	147.4	0	0	112.3	H280 I284 L285 I286	H280-E282 PolarHBondContact O-N 3.42Å; E282-I284 VanDerWaalsContact C-N 3.35Å; E282-I284 PolarHBondContact O-N 2.9Å; E282-L285 PolarHBondContact O-N 3.4Å; E282-I286 WeakPolarHBondContact O-CB 3.26Å; E282-I286 WeakPolarHBondContact O-CD1 3.31Å; E282-I286 WeakPolarHBondContact O-CG1 3.35Å; E282-I286 PolarHBondContact O-N 3.07Å
283	C	72.1	Confident	64.5	Low	14 Å²	14	78.1 Å²	78.1	10%	0.095	37%	0.367	C	S	.	.	H	α-helix	trans	-56.8	-49.1	172	-84.5	0	0	0	0	111.5	C249 C278 H280 G281 L285 I286 R287	C249-C283 PolarHBondContact SG-SG 3.02Å; C278-C283 HydrophobicContact CB-CB 4.08Å; C278-C283 WeakPolarHBondContact CB-SG 3.12Å; C278-C283 WeakPolarHBondContact SG-CB 3.42Å; C278-C283 CovalentContact SG-SG 2.06Å; C278-C283 PolarHBondContact SG-SG 3.15Å; H280-C283 HydrophobicContact CB-CB 3.96Å; H280-C283 VanDerWaalsContact O-CB 3.25Å; H280-C283 WeakPolarHBondContact O-CB 2.96Å; H280-C283 PolarHBondContact O-N 2.86Å; H280-C283 VanDerWaalsContact O-N 3.15Å; G281-C283 VanDerWaalsContact C-N 3.31Å; G281-C283 PolarHBondContact O-N 3.48Å; C283-L285 VanDerWaalsContact C-N 3.33Å; C283-I286 PolarHBondContact O-N 2.77Å; C283-R287 VanDerWaalsContact O-CB 3.29Å; C283-R287 WeakPolarHBondContact O-CB 2.96Å; C283-R287 WeakPolarHBondContact O-CG 3.2Å; C283-R287 PolarHBondContact O-N 3.18Å; C283-R287 PolarHBondContact O-NE 3.33Å
284	I	72.2	Confident	64.4	Low	1 Å²	1	74.8 Å²	74.8	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-62	-46.1	-177.8	-64.8	156.9	0	0	0	109	W215 I223 I226 I227 H280 G281 E282 R287 S288	W215-I284 HydrophobicContact CH2-CD1 4.48Å; I223-I284 HydrophobicContact CG2-CD1 4.11Å; I223-I284 HydrophobicContact CG2-CG2 3.94Å; I226-I284 HydrophobicContact CB-CG2 4.06Å; I226-I284 HydrophobicContact CG2-CG2 3.49Å; I226-I284 VanDerWaalsContact CG2-CG2 3.49Å; I227-I284 HydrophobicContact CD1-CD1 3.7Å; I227-I284 HydrophobicContact CG1-CD1 3.48Å; I227-I284 VanDerWaalsContact CG1-CD1 3.48Å; I227-I284 HydrophobicContact CG1-CG1 4.29Å; H280-I284 WeakPolarHBondContact O-CD1 3.42Å; H280-I284 VanDerWaalsContact O-CG1 3.3Å; H280-I284 WeakPolarHBondContact O-CG1 3.36Å; H280-I284 PolarHBondContact O-N 3.27Å; G281-I284 PolarHBondContact O-N 2.75Å; G281-I284 VanDerWaalsContact O-N 3.16Å; E282-I284 VanDerWaalsContact C-N 3.35Å; E282-I284 PolarHBondContact O-N 2.9Å; I284-R287 PolarHBondContact O-N 2.87Å; I284-S288 VanDerWaalsContact O-CB 3.3Å; I284-S288 WeakPolarHBondContact O-CB 3.48Å; I284-S288 PolarHBondContact O-N 2.92Å; I284-S288 PolarHBondContact O-OG 3.31Å
