G4VS24_SCHMA Loading...

Putative lupus la ribonucleoprotein

AlphaFold DB , UniProt , Accession G4VS24, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 328 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	48.8	Very low	49.7	Very low	231 Å²	231	135.5 Å²	135.5	100%	1.138	81%	0.805	S	S	*	*				0	100.4	0	-63.5	179.2	-117.1	0	0	105.4
2	E	47.7	Very low	49.3	Very low	173 Å²	173	133.8 Å²	133.8	81%	0.808	80%	0.8	S	S	*	*				62.4	129.9	62.1	-64.6	-161.7	154.7	0	0	111.9
3	L	54.4	Low	48.4	Very low	162 Å²	162	133.1 Å²	133.1	85%	0.848	80%	0.796	S	S	*	*			cis	-140	175.8	-10.5	-73.9	120.5	0	0	0	107.4
4	G	56.8	Low	47.6	Very low	66 Å²	66	134.3 Å²	134.3	68%	0.68	80%	0.796	S	S	*	*			cis	-174.3	-178.4	3.2	0	0	0	0	0	110.7
5	P	62.5	Low	47.1	Very low	133 Å²	133	137.5 Å²	137.5	86%	0.864	80%	0.8	S	S	*	*			trans	-121	165.6	-158.1	40.8	-30.7	0	0	0	117.2
6	S	51.1	Low	46.4	Very low	125 Å²	125	138 Å²	138	87%	0.874	80%	0.798	S	S	*	*			trans	-153.3	132	157.6	53.4	0	0	0	0	113.3
7	G	46.6	Very low	46.4	Very low	69 Å²	69	142.1 Å²	142.1	71%	0.711	80%	0.804	S	S	*	*			trans	72.2	83.8	167.8	0	0	0	0	0	116.9
8	F	50.1	Low	45.9	Very low	206 Å²	206	144.1 Å²	144.1	90%	0.904	81%	0.806	S	S	*	*				40.4	135.3	83.7	-90.3	-101.8	0	0	0	114.8
9	S	46	Very low	45.5	Very low	81 Å²	81	144.1 Å²	144.1	57%	0.566	80%	0.804	S	S	*	*			cis	161.7	142.3	-18.4	-111.9	0	0	0	0	105.7
10	D	42.1	Very low	45.1	Very low	137 Å²	137	143.8 Å²	143.8	73%	0.733	80%	0.799	S	S	*	*			trans	44.2	146.7	131.7	-54.8	-60.6	0	0	0	121.3
11	C	40.7	Very low	45	Very low	108 Å²	108	141.7 Å²	141.7	73%	0.73	80%	0.801	S	S	*	*			cis	-163.8	174.3	-11.3	-117.2	0	0	0	0	107
12	P	44.6	Very low	44.5	Very low	114 Å²	114	136 Å²	136	74%	0.74	78%	0.779	S	S	*	*			trans	-85.9	-171.9	-173.6	36.4	-36.3	0	0	0	113.7
13	V	37.2	Very low	43.8	Very low	125 Å²	125	134.1 Å²	134.1	76%	0.758	78%	0.783	S	S	*	*			trans	120.2	125.5	160.9	176.9	0	0	0	0	115
14	L	38.3	Very low	43.1	Very low	150 Å²	150	130.6 Å²	130.6	79%	0.785	77%	0.772	S	S	*	*			trans	21.5	128.3	154.6	-56.7	165	0	0	0	119.7
15	Q	39.3	Very low	42.6	Very low	183 Å²	183	132.4 Å²	132.4	86%	0.855	76%	0.763	S	S	*	*				-175.1	143.4	114.3	-101.1	161.9	7	0	0	113.9
16	D	36.2	Very low	42.5	Very low	145 Å²	145	130 Å²	130	78%	0.775	75%	0.747	S	S	*	*			trans	-57	143.3	-176.1	-46.5	-73.2	0	0	0	114.6
17	K	45.9	Very low	43.1	Very low	208 Å²	208	132.6 Å²	132.6	90%	0.904	74%	0.743	S	S	*	*			trans	-138.9	87.7	156.5	-70.7	-163.9	177.9	-177.9	0	111.3
