A0A3Q0KPB4_SCHMA Loading...

GTP-binding protein Di-Ras2

AlphaFold DB , UniProt , Accession A0A3Q0KPB4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 360 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	37.5	Very low	40	Very low	237 Å²	237	165.8 Å²	165.8	100%	1.167	87%	0.867	S	S	*	*				0	101.5	0	-65.9	164.9	175	0	0	107.4
2	N	32.8	Very low	40	Very low	171 Å²	171	161.9 Å²	161.9	91%	0.914	86%	0.859	S	S	*	*			trans	171.6	118.3	167.2	-95.2	-17.5	0	0	0	110.7
3	S	39.1	Very low	39.9	Very low	114 Å²	114	163.7 Å²	163.7	80%	0.797	86%	0.859	S	S	*	*			trans	175.2	152.9	153.8	54.4	0	0	0	0	109.6
4	S	44.3	Very low	40.5	Very low	118 Å²	118	163.1 Å²	163.1	83%	0.825	86%	0.855	S	S	*	*			cis	-160.7	146.5	-32.9	-95	0	0	0	0	106.8
5	I	37.3	Very low	40.1	Very low	161 Å²	161	164.1 Å²	164.1	83%	0.826	85%	0.853	S	S	*	*			trans	-71	134.3	-176.7	-64.5	162.8	0	0	0	110.9	R7	I5-R7 HydrophobicContact CG2-CG 4.36Å
6	S	43.4	Very low	40.2	Very low	118 Å²	118	162.5 Å²	162.5	83%	0.825	85%	0.853	S	S	*	*			trans	-135.2	140.3	159.2	-171.9	0	0	0	0	110.3
7	R	39	Very low	40.5	Very low	217 Å²	217	164.6 Å²	164.6	82%	0.819	85%	0.854	S	S	*	*			trans	-102.5	133.3	-164.5	-52.9	173.2	-158.4	155.2	6.6	110.3	I5 T9	I5-R7 HydrophobicContact CG2-CG 4.36Å; R7-T9 PolarHBondContact O-N 3.26Å
8	Y	37	Very low	40.3	Very low	243 Å²	243	164 Å²	164	95%	0.953	85%	0.851	S	S	*	*			trans	-73.9	122.3	167.4	-97	-94.3	0	0	0	110.7
9	T	42.7	Very low	40.1	Very low	129 Å²	129	161.5 Å²	161.5	79%	0.791	85%	0.847	S	S	*	*			trans	-104.4	132.4	168.1	49.8	0	0	0	0	110.2	R7	R7-T9 PolarHBondContact O-N 3.26Å
10	K	43.3	Very low	39.8	Very low	204 Å²	204	161.9 Å²	161.9	89%	0.887	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-88.5	136.3	-172.2	-158.4	177.7	-171.7	179.5	0	110.9
11	P	43.8	Very low	39.9	Very low	112 Å²	112	160.3 Å²	160.3	73%	0.727	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-74.5	156.7	175.1	30.3	-33.9	0	0	0	112.3
12	P	40.2	Very low	39.9	Very low	119 Å²	119	157.4 Å²	157.4	77%	0.773	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-82.7	155.2	-168.9	33.3	-36.3	0	0	0	114.3
13	Q	38.8	Very low	40.3	Very low	185 Å²	185	158.3 Å²	158.3	86%	0.864	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-91.2	135.9	171.7	-69.9	-84.6	-29.9	0	0	109.9
14	I	47.5	Very low	40.3	Very low	156 Å²	156	160.6 Å²	160.6	80%	0.8	82%	0.82	S	S	*	*			trans	-114	120.8	170	-65.9	171.2	0	0	0	108.4
15	Q	35.1	Very low	39.9	Very low	177 Å²	177	162.3 Å²	162.3	83%	0.827	82%	0.815	S	S	*	*			trans	-89.3	131.7	177.2	-72.5	172.9	-34.2	0	0	110.9
16	T	42	Very low	39.8	Very low	139 Å²	139	160.9 Å²	160.9	85%	0.853	81%	0.809	S	S	*	*			trans	-97.1	114.8	166.5	-35.3	0	0	0	0	108.7
17	K	44.1	Very low	40	Very low	198 Å²	198	161.3 Å²	161.3	86%	0.861	81%	0.806	S	S	*	*			trans	-77.6	126.8	171.4	-81.6	-168.8	173.1	-173.7	0	110.2
18	L	36.8	Very low	39.8	Very low	154 Å²	154	156.7 Å²	156.7	81%	0.806	80%	0.804	S	S	*	*			trans	-76.6	140.5	162.6	-157.7	73.4	0	0	0	108.6	E20	L18-E20 HydrophobicContact CD2-CG 4.35Å
19	C	37.4	Very low	40.5	Very low	116 Å²	116	151.8 Å²	151.8	78%	0.784	80%	0.799	S	S	*	*			trans	-125.7	110.1	173.3	-165.8	0	0	0	0	108.7
20	E	34.4	Very low	40.3	Very low	169 Å²	169	152.3 Å²	152.3	79%	0.79	80%	0.797	S	S	*	*			trans	-100.4	140.4	171.1	-64.5	177.2	155	0	0	108.4	L18	L18-E20 HydrophobicContact CD2-CG 4.35Å
21	T	40.9	Very low	40.4	Very low	129 Å²	129	150.4 Å²	150.4	79%	0.791	80%	0.797	S	S	*	*			trans	-140.3	132.4	167.1	-59.4	0	0	0	0	109.8
22	K	38.2	Very low	40.6	Very low	176 Å²	176	150.5 Å²	150.5	77%	0.765	80%	0.8	S	S	*	*			trans	-70.9	156.1	-171	-56.4	170.1	175.8	-179.4	0	112.4
23	Q	40.1	Very low	40.7	Very low	191 Å²	191	150.1 Å²	150.1	89%	0.893	80%	0.798	S	S	*	*				-158.5	139	120.9	-111.7	148.7	96.5	0	0	113.5
24	Q	39.4	Very low	40.8	Very low	162 Å²	162	147.7 Å²	147.7	76%	0.757	80%	0.796	S	S	*	*			trans	-82.9	173	160	-62.8	153.9	-65.7	0	0	107
25	E	36.4	Very low	40.5	Very low	153 Å²	153	147.5 Å²	147.5	72%	0.715	80%	0.795	S	S	*	*			cis	-165.4	153.8	19.4	-149.4	-173.9	120.1	0	0	111.3
26	N	35	Very low	41	Very low	131 Å²	131	143.8 Å²	143.8	70%	0.701	79%	0.788	S	S	*	*			trans	40.6	129.4	147.9	-71.5	-25.2	0	0	0	124.7
27	V	47.6	Very low	40.8	Very low	128 Å²	128	145.8 Å²	145.8	78%	0.776	79%	0.788	S	S	*	*				144.6	121.8	121.1	174.2	0	0	0	0	111.7
28	P	35.9	Very low	40.3	Very low	120 Å²	120	142.2 Å²	142.2	78%	0.779	79%	0.786	S	S	*	*			trans	-108.5	140.5	175.2	37.3	-28.9	0	0	0	114.2
29	V	50.5	Low	40.5	Very low	140 Å²	140	140.4 Å²	140.4	85%	0.848	78%	0.782	S	S	*	*			trans	-143	140.2	162.3	-175.6	0	0	0	0	110.4
30	N	38.6	Very low	40.7	Very low	139 Å²	139	141.2 Å²	141.2	74%	0.743	79%	0.786	S	S	*	*			trans	-70.5	153.8	-176.8	-61.9	-37.6	0	0	0	114.1
31	N	46.1	Very low	40.4	Very low	164 Å²	164	138.9 Å²	138.9	88%	0.877	78%	0.783	S	S	*	*				-174.7	141.7	113.7	-87.6	-23.2	0	0	0	112.9
32	S	48.5	Very low	40	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	79%	0.785	S	S	*	*			trans	-88.8	-174.8	-178.9	-50.4	0	0	0	0	112.1
33	P	41	Very low	39.9	Very low	112 Å²	112	135.1 Å²	135.1	73%	0.727	78%	0.784	S	S	*	*				-129.2	159.9	-57.8	34.9	-20.8	0	0	0	112.1
34	T	41.7	Very low	39.5	Very low	133 Å²	133	132.8 Å²	132.8	82%	0.816	78%	0.783	S	S	*	*			trans	-138.5	117.8	159.6	-59.7	0	0	0	0	110.3
35	I	41.3	Very low	39.2	Very low	153 Å²	153	131.3 Å²	131.3	79%	0.785	79%	0.785	S	S	*	*			trans	-84.7	114.2	176.1	-64.5	169.7	0	0	0	108.5
36	S	45.7	Very low	39.2	Very low	98 Å²	98	129.1 Å²	129.1	69%	0.685	79%	0.787	S	S	*	*			trans	-135.1	108.6	164.9	-69.9	0	0	0	0	108.3	C38	S36-C38 PolarHBondContact O-N 3.3Å
37	Q	37.4	Very low	39.4	Very low	181 Å²	181	128.6 Å²	128.6	85%	0.846	78%	0.78	S	S	*	*			trans	-71.2	109.3	-177.7	-68	175	-15.3	0	0	110.2
38	C	33.8	Very low	39.4	Very low	123 Å²	123	126.3 Å²	126.3	83%	0.831	78%	0.775	S	S	*	*			trans	-87	112.2	165.3	-70.3	0	0	0	0	109.3	S36	S36-C38 PolarHBondContact O-N 3.3Å
39	T	40.1	Very low	40.4	Very low	116 Å²	116	124.5 Å²	124.5	71%	0.712	76%	0.759	S	S	*	*			trans	-74.1	130.2	167	42.4	0	0	0	0	109.6	T41	T39-T41 PolarHBondContact O-N 2.99Å
40	P	41.4	Very low	41.5	Very low	133 Å²	133	120.9 Å²	120.9	86%	0.864	73%	0.733	S	S	*	*			trans	-78.2	95.1	176.6	30.6	-32.7	0	0	0	110
41	T	28.3	Very low	43.9	Very low	121 Å²	121	117 Å²	117	74%	0.742	71%	0.71	S	S	*	*			trans	-83.8	150.8	161.8	37.4	0	0	0	0	110.6	T39	T39-T41 PolarHBondContact O-N 2.99Å
42	S	33.1	Very low	46.1	Very low	118 Å²	118	109.3 Å²	109.3	83%	0.825	67%	0.669	S	S	*	*			trans	71.2	87.4	179.9	70.4	0	0	0	0	117.5
43	S	35.5	Very low	48.3	Very low	107 Å²	107	107.6 Å²	107.6	75%	0.748	65%	0.645	S	S	*	*			trans	-104.1	107.8	142.2	51.2	0	0	0	0	108.6	T45	S43-T45 PolarHBondContact O-N 3.13Å
44	T	31.5	Very low	50.9	Low	143 Å²	143	102.4 Å²	102.4	88%	0.877	61%	0.612	S	S	*	*			trans	-69.7	95.2	172.1	4.9	0	0	0	0	108.8	S46	T44-S46 PolarHBondContact O-N 2.99Å
45	T	34	Very low	53.6	Low	130 Å²	130	96.1 Å²	96.1	80%	0.798	57%	0.573	S	S	*	*			trans	-67.7	102.1	172.9	26.2	0	0	0	0	109.9	S43 E47	S43-T45 PolarHBondContact O-N 3.13Å; T45-E47 PolarHBondContact O-N 3.25Å
46	S	37	Very low	56.3	Low	108 Å²	108	88.8 Å²	88.8	76%	0.755	54%	0.535	S	S	*	.			trans	-59.3	133.2	167.6	49.2	0	0	0	0	109.5	T44 A48	T44-S46 PolarHBondContact O-N 2.99Å; S46-A48 PolarHBondContact O-N 3.08Å
47	E	37.8	Very low	58.7	Low	119 Å²	119	84.1 Å²	84.1	56%	0.556	50%	0.503	S	S	*	.			trans	-69.7	77.2	180	-63.4	-165	139.9	0	0	111.2	T45 D49 R252 R253	T45-E47 PolarHBondContact O-N 3.25Å; E47-D49 PolarHBondContact O-N 3.2Å; E47-R252 IonicContact OE1-NH1 3.41Å; E47-R253 IonicContact OE2-CZ 3.57Å; E47-R253 IonicContact OE2-NE 2.67Å; E47-R253 PolarHBondContact OE2-NE 3.08Å; E47-R253 IonicContact OE2-NH2 3.45Å; E47-R253 PolarHBondContact OE2-NH2 3.07Å
48	A	49.3	Very low	61.6	Low	81 Å²	81	75.5 Å²	75.5	67%	0.669	46%	0.462	S	S	*	.			trans	-74.1	108.8	165.4	0	0	0	0	0	108.7	S46 E50	S46-A48 PolarHBondContact O-N 3.08Å; A48-E50 PolarHBondContact O-N 3.06Å; A48-E50 VanDerWaalsContact O-N 3.15Å
49	D	56.2	Low	64.6	Low	81 Å²	81	70.3 Å²	70.3	43%	0.433	43%	0.427	S	S	.	.			trans	-50.8	119.5	160	-81.3	-59.8	0	0	0	108	E47 E51 K91 K100	E47-D49 PolarHBondContact O-N 3.2Å; D49-E51 PolarHBondContact O-N 2.97Å; D49-E51 VanDerWaalsContact O-N 3.08Å; D49-K91 IonicContact OD1-NZ 3.96Å; D49-K91 PolarHBondContact OD1-NZ 2.82Å; D49-K91 WeakPolarHBondContact OD2-CE 3.45Å; D49-K91 IonicContact OD2-NZ 3.93Å; D49-K91 PolarHBondContact OD2-NZ 2.85Å; D49-K100 HydrophobicContact CB-CB 4.48Å
50	E	73.8	Confident	67.2	Low	65 Å²	65	66.9 Å²	66.9	30%	0.304	41%	0.411	S	S	.	.			trans	-61	117.3	-178.1	-70.3	-174.8	140.7	0	0	110.5	A48 K100 L245 V246	A48-E50 PolarHBondContact O-N 3.06Å; A48-E50 VanDerWaalsContact O-N 3.15Å; E50-K100 PolarHBondContact O-N 3Å; E50-L245 WeakPolarHBondContact OE2-CA 3.39Å; E50-V246 VanDerWaalsContact OE1-CG2 3.31Å; E50-V246 WeakPolarHBondContact OE1-CG2 3.46Å; E50-V246 WeakPolarHBondContact OE2-CB 3.23Å; E50-V246 PolarHBondContact OE2-N 2.84Å
51	E	88.1	Confident	69.7	Low	56 Å²	56	67.3 Å²	67.3	26%	0.262	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	113.4	-171.9	-172.5	171.3	125	0	0	110.4	D49 R53 K100 V102	D49-E51 PolarHBondContact O-N 2.97Å; D49-E51 VanDerWaalsContact O-N 3.08Å; E51-R53 IonicContact OE1-CZ 2.71Å; E51-R53 IonicContact OE1-NE 2.71Å; E51-R53 IonicContact OE1-NH1 2.68Å; E51-R53 PolarHBondContact OE1-NH1 2.67Å; E51-R53 IonicContact OE1-NH2 2.75Å; E51-R53 PolarHBondContact OE1-NH2 3.44Å; E51-K100 CarbonylContact C-O 3.57Å; E51-K100 WeakPolarHBondContact CA-O 3.38Å; E51-K100 HydrophobicContact CB-CD 4.38Å; E51-K100 HydrophobicContact CG-CD 4.14Å; E51-K100 HydrophobicContact CG-CG 4.36Å; E51-K100 WeakPolarHBondContact OE2-CD 3.44Å; E51-K100 WeakPolarHBondContact OE2-CE 3.49Å; E51-K100 IonicContact OE2-NZ 2.86Å; E51-K100 PolarHBondContact OE2-NZ 2.88Å; E51-V102 HydrophobicContact CG-CB 4.21Å; E51-V102 HydrophobicContact CG-CG2 3.52Å
52	V	92.6	Very high	73	Confident	4 Å²	4	61.7 Å²	61.7	2%	0.024	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	112.2	-179.8	178.4	0	0	0	0	109.3	I54 V99 K100 L101 V102 N124 W234 I243 L245	V52-I54 HydrophobicContact CG1-CG1 4.41Å; V52-V99 HydrophobicContact CB-CG1 3.99Å; V52-V99 HydrophobicContact CG2-CG1 3.43Å; V52-V99 VanDerWaalsContact CG2-CG1 3.43Å; V52-K100 PolarHBondContact N-O 3.43Å; V52-L101 HydrophobicContact CB-CD1 4.06Å; V52-L101 HydrophobicContact CG1-CD1 4.05Å; V52-V102 PolarHBondContact O-N 2.82Å; V52-N124 HydrophobicContact CG1-CB 4.11Å; V52-W234 HydrophobicContact CG1-CH2 4.08Å; V52-W234 HydrophobicContact CG2-CH2 4.41Å; V52-I243 HydrophobicContact CG1-CD1 3.89Å; V52-I243 HydrophobicContact CG1-CG2 4.23Å; V52-I243 HydrophobicContact CG2-CG2 3.48Å; V52-I243 VanDerWaalsContact CG2-CG2 3.48Å; V52-L245 HydrophobicContact CG2-CD2 4.39Å
53	R	95	Very high	76.1	Confident	78 Å²	78	56.8 Å²	56.8	29%	0.294	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	115.2	179.1	-58	-176.5	-171.8	-64.7	-13.1	111	E51 V102 I104 K122 N124 A125	E51-R53 IonicContact OE1-CZ 2.71Å; E51-R53 IonicContact OE1-NE 2.71Å; E51-R53 IonicContact OE1-NH1 2.68Å; E51-R53 PolarHBondContact OE1-NH1 2.67Å; E51-R53 IonicContact OE1-NH2 2.75Å; E51-R53 PolarHBondContact OE1-NH2 3.44Å; R53-V102 CarbonylContact C-O 3.59Å; R53-V102 WeakPolarHBondContact CA-O 3.44Å; R53-V102 HydrophobicContact CG-CB 4.43Å; R53-V102 HydrophobicContact CG-CG1 4.48Å; R53-I104 HydrophobicContact CB-CD1 4.39Å; R53-K122 WeakPolarHBondContact CD-O 3.27Å; R53-N124 WeakPolarHBondContact CB-OD1 3.43Å; R53-N124 PolarHBondContact N-OD1 3.25Å; R53-N124 WeakPolarHBondContact O-CA 3.35Å; R53-N124 WeakPolarHBondContact O-CB 3.44Å; R53-N124 PolarHBondContact O-N 2.83Å; R53-A125 PolarHBondContact O-N 3.12Å; R53-A125 VanDerWaalsContact O-N 3.12Å
54	I	96.4	Very high	79	Confident	3 Å²	3	52 Å²	52	2%	0.015	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	121.9	170.6	-54.1	-174.4	0	0	0	108.3	V52 F56 L101 V102 L103 I104 A125 V127 F230 L233	V52-I54 HydrophobicContact CG1-CG1 4.41Å; I54-F56 HydrophobicContact CG2-CD2 4.29Å; I54-F56 HydrophobicContact CG2-CE2 3.84Å; I54-L101 HydrophobicContact CD1-CD1 3.66Å; I54-L101 HydrophobicContact CD1-CD2 4.45Å; I54-L101 HydrophobicContact CD1-CG 4.36Å; I54-L101 HydrophobicContact CG1-CD1 4.01Å; I54-V102 PolarHBondContact N-O 3.16Å; I54-L103 HydrophobicContact CB-CD2 3.9Å; I54-L103 HydrophobicContact CD1-CD2 4.15Å; I54-L103 HydrophobicContact CG1-CD2 4.28Å; I54-L103 WeakPolarHBondContact O-CA 3.21Å; I54-I104 PolarHBondContact O-N 2.79Å; I54-A125 WeakPolarHBondContact CA-O 3.49Å; I54-A125 HydrophobicContact CG1-CB 4.25Å; I54-V127 HydrophobicContact CG2-CG2 3.7Å; I54-F230 HydrophobicContact CD1-CD1 3.98Å; I54-F230 HydrophobicContact CD1-CE1 3.91Å; I54-L233 HydrophobicContact CD1-CD1 3.82Å; I54-L233 HydrophobicContact CG2-CD1 4.14Å
55	V	97	Very high	82.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	127.6	176.8	-176.2	0	0	0	0	110.1	L57 I104 T106 C119 A123 A125 V127	V55-L57 HydrophobicContact CG1-CD2 3.63Å; V55-L57 HydrophobicContact CG1-CG 3.91Å; V55-I104 HydrophobicContact CG1-CG2 4.39Å; V55-I104 HydrophobicContact CG2-CB 4.13Å; V55-I104 HydrophobicContact CG2-CD1 3.9Å; V55-I104 HydrophobicContact CG2-CG2 4.48Å; V55-T106 HydrophobicContact CG1-CG2 4.08Å; V55-C119 HydrophobicContact CG1-CB 4.37Å; V55-A123 HydrophobicContact CB-CB 4.36Å; V55-A123 HydrophobicContact CG2-CB 3.62Å; V55-A125 PolarHBondContact N-O 3.41Å; V55-A125 VanDerWaalsContact N-O 3.1Å; V55-V127 PolarHBondContact O-N 3.46Å
56	F	97.7	Very high	85.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	116.7	172.6	-75.9	-107.9	0	0	0	109.6	I54 K64 I67 I68 L103 I104 T106 V127 V129 F230	I54-F56 HydrophobicContact CG2-CD2 4.29Å; I54-F56 HydrophobicContact CG2-CE2 3.84Å; F56-K64 HydrophobicContact CB-CB 4.28Å; F56-K64 HydrophobicContact CB-CD 4.32Å; F56-I67 HydrophobicContact CE1-CG2 3.85Å; F56-I68 HydrophobicContact CB-CD1 4.12Å; F56-I68 HydrophobicContact CD1-CD1 4.2Å; F56-I68 HydrophobicContact CD1-CG1 4.11Å; F56-I68 HydrophobicContact CD2-CD1 3.7Å; F56-I68 HydrophobicContact CD2-CG1 3.96Å; F56-I68 HydrophobicContact CE1-CG1 4.05Å; F56-I68 HydrophobicContact CE2-CD1 4.16Å; F56-I68 HydrophobicContact CE2-CG1 3.92Å; F56-I68 HydrophobicContact CG-CD1 3.73Å; F56-I68 HydrophobicContact CG-CG1 4.08Å; F56-I68 HydrophobicContact CZ-CG1 3.96Å; F56-L103 HydrophobicContact CE2-CB 4.36Å; F56-L103 HydrophobicContact CE2-CD2 4.19Å; F56-I104 PolarHBondContact N-O 3.05Å; F56-T106 PolarHBondContact O-OG1 2.82Å; F56-V127 WeakPolarHBondContact CA-O 3.37Å; F56-V127 HydrophobicContact CD1-CB 3.87Å; F56-V127 HydrophobicContact CD1-CG1 3.78Å; F56-V127 HydrophobicContact CD2-CB 4.48Å; F56-V127 HydrophobicContact CE1-CB 3.89Å; F56-V127 HydrophobicContact CE1-CG1 3.67Å; F56-V127 HydrophobicContact CE1-CG2 4.12Å; F56-V127 HydrophobicContact CE2-CB 4.47Å; F56-V127 HydrophobicContact CE2-CG2 4.26Å; F56-V127 HydrophobicContact CG-CB 4.17Å; F56-V127 HydrophobicContact CZ-CB 4.19Å; F56-V127 HydrophobicContact CZ-CG1 4.35Å; F56-V127 HydrophobicContact CZ-CG2 3.96Å; F56-V129 HydrophobicContact CD1-CG2 4.13Å; F56-F230 HydrophobicContact CZ-CZ 4.19Å
57	L	97.5	Very high	88.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	159.9	179.8	-60.6	178.9	0	0	0	110.7	V55 K64 T106 Y110 L116 I120 F126 V127 V129 L144 I148	V55-L57 HydrophobicContact CG1-CD2 3.63Å; V55-L57 HydrophobicContact CG1-CG 3.91Å; L57-K64 VanDerWaalsContact C-CD 3.49Å; L57-K64 WeakPolarHBondContact O-CD 3.4Å; L57-T106 HydrophobicContact CD2-CG2 3.96Å; L57-Y110 HydrophobicContact CD2-CE1 4.44Å; L57-L116 HydrophobicContact CD2-CD1 3.54Å; L57-I120 HydrophobicContact CD1-CG1 4.41Å; L57-F126 HydrophobicContact CD1-CD1 4.31Å; L57-V127 PolarHBondContact N-O 3.45Å; L57-V129 PolarHBondContact O-N 3.02Å; L57-L144 HydrophobicContact CB-CD1 4.23Å; L57-I148 HydrophobicContact CD1-CD1 3.83Å; L57-I148 HydrophobicContact CD1-CG1 4.29Å
58	G	97.4	Very high	90.9	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.174	C	C	.	.			trans	131.1	163.4	-176.4	0	0	0	0	0	112.3	K64 G108 Y110 V129	G58-K64 PolarHBondContact O-NZ 2.86Å; G58-G108 WeakPolarHBondContact O-CA 3.27Å; G58-Y110 PolarHBondContact N-OH 3.05Å; G58-Y110 PolarHBondContact O-OH 2.87Å; G58-V129 VanDerWaalsContact CA-O 3.29Å; G58-V129 WeakPolarHBondContact CA-O 3.1Å
59	S	96.3	Very high	93.1	Very high	14 Å²	14	29.3 Å²	29.3	10%	0.098	15%	0.153	C	C	.	.			trans	-55.8	163.2	-172.3	-38.6	0	0	0	0	113.9	V62 K64 S137 Q140	S59-V62 WeakPolarHBondContact O-CG2 3.34Å; S59-K64 PolarHBondContact O-NZ 3.07Å; S59-S137 WeakPolarHBondContact OG-CA 3.29Å; S59-S137 WeakPolarHBondContact OG-CB 3.42Å; S59-Q140 PolarHBondContact OG-OE1 2.93Å
60	A	95	Very high	95	Very high	44 Å²	44	27.2 Å²	27.2	36%	0.364	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	148.3	162.7	0	0	0	0	0	110.2	V62 G108	A60-V62 PolarHBondContact O-N 3.39Å; A60-V62 VanDerWaalsContact O-N 3.11Å; A60-G108 PolarHBondContact N-O 3.03Å; A60-G108 VanDerWaalsContact N-O 3.12Å
61	K	95.4	Very high	96	Very high	142 Å²	142	25.3 Å²	25.3	62%	0.617	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.1	5.1	177.9	-53.9	172.9	-178.6	175.2	0	117.7	G63 Y80	K61-G63 PolarHBondContact O-N 2.89Å; K61-Y80 HydrophobicContact CB-CE2 4.38Å; K61-Y80 HydrophobicContact CD-CE1 4.25Å; K61-Y80 HydrophobicContact CG-CD1 4.07Å; K61-Y80 HydrophobicContact CG-CD2 4.12Å; K61-Y80 HydrophobicContact CG-CE1 3.64Å; K61-Y80 HydrophobicContact CG-CE2 3.72Å; K61-Y80 HydrophobicContact CG-CG 4.28Å; K61-Y80 VanDerWaalsContact CG-CZ 3.46Å
62	V	97	Very high	96.3	Very high	3 Å²	3	23 Å²	23	2%	0.018	12%	0.119	C	C	.	.	S	Bend	trans	-71.2	-16.9	172.4	-54.4	0	0	0	0	113.4	S59 A60 K64 V129 A131 N185	S59-V62 WeakPolarHBondContact O-CG2 3.34Å; A60-V62 PolarHBondContact O-N 3.39Å; A60-V62 VanDerWaalsContact O-N 3.11Å; V62-K64 HydrophobicContact CG2-CD 4.23Å; V62-K64 HydrophobicContact CG2-CG 3.56Å; V62-V129 HydrophobicContact CB-CG1 4.19Å; V62-V129 HydrophobicContact CG2-CB 3.87Å; V62-V129 HydrophobicContact CG2-CG1 3.72Å; V62-A131 HydrophobicContact CB-CB 4.16Å; V62-A131 HydrophobicContact CG1-CB 4.22Å; V62-N185 PolarHBondContact O-ND2 3.48Å
63	G	96.8	Very high	96.3	Very high	14 Å²	14	29.2 Å²	29.2	14%	0.144	14%	0.143	C	C	.	.			trans	98.6	26.5	174.6	0	0	0	0	0	116	K61 S66 I67	K61-G63 PolarHBondContact O-N 2.89Å; G63-S66 WeakPolarHBondContact O-CB 3.3Å; G63-S66 PolarHBondContact O-N 3.15Å; G63-S66 VanDerWaalsContact O-N 3.13Å; G63-I67 WeakPolarHBondContact O-CG1 3.46Å; G63-I67 PolarHBondContact O-N 2.86Å
64	K	97.6	Very high	96.3	Very high	8 Å²	8	30 Å²	30	4%	0.035	15%	0.152	C	C	.	.	H	α-helix	trans	-52.8	-55.6	176.6	-53.3	-169	-57	-76.2	0	112.2	F56 L57 G58 S59 V62 S66 I67 I68 D105 T106 A107 G108 V129	F56-K64 HydrophobicContact CB-CB 4.28Å; F56-K64 HydrophobicContact CB-CD 4.32Å; L57-K64 VanDerWaalsContact C-CD 3.49Å; L57-K64 WeakPolarHBondContact O-CD 3.4Å; G58-K64 PolarHBondContact O-NZ 2.86Å; S59-K64 PolarHBondContact O-NZ 3.07Å; V62-K64 HydrophobicContact CG2-CD 4.23Å; V62-K64 HydrophobicContact CG2-CG 3.56Å; K64-S66 VanDerWaalsContact C-N 3.28Å; K64-S66 PolarHBondContact O-N 2.77Å; K64-I67 WeakPolarHBondContact O-CB 3.43Å; K64-I67 PolarHBondContact O-N 2.9Å; K64-I67 VanDerWaalsContact O-N 3.11Å; K64-I68 WeakPolarHBondContact O-CG1 3.42Å; K64-I68 PolarHBondContact O-N 3.36Å; K64-D105 VanDerWaalsContact CB-OD1 3.29Å; K64-D105 WeakPolarHBondContact CB-OD1 3.41Å; K64-T106 WeakPolarHBondContact CE-O 3.11Å; K64-T106 WeakPolarHBondContact CE-OG1 3.45Å; K64-T106 PolarHBondContact NZ-O 2.88Å; K64-A107 PolarHBondContact NZ-O 2.85Å; K64-G108 VanDerWaalsContact NZ-CA 3.34Å; K64-V129 HydrophobicContact CG-CB 4.12Å; K64-V129 HydrophobicContact CG-CG2 4.14Å