285	L	70.1	Confident	64	Low	43 Å²	43	77.7 Å²	77.7	23%	0.225	37%	0.372	C	S	.	.	H	α-helix	trans	-63.6	-42.8	177.9	-76	168	0	0	0	112.6	W215 M219 I223 G281 E282 C283 R287 S288 L289	W215-L285 HydrophobicContact CZ2-CD1 4.07Å; W215-L285 HydrophobicContact CZ2-CG 4.32Å; M219-L285 HydrophobicContact CE-CD1 4.13Å; M219-L285 HydrophobicContact CE-CD2 4.05Å; M219-L285 HydrophobicContact SD-CD2 4.19Å; I223-L285 HydrophobicContact CD1-CD2 4.36Å; G281-L285 PolarHBondContact O-N 3.33Å; E282-L285 PolarHBondContact O-N 3.4Å; C283-L285 VanDerWaalsContact C-N 3.33Å; L285-R287 VanDerWaalsContact C-N 3.33Å; L285-R287 PolarHBondContact O-N 3.43Å; L285-S288 CarbonylContact O-C 3.58Å; L285-S288 WeakPolarHBondContact O-CB 3.48Å; L285-S288 PolarHBondContact O-N 3.42Å; L285-L289 WeakPolarHBondContact O-CB 3.32Å; L285-L289 WeakPolarHBondContact O-CG 3.24Å; L285-L289 PolarHBondContact O-N 3.31Å
286	I	70.8	Confident	63.3	Low	83 Å²	83	74.4 Å²	74.4	43%	0.426	37%	0.373	S	S	.	.	H	α-helix	trans	-62.1	-44.3	176.8	-70.8	166	0	0	0	110.4	E282 C283 L289 Q290	E282-I286 WeakPolarHBondContact O-CB 3.26Å; E282-I286 WeakPolarHBondContact O-CD1 3.31Å; E282-I286 WeakPolarHBondContact O-CG1 3.35Å; E282-I286 PolarHBondContact O-N 3.07Å; C283-I286 PolarHBondContact O-N 2.77Å; I286-L289 PolarHBondContact O-N 2.99Å; I286-Q290 WeakPolarHBondContact O-CG 3.38Å; I286-Q290 PolarHBondContact O-N 3.48Å
287	R	72.6	Confident	62.4	Low	7 Å²	7	71.4 Å²	71.4	3%	0.026	36%	0.359	C	S	.	.	H	α-helix	trans	-63.5	-44.3	176.6	-71.7	178.7	-59.7	112.9	0	110.9	E230 V246 F277 C278 C283 I284 L285 L289 Q290 V291	E230-R287 IonicContact OE1-CZ 3.19Å; E230-R287 VanDerWaalsContact OE1-CZ 3.28Å; E230-R287 IonicContact OE1-NH1 2.7Å; E230-R287 PolarHBondContact OE1-NH1 3.28Å; E230-R287 IonicContact OE1-NH2 2.83Å; E230-R287 IonicContact OE2-CZ 3.54Å; E230-R287 IonicContact OE2-NH1 3.28Å; E230-R287 PolarHBondContact OE2-NH1 3.05Å; E230-R287 IonicContact OE2-NH2 2.73Å; E230-R287 PolarHBondContact OE2-NH2 3.43Å; V246-R287 VanDerWaalsContact CG1-CD 3.48Å; V246-R287 HydrophobicContact CG1-CG 3.32Å; V246-R287 HydrophobicContact CG2-CG 4.41Å; F277-R287 VanDerWaalsContact CB-CZ 3.47Å; C278-R287 PolarHBondContact O-NH2 3.08Å; C283-R287 VanDerWaalsContact O-CB 3.29Å; C283-R287 WeakPolarHBondContact O-CB 2.96Å; C283-R287 WeakPolarHBondContact O-CG 3.2Å; C283-R287 PolarHBondContact O-N 3.18Å; C283-R287 PolarHBondContact O-NE 3.33Å; I284-R287 PolarHBondContact O-N 2.87Å; L285-R287 VanDerWaalsContact C-N 3.33Å; L285-R287 PolarHBondContact O-N 3.43Å; R287-L289 VanDerWaalsContact C-N 3.33Å; R287-L289 PolarHBondContact O-N 3.3Å; R287-Q290 PolarHBondContact O-N 2.1Å; R287-V291 WeakPolarHBondContact O-CB 3.37Å; R287-V291 WeakPolarHBondContact O-CG2 3.32Å; R287-V291 PolarHBondContact O-N 2.75Å