18	E	38.2	Very low	44.4	Very low	178 Å²	178	131.5 Å²	131.5	83%	0.832	72%	0.724	S	S	*	*			trans	-59.6	131.2	153.9	-57.6	179.2	128.2	0	0	109.6
19	N	37.8	Very low	45.6	Very low	143 Å²	143	127.3 Å²	127.3	77%	0.765	71%	0.707	S	S	*	*			trans	-177.2	108.9	148.2	-97.7	-31.9	0	0	0	108.2
20	I	37.5	Very low	47.7	Very low	138 Å²	138	128 Å²	128	71%	0.708	70%	0.704	S	S	*	*				73.1	96.3	78.4	-67	-179	0	0	0	112.2	V22	I20-V22 HydrophobicContact CG2-CG2 3.52Å
21	A	42.5	Very low	50	Low	101 Å²	101	124.7 Å²	124.7	84%	0.835	69%	0.685	S	S	*	*			trans	-159.9	62.1	152.5	0	0	0	0	0	107.1
22	V	39.2	Very low	52.6	Low	112 Å²	112	121.8 Å²	121.8	68%	0.679	66%	0.662	S	S	*	*				60.6	109.1	95.6	-178.3	0	0	0	0	112.1	I20 S24	I20-V22 HydrophobicContact CG2-CG2 3.52Å; V22-S24 PolarHBondContact O-N 3.47Å
23	C	32.7	Very low	55	Low	133 Å²	133	120.6 Å²	120.6	90%	0.899	65%	0.647	S	S	*	*			trans	-63.2	112.9	178.4	-55.7	0	0	0	0	112.2
24	S	40.5	Very low	57.8	Low	87 Å²	87	120.2 Å²	120.2	61%	0.608	64%	0.635	S	S	*	*			trans	-124.2	-7.1	169.5	51.3	0	0	0	0	114.8	V22	V22-S24 PolarHBondContact O-N 3.47Å
25	E	46.3	Very low	60.5	Low	105 Å²	105	113 Å²	113	49%	0.491	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.9	-8.3	-165.1	-67.8	-56.6	147	0	0	120.4	K27 S28	E25-K27 PolarHBondContact O-N 3.18Å; E25-K27 VanDerWaalsContact O-N 3.08Å; E25-S28 PolarHBondContact O-OG 3.32Å; E25-S28 PolarHBondContact OE2-OG 3.48Å
26	P	59.1	Low	63.3	Low	83 Å²	83	105.6 Å²	105.6	54%	0.539	56%	0.563	S	S	.	*	H	α-helix	trans	-71.6	-12.3	-172.8	29.3	-35.3	0	0	0	114.1	L30	P26-L30 WeakPolarHBondContact O-CB 3.48Å; P26-L30 WeakPolarHBondContact O-CD1 3.33Å; P26-L30 WeakPolarHBondContact O-CG 3.41Å
27	K	65.4	Low	66.1	Low	179 Å²	179	104.7 Å²	104.7	78%	0.778	55%	0.552	S	S	*	*	H	α-helix	trans	-92.7	-34.7	-176.3	-69.6	-178.9	-179.7	174.9	0	113.5	E25 M31	E25-K27 PolarHBondContact O-N 3.18Å; E25-K27 VanDerWaalsContact O-N 3.08Å; K27-M31 PolarHBondContact O-N 2.99Å
28	S	72.2	Confident	68.5	Low	45 Å²	45	96.3 Å²	96.3	32%	0.315	52%	0.516	S	S	.	.	H	α-helix	trans	-65.5	-56.1	176.5	29.1	0	0	0	0	110.3	E25 L30 M31 N32	E25-S28 PolarHBondContact O-OG 3.32Å; E25-S28 PolarHBondContact OE2-OG 3.48Å; S28-L30 PolarHBondContact O-N 3.02Å; S28-M31 WeakPolarHBondContact O-CB 3.39Å; S28-M31 PolarHBondContact O-N 2.99Å; S28-N32 PolarHBondContact O-N 2.87Å; S28-N32 PolarHBondContact O-OD1 2.62Å
29	E	76.4	Confident	71.3	Confident	118 Å²	118	87.8 Å²	87.8	55%	0.551	48%	0.477	S	S	*	.	H	α-helix	trans	-58.8	-47.3	-177.9	-62.3	-179.8	160.4	0	0	112.1	M31 N32 E33	E29-M31 PolarHBondContact O-N 3.44Å; E29-N32 PolarHBondContact O-N 2.91Å; E29-E33 PolarHBondContact O-N 2.85Å