65	T	97.2	Very high	96.2	Very high	32 Å²	32	34.7 Å²	34.7	20%	0.196	17%	0.174	C	C	.	.	H	α-helix	trans	-53.8	-42.9	173.1	-41.9	0	0	0	0	112.5	I67 I68 Q69 T83 D105	T65-I67 PolarHBondContact O-N 2.68Å; T65-I68 PolarHBondContact O-N 2.67Å; T65-Q69 HydrophobicContact CG2-CG 4.32Å; T65-Q69 WeakPolarHBondContact O-CB 3.31Å; T65-Q69 VanDerWaalsContact O-CG 3.31Å; T65-Q69 WeakPolarHBondContact O-CG 3.14Å; T65-Q69 PolarHBondContact O-N 3.48Å; T65-T83 PolarHBondContact OG1-OG1 3.32Å; T65-D105 WeakPolarHBondContact CA-OD2 3.46Å; T65-D105 WeakPolarHBondContact CB-OD2 3.23Å; T65-D105 WeakPolarHBondContact CG2-OD2 3.28Å; T65-D105 PolarHBondContact N-OD2 3.05Å; T65-D105 PolarHBondContact OG1-OD2 2.91Å
66	S	97.4	Very high	96.2	Very high	27 Å²	27	37.3 Å²	37.3	19%	0.189	19%	0.186	C	C	.	.	H	α-helix	trans	-64.5	-39.2	178.9	-46.8	0	0	0	0	112.3	G63 K64 R70	G63-S66 WeakPolarHBondContact O-CB 3.3Å; G63-S66 PolarHBondContact O-N 3.15Å; G63-S66 VanDerWaalsContact O-N 3.13Å; K64-S66 VanDerWaalsContact C-N 3.28Å; K64-S66 PolarHBondContact O-N 2.77Å; S66-R70 WeakPolarHBondContact O-CB 3.17Å; S66-R70 PolarHBondContact O-N 2.91Å
67	I	97.8	Very high	96	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-46.4	173.9	-68.2	165.4	0	0	0	110.1	F56 G63 K64 T65 R70 F71 V129 V183 N185 V218 A220 I226 I229	F56-I67 HydrophobicContact CE1-CG2 3.85Å; G63-I67 WeakPolarHBondContact O-CG1 3.46Å; G63-I67 PolarHBondContact O-N 2.86Å; K64-I67 WeakPolarHBondContact O-CB 3.43Å; K64-I67 PolarHBondContact O-N 2.9Å; K64-I67 VanDerWaalsContact O-N 3.11Å; T65-I67 PolarHBondContact O-N 2.68Å; I67-R70 PolarHBondContact O-N 3.26Å; I67-F71 WeakPolarHBondContact O-CB 3.37Å; I67-F71 PolarHBondContact O-N 3.04Å; I67-V129 HydrophobicContact CD1-CG1 3.84Å; I67-V129 HydrophobicContact CD1-CG2 4.08Å; I67-V183 HydrophobicContact CD1-CG1 4.17Å; I67-N185 HydrophobicContact CD1-CB 4.1Å; I67-V218 HydrophobicContact CG1-CG1 4.37Å; I67-A220 HydrophobicContact CG1-CB 4.01Å; I67-I226 HydrophobicContact CB-CD1 4.25Å; I67-I226 HydrophobicContact CG1-CD1 4.12Å; I67-I226 HydrophobicContact CG2-CD1 3.92Å; I67-I229 HydrophobicContact CG2-CD1 3.6Å
68	I	97	Very high	95.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.1	-47.3	-177.8	-63.9	164.8	0	0	0	111.4	F56 K64 T65 R70 F71 L72 H88 L103 D105	F56-I68 HydrophobicContact CB-CD1 4.12Å; F56-I68 HydrophobicContact CD1-CD1 4.2Å; F56-I68 HydrophobicContact CD1-CG1 4.11Å; F56-I68 HydrophobicContact CD2-CD1 3.7Å; F56-I68 HydrophobicContact CD2-CG1 3.96Å; F56-I68 HydrophobicContact CE1-CG1 4.05Å; F56-I68 HydrophobicContact CE2-CD1 4.16Å; F56-I68 HydrophobicContact CE2-CG1 3.92Å; F56-I68 HydrophobicContact CG-CD1 3.73Å; F56-I68 HydrophobicContact CG-CG1 4.08Å; F56-I68 HydrophobicContact CZ-CG1 3.96Å; K64-I68 WeakPolarHBondContact O-CG1 3.42Å; K64-I68 PolarHBondContact O-N 3.36Å; T65-I68 PolarHBondContact O-N 2.67Å; I68-R70 VanDerWaalsContact C-N 3.27Å; I68-R70 PolarHBondContact O-N 3.2Å; I68-F71 PolarHBondContact O-N 2.73Å; I68-L72 HydrophobicContact CG2-CD1 3.64Å; I68-L72 HydrophobicContact CG2-CG 4.15Å; I68-L72 WeakPolarHBondContact O-CB 3.47Å; I68-L72 WeakPolarHBondContact O-CG 3.27Å; I68-L72 PolarHBondContact O-N 2.64Å; I68-H88 VanDerWaalsContact CG2-CD2 3.42Å; I68-H88 WeakPolarHBondContact CG2-CD2 3.49Å; I68-L103 HydrophobicContact CG2-CB 4.24Å; I68-L103 HydrophobicContact CG2-CD1 3.85Å; I68-D105 HydrophobicContact CD1-CB 3.56Å
69	Q	96.1	Very high	95.7	Very high	45 Å²	45	54.8 Å²	54.8	21%	0.21	27%	0.274	C	S	.	.	H	α-helix	trans	-59.2	-39.8	174.4	-74.1	179.6	-13.4	0	0	111.8	T65 Y73 N74 H75	T65-Q69 HydrophobicContact CG2-CG 4.32Å; T65-Q69 WeakPolarHBondContact O-CB 3.31Å; T65-Q69 VanDerWaalsContact O-CG 3.31Å; T65-Q69 WeakPolarHBondContact O-CG 3.14Å; T65-Q69 PolarHBondContact O-N 3.48Å; Q69-Y73 WeakPolarHBondContact O-CB 3.44Å; Q69-Y73 PolarHBondContact O-N 3.08Å; Q69-N74 PolarHBondContact O-N 2.85Å; Q69-H75 CarbonylContact C-O 3.56Å; Q69-H75 PolarHBondContact O-N 2.86Å
70	R	95.7	Very high	95.5	Very high	36 Å²	36	59 Å²	59	14%	0.136	29%	0.289	C	S	.	.	H	α-helix	trans	-64.3	-46.2	177.1	178.5	59.6	78.8	-178.4	5.8	111.3	S66 I67 I68 N74 H75 A220 K221 N223 I226	S66-R70 WeakPolarHBondContact O-CB 3.17Å; S66-R70 PolarHBondContact O-N 2.91Å; I67-R70 PolarHBondContact O-N 3.26Å; I68-R70 VanDerWaalsContact C-N 3.27Å; I68-R70 PolarHBondContact O-N 3.2Å; R70-N74 WeakPolarHBondContact CD-OD1 3.33Å; R70-N74 PolarHBondContact NH1-O 3.11Å; R70-N74 PolarHBondContact NH1-OD1 3.4Å; R70-N74 WeakPolarHBondContact O-CA 3.32Å; R70-N74 PolarHBondContact O-N 3.4Å; R70-H75 VanDerWaalsContact CA-O 3.25Å; R70-H75 WeakPolarHBondContact CA-O 3.4Å; R70-H75 PolarHBondContact N-O 3.22Å; R70-A220 PolarHBondContact NE-O 3.36Å; R70-A220 PolarHBondContact NH2-O 2.88Å; R70-K221 PolarHBondContact NH2-O 2.98Å; R70-N223 WeakPolarHBondContact CD-OD1 3.41Å; R70-N223 HydrophobicContact CG-CB 4.14Å; R70-N223 WeakPolarHBondContact CG-OD1 3.35Å; R70-I226 HydrophobicContact CB-CD1 4.4Å; R70-I226 HydrophobicContact CG-CD1 4.15Å; R70-I226 HydrophobicContact CG-CG1 3.93Å
71	F	95.2	Very high	95.4	Very high	25 Å²	25	61 Å²	61	11%	0.11	30%	0.296	C	S	.	.	H	α-helix	trans	-64.2	-48.4	176.9	173.2	-109.6	0	0	0	113.1	I67 I68 F92 L101 L103 I226 M227 F230 L355	I67-F71 WeakPolarHBondContact O-CB 3.37Å; I67-F71 PolarHBondContact O-N 3.04Å; I68-F71 PolarHBondContact O-N 2.73Å; F71-F92 HydrophobicContact CD1-CZ 4.42Å; F71-F92 HydrophobicContact CE1-CE1 4.28Å; F71-F92 AromaticContact CE1-CE2 3.86Å; F71-F92 HydrophobicContact CE1-CE2 3.86Å; F71-F92 AromaticContact CE1-CZ 3.47Å; F71-F92 HydrophobicContact CE1-CZ 3.47Å; F71-F92 VanDerWaalsContact CE1-CZ 3.47Å; F71-F92 HydrophobicContact CZ-CE1 4.04Å; F71-F92 HydrophobicContact CZ-CE2 4.13Å; F71-F92 AromaticContact CZ-CZ 3.65Å; F71-F92 HydrophobicContact CZ-CZ 3.65Å; F71-L101 HydrophobicContact CE1-CD2 4.02Å; F71-L101 HydrophobicContact CZ-CD2 4.22Å; F71-L103 HydrophobicContact CD1-CD1 3.72Å; F71-L103 HydrophobicContact CE1-CD1 3.96Å; F71-I226 HydrophobicContact CB-CG2 3.84Å; F71-I226 HydrophobicContact CD2-CG2 4.42Å; F71-M227 HydrophobicContact CD2-SD 3.92Å; F71-M227 HydrophobicContact CE2-CE 4.18Å; F71-M227 HydrophobicContact CE2-SD 3.9Å; F71-F230 HydrophobicContact CB-CE2 4.12Å; F71-F230 HydrophobicContact CB-CZ 4.46Å; F71-F230 HydrophobicContact CD1-CE1 4.37Å; F71-F230 AromaticContact CD1-CE2 3.81Å; F71-F230 HydrophobicContact CD1-CE2 3.81Å; F71-F230 AromaticContact CD1-CZ 3.56Å; F71-F230 HydrophobicContact CD1-CZ 3.56Å; F71-F230 AromaticContact CD2-CD2 3.77Å; F71-F230 HydrophobicContact CD2-CD2 3.77Å; F71-F230 AromaticContact CD2-CE2 3.32Å; F71-F230 HydrophobicContact CD2-CE2 3.32Å; F71-F230 AromaticContact CD2-CZ 3.97Å; F71-F230 HydrophobicContact CD2-CZ 3.97Å; F71-F230 AromaticContact CE1-CE1 4Å; F71-F230 HydrophobicContact CE1-CE1 4Å; F71-F230 AromaticContact CE1-CE2 3.98Å; F71-F230 HydrophobicContact CE1-CE2 3.98Å; F71-F230 AromaticContact CE1-CZ 3.62Å; F71-F230 HydrophobicContact CE1-CZ 3.62Å; F71-F230 AromaticContact CE2-CD2 3.6Å; F71-F230 HydrophobicContact CE2-CD2 3.6Å; F71-F230 AromaticContact CE2-CE2 3.52Å; F71-F230 HydrophobicContact CE2-CE2 3.52Å; F71-F230 HydrophobicContact CE2-CG 4.18Å; F71-F230 HydrophobicContact CE2-CZ 4.02Å; F71-F230 HydrophobicContact CG-CD2 4.36Å; F71-F230 AromaticContact CG-CE2 3.46Å; F71-F230 HydrophobicContact CG-CE2 3.46Å; F71-F230 VanDerWaalsContact CG-CE2 3.46Å; F71-F230 AromaticContact CG-CZ 3.73Å; F71-F230 HydrophobicContact CG-CZ 3.73Å; F71-F230 HydrophobicContact CZ-CD1 4.3Å; F71-F230 HydrophobicContact CZ-CD2 4.06Å; F71-F230 HydrophobicContact CZ-CE1 4.08Å; F71-F230 AromaticContact CZ-CE2 3.84Å; F71-F230 HydrophobicContact CZ-CE2 3.84Å; F71-F230 HydrophobicContact CZ-CG 4.29Å; F71-F230 AromaticContact CZ-CZ 3.84Å; F71-F230 HydrophobicContact CZ-CZ 3.84Å; F71-L355 HydrophobicContact CE2-CD1 4.39Å; F71-L355 HydrophobicContact CE2-CD2 4.17Å; F71-L355 HydrophobicContact CZ-CD1 3.99Å; F71-L355 HydrophobicContact CZ-CD2 4.18Å
72	L	93.9	Very high	95.2	Very high	8 Å²	8	58.4 Å²	58.4	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-77.1	-37	-171.8	-67.5	-179.7	0	0	0	114.3	I68 H88 K90 F92 L103	I68-L72 HydrophobicContact CG2-CD1 3.64Å; I68-L72 HydrophobicContact CG2-CG 4.15Å; I68-L72 WeakPolarHBondContact O-CB 3.47Å; I68-L72 WeakPolarHBondContact O-CG 3.27Å; I68-L72 PolarHBondContact O-N 2.64Å; L72-H88 HydrophobicContact CD1-CB 3.37Å; L72-K90 HydrophobicContact CD2-CB 4.22Å; L72-K90 HydrophobicContact CD2-CD 4.11Å; L72-K90 PolarHBondContact O-NZ 3.31Å; L72-F92 HydrophobicContact CD2-CE2 4.24Å; L72-F92 HydrophobicContact CD2-CZ 3.85Å; L72-L103 HydrophobicContact CD1-CD1 4.23Å; L72-L103 HydrophobicContact CD2-CD1 3.94Å; L72-L103 HydrophobicContact CG-CD1 4.08Å
73	Y	93.3	Very high	94.8	Very high	135 Å²	135	59.5 Å²	59.5	53%	0.529	30%	0.301	S	S	.	.	H	α-helix	trans	-125.3	-6.3	-167.4	-50	-61.6	0	0	0	113.6	Q69 H75	Q69-Y73 WeakPolarHBondContact O-CB 3.44Å; Q69-Y73 PolarHBondContact O-N 3.08Å; Y73-H75 PolarHBondContact O-N 2.94Å
74	N	94	Very high	94.4	Very high	93 Å²	93	65.1 Å²	65.1	50%	0.497	33%	0.332	S	S	.	.	S	Bend	trans	52.5	37.3	-166.7	-165	18.7	0	0	0	112.9	Q69 R70	Q69-N74 PolarHBondContact O-N 2.85Å; R70-N74 WeakPolarHBondContact CD-OD1 3.33Å; R70-N74 PolarHBondContact NH1-O 3.11Å; R70-N74 PolarHBondContact NH1-OD1 3.4Å; R70-N74 WeakPolarHBondContact O-CA 3.32Å; R70-N74 PolarHBondContact O-N 3.4Å
75	H	95.3	Very high	93.9	Very high	102 Å²	102	68 Å²	68	47%	0.472	35%	0.345	S	S	.	.			trans	-111.8	153.2	-179.9	-175.1	69.4	0	0	0	111.1	Q69 R70 Y73	Q69-H75 CarbonylContact C-O 3.56Å; Q69-H75 PolarHBondContact O-N 2.86Å; R70-H75 VanDerWaalsContact CA-O 3.25Å; R70-H75 WeakPolarHBondContact CA-O 3.4Å; R70-H75 PolarHBondContact N-O 3.22Å; Y73-H75 PolarHBondContact O-N 2.94Å
76	F	96.1	Very high	93.6	Very high	56 Å²	56	70.1 Å²	70.1	25%	0.246	36%	0.356	C	S	.	.			trans	-149	122.5	173.3	174.5	-92.8	0	0	0	109.2	A220 K221	F76-A220 HydrophobicContact CD2-CB 4.14Å; F76-A220 WeakPolarHBondContact CD2-O 3.37Å; F76-A220 HydrophobicContact CE2-CB 4.23Å; F76-K221 HydrophobicContact CD1-CG 4.4Å; F76-K221 HydrophobicContact CD2-CB 4.39Å; F76-K221 HydrophobicContact CE1-CB 4.05Å; F76-K221 HydrophobicContact CE1-CG 3.82Å; F76-K221 HydrophobicContact CE2-CB 3.86Å; F76-K221 HydrophobicContact CZ-CB 3.68Å; F76-K221 HydrophobicContact CZ-CG 3.9Å
77	E	94.7	Very high	93.5	Very high	84 Å²	84	74 Å²	74	39%	0.393	37%	0.373	S	S	.	.			trans	-98.9	129	172.9	-168.1	178.8	178.1	0	0	110.1	K79	E77-K79 HydrophobicContact CG-CB 4.14Å
78	T	94	Very high	93.4	Very high	131 Å²	131	75 Å²	75	80%	0.804	38%	0.378	S	S	*	.	S	Bend	trans	-77.7	-24.6	177.5	-53.2	0	0	0	0	112.5
79	K	94.4	Very high	93.1	Very high	151 Å²	151	78 Å²	78	66%	0.657	40%	0.399	S	S	*	.	S	Bend	trans	-79	125.4	179.3	-178.3	-173.6	175.2	-169.6	0	109.5	E77 T81	E77-K79 HydrophobicContact CG-CB 4.14Å; K79-T81 PolarHBondContact O-N 2.74Å
80	Y	91.8	Very high	92.9	Very high	104 Å²	104	78.4 Å²	78.4	41%	0.408	40%	0.4	S	S	.	.			trans	-77.6	116.8	174.4	179	-111.8	0	0	0	111.2	K61 P82	K61-Y80 HydrophobicContact CB-CE2 4.38Å; K61-Y80 HydrophobicContact CD-CE1 4.25Å; K61-Y80 HydrophobicContact CG-CD1 4.07Å; K61-Y80 HydrophobicContact CG-CD2 4.12Å; K61-Y80 HydrophobicContact CG-CE1 3.64Å; K61-Y80 HydrophobicContact CG-CE2 3.72Å; K61-Y80 HydrophobicContact CG-CG 4.28Å; K61-Y80 VanDerWaalsContact CG-CZ 3.46Å; Y80-P82 HydrophobicContact CD1-CG 4.41Å; Y80-P82 HydrophobicContact CE1-CB 4.25Å; Y80-P82 HydrophobicContact CE1-CG 3.75Å
81	T	92.4	Very high	92.5	Very high	84 Å²	84	80.6 Å²	80.6	52%	0.515	41%	0.41	S	S	.	.			trans	-109.1	123.9	163.8	-58.8	0	0	0	0	107.4	K79 T83	K79-T81 PolarHBondContact O-N 2.74Å; T81-T83 PolarHBondContact O-N 3.24Å
82	P	92.3	Very high	92	Very high	89 Å²	89	79.6 Å²	79.6	58%	0.578	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-60.9	126.8	176	-20.2	30.4	0	0	0	111.4	Y80	Y80-P82 HydrophobicContact CD1-CG 4.41Å; Y80-P82 HydrophobicContact CE1-CB 4.25Å; Y80-P82 HydrophobicContact CE1-CG 3.75Å
83	T	88.3	Confident	91.4	Very high	25 Å²	25	80.3 Å²	80.3	15%	0.153	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-73.6	125.3	-179.8	-42.8	0	0	0	0	110.4	T65 T81 D105 A107	T65-T83 PolarHBondContact OG1-OG1 3.32Å; T81-T83 PolarHBondContact O-N 3.24Å; T83-D105 HydrophobicContact CG2-CB 4.49Å; T83-D105 WeakPolarHBondContact CG2-OD2 3.25Å; T83-A107 WeakPolarHBondContact O-CA 3.47Å; T83-A107 WeakPolarHBondContact O-CB 3.32Å
84	V	87.9	Confident	90.6	Very high	132 Å²	132	74 Å²	74	80%	0.8	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-88.3	136.5	155.8	-178.6	0	0	0	0	105.8	D86	V84-D86 PolarHBondContact O-N 3.4Å
85	E	86.6	Confident	89.8	Confident	68 Å²	68	73.3 Å²	73.3	32%	0.318	38%	0.375	S	S	.	.			trans	-44.9	123.8	-167.8	-61.4	-165.3	160	0	0	113.4	D105 M115	E85-D105 WeakPolarHBondContact CA-O 3.07Å; E85-M115 HydrophobicContact CG-SD 4.36Å; E85-M115 VanDerWaalsContact OE2-CG 3.25Å; E85-M115 WeakPolarHBondContact OE2-CG 3.14Å
86	D	92.2	Very high	88.8	Confident	77 Å²	77	75 Å²	75	41%	0.412	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	152.3	-174.1	-159.7	-4.3	0	0	0	111	V84 H88 D105	V84-D86 PolarHBondContact O-N 3.4Å; D86-H88 IonicContact OD2-CE1 3.51Å; D86-H88 PolarHBondContact OD2-CE1 3.35Å; D86-H88 IonicContact OD2-ND1 2.67Å; D86-H88 IonicContact OD2-NE2 3.08Å; D86-D105 PolarHBondContact N-O 2.9Å; D86-D105 PolarHBondContact O-N 2.93Å
87	I	94.7	Very high	87.9	Confident	108 Å²	108	73.9 Å²	73.9	55%	0.554	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	102.6	-176	-55.3	-178.3	0	0	0	108.8	V102 I104	I87-V102 HydrophobicContact CG2-CG1 3.56Å; I87-I104 HydrophobicContact CG1-CG1 4.47Å
88	H	94.7	Very high	87.2	Confident	23 Å²	23	71.5 Å²	71.5	11%	0.106	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	130.6	176.7	-50.2	-71.3	0	0	0	110.4	I68 L72 D86 V102 L103	I68-H88 VanDerWaalsContact CG2-CD2 3.42Å; I68-H88 WeakPolarHBondContact CG2-CD2 3.49Å; L72-H88 HydrophobicContact CD1-CB 3.37Å; D86-H88 IonicContact OD2-CE1 3.51Å; D86-H88 PolarHBondContact OD2-CE1 3.35Å; D86-H88 IonicContact OD2-ND1 2.67Å; D86-H88 IonicContact OD2-NE2 3.08Å; H88-V102 CarbonylContact O-C 3.6Å; H88-V102 WeakPolarHBondContact O-CA 3.49Å; H88-L103 PolarHBondContact N-O 2.82Å; H88-L103 PolarHBondContact O-N 3Å
89	S	92.4	Very high	86.8	Confident	62 Å²	62	65.4 Å²	65.4	43%	0.434	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	134.6	176.3	-168.8	0	0	0	0	112.2	K100 L101 V102	S89-K100 WeakPolarHBondContact OG-CE 3.47Å; S89-L101 WeakPolarHBondContact CA-O 3.34Å; S89-L101 PolarHBondContact OG-O 3.34Å; S89-V102 WeakPolarHBondContact OG-CG2 3.44Å
90	K	90.7	Very high	86.6	Confident	54 Å²	54	61.2 Å²	61.2	24%	0.235	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	139.6	176.8	-168	168.1	-175.1	177.6	0	110.2	L72 F92 L101	L72-K90 HydrophobicContact CD2-CB 4.22Å; L72-K90 HydrophobicContact CD2-CD 4.11Å; L72-K90 PolarHBondContact O-NZ 3.31Å; K90-F92 HydrophobicContact CB-CD2 4.34Å; K90-F92 HydrophobicContact CB-CE2 3.67Å; K90-F92 HydrophobicContact CB-CZ 3.98Å; K90-F92 HydrophobicContact CD-CE1 4.12Å; K90-F92 HydrophobicContact CD-CE2 4.31Å; K90-F92 HydrophobicContact CD-CZ 3.75Å; K90-F92 HydrophobicContact CG-CE1 4.38Å; K90-F92 HydrophobicContact CG-CE2 4.04Å; K90-F92 HydrophobicContact CG-CZ 3.96Å; K90-F92 WeakPolarHBondContact O-CD2 3.44Å; K90-L101 PolarHBondContact N-O 2.96Å; K90-L101 PolarHBondContact O-N 2.73Å
91	K	87.9	Confident	86.6	Confident	82 Å²	82	56.5 Å²	56.5	36%	0.357	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	134.3	172.9	-68.6	-163.3	179.3	-165	0	109.8	D49 I98 V99 K100	D49-K91 IonicContact OD1-NZ 3.96Å; D49-K91 PolarHBondContact OD1-NZ 2.82Å; D49-K91 WeakPolarHBondContact OD2-CE 3.45Å; D49-K91 IonicContact OD2-NZ 3.93Å; D49-K91 PolarHBondContact OD2-NZ 2.85Å; K91-I98 HydrophobicContact CB-CG2 4.42Å; K91-I98 HydrophobicContact CD-CG2 4.09Å; K91-V99 WeakPolarHBondContact CA-O 3.14Å; K91-K100 HydrophobicContact CG-CB 4.48Å
92	F	85.3	Confident	86.8	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.018	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	151.5	177.3	-65.7	-81.1	0	0	0	110.6	F71 L72 K90 I98 V99 L101 V353 L355	F71-F92 HydrophobicContact CD1-CZ 4.42Å; F71-F92 HydrophobicContact CE1-CE1 4.28Å; F71-F92 AromaticContact CE1-CE2 3.86Å; F71-F92 HydrophobicContact CE1-CE2 3.86Å; F71-F92 AromaticContact CE1-CZ 3.47Å; F71-F92 HydrophobicContact CE1-CZ 3.47Å; F71-F92 VanDerWaalsContact CE1-CZ 3.47Å; F71-F92 HydrophobicContact CZ-CE1 4.04Å; F71-F92 HydrophobicContact CZ-CE2 4.13Å; F71-F92 AromaticContact CZ-CZ 3.65Å; F71-F92 HydrophobicContact CZ-CZ 3.65Å; L72-F92 HydrophobicContact CD2-CE2 4.24Å; L72-F92 HydrophobicContact CD2-CZ 3.85Å; K90-F92 HydrophobicContact CB-CD2 4.34Å; K90-F92 HydrophobicContact CB-CE2 3.67Å; K90-F92 HydrophobicContact CB-CZ 3.98Å; K90-F92 HydrophobicContact CD-CE1 4.12Å; K90-F92 HydrophobicContact CD-CE2 4.31Å; K90-F92 HydrophobicContact CD-CZ 3.75Å; K90-F92 HydrophobicContact CG-CE1 4.38Å; K90-F92 HydrophobicContact CG-CE2 4.04Å; K90-F92 HydrophobicContact CG-CZ 3.96Å; K90-F92 WeakPolarHBondContact O-CD2 3.44Å; F92-I98 WeakPolarHBondContact O-CA 3.47Å; F92-V99 PolarHBondContact N-O 2.92Å; F92-V99 PolarHBondContact O-N 3.42Å; F92-L101 HydrophobicContact CD2-CB 3.58Å; F92-L101 HydrophobicContact CD2-CD2 3.87Å; F92-L101 HydrophobicContact CD2-CG 4.4Å; F92-L101 HydrophobicContact CE2-CB 3.84Å; F92-L101 HydrophobicContact CE2-CD2 3.76Å; F92-L101 HydrophobicContact CE2-CG 4.43Å; F92-V353 VanDerWaalsContact CA-O 3.27Å; F92-V353 WeakPolarHBondContact CA-O 3.39Å; F92-V353 HydrophobicContact CD1-CB 3.66Å; F92-V353 HydrophobicContact CD1-CG1 3.9Å; F92-V353 WeakPolarHBondContact CD1-O 3.42Å; F92-V353 HydrophobicContact CE1-CB 3.73Å; F92-V353 HydrophobicContact CE1-CG1 3.81Å; F92-L355 HydrophobicContact CB-CD1 3.54Å; F92-L355 HydrophobicContact CD1-CD1 3.09Å; F92-L355 HydrophobicContact CD2-CD1 4.15Å; F92-L355 HydrophobicContact CE1-CD1 3.66Å; F92-L355 HydrophobicContact CG-CD1 3.34Å; F92-L355 HydrophobicContact CZ-CD1 4.37Å
93	I	81.2	Confident	87	Confident	22 Å²	22	48.4 Å²	48.4	11%	0.113	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	118.8	164.7	-69.4	163.7	0	0	0	107.6	H97 I98 I352 V353 Y354 L355	I93-H97 CarbonylContact C-O 3.36Å; I93-H97 WeakPolarHBondContact CA-O 3.27Å; I93-I98 HydrophobicContact CG1-CG1 3.99Å; I93-I352 HydrophobicContact CD1-CG2 3.61Å; I93-I352 HydrophobicContact CG1-CG2 3.78Å; I93-V353 PolarHBondContact N-O 3.15Å; I93-V353 VanDerWaalsContact N-O 3.11Å; I93-Y354 HydrophobicContact CB-CD1 4.04Å; I93-Y354 HydrophobicContact CB-CE1 4.36Å; I93-Y354 HydrophobicContact CB-CG 4.47Å; I93-Y354 HydrophobicContact CD1-CD1 3.9Å; I93-Y354 HydrophobicContact CD1-CE1 3.4Å; I93-Y354 HydrophobicContact CD1-CE2 4.07Å; I93-Y354 HydrophobicContact CD1-CG 4.42Å; I93-Y354 VanDerWaalsContact CD1-CZ 3.49Å; I93-Y354 HydrophobicContact CG1-CE1 4.47Å; I93-Y354 HydrophobicContact CG2-CD1 4.09Å; I93-Y354 HydrophobicContact CG2-CE1 4.33Å; I93-L355 CarbonylContact O-C 3.49Å; I93-L355 WeakPolarHBondContact O-CA 3.37Å; I93-L355 PolarHBondContact O-N 3.06Å
94	V	76.5	Confident	87.4	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	116	172.8	179.2	0	0	0	0	106.5	N96 H97 V99 W234 L355	V94-N96 VanDerWaalsContact C-N 3.28Å; V94-N96 PolarHBondContact O-N 2.82Å; V94-H97 PolarHBondContact N-O 2.7Å; V94-H97 WeakPolarHBondContact O-CB 3.43Å; V94-H97 PolarHBondContact O-N 2.67Å; V94-V99 HydrophobicContact CB-CG2 4.28Å; V94-V99 HydrophobicContact CG2-CG2 4.43Å; V94-W234 HydrophobicContact CG1-CD2 4.04Å; V94-W234 HydrophobicContact CG1-CG 4.24Å; V94-W234 HydrophobicContact CG1-CZ2 4.44Å; V94-W234 HydrophobicContact CG2-CZ2 3.97Å; V94-L355 HydrophobicContact CG2-CB 4.09Å
95	R	75.4	Confident	87.7	Confident	80 Å²	80	41.6 Å²	41.6	30%	0.302	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	43.7	177.3	-56.4	158.1	178	-119.9	1.1	113.1	H97 D238	R95-H97 PolarHBondContact O-CE1 2.81Å; R95-H97 PolarHBondContact O-N 2.7Å; R95-H97 PolarHBondContact O-ND1 2.68Å; R95-D238 IonicContact CZ-OD1 2.64Å; R95-D238 IonicContact CZ-OD2 2.67Å; R95-D238 IonicContact NH1-OD1 3.98Å; R95-D238 PolarHBondContact NH1-OD1 2.96Å; R95-D238 IonicContact NH1-OD2 2.68Å; R95-D238 PolarHBondContact NH1-OD2 3.45Å; R95-D238 IonicContact NH2-OD1 2.93Å; R95-D238 IonicContact NH2-OD2 2.7Å; R95-D238 PolarHBondContact NH2-OD2 2.83Å