288	S	69.6	Low	61.2	Low	13 Å²	13	71 Å²	71	9%	0.091	36%	0.357	C	S	.	.	H	α-helix	trans	-58.7	-43.8	173	-52	0	0	0	0	111.4	I226 I284 L285 V291 T292	I226-S288 VanDerWaalsContact CD1-OG 3.22Å; I226-S288 WeakPolarHBondContact CD1-OG 3.26Å; I284-S288 VanDerWaalsContact O-CB 3.3Å; I284-S288 WeakPolarHBondContact O-CB 3.48Å; I284-S288 PolarHBondContact O-N 2.92Å; I284-S288 PolarHBondContact O-OG 3.31Å; L285-S288 CarbonylContact O-C 3.58Å; L285-S288 WeakPolarHBondContact O-CB 3.48Å; L285-S288 PolarHBondContact O-N 3.42Å; S288-V291 CarbonylContact O-C 3.59Å; S288-V291 WeakPolarHBondContact O-CB 3.46Å; S288-V291 PolarHBondContact O-N 3.49Å; S288-V291 VanDerWaalsContact O-N 3.14Å; S288-T292 WeakPolarHBondContact O-CB 3.45Å; S288-T292 WeakPolarHBondContact O-CG2 3.34Å; S288-T292 PolarHBondContact O-N 3.23Å; S288-T292 PolarHBondContact O-OG1 2.87Å
289	L	67.2	Low	59.9	Low	112 Å²	112	75.2 Å²	75.2	59%	0.586	38%	0.381	S	S	*	.	H	α-helix	trans	-66.4	-41.3	-178.6	-74.6	168.9	0	0	0	111.7	L285 I286 R287 V291 T292 Y293	L285-L289 WeakPolarHBondContact O-CB 3.32Å; L285-L289 WeakPolarHBondContact O-CG 3.24Å; L285-L289 PolarHBondContact O-N 3.31Å; I286-L289 PolarHBondContact O-N 2.99Å; R287-L289 VanDerWaalsContact C-N 3.33Å; R287-L289 PolarHBondContact O-N 3.3Å; L289-V291 PolarHBondContact O-N 2.95Å; L289-T292 VanDerWaalsContact CA-OG1 3.28Å; L289-T292 WeakPolarHBondContact CA-OG1 3.23Å; L289-T292 PolarHBondContact O-N 3.41Å; L289-T292 PolarHBondContact O-OG1 3.14Å; L289-Y293 PolarHBondContact O-N 3Å
290	Q	64.8	Low	58.6	Low	81 Å²	81	72.5 Å²	72.5	38%	0.379	37%	0.372	S	S	.	.	H	α-helix	trans	-61.8	-31.2	173.2	-73.5	178.9	-15.3	0	0	112.3	I286 R287	I286-Q290 WeakPolarHBondContact O-CG 3.38Å; I286-Q290 PolarHBondContact O-N 3.48Å; R287-Q290 PolarHBondContact O-N 2.1Å
291	V	59.8	Low	57.3	Low	17 Å²	17	72.2 Å²	72.2	10%	0.103	37%	0.373	C	S	.	.	H	α-helix	trans	-79.6	-40.6	175.7	174.9	0	0	0	0	112.2	F242 L243 R287 S288 L289 Y293 I294 F298	F242-V291 HydrophobicContact CE2-CB 4.31Å; F242-V291 HydrophobicContact CE2-CG2 3.51Å; F242-V291 HydrophobicContact CZ-CB 4.48Å; F242-V291 HydrophobicContact CZ-CG1 4.45Å; F242-V291 HydrophobicContact CZ-CG2 3.77Å; L243-V291 HydrophobicContact CD2-CG2 4.03Å; R287-V291 WeakPolarHBondContact O-CB 3.37Å; R287-V291 WeakPolarHBondContact O-CG2 3.32Å; R287-V291 PolarHBondContact O-N 2.75Å; S288-V291 CarbonylContact O-C 3.59Å; S288-V291 WeakPolarHBondContact O-CB 3.46Å; S288-V291 PolarHBondContact O-N 3.49Å; S288-V291 VanDerWaalsContact O-N 3.14Å; L289-V291 PolarHBondContact O-N 2.95Å; V291-Y293 VanDerWaalsContact C-N 3.3Å; V291-Y293 PolarHBondContact O-N 2.73Å; V291-I294 PolarHBondContact O-N 2.86Å; V291-F298 HydrophobicContact CB-CE1 4.42Å; V291-F298 HydrophobicContact CG1-CB 4.18Å; V291-F298 HydrophobicContact CG1-CD1 3.03Å; V291-F298 HydrophobicContact CG1-CD2 3.61Å; V291-F298 HydrophobicContact CG1-CE1 3.05Å; V291-F298 HydrophobicContact CG1-CE2 3.68Å; V291-F298 HydrophobicContact CG1-CG 3.29Å; V291-F298 HydrophobicContact CG1-CZ 3.39Å; V291-F298 HydrophobicContact CG2-CZ 4.36Å