30	L	89.1	Confident	74.1	Confident	95 Å²	95	82.5 Å²	82.5	50%	0.497	45%	0.447	S	S	.	.	H	α-helix	trans	-63.6	-22.5	176.3	-72.2	-179.5	0	0	0	113.9	P26 S28 K34	P26-L30 WeakPolarHBondContact O-CB 3.48Å; P26-L30 WeakPolarHBondContact O-CD1 3.33Å; P26-L30 WeakPolarHBondContact O-CG 3.41Å; S28-L30 PolarHBondContact O-N 3.02Å; L30-K34 WeakPolarHBondContact O-CD 3.5Å; L30-K34 VanDerWaalsContact O-CG 3.27Å; L30-K34 WeakPolarHBondContact O-CG 3.28Å
31	M	92.3	Very high	76.9	Confident	68 Å²	68	79 Å²	79	34%	0.335	43%	0.427	S	S	.	.	H	α-helix	trans	-80.3	-46.1	172.9	-172.8	63.5	89.4	0	0	110.9	K27 S28 E29 E33 K34 I35 L80	K27-M31 PolarHBondContact O-N 2.99Å; S28-M31 WeakPolarHBondContact O-CB 3.39Å; S28-M31 PolarHBondContact O-N 2.99Å; E29-M31 PolarHBondContact O-N 3.44Å; M31-E33 VanDerWaalsContact C-N 3.31Å; M31-E33 PolarHBondContact O-N 3.43Å; M31-K34 WeakPolarHBondContact O-CB 3.49Å; M31-K34 PolarHBondContact O-N 3.15Å; M31-I35 HydrophobicContact CG-CD1 4.04Å; M31-I35 WeakPolarHBondContact O-CG1 3.37Å; M31-I35 PolarHBondContact O-N 3.4Å; M31-L80 VanDerWaalsContact CE-O 3.31Å; M31-L80 WeakPolarHBondContact CE-O 3.27Å; M31-L80 HydrophobicContact SD-CB 3.96Å; M31-L80 HydrophobicContact SD-CD2 4.13Å
32	N	94.4	Very high	79.5	Confident	48 Å²	48	75 Å²	75	26%	0.257	39%	0.39	S	S	.	.	H	α-helix	trans	-58	-44.1	178.7	-64.3	-9.9	0	0	0	111	S28 E29 K34 I35 I36 S90	S28-N32 PolarHBondContact O-N 2.87Å; S28-N32 PolarHBondContact O-OD1 2.62Å; E29-N32 PolarHBondContact O-N 2.91Å; N32-K34 VanDerWaalsContact C-N 3.34Å; N32-K34 PolarHBondContact O-N 2.87Å; N32-I35 PolarHBondContact O-N 2.74Å; N32-I36 VanDerWaalsContact O-CG1 3.31Å; N32-I36 WeakPolarHBondContact O-CG1 3.38Å; N32-I36 PolarHBondContact O-N 3.46Å; N32-S90 PolarHBondContact OD1-OG 3.14Å
33	E	95.1	Very high	82.3	Confident	89 Å²	89	69.9 Å²	69.9	42%	0.416	36%	0.359	S	S	.	.	H	α-helix	trans	-56.9	-43	173.1	-80.9	-165.9	-154	0	0	113.4	E29 M31 I35 I36 K37	E29-E33 PolarHBondContact O-N 2.85Å; M31-E33 VanDerWaalsContact C-N 3.31Å; M31-E33 PolarHBondContact O-N 3.43Å; E33-I35 VanDerWaalsContact C-N 3.34Å; E33-I36 PolarHBondContact O-N 3.05Å; E33-K37 VanDerWaalsContact O-CB 3.3Å; E33-K37 WeakPolarHBondContact O-CB 3.46Å; E33-K37 WeakPolarHBondContact O-CD 3.46Å; E33-K37 WeakPolarHBondContact O-CG 3.48Å; E33-K37 PolarHBondContact O-N 3Å; E33-K37 IonicContact OE2-NZ 2.73Å; E33-K37 PolarHBondContact OE2-NZ 3.12Å