96	N	75.4	Confident	88.1	Confident	138 Å²	138	38.4 Å²	38.4	74%	0.738	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.8	8.5	-176.2	-50.6	58.8	0	0	0	115.6	V94 W248	V94-N96 VanDerWaalsContact C-N 3.28Å; V94-N96 PolarHBondContact O-N 2.82Å; N96-W248 WeakPolarHBondContact O-CB 3.21Å
97	H	76.3	Confident	88	Confident	31 Å²	31	35.6 Å²	35.6	14%	0.144	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	134.3	173.1	-57.7	57.9	0	0	0	109	I93 V94 R95 V99 L245 V246 K247	I93-H97 CarbonylContact C-O 3.36Å; I93-H97 WeakPolarHBondContact CA-O 3.27Å; V94-H97 PolarHBondContact N-O 2.7Å; V94-H97 WeakPolarHBondContact O-CB 3.43Å; V94-H97 PolarHBondContact O-N 2.67Å; R95-H97 PolarHBondContact O-CE1 2.81Å; R95-H97 PolarHBondContact O-N 2.7Å; R95-H97 PolarHBondContact O-ND1 2.68Å; H97-V99 HydrophobicContact CB-CG2 4.28Å; H97-V99 PolarHBondContact O-N 3Å; H97-L245 HydrophobicContact CB-CB 4.26Å; H97-L245 VanDerWaalsContact CD2-CB 3.46Å; H97-L245 WeakPolarHBondContact CD2-CB 3.38Å; H97-L245 PolarHBondContact CD2-O 2.79Å; H97-V246 PolarHBondContact CD2-O 3.08Å; H97-K247 PolarHBondContact CD2-N 3.36Å; H97-K247 VanDerWaalsContact NE2-CG 3.3Å; H97-K247 WeakPolarHBondContact NE2-CG 3.18Å
98	I	81.1	Confident	87.5	Confident	35 Å²	35	30.6 Å²	30.6	18%	0.179	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	112.6	172.5	-59.5	-172.3	0	0	0	108.2	K91 F92 I93 W248	K91-I98 HydrophobicContact CB-CG2 4.42Å; K91-I98 HydrophobicContact CD-CG2 4.09Å; F92-I98 WeakPolarHBondContact O-CA 3.47Å; I93-I98 HydrophobicContact CG1-CG1 3.99Å; I98-W248 HydrophobicContact CB-CE3 4.05Å; I98-W248 HydrophobicContact CB-CZ3 4.48Å; I98-W248 HydrophobicContact CD1-CD2 3.69Å; I98-W248 HydrophobicContact CD1-CE3 3.65Å; I98-W248 HydrophobicContact CD1-CG 4.39Å; I98-W248 HydrophobicContact CD1-CH2 3.94Å; I98-W248 HydrophobicContact CD1-CZ2 3.97Å; I98-W248 HydrophobicContact CD1-CZ3 3.78Å; I98-W248 HydrophobicContact CG1-CD2 3.95Å; I98-W248 HydrophobicContact CG1-CE3 3.86Å; I98-W248 HydrophobicContact CG1-CG 4.29Å; I98-W248 HydrophobicContact CG1-CZ3 4.4Å
99	V	84.5	Confident	87	Confident	3 Å²	3	32.1 Å²	32.1	2%	0.018	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	132.1	-177.5	-171.2	0	0	0	0	109.3	V52 K91 F92 V94 H97 L101 W234 L245	V52-V99 HydrophobicContact CB-CG1 3.99Å; V52-V99 HydrophobicContact CG2-CG1 3.43Å; V52-V99 VanDerWaalsContact CG2-CG1 3.43Å; K91-V99 WeakPolarHBondContact CA-O 3.14Å; F92-V99 PolarHBondContact N-O 2.92Å; F92-V99 PolarHBondContact O-N 3.42Å; V94-V99 HydrophobicContact CB-CG2 4.28Å; V94-V99 HydrophobicContact CG2-CG2 4.43Å; H97-V99 HydrophobicContact CB-CG2 4.28Å; H97-V99 PolarHBondContact O-N 3Å; V99-L101 PolarHBondContact O-N 2.92Å; V99-W234 HydrophobicContact CG1-CH2 4.47Å; V99-L245 HydrophobicContact CG1-CD2 4.23Å; V99-L245 HydrophobicContact CG2-CD1 4.35Å; V99-L245 HydrophobicContact CG2-CD2 3.72Å
100	K	90.3	Very high	86.7	Confident	63 Å²	63	31.1 Å²	31.1	27%	0.274	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	98.7	169.5	-175.7	-174.9	175.3	-166	0	108.2	D49 E50 E51 V52 S89 K91	D49-K100 HydrophobicContact CB-CB 4.48Å; E50-K100 PolarHBondContact O-N 3Å; E51-K100 CarbonylContact C-O 3.57Å; E51-K100 WeakPolarHBondContact CA-O 3.38Å; E51-K100 HydrophobicContact CB-CD 4.38Å; E51-K100 HydrophobicContact CG-CD 4.14Å; E51-K100 HydrophobicContact CG-CG 4.36Å; E51-K100 WeakPolarHBondContact OE2-CD 3.44Å; E51-K100 WeakPolarHBondContact OE2-CE 3.49Å; E51-K100 IonicContact OE2-NZ 2.86Å; E51-K100 PolarHBondContact OE2-NZ 2.88Å; V52-K100 PolarHBondContact N-O 3.43Å; S89-K100 WeakPolarHBondContact OG-CE 3.47Å; K91-K100 HydrophobicContact CG-CB 4.48Å
101	L	92.8	Very high	86.2	Confident	4 Å²	4	34.1 Å²	34.1	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	131.9	177.8	-159.5	63.8	0	0	0	109.6	V52 I54 F71 S89 K90 F92 V99 L103 F230 W234	V52-L101 HydrophobicContact CB-CD1 4.06Å; V52-L101 HydrophobicContact CG1-CD1 4.05Å; I54-L101 HydrophobicContact CD1-CD1 3.66Å; I54-L101 HydrophobicContact CD1-CD2 4.45Å; I54-L101 HydrophobicContact CD1-CG 4.36Å; I54-L101 HydrophobicContact CG1-CD1 4.01Å; F71-L101 HydrophobicContact CE1-CD2 4.02Å; F71-L101 HydrophobicContact CZ-CD2 4.22Å; S89-L101 WeakPolarHBondContact CA-O 3.34Å; S89-L101 PolarHBondContact OG-O 3.34Å; K90-L101 PolarHBondContact N-O 2.96Å; K90-L101 PolarHBondContact O-N 2.73Å; F92-L101 HydrophobicContact CD2-CB 3.58Å; F92-L101 HydrophobicContact CD2-CD2 3.87Å; F92-L101 HydrophobicContact CD2-CG 4.4Å; F92-L101 HydrophobicContact CE2-CB 3.84Å; F92-L101 HydrophobicContact CE2-CD2 3.76Å; F92-L101 HydrophobicContact CE2-CG 4.43Å; V99-L101 PolarHBondContact O-N 2.92Å; L101-L103 HydrophobicContact CD2-CD2 3.8Å; L101-L103 HydrophobicContact CG-CD2 3.72Å; L101-F230 HydrophobicContact CD2-CD1 4.33Å; L101-F230 HydrophobicContact CD2-CE1 4.07Å; L101-W234 HydrophobicContact CD1-CH2 4.49Å; L101-W234 HydrophobicContact CD1-CZ2 4.19Å
102	V	95.4	Very high	86.2	Confident	2 Å²	2	37 Å²	37	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	111.8	175.5	169.8	0	0	0	0	108.6	E51 V52 R53 I54 I87 H88 S89 I104	E51-V102 HydrophobicContact CG-CB 4.21Å; E51-V102 HydrophobicContact CG-CG2 3.52Å; V52-V102 PolarHBondContact O-N 2.82Å; R53-V102 CarbonylContact C-O 3.59Å; R53-V102 WeakPolarHBondContact CA-O 3.44Å; R53-V102 HydrophobicContact CG-CB 4.43Å; R53-V102 HydrophobicContact CG-CG1 4.48Å; I54-V102 PolarHBondContact N-O 3.16Å; I87-V102 HydrophobicContact CG2-CG1 3.56Å; H88-V102 CarbonylContact O-C 3.6Å; H88-V102 WeakPolarHBondContact O-CA 3.49Å; S89-V102 WeakPolarHBondContact OG-CG2 3.44Å; V102-I104 HydrophobicContact CG1-CG1 4.16Å
103	L	96.7	Very high	86.3	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	117.9	178.3	-49.5	-175	0	0	0	108	I54 F56 I68 F71 L72 H88 L101 F230	I54-L103 HydrophobicContact CB-CD2 3.9Å; I54-L103 HydrophobicContact CD1-CD2 4.15Å; I54-L103 HydrophobicContact CG1-CD2 4.28Å; I54-L103 WeakPolarHBondContact O-CA 3.21Å; F56-L103 HydrophobicContact CE2-CB 4.36Å; F56-L103 HydrophobicContact CE2-CD2 4.19Å; I68-L103 HydrophobicContact CG2-CB 4.24Å; I68-L103 HydrophobicContact CG2-CD1 3.85Å; F71-L103 HydrophobicContact CD1-CD1 3.72Å; F71-L103 HydrophobicContact CE1-CD1 3.96Å; L72-L103 HydrophobicContact CD1-CD1 4.23Å; L72-L103 HydrophobicContact CD2-CD1 3.94Å; L72-L103 HydrophobicContact CG-CD1 4.08Å; H88-L103 PolarHBondContact N-O 2.82Å; H88-L103 PolarHBondContact O-N 3Å; L101-L103 HydrophobicContact CD2-CD2 3.8Å; L101-L103 HydrophobicContact CG-CD2 3.72Å; L103-F230 HydrophobicContact CD1-CZ 4.32Å; L103-F230 HydrophobicContact CD2-CE1 4.02Å; L103-F230 HydrophobicContact CD2-CZ 4.48Å
104	I	96.4	Very high	86.8	Confident	15 Å²	15	42.3 Å²	42.3	8%	0.077	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	113.2	178.5	-62.6	168.6	0	0	0	107.4	R53 I54 V55 F56 I87 V102 T106	R53-I104 HydrophobicContact CB-CD1 4.39Å; I54-I104 PolarHBondContact O-N 2.79Å; V55-I104 HydrophobicContact CG1-CG2 4.39Å; V55-I104 HydrophobicContact CG2-CB 4.13Å; V55-I104 HydrophobicContact CG2-CD1 3.9Å; V55-I104 HydrophobicContact CG2-CG2 4.48Å; F56-I104 PolarHBondContact N-O 3.05Å; I87-I104 HydrophobicContact CG1-CG1 4.47Å; V102-I104 HydrophobicContact CG1-CG1 4.16Å; I104-T106 HydrophobicContact CG2-CG2 4.49Å
105	D	95.8	Very high	87.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	118.6	177.6	-165.8	15.6	0	0	0	110.2	K64 T65 I68 T83 E85 D86	K64-D105 VanDerWaalsContact CB-OD1 3.29Å; K64-D105 WeakPolarHBondContact CB-OD1 3.41Å; T65-D105 WeakPolarHBondContact CA-OD2 3.46Å; T65-D105 WeakPolarHBondContact CB-OD2 3.23Å; T65-D105 WeakPolarHBondContact CG2-OD2 3.28Å; T65-D105 PolarHBondContact N-OD2 3.05Å; T65-D105 PolarHBondContact OG1-OD2 2.91Å; I68-D105 HydrophobicContact CD1-CB 3.56Å; T83-D105 HydrophobicContact CG2-CB 4.49Å; T83-D105 WeakPolarHBondContact CG2-OD2 3.25Å; E85-D105 WeakPolarHBondContact CA-O 3.07Å; D86-D105 PolarHBondContact N-O 2.9Å; D86-D105 PolarHBondContact O-N 2.93Å
106	T	94.4	Very high	88.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.234	C	C	.	.			trans	-94.8	148.9	-179.1	63.5	0	0	0	0	111.5	V55 F56 L57 K64 I104 G108 Y110	V55-T106 HydrophobicContact CG1-CG2 4.08Å; F56-T106 PolarHBondContact O-OG1 2.82Å; L57-T106 HydrophobicContact CD2-CG2 3.96Å; K64-T106 WeakPolarHBondContact CE-O 3.11Å; K64-T106 WeakPolarHBondContact CE-OG1 3.45Å; K64-T106 PolarHBondContact NZ-O 2.88Å; I104-T106 HydrophobicContact CG2-CG2 4.49Å; T106-G108 PolarHBondContact O-N 2.8Å; T106-G108 VanDerWaalsContact O-N 3.17Å; T106-Y110 PolarHBondContact OG1-OH 3.4Å
107	A	90.4	Very high	89	Confident	19 Å²	19	42.8 Å²	42.8	16%	0.157	22%	0.223	C	C	.	.			trans	-53.5	-40	177.9	0	0	0	0	0	112.7	K64 T83 S109	K64-A107 PolarHBondContact NZ-O 2.85Å; T83-A107 WeakPolarHBondContact O-CA 3.47Å; T83-A107 WeakPolarHBondContact O-CB 3.32Å; A107-S109 PolarHBondContact O-N 3.12Å
108	G	83.4	Confident	89.8	Confident	3 Å²	3	45.7 Å²	45.7	3%	0.031	24%	0.24	C	C	.	.	S	Bend	trans	81.8	-5.9	-172.6	0	0	0	0	0	114.1	G58 A60 K64 T106	G58-G108 WeakPolarHBondContact O-CA 3.27Å; A60-G108 PolarHBondContact N-O 3.03Å; A60-G108 VanDerWaalsContact N-O 3.12Å; K64-G108 VanDerWaalsContact NZ-CA 3.34Å; T106-G108 PolarHBondContact O-N 2.8Å; T106-G108 VanDerWaalsContact O-N 3.17Å
109	S	85.6	Confident	90.3	Very high	55 Å²	55	44.8 Å²	44.8	39%	0.385	24%	0.236	S	C	.	.			trans	-85.6	146.1	140.9	69.3	0	0	0	0	108.2	A107 D111	A107-S109 PolarHBondContact O-N 3.12Å; S109-D111 WeakPolarHBondContact CB-OD2 3.48Å; S109-D111 PolarHBondContact OG-OD2 3.23Å
110	Y	84.5	Confident	90.7	Very high	40 Å²	40	44.7 Å²	44.7	16%	0.157	24%	0.235	C	C	.	.			trans	-123.9	45.3	-174.9	-63.5	-64.2	0	0	0	110.8	L57 G58 T106 F112 L116 L144	L57-Y110 HydrophobicContact CD2-CE1 4.44Å; G58-Y110 PolarHBondContact N-OH 3.05Å; G58-Y110 PolarHBondContact O-OH 2.87Å; T106-Y110 PolarHBondContact OG1-OH 3.4Å; Y110-F112 PolarHBondContact O-N 3.11Å; Y110-L116 HydrophobicContact CD1-CB 4.29Å; Y110-L116 HydrophobicContact CD1-CD1 4.11Å; Y110-L116 HydrophobicContact CD1-CD2 3.73Å; Y110-L116 HydrophobicContact CD1-CG 4.26Å; Y110-L116 HydrophobicContact CE1-CD1 3.85Å; Y110-L116 HydrophobicContact CE1-CD2 4.14Å; Y110-L116 HydrophobicContact CE1-CG 4.48Å; Y110-L116 HydrophobicContact CG-CD2 3.98Å; Y110-L144 HydrophobicContact CD2-CD2 4.24Å; Y110-L144 HydrophobicContact CE1-CD2 4.48Å; Y110-L144 HydrophobicContact CE2-CD1 3.93Å; Y110-L144 HydrophobicContact CE2-CD2 3.7Å; Y110-L144 HydrophobicContact CE2-CG 4.31Å
111	D	81.7	Confident	90.9	Very high	117 Å²	117	45.6 Å²	45.6	63%	0.626	25%	0.25	S	C	*	.	S	Bend	trans	-61.5	-17.6	-176.2	-49.7	-65.1	0	0	0	112.8	S109	S109-D111 WeakPolarHBondContact CB-OD2 3.48Å; S109-D111 PolarHBondContact OG-OD2 3.23Å
112	F	86.9	Confident	90.8	Very high	144 Å²	144	51.2 Å²	51.2	63%	0.632	27%	0.274	S	S	*	.			trans	-123.2	81.4	177.4	-56.9	-75.9	0	0	0	112.1	Y110 A114 M115 L116	Y110-F112 PolarHBondContact O-N 3.11Å; F112-A114 PolarHBondContact O-N 3.35Å; F112-M115 HydrophobicContact CB-CB 4.06Å; F112-M115 VanDerWaalsContact O-CB 3.28Å; F112-M115 WeakPolarHBondContact O-CB 3.42Å; F112-M115 PolarHBondContact O-N 3.5Å; F112-L116 PolarHBondContact O-N 3.18Å
113	P	88.6	Confident	90.8	Very high	75 Å²	75	51.3 Å²	51.3	49%	0.487	28%	0.275	S	S	.	.	H	α-helix	trans	-60.4	-15.6	-178.3	-26.6	35.4	0	0	0	115.7	R117	P113-R117 WeakPolarHBondContact O-CB 3.31Å; P113-R117 WeakPolarHBondContact O-CG 3.35Å; P113-R117 PolarHBondContact O-N 2.9Å; P113-R117 PolarHBondContact O-NE 3.37Å
114	A	90.3	Very high	90.6	Very high	62 Å²	62	53.6 Å²	53.6	51%	0.512	29%	0.287	S	S	.	.	H	α-helix	trans	-71	-35.5	170.9	0	0	0	0	0	112.7	F112 L118	F112-A114 PolarHBondContact O-N 3.35Å; A114-L118 PolarHBondContact O-N 3.12Å; A114-L118 VanDerWaalsContact O-N 3.15Å
115	M	88.5	Confident	90.6	Very high	88 Å²	88	53 Å²	53	43%	0.433	28%	0.284	S	S	.	.	H	α-helix	trans	-68.9	-50.7	178.6	-167.2	169	-82.3	0	0	109.9	E85 F112 R117 L118 C119	E85-M115 HydrophobicContact CG-SD 4.36Å; E85-M115 VanDerWaalsContact OE2-CG 3.25Å; E85-M115 WeakPolarHBondContact OE2-CG 3.14Å; F112-M115 HydrophobicContact CB-CB 4.06Å; F112-M115 VanDerWaalsContact O-CB 3.28Å; F112-M115 WeakPolarHBondContact O-CB 3.42Å; F112-M115 PolarHBondContact O-N 3.5Å; M115-R117 VanDerWaalsContact C-N 3.32Å; M115-R117 PolarHBondContact O-N 3.26Å; M115-L118 WeakPolarHBondContact O-CA 3.45Å; M115-L118 WeakPolarHBondContact O-CB 3.21Å; M115-L118 PolarHBondContact O-N 3.02Å; M115-C119 PolarHBondContact O-N 3.22Å; M115-C119 PolarHBondContact O-SG 3.38Å
116	L	92.4	Very high	90.7	Very high	4 Å²	4	53 Å²	53	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-56	-42.5	174.2	178.8	60.1	0	0	0	112.8	L57 Y110 F112 L118 C119 I120 L144 Q147	L57-L116 HydrophobicContact CD2-CD1 3.54Å; Y110-L116 HydrophobicContact CD1-CB 4.29Å; Y110-L116 HydrophobicContact CD1-CD1 4.11Å; Y110-L116 HydrophobicContact CD1-CD2 3.73Å; Y110-L116 HydrophobicContact CD1-CG 4.26Å; Y110-L116 HydrophobicContact CE1-CD1 3.85Å; Y110-L116 HydrophobicContact CE1-CD2 4.14Å; Y110-L116 HydrophobicContact CE1-CG 4.48Å; Y110-L116 HydrophobicContact CG-CD2 3.98Å; F112-L116 PolarHBondContact O-N 3.18Å; L116-L118 VanDerWaalsContact C-N 3.33Å; L116-L118 PolarHBondContact O-N 2.83Å; L116-C119 PolarHBondContact O-N 2.85Å; L116-I120 HydrophobicContact CD1-CD1 3.92Å; L116-I120 HydrophobicContact CD1-CG1 4.18Å; L116-I120 HydrophobicContact CG-CD1 3.9Å; L116-I120 WeakPolarHBondContact O-CG1 3.47Å; L116-I120 PolarHBondContact O-N 3.25Å; L116-L144 HydrophobicContact CD2-CD2 3.93Å; L116-Q147 VanDerWaalsContact CD2-OE1 3.3Å
117	R	92.9	Very high	90.8	Very high	137 Å²	137	53 Å²	53	52%	0.517	28%	0.284	S	S	.	.	H	α-helix	trans	-58	-43.1	173.7	-86.1	-179.6	-68.8	167.7	1.1	112.7	P113 M115 I120 S121	P113-R117 WeakPolarHBondContact O-CB 3.31Å; P113-R117 WeakPolarHBondContact O-CG 3.35Å; P113-R117 PolarHBondContact O-N 2.9Å; P113-R117 PolarHBondContact O-NE 3.37Å; M115-R117 VanDerWaalsContact C-N 3.32Å; M115-R117 PolarHBondContact O-N 3.26Å; R117-I120 PolarHBondContact O-N 2.99Å; R117-S121 WeakPolarHBondContact O-CB 3.4Å; R117-S121 PolarHBondContact O-N 3.34Å
118	L	92.4	Very high	91.2	Very high	93 Å²	93	52 Å²	52	49%	0.487	28%	0.277	S	S	.	.	H	α-helix	trans	-67.2	-40.5	178.2	-173.1	64.1	0	0	0	111.8	A114 M115 L116 K122	A114-L118 PolarHBondContact O-N 3.12Å; A114-L118 VanDerWaalsContact O-N 3.15Å; M115-L118 WeakPolarHBondContact O-CA 3.45Å; M115-L118 WeakPolarHBondContact O-CB 3.21Å; M115-L118 PolarHBondContact O-N 3.02Å; L116-L118 VanDerWaalsContact C-N 3.33Å; L116-L118 PolarHBondContact O-N 2.83Å; L118-K122 HydrophobicContact CD1-CD 4.1Å; L118-K122 HydrophobicContact CG-CD 4.24Å; L118-K122 WeakPolarHBondContact O-CB 3.43Å; L118-K122 WeakPolarHBondContact O-CG 3.15Å; L118-K122 PolarHBondContact O-N 2.92Å; L118-K122 VanDerWaalsContact O-N 3.12Å
119	C	92.5	Very high	91.9	Very high	16 Å²	16	51.9 Å²	51.9	11%	0.108	28%	0.275	C	S	.	.	H	α-helix	trans	-61.7	-46.5	174	-61.9	0	0	0	0	111.3	V55 M115 L116 K122 A123	V55-C119 HydrophobicContact CG1-CB 4.37Å; M115-C119 PolarHBondContact O-N 3.22Å; M115-C119 PolarHBondContact O-SG 3.38Å; L116-C119 PolarHBondContact O-N 2.85Å; C119-K122 PolarHBondContact O-N 3.26Å; C119-A123 PolarHBondContact O-N 3.23Å; C119-A123 VanDerWaalsContact O-N 3.11Å
120	I	93.9	Very high	92.5	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63	-46.1	178.5	-70.9	168.9	0	0	0	111.5	L57 L116 R117 K122 A123 F126 Q147 I148 Q151 R152	L57-I120 HydrophobicContact CD1-CG1 4.41Å; L116-I120 HydrophobicContact CD1-CD1 3.92Å; L116-I120 HydrophobicContact CD1-CG1 4.18Å; L116-I120 HydrophobicContact CG-CD1 3.9Å; L116-I120 WeakPolarHBondContact O-CG1 3.47Å; L116-I120 PolarHBondContact O-N 3.25Å; R117-I120 PolarHBondContact O-N 2.99Å; I120-K122 VanDerWaalsContact C-N 3.29Å; I120-K122 PolarHBondContact O-N 2.94Å; I120-A123 PolarHBondContact O-N 3Å; I120-F126 HydrophobicContact CB-CE1 4.33Å; I120-F126 HydrophobicContact CG1-CE1 4.24Å; I120-F126 HydrophobicContact CG2-CE1 4.16Å; I120-F126 HydrophobicContact CG2-CZ 4.18Å; I120-Q147 HydrophobicContact CD1-CG 3.97Å; I120-I148 HydrophobicContact CD1-CG1 4.15Å; I120-I148 HydrophobicContact CG1-CG1 4.22Å; I120-I148 HydrophobicContact CG2-CG1 4.28Å; I120-Q151 HydrophobicContact CG2-CB 4.05Å; I120-R152 HydrophobicContact CG2-CG 3.84Å
121	S	92.8	Very high	93.1	Very high	83 Å²	83	47.4 Å²	47.4	58%	0.58	25%	0.249	S	C	*	.	H	α-helix	trans	-61.5	-34.6	179	171.8	0	0	0	0	113.1	R117	R117-S121 WeakPolarHBondContact O-CB 3.4Å; R117-S121 PolarHBondContact O-N 3.34Å
122	K	92.2	Very high	93.7	Very high	122 Å²	122	42.8 Å²	42.8	53%	0.53	22%	0.224	S	C	.	.	H	α-helix	trans	-91.5	-8.8	-177.6	-71.2	-179.7	174	177.1	0	114.8	R53 L118 C119 I120	R53-K122 WeakPolarHBondContact CD-O 3.27Å; L118-K122 HydrophobicContact CD1-CD 4.1Å; L118-K122 HydrophobicContact CG-CD 4.24Å; L118-K122 WeakPolarHBondContact O-CB 3.43Å; L118-K122 WeakPolarHBondContact O-CG 3.15Å; L118-K122 PolarHBondContact O-N 2.92Å; L118-K122 VanDerWaalsContact O-N 3.12Å; C119-K122 PolarHBondContact O-N 3.26Å; I120-K122 VanDerWaalsContact C-N 3.29Å; I120-K122 PolarHBondContact O-N 2.94Å
123	A	94.6	Very high	94.1	Very high	3 Å²	3	38.2 Å²	38.2	3%	0.025	21%	0.206	C	C	.	.			trans	-68.1	145.5	-177.1	0	0	0	0	0	112.4	V55 C119 I120 F126 R152	V55-A123 HydrophobicContact CB-CB 4.36Å; V55-A123 HydrophobicContact CG2-CB 3.62Å; C119-A123 PolarHBondContact O-N 3.23Å; C119-A123 VanDerWaalsContact O-N 3.11Å; I120-A123 PolarHBondContact O-N 3Å; A123-F126 HydrophobicContact CB-CD1 4.1Å; A123-F126 HydrophobicContact CB-CE1 3.49Å; A123-F126 VanDerWaalsContact CB-CE1 3.49Å; A123-F126 HydrophobicContact CB-CE2 4.23Å; A123-F126 HydrophobicContact CB-CZ 3.57Å; A123-R152 PolarHBondContact O-NH1 3.15Å
124	N	93.7	Very high	94.4	Very high	50 Å²	50	36.1 Å²	36.1	27%	0.267	19%	0.193	S	C	.	.	S	Bend	trans	-96.8	-24.8	166.5	-60.6	102	0	0	0	111.9	V52 R53 S178 I243	V52-N124 HydrophobicContact CG1-CB 4.11Å; R53-N124 WeakPolarHBondContact CB-OD1 3.43Å; R53-N124 PolarHBondContact N-OD1 3.25Å; R53-N124 WeakPolarHBondContact O-CA 3.35Å; R53-N124 WeakPolarHBondContact O-CB 3.44Å; R53-N124 PolarHBondContact O-N 2.83Å; N124-S178 WeakPolarHBondContact O-CB 3.2Å; N124-S178 PolarHBondContact O-OG 3.08Å; N124-I243 HydrophobicContact CB-CD1 4.26Å; N124-I243 HydrophobicContact CB-CG1 4.2Å
125	A	95.3	Very high	94.6	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.008	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	161.1	173.7	0	0	0	0	0	111.4	R53 I54 V55 P179 L233 I243	R53-A125 PolarHBondContact O-N 3.12Å; R53-A125 VanDerWaalsContact O-N 3.12Å; I54-A125 WeakPolarHBondContact CA-O 3.49Å; I54-A125 HydrophobicContact CG1-CB 4.25Å; V55-A125 PolarHBondContact N-O 3.41Å; V55-A125 VanDerWaalsContact N-O 3.1Å; A125-P179 WeakPolarHBondContact CA-O 3.32Å; A125-P179 HydrophobicContact CB-CB 4.06Å; A125-P179 HydrophobicContact CB-CG 4.39Å; A125-L233 HydrophobicContact CB-CD1 4.43Å; A125-L233 HydrophobicContact CB-CD2 4.25Å; A125-I243 HydrophobicContact CB-CD1 4.42Å
126	F	97.1	Very high	94.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	135.2	-175	-59.1	-85.3	0	0	0	112	L57 I120 A123 I148 R152 Y155 P179 I180 T181	L57-F126 HydrophobicContact CD1-CD1 4.31Å; I120-F126 HydrophobicContact CB-CE1 4.33Å; I120-F126 HydrophobicContact CG1-CE1 4.24Å; I120-F126 HydrophobicContact CG2-CE1 4.16Å; I120-F126 HydrophobicContact CG2-CZ 4.18Å; A123-F126 HydrophobicContact CB-CD1 4.1Å; A123-F126 HydrophobicContact CB-CE1 3.49Å; A123-F126 VanDerWaalsContact CB-CE1 3.49Å; A123-F126 HydrophobicContact CB-CE2 4.23Å; A123-F126 HydrophobicContact CB-CZ 3.57Å; F126-I148 HydrophobicContact CB-CD1 4.18Å; F126-I148 HydrophobicContact CD1-CD1 3.66Å; F126-I148 HydrophobicContact CD1-CG1 4.02Å; F126-I148 HydrophobicContact CD2-CG2 4.28Å; F126-I148 HydrophobicContact CE1-CD1 4.12Å; F126-I148 HydrophobicContact CE1-CG1 3.95Å; F126-I148 HydrophobicContact CE1-CG2 4.42Å; F126-I148 HydrophobicContact CE2-CG2 3.98Å; F126-I148 HydrophobicContact CG-CD1 3.88Å; F126-I148 HydrophobicContact CZ-CG1 4.39Å; F126-I148 HydrophobicContact CZ-CG2 4.04Å; F126-R152 HydrophobicContact CE2-CG 4.37Å; F126-R152 HydrophobicContact CZ-CG 4Å; F126-Y155 HydrophobicContact CE2-CE2 4.3Å; F126-P179 PolarHBondContact N-O 3.14Å; F126-I180 HydrophobicContact CB-CG1 4.19Å; F126-I180 HydrophobicContact CB-CG2 4.43Å; F126-I180 HydrophobicContact CD2-CD1 4.47Å; F126-I180 HydrophobicContact CD2-CG1 4.09Å; F126-I180 WeakPolarHBondContact O-CA 3.42Å; F126-T181 PolarHBondContact O-N 3.47Å