292	T	52.9	Low	56.6	Low	76 Å²	76	72 Å²	72	47%	0.466	37%	0.369	S	S	.	.	H	α-helix	trans	-79.7	-3.7	-171.7	58.1	0	0	0	0	114.7	S288 L289 I294	S288-T292 WeakPolarHBondContact O-CB 3.45Å; S288-T292 WeakPolarHBondContact O-CG2 3.34Å; S288-T292 PolarHBondContact O-N 3.23Å; S288-T292 PolarHBondContact O-OG1 2.87Å; L289-T292 VanDerWaalsContact CA-OG1 3.28Å; L289-T292 WeakPolarHBondContact CA-OG1 3.23Å; L289-T292 PolarHBondContact O-N 3.41Å; L289-T292 PolarHBondContact O-OG1 3.14Å; T292-I294 PolarHBondContact O-N 3.09Å
293	Y	47.3	Very low	55.5	Low	186 Å²	186	69.8 Å²	69.8	73%	0.729	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	3.8	165.6	-138.9	-92.6	0	0	0	112.8	L289 V291	L289-Y293 PolarHBondContact O-N 3Å; V291-Y293 VanDerWaalsContact C-N 3.3Å; V291-Y293 PolarHBondContact O-N 2.73Å
294	I	42.8	Very low	54.6	Low	79 Å²	79	74.1 Å²	74.1	41%	0.405	38%	0.384	S	S	.	.	S	Bend	trans	-122	80.1	170	-50	178.7	0	0	0	108	V291 T292 T296 H297 F298	V291-I294 PolarHBondContact O-N 2.86Å; T292-I294 PolarHBondContact O-N 3.09Å; I294-T296 VanDerWaalsContact C-N 3.25Å; I294-T296 PolarHBondContact O-N 2.99Å; I294-T296 VanDerWaalsContact O-N 3.09Å; I294-H297 HydrophobicContact CG2-CB 3.3Å; I294-F298 HydrophobicContact CB-CB 4.44Å
295	P	40.6	Very low	53.5	Low	110 Å²	110	78.2 Å²	78.2	71%	0.714	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-10.1	-161.7	-19.4	32.6	0	0	0	115.9
296	T	42.3	Very low	52.5	Low	118 Å²	118	80.3 Å²	80.3	72%	0.724	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.5	-29.9	179.7	51.5	0	0	0	0	113.1	I294	I294-T296 VanDerWaalsContact C-N 3.25Å; I294-T296 PolarHBondContact O-N 2.99Å; I294-T296 VanDerWaalsContact O-N 3.09Å
297	H	43.6	Very low	51.2	Low	105 Å²	105	85.9 Å²	85.9	49%	0.486	45%	0.454	S	S	.	.	H	α-helix	trans	-80.2	-25	-175.8	-142.1	-95.9	0	0	0	113.3	I294 Y300 L301	I294-H297 HydrophobicContact CG2-CB 3.3Å; H297-Y300 PolarHBondContact O-N 2.79Å; H297-L301 VanDerWaalsContact ND1-CD1 3.29Å; H297-L301 WeakPolarHBondContact ND1-CD1 3.23Å; H297-L301 WeakPolarHBondContact O-CB 3.4Å; H297-L301 VanDerWaalsContact O-CG 3.23Å; H297-L301 WeakPolarHBondContact O-CG 3.35Å; H297-L301 PolarHBondContact O-N 3.27Å
298	F	41.4	Very low	50.2	Low	34 Å²	34	89.9 Å²	89.9	15%	0.149	48%	0.475	C	S	.	.	H	α-helix	trans	-75.2	-42.7	-176.6	-165.8	-97.3	0	0	0	113.1	F242 V291 I294 Y300 L301 V302	F242-F298 HydrophobicContact CE1-CD2 4.3Å; F242-F298 AromaticContact CE1-CE2 3.54Å; F242-F298 HydrophobicContact CE1-CE2 3.54Å; F242-F298 HydrophobicContact CE1-CZ 4.36Å; F242-F298 HydrophobicContact CZ-CD2 4.14Å; F242-F298 AromaticContact CZ-CE2 3.34Å; F242-F298 HydrophobicContact CZ-CE2 3.34Å; F242-F298 AromaticContact CZ-CZ 3.87Å; F242-F298 