34	K	95.1	Very high	85.3	Confident	116 Å²	116	65.1 Å²	65.1	50%	0.504	33%	0.327	S	S	.	.	H	α-helix	trans	-66.7	-38.9	179.8	-72.9	170	-174.5	175.5	0	111.2	L30 M31 N32 Q38 L80	L30-K34 WeakPolarHBondContact O-CD 3.5Å; L30-K34 VanDerWaalsContact O-CG 3.27Å; L30-K34 WeakPolarHBondContact O-CG 3.28Å; M31-K34 WeakPolarHBondContact O-CB 3.49Å; M31-K34 PolarHBondContact O-N 3.15Å; N32-K34 VanDerWaalsContact C-N 3.34Å; N32-K34 PolarHBondContact O-N 2.87Å; K34-Q38 WeakPolarHBondContact O-CB 3.43Å; K34-Q38 PolarHBondContact O-N 3.46Å; K34-L80 HydrophobicContact CB-CD1 3.94Å; K34-L80 HydrophobicContact CB-CD2 3.97Å; K34-L80 HydrophobicContact CD-CD2 4.13Å
35	I	96.4	Very high	87.9	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-61.8	-51.4	175.1	-69.5	165.4	0	0	0	110.2	M31 N32 E33 K37 Q38 C39 L77 L80 T81 V86 I87	M31-I35 HydrophobicContact CG-CD1 4.04Å; M31-I35 WeakPolarHBondContact O-CG1 3.37Å; M31-I35 PolarHBondContact O-N 3.4Å; N32-I35 PolarHBondContact O-N 2.74Å; E33-I35 VanDerWaalsContact C-N 3.34Å; I35-K37 PolarHBondContact O-N 3.11Å; I35-Q38 PolarHBondContact O-N 3.18Å; I35-C39 PolarHBondContact O-N 2.94Å; I35-C39 PolarHBondContact O-SG 3.14Å; I35-L77 HydrophobicContact CB-CD1 4.47Å; I35-L77 HydrophobicContact CG1-CD1 4.25Å; I35-L77 HydrophobicContact CG2-CD1 4.1Å; I35-L80 HydrophobicContact CG1-CB 4.23Å; I35-L80 HydrophobicContact CG1-CD1 4.28Å; I35-T81 HydrophobicContact CD1-CG2 3.58Å; I35-T81 HydrophobicContact CG1-CG2 4.13Å; I35-V86 HydrophobicContact CD1-CG1 3.81Å; I35-I87 HydrophobicContact CG2-CB 4.43Å; I35-I87 HydrophobicContact CG2-CG1 4.45Å; I35-I87 HydrophobicContact CG2-CG2 4.03Å
36	I	96.8	Very high	90.2	Very high	27 Å²	27	60.8 Å²	60.8	14%	0.138	30%	0.303	C	S	.	.	H	α-helix	trans	-56.5	-54.4	177.3	-65.3	161.7	0	0	0	110.1	N32 E33 Q38 C39 E40 S90 A93	N32-I36 VanDerWaalsContact O-CG1 3.31Å; N32-I36 WeakPolarHBondContact O-CG1 3.38Å; N32-I36 PolarHBondContact O-N 3.46Å; E33-I36 PolarHBondContact O-N 3.05Å; I36-Q38 VanDerWaalsContact C-N 3.27Å; I36-Q38 PolarHBondContact O-N 3.01Å; I36-C39 PolarHBondContact O-N 3.36Å; I36-E40 HydrophobicContact CG2-CG 4.19Å; I36-E40 WeakPolarHBondContact CG2-OE1 3.32Å; I36-E40 WeakPolarHBondContact O-CB 3.32Å; I36-E40 WeakPolarHBondContact O-CG 3.19Å; I36-E40 PolarHBondContact O-N 3.09Å; I36-S90 VanDerWaalsContact CD1-O 3.27Å; I36-S90 WeakPolarHBondContact CD1-O 3.47Å; I36-S90 WeakPolarHBondContact CG1-O 3.19Å; I36-A93 HydrophobicContact CD1-CB 4.1Å