127	V	98.2	Very high	95.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	115.6	167.1	-178.4	0	0	0	0	108.3	I54 V55 F56 L57 V129 T181 V183 I229 L233	I54-V127 HydrophobicContact CG2-CG2 3.7Å; V55-V127 PolarHBondContact O-N 3.46Å; F56-V127 WeakPolarHBondContact CA-O 3.37Å; F56-V127 HydrophobicContact CD1-CB 3.87Å; F56-V127 HydrophobicContact CD1-CG1 3.78Å; F56-V127 HydrophobicContact CD2-CB 4.48Å; F56-V127 HydrophobicContact CE1-CB 3.89Å; F56-V127 HydrophobicContact CE1-CG1 3.67Å; F56-V127 HydrophobicContact CE1-CG2 4.12Å; F56-V127 HydrophobicContact CE2-CB 4.47Å; F56-V127 HydrophobicContact CE2-CG2 4.26Å; F56-V127 HydrophobicContact CG-CB 4.17Å; F56-V127 HydrophobicContact CZ-CB 4.19Å; F56-V127 HydrophobicContact CZ-CG1 4.35Å; F56-V127 HydrophobicContact CZ-CG2 3.96Å; L57-V127 PolarHBondContact N-O 3.45Å; V127-V129 HydrophobicContact CG1-CG2 3.87Å; V127-T181 WeakPolarHBondContact CA-O 3.49Å; V127-V183 HydrophobicContact CG1-CB 4.43Å; V127-V183 HydrophobicContact CG1-CG2 3.65Å; V127-I229 HydrophobicContact CG1-CG2 3.92Å; V127-I229 HydrophobicContact CG2-CG2 3.71Å; V127-L233 HydrophobicContact CG2-CD1 3.84Å
128	I	97.9	Very high	95.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	109.3	179	-55.6	178.4	0	0	0	108.1	A141 L145 I148 I180 T181 V182 V183	I128-A141 HydrophobicContact CG2-CB 3.58Å; I128-L145 HydrophobicContact CD1-CB 3.89Å; I128-L145 HydrophobicContact CD1-CD1 3.87Å; I128-L145 HydrophobicContact CD1-CG 4.39Å; I128-I148 HydrophobicContact CD1-CD1 3.87Å; I128-I148 HydrophobicContact CG1-CD1 4.33Å; I128-I180 HydrophobicContact CD1-CG2 4.09Å; I128-I180 HydrophobicContact CG1-CG2 4.41Å; I128-T181 PolarHBondContact N-O 3.42Å; I128-V182 HydrophobicContact CB-CG2 4.38Å; I128-V182 CarbonylContact O-C 3.42Å; I128-V182 WeakPolarHBondContact O-CA 3.33Å; I128-V183 PolarHBondContact O-N 2.85Å
129	V	98.3	Very high	95.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.4	-175.4	-169.4	0	0	0	0	110.3	F56 L57 G58 V62 K64 I67 V127 V183 N185	F56-V129 HydrophobicContact CD1-CG2 4.13Å; L57-V129 PolarHBondContact O-N 3.02Å; G58-V129 VanDerWaalsContact CA-O 3.29Å; G58-V129 WeakPolarHBondContact CA-O 3.1Å; V62-V129 HydrophobicContact CB-CG1 4.19Å; V62-V129 HydrophobicContact CG2-CB 3.87Å; V62-V129 HydrophobicContact CG2-CG1 3.72Å; K64-V129 HydrophobicContact CG-CB 4.12Å; K64-V129 HydrophobicContact CG-CG2 4.14Å; I67-V129 HydrophobicContact CD1-CG1 3.84Å; I67-V129 HydrophobicContact CD1-CG2 4.08Å; V127-V129 HydrophobicContact CG1-CG2 3.87Å; V129-V183 WeakPolarHBondContact CA-O 3.35Å; V129-V183 HydrophobicContact CG1-CG1 4.48Å; V129-V183 HydrophobicContact CG2-CB 4.34Å; V129-N185 HydrophobicContact CG1-CB 3.85Å
130	F	98	Very high	95.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	169.9	161.8	72.3	-91.5	0	0	0	109.4	S137 L138 A141 V182 V183 C184 N185 I196 I201 F215	F130-S137 WeakPolarHBondContact CB-OG 3.37Å; F130-L138 HydrophobicContact CD1-CD1 3.69Å; F130-L138 HydrophobicContact CD2-CB 4.3Å; F130-L138 HydrophobicContact CD2-CD1 4.09Å; F130-L138 HydrophobicContact CE1-CD1 3.63Å; F130-L138 HydrophobicContact CE2-CD1 4.06Å; F130-L138 HydrophobicContact CG-CB 4.41Å; F130-L138 HydrophobicContact CG-CD1 3.91Å; F130-L138 HydrophobicContact CZ-CD1 3.82Å; F130-A141 HydrophobicContact CB-CB 4.45Å; F130-V182 HydrophobicContact CD1-CG1 3.88Å; F130-V182 HydrophobicContact CE1-CG1 3.68Å; F130-V183 PolarHBondContact N-O 3.21Å; F130-C184 HydrophobicContact CD2-CB 4.46Å; F130-C184 HydrophobicContact CE1-CB 4.06Å; F130-C184 HydrophobicContact CE2-CB 3.73Å; F130-C184 VanDerWaalsContact CE2-SG 3.52Å; F130-C184 HydrophobicContact CZ-CB 3.51Å; F130-N185 PolarHBondContact O-N 3.39Å; F130-I196 HydrophobicContact CD2-CD1 3.81Å; F130-I196 HydrophobicContact CE2-CD1 3.75Å; F130-I201 HydrophobicContact CE2-CD1 4.09Å; F130-I201 HydrophobicContact CE2-CG1 4.31Å; F130-I201 HydrophobicContact CZ-CD1 3.93Å; F130-I201 HydrophobicContact CZ-CG1 3.99Å; F130-I201 HydrophobicContact CZ-CG2 4.07Å; F130-F215 AromaticContact CE1-CE2 3.79Å; F130-F215 HydrophobicContact CE1-CE2 3.79Å; F130-F215 AromaticContact CZ-CE2 3.83Å; F130-F215 HydrophobicContact CZ-CE2 3.83Å; F130-F215 HydrophobicContact CZ-CZ 4.34Å
131	A	96.7	Very high	95.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	140.1	-179.7	0	0	0	0	0	111.7	V62 D133 S134 S137 K186	V62-A131 HydrophobicContact CB-CB 4.16Å; V62-A131 HydrophobicContact CG1-CB 4.22Å; A131-D133 WeakPolarHBondContact CB-OD1 3.1Å; A131-D133 PolarHBondContact O-N 2.91Å; A131-D133 VanDerWaalsContact O-N 3.11Å; A131-S134 PolarHBondContact O-N 3.07Å; A131-S134 VanDerWaalsContact O-N 3.08Å; A131-S137 PolarHBondContact N-OG 3.48Å; A131-K186 HydrophobicContact CB-CD 4.08Å
132	H	93.9	Very high	95.9	Very high	21 Å²	21	30.1 Å²	30.1	10%	0.097	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-29	179.8	-167.4	60.5	0	0	0	113.5	N185 S194 Q195	H132-N185 PolarHBondContact N-O 3.33Å; H132-S194 PolarHBondContact CE1-OG 3.06Å; H132-S194 VanDerWaalsContact CE1-OG 3.23Å; H132-S194 VanDerWaalsContact NE2-CB 3.34Å; H132-S194 WeakPolarHBondContact NE2-CB 3.47Å; H132-S194 PolarHBondContact NE2-OG 3.36Å; H132-Q195 PolarHBondContact O-N 2.67Å; H132-Q195 VanDerWaalsContact O-N 3.13Å
133	D	95	Very high	96.1	Very high	47 Å²	47	30.3 Å²	30.3	25%	0.251	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	12.1	-178.5	64.8	-15	0	0	0	114.7	A131 K186 L189 Y193 Q195	A131-D133 WeakPolarHBondContact CB-OD1 3.1Å; A131-D133 PolarHBondContact O-N 2.91Å; A131-D133 VanDerWaalsContact O-N 3.11Å; D133-K186 WeakPolarHBondContact OD1-CD 2.82Å; D133-K186 IonicContact OD1-NZ 3.26Å; D133-K186 PolarHBondContact OD1-NZ 3.33Å; D133-K186 IonicContact OD2-NZ 3.6Å; D133-K186 PolarHBondContact OD2-NZ 3.24Å; D133-L189 HydrophobicContact CB-CD1 3.73Å; D133-Y193 WeakPolarHBondContact CA-O 3.4Å; D133-Q195 PolarHBondContact O-NE2 3.42Å; D133-Q195 VanDerWaalsContact O-NE2 3.1Å
134	S	95.1	Very high	96.1	Very high	32 Å²	32	30.4 Å²	30.4	22%	0.224	16%	0.164	C	C	.	.			trans	-148.6	102.8	-176.7	179.6	0	0	0	0	113.5	A131 D136 S137	A131-S134 PolarHBondContact O-N 3.07Å; A131-S134 VanDerWaalsContact O-N 3.08Å; S134-D136 VanDerWaalsContact C-N 3.32Å; S134-D136 PolarHBondContact O-N 3.32Å; S134-S137 PolarHBondContact O-N 3.32Å; S134-S137 VanDerWaalsContact O-N 3.17Å; S134-S137 PolarHBondContact O-OG 2.82Å; S134-S137 PolarHBondContact OG-N 3.06Å
135	L	95.2	Very high	96.2	Very high	82 Å²	82	28 Å²	28	43%	0.429	15%	0.151	S	C	.	.	H	α-helix	trans	-60.8	-39.8	174	-179.5	62.5	0	0	0	112.1	S137 L138 V139 Q195 I196	L135-S137 PolarHBondContact O-N 3.32Å; L135-S137 VanDerWaalsContact O-N 3.16Å; L135-L138 WeakPolarHBondContact O-CB 3.49Å; L135-L138 PolarHBondContact O-N 3.48Å; L135-V139 PolarHBondContact O-N 2.85Å; L135-V139 VanDerWaalsContact O-N 3.15Å; L135-Q195 HydrophobicContact CB-CB 4.24Å; L135-I196 HydrophobicContact CB-CG1 4.41Å; L135-I196 HydrophobicContact CD1-CG1 4.14Å
136	D	95.9	Very high	96.1	Very high	125 Å²	125	31.4 Å²	31.4	67%	0.668	18%	0.175	S	C	*	.	H	α-helix	trans	-55	-34.8	176.2	-60.9	-40.2	0	0	0	112.3	S134 L138 V139 Q140	S134-D136 VanDerWaalsContact C-N 3.32Å; S134-D136 PolarHBondContact O-N 3.32Å; D136-L138 VanDerWaalsContact C-N 3.34Å; D136-L138 PolarHBondContact O-N 3.26Å; D136-V139 PolarHBondContact O-N 3Å; D136-Q140 PolarHBondContact O-N 2.51Å
137	S	96.5	Very high	95.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-70	-29.1	178.8	75.4	0	0	0	0	113.5	S59 F130 A131 S134 L135 A141	S59-S137 WeakPolarHBondContact OG-CA 3.29Å; S59-S137 WeakPolarHBondContact OG-CB 3.42Å; F130-S137 WeakPolarHBondContact CB-OG 3.37Å; A131-S137 PolarHBondContact N-OG 3.48Å; S134-S137 PolarHBondContact O-N 3.32Å; S134-S137 VanDerWaalsContact O-N 3.17Å; S134-S137 PolarHBondContact O-OG 2.82Å; S134-S137 PolarHBondContact OG-N 3.06Å; L135-S137 PolarHBondContact O-N 3.32Å; L135-S137 VanDerWaalsContact O-N 3.16Å; S137-A141 WeakPolarHBondContact O-CB 3.35Å; S137-A141 PolarHBondContact O-N 3.28Å
138	L	96.7	Very high	95.7	Very high	7 Å²	7	33.6 Å²	33.6	4%	0.037	19%	0.185	C	C	.	.	H	α-helix	trans	-73.1	-38.5	171.4	-174.9	70.1	0	0	0	111.5	F130 L135 D136 A141 G142 I196 W204	F130-L138 HydrophobicContact CD1-CD1 3.69Å; F130-L138 HydrophobicContact CD2-CB 4.3Å; F130-L138 HydrophobicContact CD2-CD1 4.09Å; F130-L138 HydrophobicContact CE1-CD1 3.63Å; F130-L138 HydrophobicContact CE2-CD1 4.06Å; F130-L138 HydrophobicContact CG-CB 4.41Å; F130-L138 HydrophobicContact CG-CD1 3.91Å; F130-L138 HydrophobicContact CZ-CD1 3.82Å; L135-L138 WeakPolarHBondContact O-CB 3.49Å; L135-L138 PolarHBondContact O-N 3.48Å; D136-L138 VanDerWaalsContact C-N 3.34Å; D136-L138 PolarHBondContact O-N 3.26Å; L138-A141 WeakPolarHBondContact O-CB 3.3Å; L138-A141 PolarHBondContact O-N 3.04Å; L138-G142 PolarHBondContact O-N 2.96Å; L138-G142 VanDerWaalsContact O-N 3.14Å; L138-I196 HydrophobicContact CB-CD1 3.95Å; L138-I196 HydrophobicContact CD2-CD1 4.24Å; L138-I196 HydrophobicContact CD2-CG2 3.9Å; L138-W204 HydrophobicContact CD1-CD2 3.65Å; L138-W204 HydrophobicContact CD1-CE3 3.98Å; L138-W204 HydrophobicContact CD1-CG 4.03Å; L138-W204 HydrophobicContact CD1-CH2 4.41Å; L138-W204 HydrophobicContact CD1-CZ2 4.07Å; L138-W204 HydrophobicContact CD1-CZ3 4.35Å; L138-W204 HydrophobicContact CD2-CB 4.3Å; L138-W204 HydrophobicContact CD2-CG 4.01Å; L138-W204 HydrophobicContact CG-CD2 4.13Å; L138-W204 HydrophobicContact CG-CG 4.06Å; L138-W204 PolarHBondContact O-NE1 3.43Å
139	V	96.2	Very high	95.3	Very high	80 Å²	80	36.6 Å²	36.6	49%	0.485	20%	0.199	S	C	.	.	H	α-helix	trans	-61.9	-45.9	174.2	178.7	0	0	0	0	110.3	L135 D136 A141 G142 Q143	L135-V139 PolarHBondContact O-N 2.85Å; L135-V139 VanDerWaalsContact O-N 3.15Å; D136-V139 PolarHBondContact O-N 3Å; V139-A141 PolarHBondContact O-N 2.91Å; V139-G142 PolarHBondContact O-N 2.92Å; V139-G142 VanDerWaalsContact O-N 3.15Å; V139-Q143 PolarHBondContact O-N 2.94Å
140	Q	95.7	Very high	94.9	Very high	50 Å²	50	40.9 Å²	40.9	23%	0.234	23%	0.228	C	C	.	.	H	α-helix	trans	-67.1	-35.2	176.7	-163.3	178.8	24.3	0	0	112.6	S59 D136 G142 Q143 L144	S59-Q140 PolarHBondContact OG-OE1 2.93Å; D136-Q140 PolarHBondContact O-N 2.51Å; Q140-G142 PolarHBondContact O-N 3.4Å; Q140-Q143 PolarHBondContact O-N 2.77Å; Q140-L144 HydrophobicContact CG-CD1 4.33Å; Q140-L144 WeakPolarHBondContact O-CG 3.25Å; Q140-L144 PolarHBondContact O-N 3.1Å
141	A	96.8	Very high	94.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-56.7	-36.3	171.4	0	0	0	0	0	112.1	I128 F130 S137 L138 V139 L144 L145 W204	I128-A141 HydrophobicContact CG2-CB 3.58Å; F130-A141 HydrophobicContact CB-CB 4.45Å; S137-A141 WeakPolarHBondContact O-CB 3.35Å; S137-A141 PolarHBondContact O-N 3.28Å; L138-A141 WeakPolarHBondContact O-CB 3.3Å; L138-A141 PolarHBondContact O-N 3.04Å; V139-A141 PolarHBondContact O-N 2.91Å; A141-L144 PolarHBondContact O-N 2.91Å; A141-L145 WeakPolarHBondContact O-CB 3.35Å; A141-L145 PolarHBondContact O-N 3.23Å; A141-W204 HydrophobicContact CB-CH2 4.26Å; A141-W204 HydrophobicContact CB-CZ2 4.02Å
142	G	96	Very high	94.2	Very high	13 Å²	13	46 Å²	46	13%	0.134	25%	0.25	C	S	.	.	H	α-helix	trans	-69.6	-40.8	177.6	0	0	0	0	0	112.5	L138 V139 Q140 L144 L145 S146	L138-G142 PolarHBondContact O-N 2.96Å; L138-G142 VanDerWaalsContact O-N 3.14Å; V139-G142 PolarHBondContact O-N 2.92Å; V139-G142 VanDerWaalsContact O-N 3.15Å; Q140-G142 PolarHBondContact O-N 3.4Å; G142-L144 VanDerWaalsContact C-N 3.35Å; G142-L144 PolarHBondContact O-N 2.63Å; G142-L145 PolarHBondContact O-N 3Å; G142-S146 WeakPolarHBondContact O-CB 3.37Å; G142-S146 PolarHBondContact O-N 2.71Å
143	Q	94.9	Very high	93.6	Very high	125 Å²	125	50.6 Å²	50.6	58%	0.584	28%	0.28	S	S	*	.	H	α-helix	trans	-61.1	-44	173.3	-64.4	173.8	-10.6	0	0	111.4	V139 Q140 S146 Q147	V139-Q143 PolarHBondContact O-N 2.94Å; Q140-Q143 PolarHBondContact O-N 2.77Å; Q143-S146 PolarHBondContact O-N 2.71Å; Q143-Q147 WeakPolarHBondContact O-CB 3.49Å; Q143-Q147 PolarHBondContact O-N 3.29Å
144	L	95.4	Very high	92.9	Very high	5 Å²	5	49.8 Å²	49.8	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-64.7	-39.8	177.1	-71.3	162.8	0	0	0	112.5	L57 Y110 L116 Q140 A141 G142 Q147 I148	L57-L144 HydrophobicContact CB-CD1 4.23Å; Y110-L144 HydrophobicContact CD2-CD2 4.24Å; Y110-L144 HydrophobicContact CE1-CD2 4.48Å; Y110-L144 HydrophobicContact CE2-CD1 3.93Å; Y110-L144 HydrophobicContact CE2-CD2 3.7Å; Y110-L144 HydrophobicContact CE2-CG 4.31Å; L116-L144 HydrophobicContact CD2-CD2 3.93Å; Q140-L144 HydrophobicContact CG-CD1 4.33Å; Q140-L144 WeakPolarHBondContact O-CG 3.25Å; Q140-L144 PolarHBondContact O-N 3.1Å; A141-L144 PolarHBondContact O-N 2.91Å; G142-L144 VanDerWaalsContact C-N 3.35Å; G142-L144 PolarHBondContact O-N 2.63Å; L144-Q147 WeakPolarHBondContact O-CB 3.36Å; L144-Q147 PolarHBondContact O-N 2.76Å; L144-I148 WeakPolarHBondContact O-CG1 3.28Å; L144-I148 PolarHBondContact O-N 2.89Å
145	L	95.2	Very high	92	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.1	-43.2	175.9	-179.5	59.2	0	0	0	112.1	I128 A141 G142 Q147 I148 K149 I180 W204 N208 L210	I128-L145 HydrophobicContact CD1-CB 3.89Å; I128-L145 HydrophobicContact CD1-CD1 3.87Å; I128-L145 HydrophobicContact CD1-CG 4.39Å; A141-L145 WeakPolarHBondContact O-CB 3.35Å; A141-L145 PolarHBondContact O-N 3.23Å; G142-L145 PolarHBondContact O-N 3Å; L145-Q147 VanDerWaalsContact C-N 3.29Å; L145-Q147 PolarHBondContact O-N 2.73Å; L145-I148 PolarHBondContact O-N 3.02Å; L145-K149 WeakPolarHBondContact O-CG 3.29Å; L145-K149 PolarHBondContact O-N 2.95Å; L145-I180 HydrophobicContact CD1-CD1 3.88Å; L145-W204 HydrophobicContact CD2-CH2 4.37Å; L145-N208 HydrophobicContact CD2-CB 3.67Å; L145-L210 HydrophobicContact CD2-CD1 3.63Å; L145-L210 HydrophobicContact CD2-CG 4.14Å
146	S	93.3	Very high	90.1	Very high	73 Å²	73	47 Å²	47	51%	0.51	26%	0.263	S	S	.	.	H	α-helix	trans	-61.1	-39.1	172.3	-175.5	0	0	0	0	111.7	G142 Q143 K149 S150	G142-S146 WeakPolarHBondContact O-CB 3.37Å; G142-S146 PolarHBondContact O-N 2.71Å; Q143-S146 PolarHBondContact O-N 2.71Å; S146-K149 PolarHBondContact O-N 3.45Å; S146-S150 WeakPolarHBondContact O-CB 3.47Å; S146-S150 PolarHBondContact O-N 2.91Å; S146-S150 PolarHBondContact O-OG 3.3Å
147	Q	93	Very high	87.9	Confident	45 Å²	45	44 Å²	44	21%	0.21	25%	0.252	C	S	.	.	H	α-helix	trans	-64.6	-40.2	174.4	-171.1	179.4	-30.9	0	0	112.7	L116 I120 Q143 L144 L145 S150 Q151	L116-Q147 VanDerWaalsContact CD2-OE1 3.3Å; I120-Q147 HydrophobicContact CD1-CG 3.97Å; Q143-Q147 WeakPolarHBondContact O-CB 3.49Å; Q143-Q147 PolarHBondContact O-N 3.29Å; L144-Q147 WeakPolarHBondContact O-CB 3.36Å; L144-Q147 PolarHBondContact O-N 2.76Å; L145-Q147 VanDerWaalsContact C-N 3.29Å; L145-Q147 PolarHBondContact O-N 2.73Å; Q147-S150 WeakPolarHBondContact CA-OG 3.38Å; Q147-S150 PolarHBondContact O-OG 3Å; Q147-S150 VanDerWaalsContact O-OG 3.12Å; Q147-Q151 VanDerWaalsContact NE2-NE2 3.2Å; Q147-Q151 WeakPolarHBondContact O-CB 3.14Å; Q147-Q151 VanDerWaalsContact O-CG 3.25Å; Q147-Q151 WeakPolarHBondContact O-CG 3.33Å; Q147-Q151 PolarHBondContact O-N 2.94Å
148	I	93.7	Very high	85.8	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-56.4	172.4	-71.5	160.3	0	0	0	109.3	L57 I120 F126 I128 L144 L145 S150 Q151 R152 Y155 I180	L57-I148 HydrophobicContact CD1-CD1 3.83Å; L57-I148 HydrophobicContact CD1-CG1 4.29Å; I120-I148 HydrophobicContact CD1-CG1 4.15Å; I120-I148 HydrophobicContact CG1-CG1 4.22Å; I120-I148 HydrophobicContact CG2-CG1 4.28Å; F126-I148 HydrophobicContact CB-CD1 4.18Å; F126-I148 HydrophobicContact CD1-CD1 3.66Å; F126-I148 HydrophobicContact CD1-CG1 4.02Å; F126-I148 HydrophobicContact CD2-CG2 4.28Å; F126-I148 HydrophobicContact CE1-CD1 4.12Å; F126-I148 HydrophobicContact CE1-CG1 3.95Å; F126-I148 HydrophobicContact CE1-CG2 4.42Å; F126-I148 HydrophobicContact CE2-CG2 3.98Å; F126-I148 HydrophobicContact CG-CD1 3.88Å; F126-I148 HydrophobicContact CZ-CG1 4.39Å; F126-I148 HydrophobicContact CZ-CG2 4.04Å; I128-I148 HydrophobicContact CD1-CD1 3.87Å; I128-I148 HydrophobicContact CG1-CD1 4.33Å; L144-I148 WeakPolarHBondContact O-CG1 3.28Å; L144-I148 PolarHBondContact O-N 2.89Å; L145-I148 PolarHBondContact O-N 3.02Å; I148-S150 PolarHBondContact O-N 3.31Å; I148-S150 VanDerWaalsContact O-N 3.15Å; I148-Q151 PolarHBondContact O-N 3.45Å; I148-R152 HydrophobicContact CG2-CB 4.41Å; I148-R152 HydrophobicContact CG2-CG 4.2Å; I148-R152 VanDerWaalsContact O-CB 3.31Å; I148-R152 WeakPolarHBondContact O-CB 3.49Å; I148-R152 PolarHBondContact O-N 3.47Å; I148-Y155 HydrophobicContact CG2-CD2 3.99Å; I148-Y155 HydrophobicContact CG2-CE2 3.59Å; I148-I180 HydrophobicContact CG2-CD1 4.24Å
149	K	90.7	Very high	83.5	Confident	64 Å²	64	52.6 Å²	52.6	28%	0.278	30%	0.302	S	S	.	.	H	α-helix	trans	-56.8	-34.3	-175.4	-71.5	-179.9	178.6	-173.2	0	113.8	L145 S146 Y155 N208	L145-K149 WeakPolarHBondContact O-CG 3.29Å; L145-K149 PolarHBondContact O-N 2.95Å; S146-K149 PolarHBondContact O-N 3.45Å; K149-Y155 HydrophobicContact CG-CG 4.45Å; K149-N208 PolarHBondContact NZ-O 2.79Å
150	S	89.8	Confident	81.2	Confident	90 Å²	90	52 Å²	52	63%	0.629	30%	0.301	S	S	*	.	H	α-helix	trans	-80.4	-16.8	178.2	52.1	0	0	0	0	114.7	S146 Q147 I148	S146-S150 WeakPolarHBondContact O-CB 3.47Å; S146-S150 PolarHBondContact O-N 2.91Å; S146-S150 PolarHBondContact O-OG 3.3Å; Q147-S150 WeakPolarHBondContact CA-OG 3.38Å; Q147-S150 PolarHBondContact O-OG 3Å; Q147-S150 VanDerWaalsContact O-OG 3.12Å; I148-S150 PolarHBondContact O-N 3.31Å; I148-S150 VanDerWaalsContact O-N 3.15Å
151	Q	89.6	Confident	78.9	Confident	69 Å²	69	57.9 Å²	57.9	32%	0.322	33%	0.334	S	S	.	.	H	α-helix	trans	-108.3	-17.3	-175.9	-68.4	174.1	9.7	0	0	113.7	I120 Q147 I148	I120-Q151 HydrophobicContact CG2-CB 4.05Å; Q147-Q151 VanDerWaalsContact NE2-NE2 3.2Å; Q147-Q151 WeakPolarHBondContact O-CB 3.14Å; Q147-Q151 VanDerWaalsContact O-CG 3.25Å; Q147-Q151 WeakPolarHBondContact O-CG 3.33Å; Q147-Q151 PolarHBondContact O-N 2.94Å; I148-Q151 PolarHBondContact O-N 3.45Å
152	R	90.4	Very high	76.8	Confident	37 Å²	37	60.2 Å²	60.2	14%	0.14	35%	0.347	C	S	.	.			trans	-110.9	112.3	-173.5	-83.5	-74.3	-54.8	-142.2	0.3	109.9	I120 A123 F126 I148 D154 Y155 A156 S178	I120-R152 HydrophobicContact CG2-CG 3.84Å; A123-R152 PolarHBondContact O-NH1 3.15Å; F126-R152 HydrophobicContact CE2-CG 4.37Å; F126-R152 HydrophobicContact CZ-CG 4Å; I148-R152 HydrophobicContact CG2-CB 4.41Å; I148-R152 HydrophobicContact CG2-CG 4.2Å; I148-R152 VanDerWaalsContact O-CB 3.31Å; I148-R152 WeakPolarHBondContact O-CB 3.49Å; I148-R152 PolarHBondContact O-N 3.47Å; R152-D154 WeakPolarHBondContact CB-OD1 3.33Å; R152-D154 IonicContact CZ-OD1 2.7Å; R152-D154 VanDerWaalsContact CZ-OD1 3.26Å; R152-D154 IonicContact CZ-OD2 3.79Å; R152-D154 IonicContact NE-OD1 3.05Å; R152-D154 PolarHBondContact NE-OD1 2.9Å; R152-D154 IonicContact NE-OD2 3.67Å; R152-D154 IonicContact NH2-OD1 3.78Å; R152-D154 PolarHBondContact NH2-OD1 2.85Å; R152-D154 IonicContact NH2-OD2 2.79Å; R152-D154 PolarHBondContact NH2-OD2 3.31Å; R152-D154 PolarHBondContact O-N 2.89Å; R152-Y155 HydrophobicContact CB-CD2 3.47Å; R152-Y155 VanDerWaalsContact CB-CD2 3.47Å; R152-Y155 HydrophobicContact CB-CE2 3.72Å; R152-Y155 HydrophobicContact CG-CD2 4.41Å; R152-Y155 HydrophobicContact CG-CE2 4.19Å; R152-Y155 PolarHBondContact O-N 3.37Å; R152-A156 PolarHBondContact O-N 3.02Å; R152-S178 PolarHBondContact NH2-OG 2.99Å