HydrophobicContact CZ-CZ 3.87Å; V291-F298 HydrophobicContact CB-CE1 4.42Å; V291-F298 HydrophobicContact CG1-CB 4.18Å; V291-F298 HydrophobicContact CG1-CD1 3.03Å; V291-F298 HydrophobicContact CG1-CD2 3.61Å; V291-F298 HydrophobicContact CG1-CE1 3.05Å; V291-F298 HydrophobicContact CG1-CE2 3.68Å; V291-F298 HydrophobicContact CG1-CG 3.29Å; V291-F298 HydrophobicContact CG1-CZ 3.39Å; V291-F298 HydrophobicContact CG2-CZ 4.36Å; I294-F298 HydrophobicContact CB-CB 4.44Å; F298-Y300 PolarHBondContact O-N 3.13Å; F298-L301 PolarHBondContact O-N 2.75Å; F298-V302 HydrophobicContact CD1-CG2 3.68Å; F298-V302 HydrophobicContact CE1-CG2 3.18Å; F298-V302 HydrophobicContact CE2-CG2 4.12Å; F298-V302 HydrophobicContact CG-CG2 4.37Å; F298-V302 HydrophobicContact CZ-CG2 3.45Å; F298-V302 VanDerWaalsContact CZ-CG2 3.45Å; F298-V302 WeakPolarHBondContact O-CB 3.15Å; F298-V302 WeakPolarHBondContact O-CG2 3.33Å; F298-V302 PolarHBondContact O-N 3.14Å
299	V	48	Very low	49.1	Very low	105 Å²	105	93.9 Å²	93.9	64%	0.636	50%	0.496	S	S	*	.	H	α-helix	trans	-59	-43	173.2	-178.4	0	0	0	0	109.2	V302 S303	V299-V302 PolarHBondContact O-N 2.91Å; V299-S303 WeakPolarHBondContact O-CB 3.39Å; V299-S303 PolarHBondContact O-N 3.44Å; V299-S303 PolarHBondContact O-OG 3.36Å
300	Y	43.1	Very low	48.1	Very low	137 Å²	137	92.9 Å²	92.9	54%	0.537	49%	0.491	S	S	.	.	H	α-helix	trans	-63.4	-43.5	176.5	-171.5	-104.5	0	0	0	113.5	H297 F298 S303 Q304	H297-Y300 PolarHBondContact O-N 2.79Å; F298-Y300 PolarHBondContact O-N 3.13Å; Y300-S303 WeakPolarHBondContact O-CB 3.38Å; Y300-S303 PolarHBondContact O-N 2.85Å; Y300-Q304 HydrophobicContact CE1-CG 4.23Å; Y300-Q304 PolarHBondContact O-N 3.12Å; Y300-Q304 PolarHBondContact OH-NE2 3.23Å
301	L	46.9	Very low	47.2	Very low	70 Å²	70	93.6 Å²	93.6	37%	0.366	50%	0.497	S	S	.	.	H	α-helix	trans	-68.4	-38.4	178.1	-76.8	170.9	0	0	0	112.5	H297 F298 Q304 S305	H297-L301 VanDerWaalsContact ND1-CD1 3.29Å; H297-L301 WeakPolarHBondContact ND1-CD1 3.23Å; H297-L301 WeakPolarHBondContact O-CB 3.4Å; H297-L301 VanDerWaalsContact O-CG 3.23Å; H297-L301 WeakPolarHBondContact O-CG 3.35Å; H297-L301 PolarHBondContact O-N 3.27Å; F298-L301 PolarHBondContact O-N 2.75Å; L301-Q304 PolarHBondContact O-N 3.4Å; L301-S305 WeakPolarHBondContact O-CB 3.39Å; L301-S305 PolarHBondContact O-N 3.02Å; L301-S305 PolarHBondContact O-OG 3.3Å
302	V	50.7	Low	46.4	Very low	14 Å²	14	98.4 Å²	98.4	9%	0.085	52%	0.522	C	S	.	.	