37	K	95.5	Very high	91.9	Very high	126 Å²	126	57.7 Å²	57.7	55%	0.548	28%	0.281	S	S	.	.	H	α-helix	trans	-57.6	-38.2	-180	-72.5	164.2	-178.2	168.5	0	112.2	E33 I35 F41	E33-K37 VanDerWaalsContact O-CB 3.3Å; E33-K37 WeakPolarHBondContact O-CB 3.46Å; E33-K37 WeakPolarHBondContact O-CD 3.46Å; E33-K37 WeakPolarHBondContact O-CG 3.48Å; E33-K37 PolarHBondContact O-N 3Å; E33-K37 IonicContact OE2-NZ 2.73Å; E33-K37 PolarHBondContact OE2-NZ 3.12Å; I35-K37 PolarHBondContact O-N 3.11Å; K37-F41 VanDerWaalsContact O-CB 3.29Å; K37-F41 WeakPolarHBondContact O-CB 3.33Å; K37-F41 PolarHBondContact O-N 3.08Å
38	Q	96.1	Very high	93.4	Very high	31 Å²	31	49.2 Å²	49.2	15%	0.145	24%	0.244	C	C	.	.	H	α-helix	trans	-72.2	-40	179.6	-174.3	54.7	88.4	0	0	112.7	K34 I35 I36 Y42 K76 L77 L80	K34-Q38 WeakPolarHBondContact O-CB 3.43Å; K34-Q38 PolarHBondContact O-N 3.46Å; I35-Q38 PolarHBondContact O-N 3.18Å; I36-Q38 VanDerWaalsContact C-N 3.27Å; I36-Q38 PolarHBondContact O-N 3.01Å; Q38-Y42 HydrophobicContact CG-CE1 4.48Å; Q38-Y42 HydrophobicContact CG-CE2 4.05Å; Q38-Y42 WeakPolarHBondContact O-CD2 3.37Å; Q38-Y42 PolarHBondContact O-N 3.14Å; Q38-K76 HydrophobicContact CG-CB 4.21Å; Q38-K76 VanDerWaalsContact OE1-CB 3.26Å; Q38-K76 VanDerWaalsContact OE1-CD 3.27Å; Q38-L77 HydrophobicContact CG-CB 4.5Å; Q38-L80 HydrophobicContact CB-CD1 4.06Å; Q38-L80 HydrophobicContact CG-CD1 4.41Å
39	C	96.9	Very high	94.4	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-69.8	-46.7	175.3	-70.9	0	0	0	0	111.8	I35 I36 F41 Y42 F43 L91	I35-C39 PolarHBondContact O-N 2.94Å; I35-C39 PolarHBondContact O-SG 3.14Å; I36-C39 PolarHBondContact O-N 3.36Å; C39-F41 PolarHBondContact O-N 3.46Å; C39-Y42 WeakPolarHBondContact O-CB 3.39Å; C39-Y42 PolarHBondContact O-N 2.97Å; C39-Y42 VanDerWaalsContact O-N 3.09Å; C39-F43 WeakPolarHBondContact O-CD2 3.16Å; C39-F43 PolarHBondContact O-N 3.31Å; C39-L91 HydrophobicContact CB-CD2 3.61Å
40	E	97.4	Very high	95.2	Very high	32 Å²	32	44.2 Å²	44.2	15%	0.15	22%	0.217	C	C	.	.	H	α-helix	trans	-57.6	-37.5	174.3	-73.9	-168.5	-171.5	0	0	111.9	I36 F43 S44 S94 K96 I97	I36-E40 HydrophobicContact CG2-CG 4.19Å; I36-E40 WeakPolarHBondContact CG2-OE1 3.32Å; I36-E40 WeakPolarHBondContact O-CB 3.32Å; I36-E40 WeakPolarHBondContact O-CG 3.19Å; I36-E40 PolarHBondContact O-N 3.09Å; E40-F43 CarbonylContact O-C 3.55Å; E40-S44 WeakPolarHBondContact O-CA 3.46Å; E40-S44 WeakPolarHBondContact O-CB 3.47Å; E40-S44 PolarHBondContact O-N 3.3Å; E40-S94 WeakPolarHBondContact CG-OG 3.18Å; E40-S94 PolarHBondContact OE1-OG 3.18Å; E40-K96 HydrophobicContact CG-CB 4.24Å; E40-K96 HydrophobicContact CG-CD 4.37Å; E40-K96 IonicContact OE2-NZ 3.14Å; E40-K96 PolarHBondContact OE2-NZ 2.87Å; E40-I97 HydrophobicContact CG-CG1 4.23Å