153	T	81.5	Confident	74.5	Confident	118 Å²	118	62.9 Å²	62.9	72%	0.724	36%	0.363	S	S	*	.	H	α-helix	trans	-63	-27.4	-171.8	48.1	0	0	0	0	113.9	Y155 A156	T153-Y155 PolarHBondContact O-N 2.98Å; T153-A156 WeakPolarHBondContact O-CB 3.39Å; T153-A156 PolarHBondContact O-N 3.47Å
154	D	79.9	Confident	72.5	Confident	30 Å²	30	65.7 Å²	65.7	16%	0.16	38%	0.376	C	S	.	.	H	α-helix	trans	-68.2	-16.5	175	60.1	-57.8	0	0	0	114.4	R152 A177 S178	R152-D154 WeakPolarHBondContact CB-OD1 3.33Å; R152-D154 IonicContact CZ-OD1 2.7Å; R152-D154 VanDerWaalsContact CZ-OD1 3.26Å; R152-D154 IonicContact CZ-OD2 3.79Å; R152-D154 IonicContact NE-OD1 3.05Å; R152-D154 PolarHBondContact NE-OD1 2.9Å; R152-D154 IonicContact NE-OD2 3.67Å; R152-D154 IonicContact NH2-OD1 3.78Å; R152-D154 PolarHBondContact NH2-OD1 2.85Å; R152-D154 IonicContact NH2-OD2 2.79Å; R152-D154 PolarHBondContact NH2-OD2 3.31Å; R152-D154 PolarHBondContact O-N 2.89Å; D154-A177 WeakPolarHBondContact OD2-CA 3.37Å; D154-S178 PolarHBondContact OD2-N 2.86Å
155	Y	75.5	Confident	70.6	Confident	19 Å²	19	74 Å²	74	8%	0.075	41%	0.414	C	S	.	.	H	α-helix	trans	-103.5	-12.3	163.8	-44.7	-84.2	0	0	0	112.5	F126 I148 K149 R152 T153 S157 L158 A177 S178 I180	F126-Y155 HydrophobicContact CE2-CE2 4.3Å; I148-Y155 HydrophobicContact CG2-CD2 3.99Å; I148-Y155 HydrophobicContact CG2-CE2 3.59Å; K149-Y155 HydrophobicContact CG-CG 4.45Å; R152-Y155 HydrophobicContact CB-CD2 3.47Å; R152-Y155 VanDerWaalsContact CB-CD2 3.47Å; R152-Y155 HydrophobicContact CB-CE2 3.72Å; R152-Y155 HydrophobicContact CG-CD2 4.41Å; R152-Y155 HydrophobicContact CG-CE2 4.19Å; R152-Y155 PolarHBondContact O-N 3.37Å; T153-Y155 PolarHBondContact O-N 2.98Å; Y155-S157 VanDerWaalsContact C-N 3.35Å; Y155-S157 PolarHBondContact O-N 3.13Å; Y155-L158 VanDerWaalsContact O-CB 3.31Å; Y155-L158 WeakPolarHBondContact O-CB 3.29Å; Y155-L158 WeakPolarHBondContact O-CD1 3.3Å; Y155-L158 VanDerWaalsContact O-CG 3.27Å; Y155-L158 WeakPolarHBondContact O-CG 3.4Å; Y155-L158 PolarHBondContact O-N 3.11Å; Y155-A177 HydrophobicContact CD1-CB 4.05Å; Y155-A177 HydrophobicContact CE1-CB 3.75Å; Y155-S178 VanDerWaalsContact OH-CB 3.3Å; Y155-S178 WeakPolarHBondContact OH-CB 3.47Å; Y155-S178 PolarHBondContact OH-O 3.19Å; Y155-I180 HydrophobicContact CE1-CD1 3.73Å; Y155-I180 HydrophobicContact CE1-CG1 4.16Å; Y155-I180 HydrophobicContact CE2-CD1 4.39Å; Y155-I180 WeakPolarHBondContact OH-CD1 3.44Å; Y155-I180 WeakPolarHBondContact OH-CG1 3.44Å
156	A	55.7	Low	68.5	Low	37 Å²	37	76.9 Å²	76.9	31%	0.306	43%	0.428	S	S	.	.	H	α-helix	trans	-72.1	-26.9	-174.4	0	0	0	0	0	113.2	R152 T153 L158 T159	R152-A156 PolarHBondContact O-N 3.02Å; T153-A156 WeakPolarHBondContact O-CB 3.39Å; T153-A156 PolarHBondContact O-N 3.47Å; A156-L158 PolarHBondContact O-N 3.21Å; A156-T159 PolarHBondContact O-N 3.28Å; A156-T159 VanDerWaalsContact O-N 3.15Å; A156-T159 PolarHBondContact O-OG1 2.99Å
157	S	50.5	Low	66.5	Low	63 Å²	63	76.9 Å²	76.9	44%	0.441	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-11.5	173.5	-52.1	0	0	0	0	114	Y155 T159	Y155-S157 VanDerWaalsContact C-N 3.35Å; Y155-S157 PolarHBondContact O-N 3.13Å; S157-T159 VanDerWaalsContact C-N 3.31Å; S157-T159 PolarHBondContact O-N 3.29Å
158	L	52.4	Low	64.6	Low	71 Å²	71	82.6 Å²	82.6	37%	0.372	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	3	177.2	-57.8	172	0	0	0	114.5	Y155 A156	Y155-L158 VanDerWaalsContact O-CB 3.31Å; Y155-L158 WeakPolarHBondContact O-CB 3.29Å; Y155-L158 WeakPolarHBondContact O-CD1 3.3Å; Y155-L158 VanDerWaalsContact O-CG 3.27Å; Y155-L158 WeakPolarHBondContact O-CG 3.4Å; Y155-L158 PolarHBondContact O-N 3.11Å; A156-L158 PolarHBondContact O-N 3.21Å
159	T	47.1	Very low	62.6	Low	115 Å²	115	88.7 Å²	88.7	71%	0.706	48%	0.483	S	S	*	.	S	Bend	trans	-129.5	-0.2	-165.2	60.2	0	0	0	0	117.5	A156 S157	A156-T159 PolarHBondContact O-N 3.28Å; A156-T159 VanDerWaalsContact O-N 3.15Å; A156-T159 PolarHBondContact O-OG1 2.99Å; S157-T159 VanDerWaalsContact C-N 3.31Å; S157-T159 PolarHBondContact O-N 3.29Å
160	S	47.5	Very low	60.5	Low	68 Å²	68	90.5 Å²	90.5	48%	0.476	49%	0.488	S	S	.	.	S	Bend	trans	-78.6	155	166.4	35.9	0	0	0	0	111.2	L162	S160-L162 WeakPolarHBondContact O-CG 3.39Å; S160-L162 PolarHBondContact O-N 2.94Å; S160-L162 WeakPolarHBondContact OG-CD2 3.45Å; S160-L162 WeakPolarHBondContact OG-CG 3.38Å
161	N	47.8	Very low	58.7	Low	174 Å²	174	89 Å²	89	93%	0.93	48%	0.482	S	S	*	.			trans	-75.1	72.3	178.8	-64.7	-47.6	0	0	0	110.8
162	L	53.4	Low	56.9	Low	49 Å²	49	91.3 Å²	91.3	26%	0.257	50%	0.495	S	S	.	.			trans	-81.1	124.3	-171.7	-58.9	-178.9	0	0	0	110.9	S160 Q166 W170	S160-L162 WeakPolarHBondContact O-CG 3.39Å; S160-L162 PolarHBondContact O-N 2.94Å; S160-L162 WeakPolarHBondContact OG-CD2 3.45Å; S160-L162 WeakPolarHBondContact OG-CG 3.38Å; L162-Q166 HydrophobicContact CB-CB 4.43Å; L162-Q166 VanDerWaalsContact CD1-OE1 3.28Å; L162-W170 HydrophobicContact CB-CZ2 3.56Å; L162-W170 HydrophobicContact CD1-CZ2 4.24Å; L162-W170 HydrophobicContact CG-CZ2 4.41Å
163	S	47.2	Very low	55	Low	68 Å²	68	91 Å²	91	48%	0.476	50%	0.499	S	S	.	.			trans	-65.9	162.4	178.1	47.6	0	0	0	0	112.1	E165 Q166	S163-E165 PolarHBondContact O-N 3.28Å; S163-Q166 PolarHBondContact O-N 3.4Å
164	H	53.1	Low	53.6	Low	185 Å²	185	89.9 Å²	89.9	86%	0.856	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	2.5	-170.6	-153.7	-69.1	0	0	0	116
165	E	55.5	Low	52.3	Low	179 Å²	179	91.4 Å²	91.4	84%	0.836	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-15.8	179.7	-64.9	179.1	134.8	0	0	113.3	S163	S163-E165 PolarHBondContact O-N 3.28Å
166	Q	51.2	Low	51.7	Low	60 Å²	60	96.1 Å²	96.1	28%	0.28	52%	0.519	S	S	.	.			trans	-91.1	-1.2	-169	-65.3	-170.3	13.1	0	0	115.2	L162 S163 E168 E169 W170	L162-Q166 HydrophobicContact CB-CB 4.43Å; L162-Q166 VanDerWaalsContact CD1-OE1 3.28Å; S163-Q166 PolarHBondContact O-N 3.4Å; Q166-E168 PolarHBondContact O-N 2.97Å; Q166-E169 WeakPolarHBondContact O-CA 3.45Å; Q166-E169 WeakPolarHBondContact O-CB 3.34Å; Q166-E169 PolarHBondContact O-N 3.11Å; Q166-W170 VanDerWaalsContact C-CD1 3.47Å; Q166-W170 PolarHBondContact O-N 3.13Å
167	S	50.2	Low	52.9	Low	74 Å²	74	95.2 Å²	95.2	52%	0.517	51%	0.512	S	S	.	.	H	α-helix	trans	-49.7	-29.3	-170.9	-52.4	0	0	0	0	116	A171	S167-A171 PolarHBondContact O-N 3.3Å
168	E	54.8	Low	54.7	Low	164 Å²	164	92.6 Å²	92.6	77%	0.766	49%	0.493	S	S	*	.	H	α-helix	trans	-76.4	-36.8	175.7	-60.4	-160	160	0	0	113	Q166 W170 A171 L172	Q166-E168 PolarHBondContact O-N 2.97Å; E168-W170 PolarHBondContact O-N 3.12Å; E168-A171 PolarHBondContact O-N 2.94Å; E168-L172 WeakPolarHBondContact O-CG 3.34Å; E168-L172 PolarHBondContact O-N 3.33Å
169	E	51.5	Low	56.6	Low	129 Å²	129	89.3 Å²	89.3	60%	0.603	48%	0.476	S	S	*	.	H	α-helix	trans	-65.8	-29.7	173.5	-168.3	170.3	-170.8	0	0	111.4	Q166 L172 S173	Q166-E169 WeakPolarHBondContact O-CA 3.45Å; Q166-E169 WeakPolarHBondContact O-CB 3.34Å; Q166-E169 PolarHBondContact O-N 3.11Å; E169-L172 PolarHBondContact O-N 2.93Å; E169-S173 WeakPolarHBondContact O-CB 3.44Å; E169-S173 PolarHBondContact O-N 2.96Å; E169-S173 PolarHBondContact O-OG 2.84Å; E169-S173 VanDerWaalsContact O-OG 3.08Å
170	W	47	Very low	58.9	Low	102 Å²	102	84 Å²	84	39%	0.386	44%	0.443	S	S	.	.	H	α-helix	trans	-67.7	-41.4	173.2	-61.8	37.8	0	0	0	111.6	L162 Q166 E168 L172 S173 M174	L162-W170 HydrophobicContact CB-CZ2 3.56Å; L162-W170 HydrophobicContact CD1-CZ2 4.24Å; L162-W170 HydrophobicContact CG-CZ2 4.41Å; Q166-W170 VanDerWaalsContact C-CD1 3.47Å; Q166-W170 PolarHBondContact O-N 3.13Å; E168-W170 PolarHBondContact O-N 3.12Å; W170-L172 VanDerWaalsContact C-N 3.33Å; W170-S173 WeakPolarHBondContact CA-OG 3.46Å; W170-S173 PolarHBondContact O-N 2.98Å; W170-S173 PolarHBondContact O-OG 3.41Å; W170-M174 PolarHBondContact O-N 3.24Å
171	A	50.9	Low	61.3	Low	59 Å²	59	80.7 Å²	80.7	49%	0.488	42%	0.42	S	S	.	.	H	α-helix	trans	-65.5	-37.5	175.2	0	0	0	0	0	111.9	S167 E168	S167-A171 PolarHBondContact O-N 3.3Å; E168-A171 PolarHBondContact O-N 2.94Å
172	L	52.8	Low	63.7	Low	116 Å²	116	72.4 Å²	72.4	61%	0.607	38%	0.376	S	S	*	.	H	α-helix	trans	-71.6	-37.3	176.3	-69.2	171.7	0	0	0	113	E168 E169 W170 N175	E168-L172 WeakPolarHBondContact O-CG 3.34Å; E168-L172 PolarHBondContact O-N 3.33Å; E169-L172 PolarHBondContact O-N 2.93Å; W170-L172 VanDerWaalsContact C-N 3.33Å; L172-N175 WeakPolarHBondContact O-CA 3.45Å; L172-N175 VanDerWaalsContact O-CB 3.32Å; L172-N175 WeakPolarHBondContact O-CB 3.41Å; L172-N175 PolarHBondContact O-N 3.04Å
173	S	49.5	Very low	65.8	Low	31 Å²	31	70.1 Å²	70.1	22%	0.217	36%	0.364	C	S	.	.	H	α-helix	trans	-68.6	-33.6	176.7	57.2	0	0	0	0	113.1	E169 W170 N175 M176	E169-S173 WeakPolarHBondContact O-CB 3.44Å; E169-S173 PolarHBondContact O-N 2.96Å; E169-S173 PolarHBondContact O-OG 2.84Å; E169-S173 VanDerWaalsContact O-OG 3.08Å; W170-S173 WeakPolarHBondContact CA-OG 3.46Å; W170-S173 PolarHBondContact O-N 2.98Å; W170-S173 PolarHBondContact O-OG 3.41Å; S173-N175 PolarHBondContact O-N 3.38Å; S173-M176 PolarHBondContact O-N 2.83Å
174	M	52.5	Low	68.2	Low	95 Å²	95	66.9 Å²	66.9	47%	0.468	34%	0.341	S	S	.	.	H	α-helix	trans	-58.2	-30.2	167.6	-80.5	-155.7	149	0	0	112.7	W170 M176	W170-M174 PolarHBondContact O-N 3.24Å; M174-M176 PolarHBondContact O-N 2.8Å
175	N	53.2	Low	70.3	Confident	62 Å²	62	58.3 Å²	58.3	33%	0.332	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	17.1	174.3	-60.2	-20.4	0	0	0	113.3	L172 S173 V239 S240	L172-N175 WeakPolarHBondContact O-CA 3.45Å; L172-N175 VanDerWaalsContact O-CB 3.32Å; L172-N175 WeakPolarHBondContact O-CB 3.41Å; L172-N175 PolarHBondContact O-N 3.04Å; S173-N175 PolarHBondContact O-N 3.38Å; N175-V239 WeakPolarHBondContact OD1-CG1 3.4Å; N175-S240 CarbonylContact O-C 3.55Å; N175-S240 VanDerWaalsContact O-C 3.27Å; N175-S240 WeakPolarHBondContact O-CA 3.36Å
176	M	61.8	Low	72.3	Confident	118 Å²	118	52 Å²	52	58%	0.581	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.3	-0.7	168.7	-75.8	-71.5	136.6	0	0	113.4	S173 M174 S240	S173-M176 PolarHBondContact O-N 2.83Å; M174-M176 PolarHBondContact O-N 2.8Å; M176-S240 WeakPolarHBondContact CE-O 3.36Å
177	A	80.9	Confident	74.4	Confident	18 Å²	18	51.3 Å²	51.3	15%	0.149	27%	0.273	C	S	.	.	S	Bend	trans	-64.9	142.4	176.2	0	0	0	0	0	112.1	D154 Y155 S240	D154-A177 WeakPolarHBondContact OD2-CA 3.37Å; Y155-A177 HydrophobicContact CD1-CB 4.05Å; Y155-A177 HydrophobicContact CE1-CB 3.75Å; A177-S240 VanDerWaalsContact O-CB 3.27Å; A177-S240 WeakPolarHBondContact O-CB 3.43Å; A177-S240 PolarHBondContact O-OG 3.5Å
178	S	88.4	Confident	76.5	Confident	8 Å²	8	49.8 Å²	49.8	6%	0.056	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-60.2	147.6	169	-97.3	0	0	0	0	111	N124 R152 D154 Y155 I180	N124-S178 WeakPolarHBondContact O-CB 3.2Å; N124-S178 PolarHBondContact O-OG 3.08Å; R152-S178 PolarHBondContact NH2-OG 2.99Å; D154-S178 PolarHBondContact OD2-N 2.86Å; Y155-S178 VanDerWaalsContact OH-CB 3.3Å; Y155-S178 WeakPolarHBondContact OH-CB 3.47Å; Y155-S178 PolarHBondContact OH-O 3.19Å; S178-I180 PolarHBondContact O-N 2.86Å
179	P	93.4	Very high	78.3	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.006	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-60.6	133.5	172.1	-26.1	36.4	0	0	0	112.4	A125 F126 L233 Q236 N237 I243	A125-P179 WeakPolarHBondContact CA-O 3.32Å; A125-P179 HydrophobicContact CB-CB 4.06Å; A125-P179 HydrophobicContact CB-CG 4.39Å; F126-P179 PolarHBondContact N-O 3.14Å; P179-L233 HydrophobicContact CB-CB 4.07Å; P179-L233 HydrophobicContact CB-CD2 3.67Å; P179-L233 HydrophobicContact CB-CG 4.48Å; P179-L233 WeakPolarHBondContact CB-O 3.2Å; P179-L233 WeakPolarHBondContact CG-O 3.47Å; P179-Q236 HydrophobicContact CB-CB 3.91Å; P179-Q236 HydrophobicContact CG-CB 4.22Å; P179-N237 HydrophobicContact CG-CB 3.89Å; P179-I243 HydrophobicContact CG-CD1 4.24Å
180	I	95.3	Very high	80.2	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.015	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.9	169.9	-55.8	-169.2	0	0	0	108.6	F126 I128 L145 I148 Y155 S178 Q236	F126-I180 HydrophobicContact CB-CG1 4.19Å; F126-I180 HydrophobicContact CB-CG2 4.43Å; F126-I180 HydrophobicContact CD2-CD1 4.47Å; F126-I180 HydrophobicContact CD2-CG1 4.09Å; F126-I180 WeakPolarHBondContact O-CA 3.42Å; I128-I180 HydrophobicContact CD1-CG2 4.09Å; I128-I180 HydrophobicContact CG1-CG2 4.41Å; L145-I180 HydrophobicContact CD1-CD1 3.88Å; I148-I180 HydrophobicContact CG2-CD1 4.24Å; Y155-I180 HydrophobicContact CE1-CD1 3.73Å; Y155-I180 HydrophobicContact CE1-CG1 4.16Å; Y155-I180 HydrophobicContact CE2-CD1 4.39Å; Y155-I180 WeakPolarHBondContact OH-CD1 3.44Å; Y155-I180 WeakPolarHBondContact OH-CG1 3.44Å; S178-I180 PolarHBondContact O-N 2.86Å; I180-Q236 PolarHBondContact O-NE2 3.44Å; I180-Q236 PolarHBondContact O-OE1 3.14Å
181	T	97.1	Very high	82	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126.6	168.2	-60.3	0	0	0	0	110.1	F126 V127 I128 V183 Q214 V216 I229 S232 L233 Q236	F126-T181 PolarHBondContact O-N 3.47Å; V127-T181 WeakPolarHBondContact CA-O 3.49Å; I128-T181 PolarHBondContact N-O 3.42Å; T181-V183 HydrophobicContact CG2-CG2 4.11Å; T181-Q214 CarbonylContact C-O 3.27Å; T181-Q214 WeakPolarHBondContact CA-O 3.4Å; T181-V216 HydrophobicContact CG2-CG2 3.73Å; T181-I229 HydrophobicContact CG2-CG2 4.3Å; T181-S232 WeakPolarHBondContact OG1-CB 3.48Å; T181-S232 PolarHBondContact OG1-OG 3.11Å; T181-L233 WeakPolarHBondContact OG1-CD2 3.49Å; T181-Q236 PolarHBondContact OG1-NE2 3.05Å
182	V	97.8	Very high	83.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	133	172.3	-179.1	0	0	0	0	108.8	I128 F130 W204 L205 L210 Q214 F215 V216	I128-V182 HydrophobicContact CB-CG2 4.38Å; I128-V182 CarbonylContact O-C 3.42Å; I128-V182 WeakPolarHBondContact O-CA 3.33Å; F130-V182 HydrophobicContact CD1-CG1 3.88Å; F130-V182 HydrophobicContact CE1-CG1 3.68Å; V182-W204 HydrophobicContact CG1-CH2 4.32Å; V182-W204 HydrophobicContact CG1-CZ3 3.97Å; V182-W204 HydrophobicContact CG2-CH2 4.4Å; V182-W204 HydrophobicContact CG2-CZ3 4.17Å; V182-L205 HydrophobicContact CB-CD2 4.21Å; V182-L205 HydrophobicContact CG1-CD2 4.47Å; V182-L205 HydrophobicContact CG2-CD2 4.26Å; V182-L210 HydrophobicContact CG2-CD1 3.46Å; V182-L210 VanDerWaalsContact CG2-CD1 3.46Å; V182-Q214 PolarHBondContact N-O 2.92Å; V182-F215 HydrophobicContact CB-CD2 4.2Å; V182-F215 HydrophobicContact CG1-CD2 4.07Å; V182-F215 WeakPolarHBondContact O-CA 3.33Å; V182-F215 WeakPolarHBondContact O-CD2 3.14Å; V182-V216 PolarHBondContact O-N 2.95Å
183	V	98.3	Very high	85.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	120.4	-172.6	178.1	0	0	0	0	110	I67 V127 I128 V129 F130 T181 V216 V218 I229	I67-V183 HydrophobicContact CD1-CG1 4.17Å; V127-V183 HydrophobicContact CG1-CB 4.43Å; V127-V183 HydrophobicContact CG1-CG2 3.65Å; I128-V183 PolarHBondContact O-N 2.85Å; V129-V183 WeakPolarHBondContact CA-O 3.35Å; V129-V183 HydrophobicContact CG1-CG1 4.48Å; V129-V183 HydrophobicContact CG2-CB 4.34Å; F130-V183 PolarHBondContact N-O 3.21Å; T181-V183 HydrophobicContact CG2-CG2 4.11Å; V183-V216 WeakPolarHBondContact CA-O 3.33Å; V183-V218 HydrophobicContact CG1-CB 3.74Å; V183-V218 HydrophobicContact CG1-CG1 4.42Å; V183-V218 HydrophobicContact CG1-CG2 3.62Å; V183-I229 HydrophobicContact CG1-CD1 4.25Å; V183-I229 HydrophobicContact CG2-CD1 4.01Å; V183-I229 HydrophobicContact CG2-CG1 3.86Å; V183-I229 HydrophobicContact CG2-CG2 4.06Å
184	C	97.6	Very high	87.2	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	100.3	166.2	-177.1	0	0	0	0	108.4	F130 F215 V216 Y217 V218	F130-C184 HydrophobicContact CD2-CB 4.46Å; F130-C184 HydrophobicContact CE1-CB 4.06Å; F130-C184 HydrophobicContact CE2-CB 3.73Å; F130-C184 VanDerWaalsContact CE2-SG 3.52Å; F130-C184 HydrophobicContact CZ-CB 3.51Å; C184-F215 HydrophobicContact CB-CE2 3.64Å; C184-F215 HydrophobicContact CB-CZ 3.54Å; C184-V216 PolarHBondContact N-O 3.42Å; C184-Y217 HydrophobicContact CB-CD1 3.62Å; C184-Y217 HydrophobicContact CB-CE1 3.9Å; C184-V218 PolarHBondContact O-N 3.35Å
185	N	98	Very high	88.9	Confident	5 Å²	5	48 Å²	48	3%	0.027	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	163.8	178.4	-168.4	30.6	0	0	0	111.8	V62 I67 V129 F130 H132 V218 A220	V62-N185 PolarHBondContact O-ND2 3.48Å; I67-N185 HydrophobicContact CD1-CB 4.1Å; V129-N185 HydrophobicContact CG1-CB 3.85Å; F130-N185 PolarHBondContact O-N 3.39Å; H132-N185 PolarHBondContact N-O 3.33Å; N185-V218 CarbonylContact C-O 3.45Å; N185-V218 VanDerWaalsContact CA-O 3.25Å; N185-V218 WeakPolarHBondContact CA-O 3.43Å; N185-V218 PolarHBondContact OD1-O 2.95Å; N185-A220 PolarHBondContact OD1-N 3.5Å
186	K	96.4	Very high	90.7	Very high	48 Å²	48	45.3 Å²	45.3	21%	0.209	25%	0.245	C	C	.	.			trans	67.4	34.6	-176.2	-42.6	177.7	-168.7	161.9	0	113.3	A131 D133 D188 L189 V218	A131-K186 HydrophobicContact CB-CD 4.08Å; D133-K186 WeakPolarHBondContact OD1-CD 2.82Å; D133-K186 IonicContact OD1-NZ 3.26Å; D133-K186 PolarHBondContact OD1-NZ 3.33Å; D133-K186 IonicContact OD2-NZ 3.6Å; D133-K186 PolarHBondContact OD2-NZ 3.24Å; K186-D188 PolarHBondContact O-N 3.17Å; K186-L189 HydrophobicContact CB-CD1 3.76Å; K186-L189 HydrophobicContact CB-CG 4.03Å; K186-L189 HydrophobicContact CD-CD1 3.95Å; K186-L189 WeakPolarHBondContact O-CB 3.43Å; K186-L189 WeakPolarHBondContact O-CG 3.31Å; K186-L189 PolarHBondContact O-N 2.69Å; K186-V218 PolarHBondContact N-O 3.47Å
187	S	94.9	Very high	92.1	Very high	45 Å²	45	43.4 Å²	43.4	32%	0.315	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-3.3	173.5	67.6	0	0	0	0	114.3	L189 V218	S187-L189 VanDerWaalsContact C-N 3.32Å; S187-V218 PolarHBondContact N-O 2.9Å; S187-V218 PolarHBondContact OG-O 2.99Å
188	D	94.7	Very high	92.6	Very high	41 Å²	41	48.1 Å²	48.1	22%	0.219	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-10.6	170.4	67.5	-80.7	0	0	0	113.7	K186 S219 K221 T222	K186-D188 PolarHBondContact O-N 3.17Å; D188-S219 WeakPolarHBondContact OD1-CB 3.43Å; D188-S219 PolarHBondContact OD1-OG 3.3Å; D188-K221 WeakPolarHBondContact OD2-CD 3.35Å; D188-K221 WeakPolarHBondContact OD2-CE 3.29Å; D188-K221 IonicContact OD2-NZ 3.86Å; D188-K221 PolarHBondContact OD2-NZ 3.38Å; D188-T222 HydrophobicContact CB-CG2 3.95Å
189	L	93.1	Very high	92.9	Very high	41 Å²	41	50.1 Å²	50.1	22%	0.215	28%	0.284	C	S	.	.	S	Bend	trans	-74.5	135.5	177.2	-65.7	178.3	0	0	0	110.5	D133 K186 S187	D133-L189 HydrophobicContact CB-CD1 3.73Å; K186-L189 HydrophobicContact CB-CD1 3.76Å; K186-L189 HydrophobicContact CB-CG 4.03Å; K186-L189 HydrophobicContact CD-CD1 3.95Å; K186-L189 WeakPolarHBondContact O-CB 3.43Å; K186-L189 WeakPolarHBondContact O-CG 3.31Å; K186-L189 PolarHBondContact O-N 2.69Å; S187-L189 VanDerWaalsContact C-N 3.32Å
190	P	90.7	Very high	92.9	Very high	74 Å²	74	51.8 Å²	51.8	48%	0.481	30%	0.298	S	S	.	.			trans	-58.5	148	173.9	-23.2	32.5	0	0	0	112	S192 Y193	P190-S192 PolarHBondContact O-N 2.97Å; P190-Y193 HydrophobicContact CB-CD2 4.43Å; P190-Y193 HydrophobicContact CG-CD2 4.42Å; P190-Y193 PolarHBondContact O-N 2.85Å
191	N	85.6	Confident	92.8	Very high	142 Å²	142	51.7 Å²	51.7	76%	0.759	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-54.1	-20.6	-179	-59.2	40.5	0	0	0	114.2	Y193 S194	N191-Y193 PolarHBondContact O-N 3.24Å; N191-S194 VanDerWaalsContact O-CB 3.26Å; N191-S194 WeakPolarHBondContact O-CB 3.33Å; N191-S194 PolarHBondContact O-N 3.03Å; N191-S194 VanDerWaalsContact O-N 3.08Å
192	S	88.3	Confident	92.7	Very high	103 Å²	103	54.3 Å²	54.3	72%	0.72	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-64.2	-21.1	172.7	59.8	0	0	0	0	114.4	P190	P190-S192 PolarHBondContact O-N 2.97Å
193	Y	86.9	Confident	92.6	Very high	150 Å²	150	60.6 Å²	60.6	59%	0.588	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-97.7	-5	172.9	-67.8	-84	0	0	0	112.6	D133 P190 N191 Q195	D133-Y193 WeakPolarHBondContact CA-O 3.4Å; P190-Y193 HydrophobicContact CB-CD2 4.43Å; P190-Y193 HydrophobicContact CG-CD2 4.42Å; P190-Y193 PolarHBondContact O-N 2.85Å; N191-Y193 PolarHBondContact O-N 3.24Å; Y193-Q195 PolarHBondContact O-N 3.22Å