H	α-helix	trans	-68	-39.5	174.6	173.3	0	0	0	0	110.6	L229 F298 V299 Q304 S305 L306	L229-V302 HydrophobicContact CD2-CG1 3.82Å; F298-V302 HydrophobicContact CD1-CG2 3.68Å; F298-V302 HydrophobicContact CE1-CG2 3.18Å; F298-V302 HydrophobicContact CE2-CG2 4.12Å; F298-V302 HydrophobicContact CG-CG2 4.37Å; F298-V302 HydrophobicContact CZ-CG2 3.45Å; F298-V302 VanDerWaalsContact CZ-CG2 3.45Å; F298-V302 WeakPolarHBondContact O-CB 3.15Å; F298-V302 WeakPolarHBondContact O-CG2 3.33Å; F298-V302 PolarHBondContact O-N 3.14Å; V299-V302 PolarHBondContact O-N 2.91Å; V302-Q304 VanDerWaalsContact C-N 3.33Å; V302-Q304 PolarHBondContact O-N 3.3Å; V302-S305 PolarHBondContact O-N 3.3Å; V302-S305 VanDerWaalsContact O-N 3.12Å; V302-L306 HydrophobicContact CG1-CD1 3.67Å; V302-L306 HydrophobicContact CG1-CG 4.32Å; V302-L306 WeakPolarHBondContact O-CB 3.27Å; V302-L306 WeakPolarHBondContact O-CG 3.4Å; V302-L306 PolarHBondContact O-N 3.42Å
303	S	47.2	Very low	45.9	Very low	61 Å²	61	99.9 Å²	99.9	43%	0.427	53%	0.525	S	S	.	.	H	α-helix	trans	-60.6	-40.5	171.4	-57	0	0	0	0	112.3	V299 Y300 S305 L306 N307	V299-S303 WeakPolarHBondContact O-CB 3.39Å; V299-S303 PolarHBondContact O-N 3.44Å; V299-S303 PolarHBondContact O-OG 3.36Å; Y300-S303 WeakPolarHBondContact O-CB 3.38Å; Y300-S303 PolarHBondContact O-N 2.85Å; S303-S305 VanDerWaalsContact C-N 3.3Å; S303-S305 PolarHBondContact O-N 3.49Å; S303-L306 PolarHBondContact O-N 3.47Å; S303-N307 PolarHBondContact O-N 3.34Å
304	Q	52.2	Low	45.9	Very low	105 Å²	105	93.7 Å²	93.7	49%	0.491	51%	0.511	S	S	.	.	H	α-helix	trans	-72	-21.9	174.5	-77	-158.7	12.6	0	0	113.7	Y300 L301 V302	Y300-Q304 HydrophobicContact CE1-CG 4.23Å; Y300-Q304 PolarHBondContact O-N 3.12Å; Y300-Q304 PolarHBondContact OH-NE2 3.23Å; L301-Q304 PolarHBondContact O-N 3.4Å; V302-Q304 VanDerWaalsContact C-N 3.33Å; V302-Q304 PolarHBondContact O-N 3.3Å
305	S	50.6	Low	46.1	Very low	86 Å²	86	94.8 Å²	94.8	60%	0.601	52%	0.519	S	S	*	.	H	α-helix	trans	-87.3	-18.6	178	-52.4	0	0	0	0	112.7	L301 V302 S303	L301-S305 WeakPolarHBondContact O-CB 3.39Å; L301-S305 PolarHBondContact O-N 3.02Å; L301-S305 PolarHBondContact O-OG 3.3Å; V302-S305 PolarHBondContact O-N 3.3Å; V302-S305 VanDerWaalsContact O-N 3.12Å; S303-S305 VanDerWaalsContact C-N 3.3Å; S303-S305 PolarHBondContact O-N 3.49Å
306	L	47.6	Very low	46.5	Very low	88 Å²	88	93.6 Å²	93.6	46%	0.461	50%	0.503	S	S	.	.	H	α-helix	trans	-97.7	-10	179.2	-72.1	170.5	0	0	0	113.2	L229 K232 V302 S303	L229-L306 HydrophobicContact CD2-CD1 4Å; K232-L306 HydrophobicContact CB-CD2 4.32Å; K232-L306 HydrophobicContact CD-CD2 4.29Å; V302-L306 HydrophobicContact CG1-CD1 3.67Å; V302-L306 HydrophobicContact CG1-CG 4.32Å; V302-L306 WeakPolarHBondContact O-CB 3.27Å; V302-L306 WeakPolarHBondContact O-CG 3.4Å; V302-L306 PolarHBondContact O-N 3.42Å; S303-L306 PolarHBondContact O-N 3.47Å
307	N	45.1	Very low	46.9	Very low	200 Å²	200	91.4 Å²	91.4	100%	1.07	48%	0.483	S	S	*	.			trans	-97	0	165	-85.2	-13.5	0	0	0	110.4	S303	S303-N307 PolarHBondContact O-N 3.34Å

Retrieved 307 of 307 residues in 70.7 ms (Link to these results)

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