41	F	96.5	Very high	95.5	Very high	65 Å²	65	41.9 Å²	41.9	29%	0.285	21%	0.205	S	C	.	.	H	α-helix	trans	-62.5	-45.4	173.9	170	-94.2	0	0	0	112.5	K37 C39 F43 S44 N47 L153	K37-F41 VanDerWaalsContact O-CB 3.29Å; K37-F41 WeakPolarHBondContact O-CB 3.33Å; K37-F41 PolarHBondContact O-N 3.08Å; C39-F41 PolarHBondContact O-N 3.46Å; F41-F43 VanDerWaalsContact C-N 3.3Å; F41-F43 PolarHBondContact O-N 2.96Å; F41-S44 VanDerWaalsContact O-CB 3.3Å; F41-S44 WeakPolarHBondContact O-CB 3.42Å; F41-S44 PolarHBondContact O-N 3.11Å; F41-S44 VanDerWaalsContact O-N 3.14Å; F41-S44 PolarHBondContact O-OG 3Å; F41-N47 HydrophobicContact CZ-CB 4.4Å; F41-N47 WeakPolarHBondContact O-CB 3.22Å; F41-L153 HydrophobicContact CE2-CD1 3.9Å; F41-L153 HydrophobicContact CZ-CD1 3.54Å
42	Y	96.8	Very high	95.5	Very high	16 Å²	16	42.5 Å²	42.5	6%	0.063	21%	0.207	C	C	.	.	H	α-helix	trans	-57.3	-47	179.7	-67.9	-33.5	0	0	0	111.6	Q38 C39 S44 N47 L54 I71 F74 K76 L77	Q38-Y42 HydrophobicContact CG-CE1 4.48Å; Q38-Y42 HydrophobicContact CG-CE2 4.05Å; Q38-Y42 WeakPolarHBondContact O-CD2 3.37Å; Q38-Y42 PolarHBondContact O-N 3.14Å; C39-Y42 WeakPolarHBondContact O-CB 3.39Å; C39-Y42 PolarHBondContact O-N 2.97Å; C39-Y42 VanDerWaalsContact O-N 3.09Å; Y42-S44 VanDerWaalsContact C-N 3.33Å; Y42-N47 PolarHBondContact O-ND2 2.99Å; Y42-L54 WeakPolarHBondContact O-CD2 3.46Å; Y42-I71 HydrophobicContact CD2-CG2 4.29Å; Y42-F74 HydrophobicContact CD1-CD2 4.16Å; Y42-F74 AromaticContact CD2-CD2 3.94Å; Y42-F74 HydrophobicContact CD2-CD2 3.94Å; Y42-F74 HydrophobicContact CD2-CE2 4.47Å; Y42-F74 AromaticContact CE1-CD2 3.92Å; Y42-F74 HydrophobicContact CE1-CD2 3.92Å; Y42-F74 HydrophobicContact CE2-CB 3.85Å; Y42-F74 AromaticContact CE2-CD2 3.68Å; Y42-F74 HydrophobicContact CE2-CD2 3.68Å; Y42-F74 HydrophobicContact CE2-CG 4.11Å; Y42-F74 HydrophobicContact CG-CD2 4.18Å; Y42-F74 HydrophobicContact CG-CE2 4.47Å; Y42-F74 AromaticContact CZ-CD2 3.68Å; Y42-F74 WeakPolarHBondContact OH-CB 3.47Å; Y42-K76 WeakPolarHBondContact OH-CB 3.28Å; Y42-L77 HydrophobicContact CE2-CB 4.17Å; Y42-L77 PolarHBondContact OH-N 2.97Å