194	S	86.1	Confident	92.5	Very high	36 Å²	36	62.3 Å²	62.3	25%	0.252	35%	0.346	S	S	.	.			trans	-66.8	124.6	175.6	-172.8	0	0	0	0	110.1	H132 N191 I196	H132-S194 PolarHBondContact CE1-OG 3.06Å; H132-S194 VanDerWaalsContact CE1-OG 3.23Å; H132-S194 VanDerWaalsContact NE2-CB 3.34Å; H132-S194 WeakPolarHBondContact NE2-CB 3.47Å; H132-S194 PolarHBondContact NE2-OG 3.36Å; N191-S194 VanDerWaalsContact O-CB 3.26Å; N191-S194 WeakPolarHBondContact O-CB 3.33Å; N191-S194 PolarHBondContact O-N 3.03Å; N191-S194 VanDerWaalsContact O-N 3.08Å; S194-I196 PolarHBondContact OG-N 3.23Å; S194-I196 PolarHBondContact OG-O 3Å
195	Q	88.8	Confident	92.3	Very high	114 Å²	114	62.3 Å²	62.3	53%	0.533	35%	0.346	S	S	.	.	S	Bend	trans	-93	-4.1	168.5	-63.6	-169.9	1	0	0	112.3	H132 D133 L135 Y193	H132-Q195 PolarHBondContact O-N 2.67Å; H132-Q195 VanDerWaalsContact O-N 3.13Å; D133-Q195 PolarHBondContact O-NE2 3.42Å; D133-Q195 VanDerWaalsContact O-NE2 3.1Å; L135-Q195 HydrophobicContact CB-CB 4.24Å; Y193-Q195 PolarHBondContact O-N 3.22Å
196	I	90.5	Very high	92.1	Very high	5 Å²	5	67.7 Å²	67.7	3%	0.026	37%	0.374	C	S	.	.	S	Bend	trans	-138.9	116.5	-167.7	-40.8	170	0	0	0	109.2	F130 L135 L138 S194 A200 I201	F130-I196 HydrophobicContact CD2-CD1 3.81Å; F130-I196 HydrophobicContact CE2-CD1 3.75Å; L135-I196 HydrophobicContact CB-CG1 4.41Å; L135-I196 HydrophobicContact CD1-CG1 4.14Å; L138-I196 HydrophobicContact CB-CD1 3.95Å; L138-I196 HydrophobicContact CD2-CD1 4.24Å; L138-I196 HydrophobicContact CD2-CG2 3.9Å; S194-I196 PolarHBondContact OG-N 3.23Å; S194-I196 PolarHBondContact OG-O 3Å; I196-A200 HydrophobicContact CG2-CB 4.21Å; I196-I201 HydrophobicContact CB-CD1 4.46Å; I196-I201 HydrophobicContact CB-CG1 4.36Å; I196-I201 HydrophobicContact CG2-CD1 4.16Å; I196-I201 HydrophobicContact CG2-CG1 3.54Å
197	S	92.1	Very high	92	Very high	77 Å²	77	70.8 Å²	70.8	54%	0.538	40%	0.397	S	S	.	.			trans	-70.3	151.4	174.3	68.2	0	0	0	0	110.9	G199 A200 I201	S197-G199 PolarHBondContact O-N 2.97Å; S197-A200 PolarHBondContact O-N 3.31Å; S197-A200 VanDerWaalsContact O-N 3.08Å; S197-A200 WeakPolarHBondContact OG-CB 3.45Å; S197-A200 PolarHBondContact OG-N 2.98Å; S197-I201 PolarHBondContact O-N 3.15Å; S197-I201 VanDerWaalsContact O-N 3.07Å
198	E	91	Very high	91.8	Very high	118 Å²	118	70.3 Å²	70.3	55%	0.551	39%	0.391	S	S	*	.	H	α-helix	trans	-57.1	-38.6	175.2	179.2	168	-150.8	0	0	111.8	A200 I201 M202	E198-A200 PolarHBondContact O-N 3.07Å; E198-I201 PolarHBondContact O-N 3.25Å; E198-M202 HydrophobicContact CG-CE 4.34Å; E198-M202 WeakPolarHBondContact O-CG 3.22Å; E198-M202 PolarHBondContact O-N 2.99Å
199	G	93.7	Very high	91.6	Very high	50 Å²	50	70.9 Å²	70.9	52%	0.515	41%	0.407	S	S	.	.	H	α-helix	trans	-58.3	-44.5	173.6	0	0	0	0	0	113.1	S197 I201 M202 E203	S197-G199 PolarHBondContact O-N 2.97Å; G199-I201 VanDerWaalsContact C-N 3.33Å; G199-I201 PolarHBondContact O-N 3.48Å; G199-M202 PolarHBondContact O-N 2.55Å; G199-E203 WeakPolarHBondContact O-CB 3.48Å; G199-E203 PolarHBondContact O-N 3.27Å
200	A	93.5	Very high	91.5	Very high	36 Å²	36	69.4 Å²	69.4	30%	0.298	40%	0.399	S	S	.	.	H	α-helix	trans	-67	-32.5	177.1	0	0	0	0	0	112.6	I196 S197 E198 W204	I196-A200 HydrophobicContact CG2-CB 4.21Å; S197-A200 PolarHBondContact O-N 3.31Å; S197-A200 VanDerWaalsContact O-N 3.08Å; S197-A200 WeakPolarHBondContact OG-CB 3.45Å; S197-A200 PolarHBondContact OG-N 2.98Å; E198-A200 PolarHBondContact O-N 3.07Å; A200-W204 WeakPolarHBondContact O-CB 3.25Å; A200-W204 PolarHBondContact O-N 2.58Å
201	I	94.7	Very high	91.5	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-66.5	-45.4	172.8	-64	169.1	0	0	0	110.4	F130 I196 S197 E198 G199 W204 L205 F215 Y217	F130-I201 HydrophobicContact CE2-CD1 4.09Å; F130-I201 HydrophobicContact CE2-CG1 4.31Å; F130-I201 HydrophobicContact CZ-CD1 3.93Å; F130-I201 HydrophobicContact CZ-CG1 3.99Å; F130-I201 HydrophobicContact CZ-CG2 4.07Å; I196-I201 HydrophobicContact CB-CD1 4.46Å; I196-I201 HydrophobicContact CB-CG1 4.36Å; I196-I201 HydrophobicContact CG2-CD1 4.16Å; I196-I201 HydrophobicContact CG2-CG1 3.54Å; S197-I201 PolarHBondContact O-N 3.15Å; S197-I201 VanDerWaalsContact O-N 3.07Å; E198-I201 PolarHBondContact O-N 3.25Å; G199-I201 VanDerWaalsContact C-N 3.33Å; G199-I201 PolarHBondContact O-N 3.48Å; I201-W204 PolarHBondContact O-N 2.98Å; I201-L205 HydrophobicContact CG2-CD1 4.11Å; I201-L205 VanDerWaalsContact O-CG 3.3Å; I201-L205 WeakPolarHBondContact O-CG 2.99Å; I201-L205 PolarHBondContact O-N 3.34Å; I201-F215 HydrophobicContact CD1-CZ 4.43Å; I201-F215 HydrophobicContact CG2-CD1 4.43Å; I201-F215 HydrophobicContact CG2-CD2 4.24Å; I201-F215 HydrophobicContact CG2-CE1 3.94Å; I201-F215 HydrophobicContact CG2-CE2 3.74Å; I201-F215 HydrophobicContact CG2-CZ 3.58Å; I201-Y217 HydrophobicContact CD1-CE1 4.09Å
202	M	94.9	Very high	91.7	Very high	56 Å²	56	68.6 Å²	68.6	28%	0.276	39%	0.389	S	S	.	.	H	α-helix	trans	-66.6	-42.2	179.8	-65.3	-61.8	159.2	0	0	112.1	E198 G199 L205 L206 F215	E198-M202 HydrophobicContact CG-CE 4.34Å; E198-M202 WeakPolarHBondContact O-CG 3.22Å; E198-M202 PolarHBondContact O-N 2.99Å; G199-M202 PolarHBondContact O-N 2.55Å; M202-L205 PolarHBondContact O-N 3.06Å; M202-L205 HydrophobicContact SD-CD1 4.03Å; M202-L206 WeakPolarHBondContact O-CG 3.37Å; M202-L206 PolarHBondContact O-N 3.13Å; M202-L206 VanDerWaalsContact O-N 3.11Å; M202-F215 HydrophobicContact CE-CD1 3.94Å; M202-F215 HydrophobicContact CE-CE1 4.12Å
203	E	94.8	Very high	91.8	Very high	132 Å²	132	67.8 Å²	67.8	62%	0.617	38%	0.384	S	S	*	.	H	α-helix	trans	-57.8	-51.5	171.4	-176.3	177	-171.7	0	0	110.7	G199 L205 L206 T207	G199-E203 WeakPolarHBondContact O-CB 3.48Å; G199-E203 PolarHBondContact O-N 3.27Å; E203-L205 VanDerWaalsContact C-N 3.31Å; E203-L205 PolarHBondContact O-N 2.89Å; E203-L206 PolarHBondContact O-N 3.25Å; E203-L206 VanDerWaalsContact O-N 3.13Å; E203-T207 PolarHBondContact O-N 3.14Å; E203-T207 PolarHBondContact O-OG1 2.75Å
204	W	95.8	Very high	92.1	Very high	35 Å²	35	62.1 Å²	62.1	13%	0.133	36%	0.363	C	S	.	.	H	α-helix	trans	-57.2	-40.6	178.5	179.5	99.7	0	0	0	112.8	L138 A141 L145 V182 A200 I201 N208 L210	L138-W204 HydrophobicContact CD1-CD2 3.65Å; L138-W204 HydrophobicContact CD1-CE3 3.98Å; L138-W204 HydrophobicContact CD1-CG 4.03Å; L138-W204 HydrophobicContact CD1-CH2 4.41Å; L138-W204 HydrophobicContact CD1-CZ2 4.07Å; L138-W204 HydrophobicContact CD1-CZ3 4.35Å; L138-W204 HydrophobicContact CD2-CB 4.3Å; L138-W204 HydrophobicContact CD2-CG 4.01Å; L138-W204 HydrophobicContact CG-CD2 4.13Å; L138-W204 HydrophobicContact CG-CG 4.06Å; L138-W204 PolarHBondContact O-NE1 3.43Å; A141-W204 HydrophobicContact CB-CH2 4.26Å; A141-W204 HydrophobicContact CB-CZ2 4.02Å; L145-W204 HydrophobicContact CD2-CH2 4.37Å; V182-W204 HydrophobicContact CG1-CH2 4.32Å; V182-W204 HydrophobicContact CG1-CZ3 3.97Å; V182-W204 HydrophobicContact CG2-CH2 4.4Å; V182-W204 HydrophobicContact CG2-CZ3 4.17Å; A200-W204 WeakPolarHBondContact O-CB 3.25Å; A200-W204 PolarHBondContact O-N 2.58Å; I201-W204 PolarHBondContact O-N 2.98Å; W204-N208 VanDerWaalsContact O-CB 3.32Å; W204-N208 WeakPolarHBondContact O-CB 3.25Å; W204-N208 PolarHBondContact O-N 2.88Å; W204-N208 PolarHBondContact O-ND2 2.89Å; W204-L210 HydrophobicContact CZ3-CD1 4.26Å
205	L	94.8	Very high	92.6	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-61.7	-48.8	176.3	-74	164.1	0	0	0	111	V182 I201 M202 E203 N208 G209 L210 F215	V182-L205 HydrophobicContact CB-CD2 4.21Å; V182-L205 HydrophobicContact CG1-CD2 4.47Å; V182-L205 HydrophobicContact CG2-CD2 4.26Å; I201-L205 HydrophobicContact CG2-CD1 4.11Å; I201-L205 VanDerWaalsContact O-CG 3.3Å; I201-L205 WeakPolarHBondContact O-CG 2.99Å; I201-L205 PolarHBondContact O-N 3.34Å; M202-L205 PolarHBondContact O-N 3.06Å; M202-L205 HydrophobicContact SD-CD1 4.03Å; E203-L205 VanDerWaalsContact C-N 3.31Å; E203-L205 PolarHBondContact O-N 2.89Å; L205-N208 CarbonylContact O-C 3.59Å; L205-N208 PolarHBondContact O-N 2.97Å; L205-G209 PolarHBondContact O-N 2.99Å; L205-G209 VanDerWaalsContact O-N 3.15Å; L205-L210 HydrophobicContact CB-CB 4.39Å; L205-L210 HydrophobicContact CD2-CB 3.99Å; L205-L210 HydrophobicContact CD2-CD1 3.9Å; L205-L210 PolarHBondContact O-N 2.78Å; L205-F215 HydrophobicContact CD1-CB 3.52Å; L205-F215 HydrophobicContact CD1-CD1 4.1Å; L205-F215 HydrophobicContact CD1-CD2 4.1Å; L205-F215 HydrophobicContact CD1-CG 3.63Å; L205-F215 HydrophobicContact CD2-CB 4.08Å; L205-F215 HydrophobicContact CD2-CD2 4.43Å; L205-F215 HydrophobicContact CD2-CG 4.5Å; L205-F215 HydrophobicContact CG-CB 4.47Å
206	L	93.1	Very high	93	Very high	117 Å²	117	56.7 Å²	56.7	61%	0.613	33%	0.334	S	S	*	.	H	α-helix	trans	-66.2	-44.2	-178.6	-66.7	173.4	0	0	0	111.9	M202 E203 N208 G209	M202-L206 WeakPolarHBondContact O-CG 3.37Å; M202-L206 PolarHBondContact O-N 3.13Å; M202-L206 VanDerWaalsContact O-N 3.11Å; E203-L206 PolarHBondContact O-N 3.25Å; E203-L206 VanDerWaalsContact O-N 3.13Å; L206-N208 PolarHBondContact O-N 3.08Å; L206-G209 PolarHBondContact O-N 2.93Å
207	T	93.4	Very high	93.3	Very high	113 Å²	113	59.6 Å²	59.6	69%	0.693	35%	0.345	S	S	*	.	H	α-helix	trans	-58.8	-34	173.6	-55.6	0	0	0	0	111.9	E203 G209	E203-T207 PolarHBondContact O-N 3.14Å; E203-T207 PolarHBondContact O-OG1 2.75Å; T207-G209 VanDerWaalsContact C-N 3.3Å; T207-G209 PolarHBondContact O-N 2.82Å
208	N	92.1	Very high	93.6	Very high	35 Å²	35	55.9 Å²	55.9	19%	0.187	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	7.6	175.3	-77.8	-82.5	0	0	0	113.9	L145 K149 W204 L205 L206 L210	L145-N208 HydrophobicContact CD2-CB 3.67Å; K149-N208 PolarHBondContact NZ-O 2.79Å; W204-N208 VanDerWaalsContact O-CB 3.32Å; W204-N208 WeakPolarHBondContact O-CB 3.25Å; W204-N208 PolarHBondContact O-N 2.88Å; W204-N208 PolarHBondContact O-ND2 2.89Å; L205-N208 CarbonylContact O-C 3.59Å; L205-N208 PolarHBondContact O-N 2.97Å; L206-N208 PolarHBondContact O-N 3.08Å; N208-L210 VanDerWaalsContact C-N 3.31Å; N208-L210 PolarHBondContact O-N 3.37Å
209	G	88.7	Confident	93.9	Very high	53 Å²	53	50.3 Å²	50.3	55%	0.546	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	28.7	177.5	0	0	0	0	0	114.2	L205 L206 T207	L205-G209 PolarHBondContact O-N 2.99Å; L205-G209 VanDerWaalsContact O-N 3.15Å; L206-G209 PolarHBondContact O-N 2.93Å; T207-G209 VanDerWaalsContact C-N 3.3Å; T207-G209 PolarHBondContact O-N 2.82Å
210	L	91.6	Very high	94.1	Very high	10 Å²	10	48 Å²	48	5%	0.052	27%	0.27	C	S	.	.			trans	-103.1	145.3	176	-65.4	175.3	0	0	0	111	L145 V182 W204 L205 N208	L145-L210 HydrophobicContact CD2-CD1 3.63Å; L145-L210 HydrophobicContact CD2-CG 4.14Å; V182-L210 HydrophobicContact CG2-CD1 3.46Å; V182-L210 VanDerWaalsContact CG2-CD1 3.46Å; W204-L210 HydrophobicContact CZ3-CD1 4.26Å; L205-L210 HydrophobicContact CB-CB 4.39Å; L205-L210 HydrophobicContact CD2-CB 3.99Å; L205-L210 HydrophobicContact CD2-CD1 3.9Å; L205-L210 PolarHBondContact O-N 2.78Å; N208-L210 VanDerWaalsContact C-N 3.31Å; N208-L210 PolarHBondContact O-N 3.37Å
211	K	90.2	Very high	94.2	Very high	121 Å²	121	51.6 Å²	51.6	53%	0.526	28%	0.278	S	S	.	.			trans	-84.9	148.5	176.1	-62.8	175.3	-176.4	172.5	0	110.1	S213 Q214	K211-S213 PolarHBondContact O-N 3.11Å; K211-S213 VanDerWaalsContact O-N 3.08Å; K211-Q214 HydrophobicContact CB-CG 4.35Å; K211-Q214 WeakPolarHBondContact O-CB 3.38Å; K211-Q214 PolarHBondContact O-N 3.39Å
212	P	91.1	Very high	94.3	Very high	78 Å²	78	54.9 Å²	54.9	51%	0.506	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-55.1	-27.5	174.2	-28.4	36.1	0	0	0	114.6	Q214 F215	P212-Q214 PolarHBondContact O-N 3.25Å; P212-F215 PolarHBondContact O-N 3.12Å; P212-F215 VanDerWaalsContact O-N 3.13Å
213	S	90.7	Very high	94.4	Very high	86 Å²	86	55.6 Å²	55.6	60%	0.601	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-67.9	-12.5	174	56.6	0	0	0	0	114.9	K211 F215 S232	K211-S213 PolarHBondContact O-N 3.11Å; K211-S213 VanDerWaalsContact O-N 3.08Å; S213-F215 VanDerWaalsContact C-N 3.33Å; S213-S232 PolarHBondContact O-OG 2.97Å
214	Q	93.4	Very high	94.4	Very high	31 Å²	31	53.1 Å²	53.1	15%	0.145	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-93.3	8.1	174.4	-57.4	179.9	-80	0	0	111.8	T181 V182 K211 P212 Q236	T181-Q214 CarbonylContact C-O 3.27Å; T181-Q214 WeakPolarHBondContact CA-O 3.4Å; V182-Q214 PolarHBondContact N-O 2.92Å; K211-Q214 HydrophobicContact CB-CG 4.35Å; K211-Q214 WeakPolarHBondContact O-CB 3.38Å; K211-Q214 PolarHBondContact O-N 3.39Å; P212-Q214 PolarHBondContact O-N 3.25Å; Q214-Q236 HydrophobicContact CG-CG 4.48Å
215	F	96.4	Very high	94.4	Very high	20 Å²	20	54.3 Å²	54.3	9%	0.088	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	139	-178.1	175.8	-107.2	0	0	0	112.5	F130 V182 C184 I201 M202 L205 P212 S213 Y217	F130-F215 AromaticContact CE1-CE2 3.79Å; F130-F215 HydrophobicContact CE1-CE2 3.79Å; F130-F215 AromaticContact CZ-CE2 3.83Å; F130-F215 HydrophobicContact CZ-CE2 3.83Å; F130-F215 HydrophobicContact CZ-CZ 4.34Å; V182-F215 HydrophobicContact CB-CD2 4.2Å; V182-F215 HydrophobicContact CG1-CD2 4.07Å; V182-F215 WeakPolarHBondContact O-CA 3.33Å; V182-F215 WeakPolarHBondContact O-CD2 3.14Å; C184-F215 HydrophobicContact CB-CE2 3.64Å; C184-F215 HydrophobicContact CB-CZ 3.54Å; I201-F215 HydrophobicContact CD1-CZ 4.43Å; I201-F215 HydrophobicContact CG2-CD1 4.43Å; I201-F215 HydrophobicContact CG2-CD2 4.24Å; I201-F215 HydrophobicContact CG2-CE1 3.94Å; I201-F215 HydrophobicContact CG2-CE2 3.74Å; I201-F215 HydrophobicContact CG2-CZ 3.58Å; M202-F215 HydrophobicContact CE-CD1 3.94Å; M202-F215 HydrophobicContact CE-CE1 4.12Å; L205-F215 HydrophobicContact CD1-CB 3.52Å; L205-F215 HydrophobicContact CD1-CD1 4.1Å; L205-F215 HydrophobicContact CD1-CD2 4.1Å; L205-F215 HydrophobicContact CD1-CG 3.63Å; L205-F215 HydrophobicContact CD2-CB 4.08Å; L205-F215 HydrophobicContact CD2-CD2 4.43Å; L205-F215 HydrophobicContact CD2-CG 4.5Å; L205-F215 HydrophobicContact CG-CB 4.47Å; P212-F215 PolarHBondContact O-N 3.12Å; P212-F215 VanDerWaalsContact O-N 3.13Å; S213-F215 VanDerWaalsContact C-N 3.33Å; F215-Y217 HydrophobicContact CE1-CD1 4.38Å; F215-Y217 AromaticContact CE1-CD2 3.83Å; F215-Y217 HydrophobicContact CE1-CD2 3.83Å; F215-Y217 HydrophobicContact CE1-CE1 4.14Å; F215-Y217 AromaticContact CE1-CE2 3.58Å; F215-Y217 HydrophobicContact CE1-CE2 3.58Å; F215-Y217 HydrophobicContact CE1-CG 4.22Å; F215-Y217 AromaticContact CE1-CZ 3.74Å; F215-Y217 HydrophobicContact CZ-CD1 4.03Å; F215-Y217 HydrophobicContact CZ-CD2 4.3Å; F215-Y217 AromaticContact CZ-CE1 3.82Å; F215-Y217 HydrophobicContact CZ-CE1 3.82Å; F215-Y217 HydrophobicContact CZ-CE2 4.13Å; F215-Y217 HydrophobicContact CZ-CG 4.25Å; F215-Y217 AromaticContact CZ-CZ 3.87Å
216	V	96.9	Very high	94.4	Very high	17 Å²	17	54.4 Å²	54.4	10%	0.103	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	130.1	-178.5	-168.8	0	0	0	0	111	T181 V182 V183 C184 V218	T181-V216 HydrophobicContact CG2-CG2 3.73Å; V182-V216 PolarHBondContact O-N 2.95Å; V183-V216 WeakPolarHBondContact CA-O 3.33Å; C184-V216 PolarHBondContact N-O 3.42Å; V216-V218 HydrophobicContact CB-CG2 4.26Å; V216-V218 HydrophobicContact CG1-CG2 3.69Å
217	Y	96.8	Very high	94.5	Very high	65 Å²	65	52 Å²	52	26%	0.255	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	132.8	163.8	-73.5	-71.9	0	0	0	110.4	C184 I201 F215 S225	C184-Y217 HydrophobicContact CB-CD1 3.62Å; C184-Y217 HydrophobicContact CB-CE1 3.9Å; I201-Y217 HydrophobicContact CD1-CE1 4.09Å; F215-Y217 HydrophobicContact CE1-CD1 4.38Å; F215-Y217 AromaticContact CE1-CD2 3.83Å; F215-Y217 HydrophobicContact CE1-CD2 3.83Å; F215-Y217 HydrophobicContact CE1-CE1 4.14Å; F215-Y217 AromaticContact CE1-CE2 3.58Å; F215-Y217 HydrophobicContact CE1-CE2 3.58Å; F215-Y217 HydrophobicContact CE1-CG 4.22Å; F215-Y217 AromaticContact CE1-CZ 3.74Å; F215-Y217 HydrophobicContact CZ-CD1 4.03Å; F215-Y217 HydrophobicContact CZ-CD2 4.3Å; F215-Y217 AromaticContact CZ-CE1 3.82Å; F215-Y217 HydrophobicContact CZ-CE1 3.82Å; F215-Y217 HydrophobicContact CZ-CE2 4.13Å; F215-Y217 HydrophobicContact CZ-CG 4.25Å; F215-Y217 AromaticContact CZ-CZ 3.87Å; Y217-S225 WeakPolarHBondContact O-CB 3.42Å
218	V	97.6	Very high	94.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	148.2	-172.1	173.3	0	0	0	0	110.8	I67 V183 C184 N185 K186 S187 V216 I226 I229	I67-V218 HydrophobicContact CG1-CG1 4.37Å; V183-V218 HydrophobicContact CG1-CB 3.74Å; V183-V218 HydrophobicContact CG1-CG1 4.42Å; V183-V218 HydrophobicContact CG1-CG2 3.62Å; C184-V218 PolarHBondContact O-N 3.35Å; N185-V218 CarbonylContact C-O 3.45Å; N185-V218 VanDerWaalsContact CA-O 3.25Å; N185-V218 WeakPolarHBondContact CA-O 3.43Å; N185-V218 PolarHBondContact OD1-O 2.95Å; K186-V218 PolarHBondContact N-O 3.47Å; S187-V218 PolarHBondContact N-O 2.9Å; S187-V218 PolarHBondContact OG-O 2.99Å; V216-V218 HydrophobicContact CB-CG2 4.26Å; V216-V218 HydrophobicContact CG1-CG2 3.69Å; V218-I226 HydrophobicContact CG1-CD1 3.33Å; V218-I226 HydrophobicContact CG1-CG1 4Å; V218-I229 HydrophobicContact CG1-CD1 4.39Å; V218-I229 HydrophobicContact CG2-CD1 4.05Å; V218-I229 HydrophobicContact CG2-CG1 3.88Å
219	S	97.6	Very high	94.7	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.007	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-131.4	114.5	158.6	176.9	0	0	0	0	112	D188 K221 T222 N223 D224	D188-S219 WeakPolarHBondContact OD1-CB 3.43Å; D188-S219 PolarHBondContact OD1-OG 3.3Å; S219-K221 PolarHBondContact O-N 3.44Å; S219-K221 PolarHBondContact OG-N 2.97Å; S219-T222 WeakPolarHBondContact CB-OG1 3.32Å; S219-T222 PolarHBondContact OG-N 3.25Å; S219-T222 PolarHBondContact OG-OG1 3.46Å; S219-N223 CarbonylContact O-C 3.53Å; S219-N223 VanDerWaalsContact O-CA 3.29Å; S219-N223 WeakPolarHBondContact O-CA 3.14Å; S219-N223 PolarHBondContact O-N 3.46Å; S219-D224 PolarHBondContact N-O 2.93Å; S219-D224 VanDerWaalsContact N-O 3.13Å; S219-D224 PolarHBondContact O-N 3.36Å; S219-D224 VanDerWaalsContact O-N 3.11Å
220	A	97.6	Very high	94.9	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.008	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.4	170.1	0	0	0	0	0	113.3	I67 R70 F76 N185 I226	I67-A220 HydrophobicContact CG1-CB 4.01Å; R70-A220 PolarHBondContact NE-O 3.36Å; R70-A220 PolarHBondContact NH2-O 2.88Å; F76-A220 HydrophobicContact CD2-CB 4.14Å; F76-A220 WeakPolarHBondContact CD2-O 3.37Å; F76-A220 HydrophobicContact CE2-CB 4.23Å; N185-A220 PolarHBondContact OD1-N 3.5Å; A220-I226 HydrophobicContact CB-CD1 4.34Å
221	K	97	Very high	94.9	Very high	111 Å²	111	46.2 Å²	46.2	48%	0.483	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-50.8	-178.1	-177.9	-160.9	-179.2	-177.8	0	111.1	R70 F76 D188 S219	R70-K221 PolarHBondContact NH2-O 2.98Å; F76-K221 HydrophobicContact CD1-CG 4.4Å; F76-K221 HydrophobicContact CD2-CB 4.39Å; F76-K221 HydrophobicContact CE1-CB 4.05Å; F76-K221 HydrophobicContact CE1-CG 3.82Å; F76-K221 HydrophobicContact CE2-CB 3.86Å; F76-K221 HydrophobicContact CZ-CB 3.68Å; F76-K221 HydrophobicContact CZ-CG 3.9Å; D188-K221 WeakPolarHBondContact OD2-CD 3.35Å; D188-K221 WeakPolarHBondContact OD2-CE 3.29Å; D188-K221 IonicContact OD2-NZ 3.86Å; D188-K221 PolarHBondContact OD2-NZ 3.38Å; S219-K221 PolarHBondContact O-N 3.44Å; S219-K221 PolarHBondContact OG-N 2.97Å
222	T	96.3	Very high	95	Very high	70 Å²	70	40.9 Å²	40.9	43%	0.429	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-12.6	179.3	50	0	0	0	0	113.8	D188 S219 D224	D188-T222 HydrophobicContact CB-CG2 3.95Å; S219-T222 WeakPolarHBondContact CB-OG1 3.32Å; S219-T222 PolarHBondContact OG-N 3.25Å; S219-T222 PolarHBondContact OG-OG1 3.46Å; T222-D224 VanDerWaalsContact CB-OD2 3.25Å; T222-D224 WeakPolarHBondContact CB-OD2 3.47Å; T222-D224 PolarHBondContact OG1-OD2 3.46Å
223	N	96.3	Very high	95.1	Very high	70 Å²	70	37.4 Å²	37.4	37%	0.374	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	28.7	-171.6	-167.2	45.6	0	0	0	114.2	R70 S219	R70-N223 WeakPolarHBondContact CD-OD1 3.41Å; R70-N223 HydrophobicContact CG-CB 4.14Å; R70-N223 WeakPolarHBondContact CG-OD1 3.35Å; S219-N223 CarbonylContact O-C 3.53Å; S219-N223 VanDerWaalsContact O-CA 3.29Å; S219-N223 WeakPolarHBondContact O-CA 3.14Å; S219-N223 PolarHBondContact O-N 3.46Å
224	D	95.8	Very high	95	Very high	80 Å²	80	33.6 Å²	33.6	43%	0.428	18%	0.176	S	C	.	.	B	Isolated β-bridge	trans	-80.9	130.4	178.7	-63.1	-37.2	0	0	0	110.7	S219 T222 I226	S219-D224 PolarHBondContact N-O 2.93Å; S219-D224 VanDerWaalsContact N-O 3.13Å; S219-D224 PolarHBondContact O-N 3.36Å; S219-D224 VanDerWaalsContact O-N 3.11Å; T222-D224 VanDerWaalsContact CB-OD2 3.25Å; T222-D224 WeakPolarHBondContact CB-OD2 3.47Å; T222-D224 PolarHBondContact OG1-OD2 3.46Å; D224-I226 PolarHBondContact O-N 3.18Å
225	S	95.1	Very high	94.8	Very high	60 Å²	60	36.1 Å²	36.1	42%	0.42	19%	0.19	S	C	.	.	S	Bend	trans	56.3	14.2	171.9	-54.3	0	0	0	0	117.4	Y217 M227 S228	Y217-S225 WeakPolarHBondContact O-CB 3.42Å; S225-M227 PolarHBondContact O-N 2.9Å; S225-S228 WeakPolarHBondContact O-CB 3.27Å; S225-S228 PolarHBondContact O-N 3.02Å
226	I	95.7	Very high	94.4	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.015	19%	0.193	C	C	.	.	H	α-helix	trans	-55.8	-39.1	178	-66.5	-79.2	0	0	0	112	I67 R70 F71 V218 A220 D224 S228 I229	I67-I226 HydrophobicContact CB-CD1 4.25Å; I67-I226 HydrophobicContact CG1-CD1 4.12Å; I67-I226 HydrophobicContact CG2-CD1 3.92Å; R70-I226 HydrophobicContact CB-CD1 4.4Å; R70-I226 HydrophobicContact CG-CD1 4.15Å; R70-I226 HydrophobicContact CG-CG1 3.93Å; F71-I226 HydrophobicContact CB-CG2 3.84Å; F71-I226 HydrophobicContact CD2-CG2 4.42Å; V218-I226 HydrophobicContact CG1-CD1 3.33Å; V218-I226 HydrophobicContact CG1-CG1 4Å; A220-I226 HydrophobicContact CB-CD1 4.34Å; D224-I226 PolarHBondContact O-N 3.18Å; I226-S228 VanDerWaalsContact C-N 3.31Å; I226-S228 PolarHBondContact O-N 2.83Å; I226-I229 WeakPolarHBondContact O-CG1 3.38Å
227	M	93.3	Very high	94	Very high	68 Å²	68	36.2 Å²	36.2	34%	0.335	19%	0.19	S	C	.	.	H	α-helix	trans	-66.6	-32.8	177.9	-65	-56.1	-60.3	0	0	112.7	F71 S225 I229 F230 E231 L355	F71-M227 HydrophobicContact CD2-SD 3.92Å; F71-M227 HydrophobicContact CE2-CE 4.18Å; F71-M227 HydrophobicContact CE2-SD 3.9Å; S225-M227 PolarHBondContact O-N 2.9Å; M227-I229 PolarHBondContact O-N 3.12Å; M227-F230 PolarHBondContact O-N 3.15Å; M227-E231 PolarHBondContact O-N 2.85Å; M227-L355 HydrophobicContact CE-CD2 3.85Å; M227-L355 HydrophobicContact CE-CG 3.92Å
228	S	94.2	Very high	93.4	Very high	38 Å²	38	35.8 Å²	35.8	27%	0.266	19%	0.192	S	C	.	.	H	α-helix	trans	-69.6	-17.7	-176.1	-55.1	0	0	0	0	113.9	S225 I226 E231 S232	S225-S228 WeakPolarHBondContact O-CB 3.27Å; S225-S228 PolarHBondContact O-N 3.02Å; I226-S228 VanDerWaalsContact C-N 3.31Å; I226-S228 PolarHBondContact O-N 2.83Å; S228-E231 VanDerWaalsContact CA-OE2 3.23Å; S228-E231 WeakPolarHBondContact CA-OE2 3.16Å; S228-E231 WeakPolarHBondContact CB-OE2 3.41Å; S228-E231 PolarHBondContact OG-OE2 2.71Å; S228-S232 VanDerWaalsContact O-CB 3.29Å; S228-S232 WeakPolarHBondContact O-CB 3.49Å; S228-S232 PolarHBondContact O-N 2.68Å
229	I	96.2	Very high	92.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.6	-53.3	164.3	-52.2	174.5	0	0	0	109.5	I67 V127 T181 V183 V218 I226 M227 S232 L233	I67-I229 HydrophobicContact CG2-CD1 3.6Å; V127-I229 HydrophobicContact CG1-CG2 3.92Å; V127-I229 HydrophobicContact CG2-CG2 3.71Å; T181-I229 HydrophobicContact CG2-CG2 4.3Å; V183-I229 HydrophobicContact CG1-CD1 4.25Å; V183-I229 HydrophobicContact CG2-CD1 4.01Å; V183-I229 HydrophobicContact CG2-CG1 3.86Å; V183-I229 HydrophobicContact CG2-CG2 4.06Å; V218-I229 HydrophobicContact CG1-CD1 4.39Å; V218-I229 HydrophobicContact CG2-CD1 4.05Å; V218-I229 HydrophobicContact CG2-CG1 3.88Å; I226-I229 WeakPolarHBondContact O-CG1 3.38Å; M227-I229 PolarHBondContact O-N 3.12Å; I229-S232 PolarHBondContact O-N 2.96Å; I229-L233 WeakPolarHBondContact O-CG 3.31Å; I229-L233 PolarHBondContact O-N 3.42Å; I229-L233 VanDerWaalsContact O-N 3.14Å
230	F	93.6	Very high	91.8	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-72	-37	-177.1	-60	-83.3	0	0	0	111.7	I54 F56 F71 L101 L103 M227 S232 L233 W234 L355	I54-F230 HydrophobicContact CD1-CD1 3.98Å; I54-F230 HydrophobicContact CD1-CE1 3.91Å; F56-F230 HydrophobicContact CZ-CZ 4.19Å; F71-F230 HydrophobicContact CB-CE2 4.12Å; F71-F230 HydrophobicContact CB-CZ 4.46Å; F71-F230 HydrophobicContact CD1-CE1 4.37Å; F71-F230 AromaticContact CD1-CE2 3.81Å; F71-F230 HydrophobicContact CD1-CE2 3.81Å; F71-F230 AromaticContact CD1-CZ 3.56Å; F71-F230 HydrophobicContact CD1-CZ 3.56Å; F71-F230 AromaticContact CD2-CD2 3.77Å; F71-F230 HydrophobicContact CD2-CD2 3.77Å; F71-F230 AromaticContact CD2-CE2 3.32Å; F71-F230 HydrophobicContact CD2-CE2 3.32Å; F71-F230 AromaticContact CD2-CZ 3.97Å; F71-F230 HydrophobicContact CD2-CZ 3.97Å; F71-F230 AromaticContact CE1-CE1 4Å; F71-F230 HydrophobicContact CE1-CE1 4Å; F71-F230 AromaticContact CE1-CE2 3.98Å; F71-F230 HydrophobicContact CE1-CE2 3.98Å; F71-F230 AromaticContact CE1-CZ 3.62Å; F71-F230 HydrophobicContact CE1-CZ 3.62Å; F71-F230 AromaticContact CE2-CD2 3.6Å; F71-F230 HydrophobicContact CE2-CD2 3.6Å; F71-F230 AromaticContact CE2-CE2 3.52Å; F71-F230 HydrophobicContact CE2-CE2 3.52Å; F71-F230 HydrophobicContact CE2-CG 4.18Å; F71-F230 HydrophobicContact CE2-CZ 4.02Å; F71-F230 HydrophobicContact CG-CD2 4.36Å; F71-F230 AromaticContact CG-CE2 3.46Å; F71-F230 HydrophobicContact CG-CE2 3.46Å; F71-F230 VanDerWaalsContact CG-CE2 3.46Å; F71-F230 AromaticContact CG-CZ 3.73Å; F71-F230 HydrophobicContact CG-CZ 3.73Å; F71-F230 HydrophobicContact CZ-CD1 4.3Å; F71-F230 HydrophobicContact CZ-CD2 4.06Å; F71-F230 HydrophobicContact CZ-CE1 4.08Å; F71-F230 AromaticContact CZ-CE2 3.84Å; F71-F230 HydrophobicContact CZ-CE2 3.84Å; F71-F230 HydrophobicContact CZ-CG 4.29Å; F71-F230 AromaticContact CZ-CZ 3.84Å; F71-F230 HydrophobicContact CZ-CZ 3.84Å; L101-F230 HydrophobicContact CD2-CD1 4.33Å; L101-F230 HydrophobicContact CD2-CE1 4.07Å; L103-F230 HydrophobicContact CD1-CZ 4.32Å; L103-F230 HydrophobicContact CD2-CE1 4.02Å; L103-F230 HydrophobicContact CD2-CZ 4.48Å; M227-F230 PolarHBondContact O-N 3.15Å; F230-S232 VanDerWaalsContact C-N 3.35Å; F230-S232 PolarHBondContact O-N 3.04Å; F230-L233 PolarHBondContact O-N 3.21Å; F230-W234 PolarHBondContact O-N 3.06Å; F230-L355 HydrophobicContact CB-CD2 4.06Å; F230-L355 HydrophobicContact CG-CD2 4.48Å
231	E	91.7	Very high	91	Very high	51 Å²	51	46.3 Å²	46.3	24%	0.238	25%	0.246	C	C	.	.	H	α-helix	trans	-58.3	-45.8	172.6	-64.6	159.3	178.8	0	0	111.2	M227 S228 L233 W234 L235 C357	M227-E231 PolarHBondContact O-N 2.85Å; S228-E231 VanDerWaalsContact CA-OE2 3.23Å; S228-E231 WeakPolarHBondContact CA-OE2 3.16Å; S228-E231 WeakPolarHBondContact CB-OE2 3.41Å; S228-E231 PolarHBondContact OG-OE2 2.71Å; E231-L233 PolarHBondContact O-N 3.15Å; E231-W234 PolarHBondContact O-N 3.48Å; E231-L235 VanDerWaalsContact O-CB 3.27Å; E231-L235 WeakPolarHBondContact O-CB 3.45Å; E231-L235 WeakPolarHBondContact O-CD1 3.44Å; E231-L235 VanDerWaalsContact O-CG 3.28Å; E231-L235 WeakPolarHBondContact O-CG 3.44Å; E231-L235 PolarHBondContact O-N 3.17Å; E231-C357 HydrophobicContact CG-CB 4.44Å
232	S	92.2	Very high	90.1	Very high	9 Å²	9	42.8 Å²	42.8	6%	0.063	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-41.9	175.4	179.1	0	0	0	0	112.4	T181 S213 S228 I229 F230 Q236	T181-S232 WeakPolarHBondContact OG1-CB 3.48Å; T181-S232 PolarHBondContact OG1-OG 3.11Å; S213-S232 PolarHBondContact O-OG 2.97Å; S228-S232 VanDerWaalsContact O-CB 3.29Å; S228-S232 WeakPolarHBondContact O-CB 3.49Å; S228-S232 PolarHBondContact O-N 2.68Å; I229-S232 PolarHBondContact O-N 2.96Å; F230-S232 VanDerWaalsContact C-N 3.35Å; F230-S232 PolarHBondContact O-N 3.04Å; S232-Q236 VanDerWaalsContact O-CG 3.3Å; S232-Q236 WeakPolarHBondContact O-CG 3.25Å; S232-Q236 PolarHBondContact O-N 3.39Å; S232-Q236 PolarHBondContact O-NE2 3.08Å; S232-Q236 VanDerWaalsContact O-NE2 3.12Å; S232-Q236 PolarHBondContact OG-NE2 2.88Å
233	L	93	Very high	89.2	Confident	4 Å²	4	40 Å²	40	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-66.6	-43.1	176.6	-64.1	174.1	0	0	0	112.3	I54 A125 V127 P179 T181 I229 F230 E231 Q236 N237	I54-L233 HydrophobicContact CD1-CD1 3.82Å; I54-L233 HydrophobicContact CG2-CD1 4.14Å; A125-L233 HydrophobicContact CB-CD1 4.43Å; A125-L233 HydrophobicContact CB-CD2 4.25Å; V127-L233 HydrophobicContact CG2-CD1 3.84Å; P179-L233 HydrophobicContact CB-CB 4.07Å; P179-L233 HydrophobicContact CB-CD2 3.67Å; P179-L233 HydrophobicContact CB-CG 4.48Å; P179-L233 WeakPolarHBondContact CB-O 3.2Å; P179-L233 WeakPolarHBondContact CG-O 3.47Å; T181-L233 WeakPolarHBondContact OG1-CD2 3.49Å; I229-L233 WeakPolarHBondContact O-CG 3.31Å; I229-L233 PolarHBondContact O-N 3.42Å; I229-L233 VanDerWaalsContact O-N 3.14Å; F230-L233 PolarHBondContact O-N 3.21Å; E231-L233 PolarHBondContact O-N 3.15Å; L233-Q236 PolarHBondContact O-N 3.32Å; L233-N237 WeakPolarHBondContact O-CB 3.13Å; L233-N237 PolarHBondContact O-N 2.99Å
234	W	89.4	Confident	88.2	Confident	6 Å²	6	41.6 Å²	41.6	2%	0.023	23%	0.232	C	C	.	.	H	α-helix	trans	-71.5	-34.5	179.3	-64	127.1	0	0	0	112.7	V52 V94 V99 L101 F230 E231 N237 D238 I243 L245	V52-W234 HydrophobicContact CG1-CH2 4.08Å; V52-W234 HydrophobicContact CG2-CH2 4.41Å; V94-W234 HydrophobicContact CG1-CD2 4.04Å; V94-W234 HydrophobicContact CG1-CG 4.24Å; V94-W234 HydrophobicContact CG1-CZ2 4.44Å; V94-W234 HydrophobicContact CG2-CZ2 3.97Å; V99-W234 HydrophobicContact CG1-CH2 4.47Å; L101-W234 HydrophobicContact CD1-CH2 4.49Å; L101-W234 HydrophobicContact CD1-CZ2 4.19Å; F230-W234 PolarHBondContact O-N 3.06Å; E231-W234 PolarHBondContact O-N 3.48Å; W234-N237 HydrophobicContact CE3-CB 4.46Å; W234-N237 PolarHBondContact O-N 2.67Å; W234-D238 PolarHBondContact O-N 3.16Å; W234-I243 HydrophobicContact CZ3-CD1 4.25Å; W234-L245 HydrophobicContact CZ3-CD1 4.38Å; W234-L245 HydrophobicContact CZ3-CD2 4.49Å
235	L	87.9	Confident	87.2	Confident	84 Å²	84	39.4 Å²	39.4	44%	0.44	22%	0.221	S	C	.	.	H	α-helix	trans	-62.4	-43.2	171.2	-82.1	165	0	0	0	111.8	E231 N237 D238 I359	E231-L235 VanDerWaalsContact O-CB 3.27Å; E231-L235 WeakPolarHBondContact O-CB 3.45Å; E231-L235 WeakPolarHBondContact O-CD1 3.44Å; E231-L235 VanDerWaalsContact O-CG 3.28Å; E231-L235 WeakPolarHBondContact O-CG 3.44Å; E231-L235 PolarHBondContact O-N 3.17Å; L235-N237 VanDerWaalsContact C-N 3.35Å; L235-D238 WeakPolarHBondContact O-CB 3.49Å; L235-D238 PolarHBondContact O-N 3.49Å; L235-I359 HydrophobicContact CD2-CD1 3.5Å; L235-I359 HydrophobicContact CD2-CG1 4.48Å; L235-I359 HydrophobicContact CG-CD1 4.07Å
236	Q	89.2	Confident	85.7	Confident	30 Å²	30	40.4 Å²	40.4	14%	0.14	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-43.2	173.3	-74.7	172.4	73.8	0	0	111.3	P179 I180 T181 Q214 S232 L233 D238 V239 S240	P179-Q236 HydrophobicContact CB-CB 3.91Å; P179-Q236 HydrophobicContact CG-CB 4.22Å; I180-Q236 PolarHBondContact O-NE2 3.44Å; I180-Q236 PolarHBondContact O-OE1 3.14Å; T181-Q236 PolarHBondContact OG1-NE2 3.05Å; Q214-Q236 HydrophobicContact CG-CG 4.48Å; S232-Q236 VanDerWaalsContact O-CG 3.3Å; S232-Q236 WeakPolarHBondContact O-CG 3.25Å; S232-Q236 PolarHBondContact O-N 3.39Å; S232-Q236 PolarHBondContact O-NE2 3.08Å; S232-Q236 VanDerWaalsContact O-NE2 3.12Å; S232-Q236 PolarHBondContact OG-NE2 2.88Å; L233-Q236 PolarHBondContact O-N 3.32Å; Q236-D238 PolarHBondContact O-N 2.93Å; Q236-V239 PolarHBondContact O-N 2.67Å; Q236-S240 PolarHBondContact O-N 2.61Å; Q236-S240 PolarHBondContact O-OG 3.22Å
237	N	87.8	Confident	84	Confident	9 Å²	9	48.2 Å²	48.2	5%	0.048	26%	0.258	C	S	.	.	H	α-helix	trans	-65	-23.8	177.9	-167.4	63.7	0	0	0	113.8	P179 L233 W234 L235 V239 K241 A242 I243	P179-N237 HydrophobicContact CG-CB 3.89Å; L233-N237 WeakPolarHBondContact O-CB 3.13Å; L233-N237 PolarHBondContact O-N 2.99Å; W234-N237 HydrophobicContact CE3-CB 4.46Å; W234-N237 PolarHBondContact O-N 2.67Å; L235-N237 VanDerWaalsContact C-N 3.35Å; N237-V239 VanDerWaalsContact C-N 3.29Å; N237-K241 VanDerWaalsContact O-CA 3.27Å; N237-K241 WeakPolarHBondContact O-CA 3.32Å; N237-K241 PolarHBondContact O-N 3.3Å; N237-A242 PolarHBondContact OD1-N 3.15Å; N237-I243 PolarHBondContact ND2-O 2.84Å; N237-I243 WeakPolarHBondContact OD1-CA 3.26Å; N237-I243 WeakPolarHBondContact OD1-CB 3.35Å; N237-I243 WeakPolarHBondContact OD1-CG1 3.3Å; N237-I243 PolarHBondContact OD1-N 2.97Å
238	D	83.5	Confident	82.2	Confident	56 Å²	56	51 Å²	51	30%	0.299	27%	0.265	S	S	.	.	H	α-helix	trans	-65.6	-36	171.7	-84.3	-30.7	0	0	0	112.8	R95 W234 L235 Q236 K241	R95-D238 IonicContact CZ-OD1 2.64Å; R95-D238 IonicContact CZ-OD2 2.67Å; R95-D238 IonicContact NH1-OD1 3.98Å; R95-D238 PolarHBondContact NH1-OD1 2.96Å; R95-D238 IonicContact NH1-OD2 2.68Å; R95-D238 PolarHBondContact NH1-OD2 3.45Å; R95-D238 IonicContact NH2-OD1 2.93Å; R95-D238 IonicContact NH2-OD2 2.7Å; R95-D238 PolarHBondContact NH2-OD2 2.83Å; W234-D238 PolarHBondContact O-N 3.16Å; L235-D238 WeakPolarHBondContact O-CB 3.49Å; L235-D238 PolarHBondContact O-N 3.49Å; Q236-D238 PolarHBondContact O-N 2.93Å; D238-K241 WeakPolarHBondContact O-CD 3.47Å; D238-K241 WeakPolarHBondContact O-CE 3.34Å; D238-K241 PolarHBondContact O-NZ 3.25Å; D238-K241 IonicContact OD1-NZ 2.68Å
239	V	79.9	Confident	80.4	Confident	96 Å²	96	52.5 Å²	52.5	58%	0.582	27%	0.27	S	S	*	.	H	α-helix	trans	-80.1	-44.4	179.1	-176.9	0	0	0	0	109.8	N175 Q236 N237	N175-V239 WeakPolarHBondContact OD1-CG1 3.4Å; Q236-V239 PolarHBondContact O-N 2.67Å; N237-V239 VanDerWaalsContact C-N 3.29Å
240	S	82.1	Confident	78.5	Confident	5 Å²	5	55.8 Å²	55.8	4%	0.035	30%	0.304	C	S	.	.	H	α-helix	trans	-88.1	-19	-174.9	72.8	0	0	0	0	115.9	N175 M176 A177 Q236 A242	N175-S240 CarbonylContact O-C 3.55Å; N175-S240 VanDerWaalsContact O-C 3.27Å; N175-S240 WeakPolarHBondContact O-CA 3.36Å; M176-S240 WeakPolarHBondContact CE-O 3.36Å; A177-S240 VanDerWaalsContact O-CB 3.27Å; A177-S240 WeakPolarHBondContact O-CB 3.43Å; A177-S240 PolarHBondContact O-OG 3.5Å; Q236-S240 PolarHBondContact O-N 2.61Å; Q236-S240 PolarHBondContact O-OG 3.22Å; S240-A242 PolarHBondContact O-N 2.8Å
241	K	81.1	Confident	76.7	Confident	122 Å²	122	61.7 Å²	61.7	53%	0.53	34%	0.34	S	S	.	.			trans	48.3	18.2	-173.3	-54.9	-51.4	-169.1	-153.8	0	114.8	N237 D238 I243	N237-K241 VanDerWaalsContact O-CA 3.27Å; N237-K241 WeakPolarHBondContact O-CA 3.32Å; N237-K241 PolarHBondContact O-N 3.3Å; D238-K241 WeakPolarHBondContact O-CD 3.47Å; D238-K241 WeakPolarHBondContact O-CE 3.34Å; D238-K241 PolarHBondContact O-NZ 3.25Å; D238-K241 IonicContact OD1-NZ 2.68Å; K241-I243 PolarHBondContact O-N 2.94Å; K241-I243 VanDerWaalsContact O-N 3.16Å
242	A	77.5	Confident	74.8	Confident	37 Å²	37	65.5 Å²	65.5	31%	0.306	35%	0.352	S	S	.	.			trans	-65.3	-22.7	-173.9	0	0	0	0	0	112.6	N237 S240	N237-A242 PolarHBondContact OD1-N 3.15Å; S240-A242 PolarHBondContact O-N 2.8Å
243	I	78	Confident	72.7	Confident	13 Å²	13	74.6 Å²	74.6	7%	0.067	39%	0.385	C	S	.	.	S	Bend	trans	-110.8	100.7	170.6	-48.8	168.8	0	0	0	107.4	V52 N124 A125 P179 W234 N237 K241 L245	V52-I243 HydrophobicContact CG1-CD1 3.89Å; V52-I243 HydrophobicContact CG1-CG2 4.23Å; V52-I243 HydrophobicContact CG2-CG2 3.48Å; V52-I243 VanDerWaalsContact CG2-CG2 3.48Å; N124-I243 HydrophobicContact CB-CD1 4.26Å; N124-I243 HydrophobicContact CB-CG1 4.2Å; A125-I243 HydrophobicContact CB-CD1 4.42Å; P179-I243 HydrophobicContact CG-CD1 4.24Å; W234-I243 HydrophobicContact CZ3-CD1 4.25Å; N237-I243 PolarHBondContact ND2-O 2.84Å; N237-I243 WeakPolarHBondContact OD1-CA 3.26Å; N237-I243 WeakPolarHBondContact OD1-CB 3.35Å; N237-I243 WeakPolarHBondContact OD1-CG1 3.3Å; N237-I243 PolarHBondContact OD1-N 2.97Å; K241-I243 PolarHBondContact O-N 2.94Å; K241-I243 VanDerWaalsContact O-N 3.16Å; I243-L245 HydrophobicContact CG2-CD2 3.96Å
244	T	75.9	Confident	70.2	Confident	102 Å²	102	78.9 Å²	78.9	63%	0.626	42%	0.421	S	S	*	.			trans	-63.8	135.5	166.8	-54.1	0	0	0	0	109.3
245	L	73	Confident	68	Low	35 Å²	35	84.1 Å²	84.1	18%	0.183	46%	0.459	C	S	.	.			trans	-122.4	123	170.8	-56.3	179.7	0	0	0	108.2	E50 V52 H97 V99 W234 I243	E50-L245 WeakPolarHBondContact OE2-CA 3.39Å; V52-L245 HydrophobicContact CG2-CD2 4.39Å; H97-L245 HydrophobicContact CB-CB 4.26Å; H97-L245 VanDerWaalsContact CD2-CB 3.46Å; H97-L245 WeakPolarHBondContact CD2-CB 3.38Å; H97-L245 PolarHBondContact CD2-O 2.79Å; V99-L245 HydrophobicContact CG1-CD2 4.23Å; V99-L245 HydrophobicContact CG2-CD1 4.35Å; V99-L245 HydrophobicContact CG2-CD2 3.72Å; W234-L245 HydrophobicContact CZ3-CD1 4.38Å; W234-L245 HydrophobicContact CZ3-CD2 4.49Å; I243-L245 HydrophobicContact CG2-CD2 3.96Å
246	V	65.5	Low	65.7	Low	80 Å²	80	88.4 Å²	88.4	49%	0.485	48%	0.481	S	S	.	.			trans	-78.2	123.4	174.7	166.9	0	0	0	0	109.9	E50 H97 W248	E50-V246 VanDerWaalsContact OE1-CG2 3.31Å; E50-V246 WeakPolarHBondContact OE1-CG2 3.46Å; E50-V246 WeakPolarHBondContact OE2-CB 3.23Å; E50-V246 PolarHBondContact OE2-N 2.84Å; H97-V246 PolarHBondContact CD2-O 3.08Å; V246-W248 PolarHBondContact O-N 2.85Å
247	K	59.3	Low	63.5	Low	167 Å²	167	91.8 Å²	91.8	73%	0.726	51%	0.508	S	S	*	.			trans	-55.2	126.5	175.7	-77.3	-178.1	176.4	-178.4	0	109.7	H97 D249	H97-K247 PolarHBondContact CD2-N 3.36Å; H97-K247 VanDerWaalsContact NE2-CG 3.3Å; H97-K247 WeakPolarHBondContact NE2-CG 3.18Å; K247-D249 PolarHBondContact O-N 2.89Å
248	W	54.8	Low	61	Low	128 Å²	128	98.7 Å²	98.7	49%	0.485	55%	0.545	S	S	.	.			trans	-70.7	101.9	172.6	-179.4	-92.4	0	0	0	109.6	N96 I98 V246 G250	N96-W248 WeakPolarHBondContact O-CB 3.21Å; I98-W248 HydrophobicContact CB-CE3 4.05Å; I98-W248 HydrophobicContact CB-CZ3 4.48Å; I98-W248 HydrophobicContact CD1-CD2 3.69Å; I98-W248 HydrophobicContact CD1-CE3 3.65Å; I98-W248 HydrophobicContact CD1-CG 4.39Å; I98-W248 HydrophobicContact CD1-CH2 3.94Å; I98-W248 HydrophobicContact CD1-CZ2 3.97Å; I98-W248 HydrophobicContact CD1-CZ3 3.78Å; I98-W248 HydrophobicContact CG1-CD2 3.95Å; I98-W248 HydrophobicContact CG1-CE3 3.86Å; I98-W248 HydrophobicContact CG1-CG 4.29Å; I98-W248 HydrophobicContact CG1-CZ3 4.4Å; V246-W248 PolarHBondContact O-N 2.85Å; W248-G250 PolarHBondContact O-N 3.47Å
249	D	55.9	Low	58.9	Low	69 Å²	69	101.6 Å²	101.6	37%	0.369	57%	0.565	S	S	.	*			trans	-74.7	114.3	163.3	54.9	-29.8	0	0	0	109	K247 T251 R252	K247-D249 PolarHBondContact O-N 2.89Å; D249-T251 PolarHBondContact O-N 3.23Å; D249-R252 PolarHBondContact O-N 3.2Å; D249-R252 VanDerWaalsContact O-N 3.12Å; D249-R252 VanDerWaalsContact OD1-CD 3.23Å; D249-R252 WeakPolarHBondContact OD1-CD 3.33Å; D249-R252 WeakPolarHBondContact OD1-CG 3.41Å; D249-R252 IonicContact OD1-CZ 3.02Å; D249-R252 IonicContact OD1-NE 3.65Å; D249-R252 PolarHBondContact OD1-NE 2.8Å; D249-R252 IonicContact OD2-NE 2.73Å
250	G	57.3	Low	56.9	Low	69 Å²	69	106 Å²	106	71%	0.711	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-7.6	-176.9	0	0	0	0	0	115.2	W248	W248-G250 PolarHBondContact O-N 3.47Å
251	T	54.9	Low	54.9	Low	124 Å²	124	110.2 Å²	110.2	76%	0.761	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-13.1	179	-26.2	0	0	0	0	113.7	D249 R253	D249-T251 PolarHBondContact O-N 3.23Å; T251-R253 PolarHBondContact O-N 3.29Å; T251-R253 VanDerWaalsContact O-N 3.08Å
252	R	52.5	Low	52.9	Low	130 Å²	130	108 Å²	108	49%	0.491	63%	0.627	S	S	.	*			trans	-72.2	107	-178	-77.8	-173.6	-171	-120.3	1.9	113.2	E47 D249	E47-R252 IonicContact OE1-NH1 3.41Å; D249-R252 PolarHBondContact O-N 3.2Å; D249-R252 VanDerWaalsContact O-N 3.12Å; D249-R252 VanDerWaalsContact OD1-CD 3.23Å; D249-R252 WeakPolarHBondContact OD1-CD 3.33Å; D249-R252 WeakPolarHBondContact OD1-CG 3.41Å; D249-R252 IonicContact OD1-CZ 3.02Å; D249-R252 IonicContact OD1-NE 3.65Å; D249-R252 PolarHBondContact OD1-NE 2.8Å; D249-R252 IonicContact OD2-NE 2.73Å
253	R	48.9	Very low	51	Low	200 Å²	200	114 Å²	114	76%	0.755	65%	0.652	S	S	*	*			trans	96.3	82.8	168	-57.6	-176.8	179.3	177.8	2.5	116.8	E47 T251	E47-R253 IonicContact OE2-CZ 3.57Å; E47-R253 IonicContact OE2-NE 2.67Å; E47-R253 PolarHBondContact OE2-NE 3.08Å; E47-R253 IonicContact OE2-NH2 3.45Å; E47-R253 PolarHBondContact OE2-NH2 3.07Å; T251-R253 PolarHBondContact O-N 3.29Å; T251-R253 VanDerWaalsContact O-N 3.08Å
254	A	39.3	Very low	49.3	Very low	95 Å²	95	120.1 Å²	120.1	79%	0.785	69%	0.69	S	S	*	*				-108	116.1	117.6	0	0	0	0	0	108.2	L256	A254-L256 PolarHBondContact O-N 3.45Å
255	S	44.4	Very low	47.5	Very low	116 Å²	116	121.6 Å²	121.6	81%	0.811	70%	0.699	S	S	*	*			trans	-68.7	114.2	172.8	50.1	0	0	0	0	109.1	S257	S255-S257 PolarHBondContact O-N 2.95Å
256	L	38.9	Very low	45.9	Very low	173 Å²	173	125.8 Å²	125.8	91%	0.906	73%	0.731	S	S	*	*			trans	-62.6	104.6	175.9	-77.3	167	0	0	0	110.2	A254 N258	A254-L256 PolarHBondContact O-N 3.45Å; L256-N258 PolarHBondContact O-N 3.2Å; L256-N258 VanDerWaalsContact O-N 3.13Å
257	S	42.7	Very low	44.8	Very low	102 Å²	102	129.3 Å²	129.3	71%	0.713	75%	0.753	S	S	*	*			trans	-67.4	104.5	163.6	52.9	0	0	0	0	108.2	S255 T259	S255-S257 PolarHBondContact O-N 2.95Å; S257-T259 PolarHBondContact O-N 3.32Å
258	N	34.7	Very low	43.7	Very low	153 Å²	153	125.2 Å²	125.2	82%	0.818	76%	0.759	S	S	*	*			trans	-68.6	97	179	-170.5	25.1	0	0	0	110	L256	L256-N258 PolarHBondContact O-N 3.2Å; L256-N258 VanDerWaalsContact O-N 3.13Å
259	T	40.5	Very low	43	Very low	118 Å²	118	124.1 Å²	124.1	72%	0.724	77%	0.77	S	S	*	*			trans	-104.5	96.5	175	-49	0	0	0	0	109.3	S257 A261	S257-T259 PolarHBondContact O-N 3.32Å; T259-A261 PolarHBondContact O-N 3.1Å
260	Q	37.9	Very low	42.1	Very low	188 Å²	188	127.7 Å²	127.7	88%	0.879	79%	0.79	S	S	*	*			trans	-72.8	109.2	176.2	-167.4	175.8	38.1	0	0	109.3
261	A	40.7	Very low	41.4	Very low	93 Å²	93	130.8 Å²	130.8	77%	0.769	80%	0.795	S	S	*	*			trans	-108.3	133.8	175.6	0	0	0	0	0	110.4	T259	T259-A261 PolarHBondContact O-N 3.1Å
262	G	38.4	Very low	40.7	Very low	77 Å²	77	131 Å²	131	79%	0.794	80%	0.801	S	S	*	*			trans	-75.7	152.7	-164.5	0	0	0	0	0	115.9
263	I	38.4	Very low	39.9	Very low	162 Å²	162	128 Å²	128	83%	0.831	81%	0.81	S	S	*	*			trans	-71.1	127.9	170.7	-63.1	161.8	0	0	0	109.3
264	T	40.4	Very low	39.2	Very low	142 Å²	142	127 Å²	127	87%	0.871	82%	0.82	S	S	*	*			trans	-136.2	141.1	155.4	49	0	0	0	0	109.7
265	T	38.1	Very low	39.2	Very low	132 Å²	132	130 Å²	130	81%	0.81	82%	0.821	S	S	*	*			trans	-108.5	133.2	-173.3	39.5	0	0	0	0	111
266	S	40.3	Very low	38.7	Very low	124 Å²	124	131.9 Å²	131.9	87%	0.867	82%	0.822	S	S	*	*			trans	-156.6	142.2	156.8	55.2	0	0	0	0	111.7
267	T	41.8	Very low	38.7	Very low	153 Å²	153	129.9 Å²	129.9	94%	0.939	82%	0.819	S	S	*	*			trans	-76.1	141.9	-176	23.8	0	0	0	0	113.4
268	G	37.8	Very low	38.3	Very low	82 Å²	82	133.1 Å²	133.1	85%	0.845	83%	0.826	S	S	*	*			trans	-171.6	132.5	170.4	0	0	0	0	0	110.3
269	S	40.2	Very low	38.1	Very low	104 Å²	104	129 Å²	129	73%	0.727	82%	0.821	S	S	*	*			trans	-108.5	158.6	-166.7	49.6	0	0	0	0	114.4
270	N	36.5	Very low	37.8	Very low	145 Å²	145	132 Å²	132	78%	0.775	83%	0.83	S	S	*	*			trans	86	149.9	156.8	-59.4	-22.3	0	0	0	120.8
271	T	42.6	Very low	37.5	Very low	133 Å²	133	134.2 Å²	134.2	82%	0.816	83%	0.831	S	S	*	*			trans	73.7	92.4	166	51.5	0	0	0	0	119.9
272	S	39.1	Very low	37.1	Very low	128 Å²	128	138.2 Å²	138.2	90%	0.895	83%	0.834	S	S	*	*				41.6	110.1	123.1	-50.2	0	0	0	0	120.3
273	G	36.3	Very low	36.8	Very low	67 Å²	67	141 Å²	141	69%	0.691	84%	0.835	S	S	*	*			trans	168.5	81	162.8	0	0	0	0	0	114.8	I275	G273-I275 PolarHBondContact O-N 3.13Å
274	N	33.6	Very low	36.3	Very low	180 Å²	180	139.4 Å²	139.4	96%	0.963	83%	0.829	S	S	*	*			trans	-73	111.1	169.1	-86.6	-7.2	0	0	0	110
275	I	39.8	Very low	35.9	Very low	157 Å²	157	143 Å²	143	81%	0.805	83%	0.832	S	S	*	*			trans	-129.8	114	169.9	-59.6	179.4	0	0	0	108.4	G273	G273-I275 PolarHBondContact O-N 3.13Å
276	L	33	Very low	35.6	Very low	157 Å²	157	141.8 Å²	141.8	82%	0.822	83%	0.829	S	S	*	*			trans	-93.7	139.6	169.1	-75.4	166.7	0	0	0	109.6
277	P	39.2	Very low	35.3	Very low	130 Å²	130	139.9 Å²	139.9	84%	0.844	82%	0.821	S	S	*	*			trans	-68.6	145.9	173.6	-18.2	32.1	0	0	0	112.9
278	I	35.1	Very low	34.7	Very low	170 Å²	170	141.4 Å²	141.4	87%	0.872	82%	0.822	S	S	*	*			trans	-104.8	145.1	-173.6	-78.1	166	0	0	0	111.6
279	G	30.7	Very low	34.4	Very low	68 Å²	68	143.2 Å²	143.2	70%	0.701	82%	0.822	S	S	*	*			trans	87.1	144.8	162.7	0	0	0	0	0	114.3
280	I	34.7	Very low	34	Very low	179 Å²	179	142 Å²	142	92%	0.918	83%	0.826	S	S	*	*			cis	-127.9	151.9	29.9	-71.4	161.7	0	0	0	111.3
281	R	31.2	Very low	34	Very low	235 Å²	235	141.3 Å²	141.3	89%	0.887	83%	0.827	S	S	*	*			trans	-77	147.8	-171	-66.5	177.1	169.1	174.1	-5.9	114.4
282	E	31.1	Very low	33.5	Very low	178 Å²	178	140.6 Å²	140.6	83%	0.832	82%	0.822	S	S	*	*			trans	-68.8	160.7	154.9	-64.1	172.3	131.4	0	0	110.8
283	T	33.2	Very low	33.4	Very low	136 Å²	136	140 Å²	140	83%	0.834	82%	0.816	S	S	*	*			trans	-126.5	115.9	167.7	51.2	0	0	0	0	109.5
284	D	28.3	Very low	33.2	Very low	128 Å²	128	144.1 Å²	144.1	68%	0.684	82%	0.822	S	S	*	*			trans	-66.2	154	-176.4	-53.2	-77	0	0	0	113.8
285	F	32.2	Very low	33.2	Very low	217 Å²	217	143.2 Å²	143.2	95%	0.952	82%	0.817	S	S	*	*			trans	-148.5	67.9	150.3	-125.5	-79.3	0	0	0	110.9
286	S	31	Very low	32.9	Very low	106 Å²	106	141.6 Å²	141.6	74%	0.741	82%	0.815	S	S	*	*			trans	-126.1	70	-179.6	39.9	0	0	0	0	110.5
287	A	33.6	Very low	33	Very low	85 Å²	85	140.2 Å²	140.2	70%	0.702	81%	0.812	S	S	*	*			trans	-147.7	98.9	173.1	0	0	0	0	0	110.8
288	L	30.6	Very low	32.8	Very low	184 Å²	184	138.9 Å²	138.9	96%	0.963	81%	0.806	S	S	*	*			trans	177	68.3	150.3	-97.3	161.8	0	0	0	110.2
289	S	29.8	Very low	33.1	Very low	121 Å²	121	135 Å²	135	85%	0.846	79%	0.794	S	S	*	*			trans	-149.3	98.6	156.5	-173.6	0	0	0	0	107.2
290	G	33.5	Very low	33.4	Very low	78 Å²	78	138.6 Å²	138.6	80%	0.804	80%	0.797	S	S	*	*			trans	-124.1	108.9	-177.6	0	0	0	0	0	109.2
291	T	36.4	Very low	33.5	Very low	131 Å²	131	136.7 Å²	136.7	80%	0.804	79%	0.789	S	S	*	*			trans	-69.1	146.4	-172.3	-42	0	0	0	0	112.7
292	V	31.4	Very low	34.1	Very low	117 Å²	117	130.1 Å²	130.1	71%	0.709	78%	0.779	S	S	*	*			trans	-63.7	140.9	172.4	177.9	0	0	0	0	111.7
293	P	37.7	Very low	34.3	Very low	117 Å²	117	128.5 Å²	128.5	76%	0.76	78%	0.776	S	S	*	*			trans	-114.2	130.7	150	33.8	-23.8	0	0	0	111.6
294	N	31.2	Very low	34.7	Very low	152 Å²	152	130.2 Å²	130.2	81%	0.813	78%	0.778	S	S	*	*			trans	-67.9	140.7	167.5	-76.2	-27.4	0	0	0	110.4
295	N	34.6	Very low	35.2	Very low	162 Å²	162	131.4 Å²	131.4	87%	0.866	79%	0.785	S	S	*	*			trans	-155.2	136.5	133.8	-119.2	-15.1	0	0	0	113.1
296	T	31.7	Very low	35.6	Very low	123 Å²	123	126 Å²	126	76%	0.755	77%	0.771	S	S	*	*			trans	-69.5	156.8	176.2	21.4	0	0	0	0	113.4
297	V	36.1	Very low	35.8	Very low	127 Å²	127	128.3 Å²	128.3	77%	0.77	78%	0.776	S	S	*	*				164.6	124.7	123.4	156.2	0	0	0	0	111.1
298	S	35.5	Very low	36.1	Very low	102 Å²	102	129.8 Å²	129.8	71%	0.713	78%	0.776	S	S	*	*			trans	27.2	149.1	151.4	74.7	0	0	0	0	121.9
299	S	39.8	Very low	36.5	Very low	89 Å²	89	128.6 Å²	128.6	62%	0.622	77%	0.77	S	S	*	*			cis	179	158.8	15.1	24.8	0	0	0	0	110.4
300	N	37.3	Very low	36.7	Very low	143 Å²	143	126.8 Å²	126.8	77%	0.765	76%	0.757	S	S	*	*			trans	65.5	152.1	161.3	-57.3	7.7	0	0	0	115.7
301	D	37.9	Very low	36.8	Very low	140 Å²	140	130 Å²	130	75%	0.749	76%	0.756	S	S	*	*			cis	-167.4	160.6	-14	-108	-43.8	0	0	0	107.3
302	S	42.8	Very low	36.8	Very low	97 Å²	97	132.3 Å²	132.3	68%	0.678	76%	0.757	S	S	*	*			cis	-160.7	-176.2	-3	60.5	0	0	0	0	111.6
303	N	36.7	Very low	36.9	Very low	143 Å²	143	134.7 Å²	134.7	77%	0.765	77%	0.765	S	S	*	*			trans	-26.9	148.1	172.6	-54.6	-46.5	0	0	0	121.7
304	I	39.9	Very low	36.7	Very low	172 Å²	172	133.7 Å²	133.7	88%	0.882	76%	0.761	S	S	*	*				-172.6	149.4	100.3	-90.4	160.6	0	0	0	111.5
305	N	40.5	Very low	36.9	Very low	154 Å²	154	133.7 Å²	133.7	82%	0.824	76%	0.761	S	S	*	*			trans	-85.7	163.4	-165.3	-94.1	-27.4	0	0	0	116.9
306	P	39.2	Very low	36.8	Very low	103 Å²	103	132.4 Å²	132.4	67%	0.669	76%	0.759	S	S	*	*			trans	-93	163.2	167.4	39.1	-34.9	0	0	0	113.7
307	N	36.6	Very low	36.8	Very low	155 Å²	155	132 Å²	132	83%	0.829	76%	0.761	S	S	*	*			trans	173.2	150.6	152.6	-82.9	-32	0	0	0	105.4
308	T	38.1	Very low	36.6	Very low	115 Å²	115	133.5 Å²	133.5	71%	0.706	76%	0.763	S	S	*	*				171.7	139.7	69.2	-47.9	0	0	0	0	108.2
309	L	39.6	Very low	36.5	Very low	159 Å²	159	135.2 Å²	135.2	83%	0.832	77%	0.769	S	S	*	*			trans	31.6	155.6	145.6	-55.4	171.5	0	0	0	122.2
310	S	34.8	Very low	36	Very low	84 Å²	84	139.7 Å²	139.7	59%	0.587	78%	0.78	S	S	*	*			cis	177.5	163	-12.7	54.2	0	0	0	0	111.3
311	N	35.3	Very low	35.7	Very low	146 Å²	146	144.4 Å²	144.4	78%	0.781	79%	0.788	S	S	*	*			trans	82.2	154.2	144.5	-70.7	-1.9	0	0	0	124.2
312	E	36.5	Very low	35.2	Very low	178 Å²	178	147.2 Å²	147.2	83%	0.832	79%	0.793	S	S	*	*			trans	72.6	119.3	166.4	-72.3	170.4	163.6	0	0	117.1
313	L	34	Very low	34.7	Very low	167 Å²	167	151.8 Å²	151.8	87%	0.874	80%	0.803	S	S	*	*			cis	60.4	129.4	44.6	-57.7	174.5	0	0	0	112
314	S	32.9	Very low	34.4	Very low	96 Å²	96	149.3 Å²	149.3	67%	0.671	80%	0.797	S	S	*	*			cis	-154.6	-165.5	11.7	57.3	0	0	0	0	112.4
315	D	35.3	Very low	34	Very low	153 Å²	153	150.6 Å²	150.6	82%	0.818	80%	0.797	S	S	*	*			trans	104.1	146.2	154.6	-65.6	8	0	0	0	120.7
316	V	32.2	Very low	33.6	Very low	135 Å²	135	151 Å²	151	82%	0.818	79%	0.791	S	S	*	*			trans	-122.2	135.5	-156.8	170.1	0	0	0	0	110.1
317	S	31.6	Very low	33.4	Very low	113 Å²	113	155.3 Å²	155.3	79%	0.79	79%	0.794	S	S	*	*			trans	-165.6	140.8	142.9	39.4	0	0	0	0	112.8
318	I	31.3	Very low	33.4	Very low	160 Å²	160	155.7 Å²	155.7	82%	0.821	79%	0.791	S	S	*	*			trans	-88.4	131.2	177.4	-66.6	163.1	0	0	0	108.7
319	T	34.2	Very low	33.1	Very low	137 Å²	137	155.2 Å²	155.2	84%	0.84	80%	0.799	S	S	*	*			trans	-159.2	133.6	154.1	4.6	0	0	0	0	111.2
320	E	28.8	Very low	33.2	Very low	183 Å²	183	153.5 Å²	153.5	86%	0.855	79%	0.789	S	S	*	*			trans	-70.2	135.4	179.5	-57.4	-179.7	117.2	0	0	112.3
321	R	30.8	Very low	33.3	Very low	243 Å²	243	158.3 Å²	158.3	92%	0.917	80%	0.8	S	S	*	*			trans	-168.4	121.6	140.7	-103.2	147.7	-166	-178.3	5.4	112.5
322	K	27.8	Very low	33.3	Very low	199 Å²	199	162.7 Å²	162.7	87%	0.865	81%	0.805	S	S	*	*			trans	-0.5	118.3	157	-59.1	172	179.2	177.1	0	116.5
323	H	32.2	Very low	33.3	Very low	192 Å²	192	160.9 Å²	160.9	89%	0.889	80%	0.801	S	S	*	*			trans	-165.8	143.8	137.4	-112.9	-81.8	0	0	0	114.2
324	S	30.3	Very low	33.3	Very low	92 Å²	92	158.1 Å²	158.1	64%	0.643	80%	0.796	S	S	*	*			trans	61.2	99.8	143.4	-161.7	0	0	0	0	122.6
325	K	32.8	Very low	33.6	Very low	199 Å²	199	159.6 Å²	159.6	87%	0.865	80%	0.796	S	S	*	*				29.1	106.4	123.9	-60.3	175.3	177.8	176.9	0	118.5
326	F	32.4	Very low	34	Very low	161 Å²	161	163.3 Å²	163.3	71%	0.706	80%	0.798	S	S	*	*			trans	-161.4	133.3	146.7	-148.2	-145.3	0	0	0	114.7
327	R	33.2	Very low	34.5	Very low	195 Å²	195	163 Å²	163	74%	0.736	79%	0.792	S	S	*	*			trans	61.4	144	157.5	-72.5	179.1	-177.8	177.9	4	118.2
328	Q	38.5	Very low	34.9	Very low	162 Å²	162	162.4 Å²	162.4	76%	0.757	79%	0.787	S	S	*	*			cis	-125.1	139.2	3.4	-100.7	140.5	-8.2	0	0	111	I330	Q328-I330 HydrophobicContact CB-CD1 4.39Å; Q328-I330 HydrophobicContact CB-CG1 4.39Å; Q328-I330 HydrophobicContact CG-CD1 4.15Å
329	A	31.5	Very low	35.6	Very low	106 Å²	106	165.3 Å²	165.3	88%	0.876	79%	0.788	S	S	*	*			trans	-104.4	113.2	163.1	0	0	0	0	0	108
330	I	41.3	Very low	36	Very low	122 Å²	122	170 Å²	170	63%	0.626	79%	0.79	S	S	*	*			trans	-138.7	133.7	179.9	-68.1	-176.9	0	0	0	108.5	Q328	Q328-I330 HydrophobicContact CB-CD1 4.39Å; Q328-I330 HydrophobicContact CB-CG1 4.39Å; Q328-I330 HydrophobicContact CG-CD1 4.15Å
331	F	37.5	Very low	36.6	Very low	186 Å²	186	167 Å²	167	82%	0.816	79%	0.789	S	S	*	*			trans	53.5	71.8	178.4	-64.6	-62	0	0	0	119.1
332	R	34.2	Very low	37.1	Very low	238 Å²	238	161 Å²	161	90%	0.898	79%	0.785	S	S	*	*			trans	-86.6	108.2	137.6	-95.6	-175	152.2	124	-1.9	108.9
333	N	36.5	Very low	37.7	Very low	140 Å²	140	154.4 Å²	154.4	75%	0.749	77%	0.773	S	S	*	*			trans	-135.5	115.9	157	-96.6	-17.6	0	0	0	108.9	L335	N333-L335 PolarHBondContact O-N 2.93Å
334	S	34.8	Very low	38.2	Very low	108 Å²	108	155.1 Å²	155.1	76%	0.755	77%	0.773	S	S	*	*			trans	-92.1	102.8	-172.2	-59.2	0	0	0	0	111.4	R336	S334-R336 VanDerWaalsContact C-N 3.34Å; S334-R336 PolarHBondContact O-N 3.29Å
335	L	38.4	Very low	39	Very low	128 Å²	128	157.3 Å²	157.3	67%	0.67	78%	0.783	S	S	*	*			trans	-71.9	91.6	166	-77.7	173	0	0	0	110.1	N333 L337	N333-L335 PolarHBondContact O-N 2.93Å; L335-L337 PolarHBondContact O-N 3.36Å
336	R	43.9	Very low	39.2	Very low	230 Å²	230	156.2 Å²	156.2	87%	0.868	79%	0.787	S	S	*	*			trans	-80.8	111.9	175.5	-143.1	-179.2	-171.4	120.1	-2.2	108.2	S334 S338	S334-R336 VanDerWaalsContact C-N 3.34Å; S334-R336 PolarHBondContact O-N 3.29Å; R336-S338 VanDerWaalsContact C-N 3.35Å; R336-S338 PolarHBondContact O-N 3.37Å
337	L	41.7	Very low	39.8	Very low	130 Å²	130	157.3 Å²	157.3	68%	0.681	79%	0.791	S	S	*	*			trans	-58.3	96	169.4	-91	162.7	0	0	0	110	L335 R339 V353	L335-L337 PolarHBondContact O-N 3.36Å; L337-R339 PolarHBondContact O-N 2.96Å; L337-V353 HydrophobicContact CD2-CG1 4.36Å
338	S	41.3	Very low	40.1	Very low	99 Å²	99	154.8 Å²	154.8	69%	0.692	80%	0.802	S	S	*	*			trans	-72.8	85.6	178.7	165.9	0	0	0	0	110.3	R336 R340	R336-S338 VanDerWaalsContact C-N 3.35Å; R336-S338 PolarHBondContact O-N 3.37Å; S338-R340 VanDerWaalsContact C-N 3.32Å; S338-R340 PolarHBondContact O-N 2.88Å
339	R	46.4	Very low	40.2	Very low	222 Å²	222	155.8 Å²	155.8	84%	0.838	80%	0.804	S	S	*	*			trans	-65.2	91.7	162.8	-71.1	-171.7	-176.2	-176.3	1.5	109.2	L337 S341	L337-R339 PolarHBondContact O-N 2.96Å; R339-S341 PolarHBondContact O-N 3.27Å
340	R	42.8	Very low	40.9	Very low	235 Å²	235	155.8 Å²	155.8	89%	0.887	80%	0.795	S	S	*	*			trans	-69.5	81.7	165.1	-95.9	-169.7	171.2	-157.3	-0.9	109.7	S338 S342	S338-R340 VanDerWaalsContact C-N 3.32Å; S338-R340 PolarHBondContact O-N 2.88Å; R340-S342 VanDerWaalsContact C-N 3.34Å; R340-S342 PolarHBondContact O-N 3.46Å
341	S	39.7	Very low	41.6	Very low	119 Å²	119	157 Å²	157	83%	0.832	80%	0.802	S	S	*	*			trans	-68.2	93.4	160.7	-177.7	0	0	0	0	108.4	R339	R339-S341 PolarHBondContact O-N 3.27Å
342	S	42.9	Very low	42.7	Very low	119 Å²	119	151.5 Å²	151.5	83%	0.832	78%	0.781	S	S	*	*			trans	-95.9	114	164.7	-166.9	0	0	0	0	108	R340	R340-S342 VanDerWaalsContact C-N 3.34Å; R340-S342 PolarHBondContact O-N 3.46Å
343	G	39.9	Very low	43.9	Very low	59 Å²	59	142 Å²	142	61%	0.608	75%	0.749	S	S	*	*			trans	-73.7	166.8	-171.6	0	0	0	0	0	114.5
344	K	41.3	Very low	45	Very low	207 Å²	207	141.8 Å²	141.8	90%	0.9	74%	0.739	S	S	*	*			trans	65.6	79.3	168	-58.9	177.8	178.5	176.3	0	116
345	T	48.2	Very low	46.1	Very low	138 Å²	138	136.9 Å²	136.9	85%	0.847	70%	0.704	S	S	*	*				-171.1	133.9	119.6	31.2	0	0	0	0	109.8	K347	T345-K347 PolarHBondContact O-N 3.13Å
346	N	36.8	Very low	46.9	Very low	177 Å²	177	135.6 Å²	135.6	95%	0.947	70%	0.698	S	S	*	*			trans	-75	88.9	177.8	-81	-14.7	0	0	0	111.5
347	K	44.8	Very low	46.9	Very low	183 Å²	183	125.5 Å²	125.5	80%	0.796	66%	0.662	S	S	*	*			trans	-139.7	126.2	151.5	-81.6	-173.4	175.6	177.4	0	107.5	T345 K349	T345-K347 PolarHBondContact O-N 3.13Å; K347-K349 VanDerWaalsContact C-N 3.35Å; K347-K349 PolarHBondContact O-N 3.11Å
348	C	40.5	Very low	46.5	Very low	143 Å²	143	122.7 Å²	122.7	97%	0.966	66%	0.658	S	S	*	*			trans	-61	94.9	172.7	-89.4	0	0	0	0	110
349	K	39.2	Very low	45.9	Very low	182 Å²	182	123.2 Å²	123.2	79%	0.791	65%	0.652	S	S	*	*			trans	-76.5	140.4	159.3	-70.5	-175.9	177	-178.8	0	107.5	K347 D351	K347-K349 VanDerWaalsContact C-N 3.35Å; K347-K349 PolarHBondContact O-N 3.11Å; K349-D351 PolarHBondContact O-N 3.03Å
350	P	47.9	Very low	45	Very low	107 Å²	107	121 Å²	121	70%	0.695	67%	0.671	S	S	*	*			trans	-62.5	131.6	172	26.5	-33.1	0	0	0	109.5	I352	P350-I352 VanDerWaalsContact C-N 3.32Å; P350-I352 PolarHBondContact O-N 2.87Å
351	D	55.3	Low	45.1	Very low	146 Å²	146	115.4 Å²	115.4	78%	0.781	66%	0.66	S	S	*	*			trans	-67.9	88.6	173.3	-89.2	-14.5	0	0	0	109.7	K349 V353	K349-D351 PolarHBondContact O-N 3.03Å; D351-V353 PolarHBondContact O-N 3.44Å
352	I	59.3	Low	45.4	Very low	71 Å²	71	115.2 Å²	115.2	36%	0.364	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-73.7	116.8	171	-57.8	175.6	0	0	0	107.8	I93 P350	I93-I352 HydrophobicContact CD1-CG2 3.61Å; I93-I352 HydrophobicContact CG1-CG2 3.78Å; P350-I352 VanDerWaalsContact C-N 3.32Å; P350-I352 PolarHBondContact O-N 2.87Å
353	V	60.9	Low	45.5	Very low	39 Å²	39	114.9 Å²	114.9	24%	0.236	64%	0.641	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.7	131.2	174.3	175.8	0	0	0	0	108.8	F92 I93 L337 D351	F92-V353 VanDerWaalsContact CA-O 3.27Å; F92-V353 WeakPolarHBondContact CA-O 3.39Å; F92-V353 HydrophobicContact CD1-CB 3.66Å; F92-V353 HydrophobicContact CD1-CG1 3.9Å; F92-V353 WeakPolarHBondContact CD1-O 3.42Å; F92-V353 HydrophobicContact CE1-CB 3.73Å; F92-V353 HydrophobicContact CE1-CG1 3.81Å; I93-V353 PolarHBondContact N-O 3.15Å; I93-V353 VanDerWaalsContact N-O 3.11Å; L337-V353 HydrophobicContact CD2-CG1 4.36Å; D351-V353 PolarHBondContact O-N 3.44Å
354	Y	58.2	Low	45.8	Very low	136 Å²	136	118.2 Å²	118.2	53%	0.533	64%	0.643	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.3	120.6	174.4	-69.9	-106.6	0	0	0	108.6	I93 D356	I93-Y354 HydrophobicContact CB-CD1 4.04Å; I93-Y354 HydrophobicContact CB-CE1 4.36Å; I93-Y354 HydrophobicContact CB-CG 4.47Å; I93-Y354 HydrophobicContact CD1-CD1 3.9Å; I93-Y354 HydrophobicContact CD1-CE1 3.4Å; I93-Y354 HydrophobicContact CD1-CE2 4.07Å; I93-Y354 HydrophobicContact CD1-CG 4.42Å; I93-Y354 VanDerWaalsContact CD1-CZ 3.49Å; I93-Y354 HydrophobicContact CG1-CE1 4.47Å; I93-Y354 HydrophobicContact CG2-CD1 4.09Å; I93-Y354 HydrophobicContact CG2-CE1 4.33Å; Y354-D356 VanDerWaalsContact C-N 3.31Å; Y354-D356 PolarHBondContact O-N 2.8Å
355	L	59.6	Low	46.1	Very low	4 Å²	4	112.7 Å²	112.7	2%	0.021	63%	0.627	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.1	85.1	154.1	-87.4	92.9	0	0	0	106.8	F71 F92 I93 V94 M227 F230 C357	F71-L355 HydrophobicContact CE2-CD1 4.39Å; F71-L355 HydrophobicContact CE2-CD2 4.17Å; F71-L355 HydrophobicContact CZ-CD1 3.99Å; F71-L355 HydrophobicContact CZ-CD2 4.18Å; F92-L355 HydrophobicContact CB-CD1 3.54Å; F92-L355 HydrophobicContact CD1-CD1 3.09Å; F92-L355 HydrophobicContact CD2-CD1 4.15Å; F92-L355 HydrophobicContact CE1-CD1 3.66Å; F92-L355 HydrophobicContact CG-CD1 3.34Å; F92-L355 HydrophobicContact CZ-CD1 4.37Å; I93-L355 CarbonylContact O-C 3.49Å; I93-L355 WeakPolarHBondContact O-CA 3.37Å; I93-L355 PolarHBondContact O-N 3.06Å; V94-L355 HydrophobicContact CG2-CB 4.09Å; M227-L355 HydrophobicContact CE-CD2 3.85Å; M227-L355 HydrophobicContact CE-CG 3.92Å; F230-L355 HydrophobicContact CB-CD2 4.06Å; F230-L355 HydrophobicContact CG-CD2 4.48Å; L355-C357 PolarHBondContact O-N 3.28Å
356	D	53.6	Low	46	Very low	102 Å²	102	111 Å²	111	55%	0.545	61%	0.612	S	S	.	*			trans	-69.9	74.1	158.9	-68.3	-29.4	0	0	0	108	Y354 A358	Y354-D356 VanDerWaalsContact C-N 3.31Å; Y354-D356 PolarHBondContact O-N 2.8Å; D356-A358 PolarHBondContact O-N 3.29Å
357	C	45.1	Very low	46.6	Very low	17 Å²	17	106.3 Å²	106.3	12%	0.115	59%	0.588	C	S	.	*			trans	-69.6	62.3	157.9	-67.8	0	0	0	0	108	E231 L355 I359	E231-C357 HydrophobicContact CG-CB 4.44Å; L355-C357 PolarHBondContact O-N 3.28Å; C357-I359 VanDerWaalsContact C-N 3.3Å; C357-I359 PolarHBondContact O-N 3.2Å
358	A	32.2	Very low	46.8	Very low	72 Å²	72	100.4 Å²	100.4	60%	0.595	57%	0.572	S	S	*	*			trans	-76.6	85.4	177.1	0	0	0	0	0	108.2	D356 S360	D356-A358 PolarHBondContact O-N 3.29Å; A358-S360 PolarHBondContact O-N 3.33Å
359	I	28.8	Very low	47.3	Very low	109 Å²	109	96.8 Å²	96.8	56%	0.559	54%	0.539	S	S	*	.			trans	-68.6	109.4	158.2	-56.6	154.2	0	0	0	105.4	L235 C357	L235-I359 HydrophobicContact CD2-CD1 3.5Å; L235-I359 HydrophobicContact CD2-CG1 4.48Å; L235-I359 HydrophobicContact CG-CD1 4.07Å; C357-I359 VanDerWaalsContact C-N 3.3Å; C357-I359 PolarHBondContact O-N 3.2Å
360	S	27.4	Very low	48	Very low	177 Å²	177	89.1 Å²	89.1	100%	1.238	52%	0.517	S	S	*	.			trans	-99.1	0	167.7	70	0	0	0	0	110	A358	A358-S360 PolarHBondContact O-N 3.33Å

Retrieved 360 of 360 residues in 331.6 ms (Link to these results)

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