43	F	96.9	Very high	95.6	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.018	22%	0.218	C	C	.	.	H	α-helix	trans	-84.9	-0.8	-179.9	-71.3	-79	0	0	0	114	C39 E40 F41 I48 L54 V58 V66 I71 I97 I106 R108	C39-F43 WeakPolarHBondContact O-CD2 3.16Å; C39-F43 PolarHBondContact O-N 3.31Å; E40-F43 CarbonylContact O-C 3.55Å; F41-F43 VanDerWaalsContact C-N 3.3Å; F41-F43 PolarHBondContact O-N 2.96Å; F43-I48 HydrophobicContact CD1-CD1 4.37Å; F43-L54 HydrophobicContact CD1-CD2 4.36Å; F43-L54 HydrophobicContact CE1-CD1 3.94Å; F43-L54 HydrophobicContact CE1-CD2 4.48Å; F43-L54 HydrophobicContact CE1-CG 4.42Å; F43-L54 HydrophobicContact CZ-CD1 3.99Å; F43-V58 HydrophobicContact CD1-CG2 4.26Å; F43-V58 HydrophobicContact CE1-CG2 3.76Å; F43-V66 HydrophobicContact CE1-CG2 4.33Å; F43-V66 HydrophobicContact CZ-CB 4.46Å; F43-V66 HydrophobicContact CZ-CG2 4.48Å; F43-I71 HydrophobicContact CE2-CD1 4.05Å; F43-I71 HydrophobicContact CE2-CG1 4.29Å; F43-I71 HydrophobicContact CZ-CD1 3.81Å; F43-I71 HydrophobicContact CZ-CG1 4.18Å; F43-I97 HydrophobicContact CB-CD1 3.61Å; F43-I97 HydrophobicContact CD2-CD1 3.61Å; F43-I97 HydrophobicContact CE2-CD1 4.48Å; F43-I97 HydrophobicContact CG-CD1 3.76Å; F43-I106 HydrophobicContact CE2-CD1 3.74Å; F43-I106 HydrophobicContact CE2-CG1 4.27Å; F43-I106 HydrophobicContact CZ-CD1 4.18Å; F43-I106 HydrophobicContact CZ-CG1 4.23Å; F43-R108 HydrophobicContact CB-CG 3.75Å; F43-R108 HydrophobicContact CD1-CG 3.81Å; F43-R108 HydrophobicContact CG-CG 4.12Å; F43-R108 WeakPolarHBondContact O-CD 3.37Å; F43-R108 PolarHBondContact O-NH1 2.87Å
44	S	95.8	Very high	95.6	Very high	33 Å²	33	42 Å²	42	23%	0.231	20%	0.198	C	C	.	.	S	Bend	trans	-62.3	153.5	179.9	70.2	0	0	0	0	112.9	E40 F41 Y42 A46 N47 I48	E40-S44 WeakPolarHBondContact O-CA 3.46Å; E40-S44 WeakPolarHBondContact O-CB 3.47Å; E40-S44 PolarHBondContact O-N 3.3Å; F41-S44 VanDerWaalsContact O-CB 3.3Å; F41-S44 WeakPolarHBondContact O-CB 3.42Å; F41-S44 PolarHBondContact O-N 3.11Å; F41-S44 VanDerWaalsContact O-N 3.14Å; F41-S44 PolarHBondContact O-OG 3Å; Y42-S44 VanDerWaalsContact C-N 3.33Å; S44-A46 PolarHBondContact O-N 3.08Å; S44-N47 PolarHBondContact O-N 3.29Å; S44-N47 PolarHBondContact OG-N 3.41Å; S44-I48 WeakPolarHBondContact O-CB 3.22Å; S44-I48 WeakPolarHBondContact O-CG2 3.42Å; S44-I48 PolarHBondContact O-N 3.04Å
45	D	95.3	Very high	95.6	Very high	89 Å²	89	37 Å²	37	48%	0.476	18%	0.177	S	C	.	.	H	α-helix	trans	-60.2	-31.8	178.1	-67.2	-13.7	0	0	0	113.4	R108 P113	D45-R108 IonicContact OD1-CZ 3.33Å; D45-R108 VanDerWaalsContact OD1-CZ 3.23Å; D45-R108 IonicContact OD1-NH1 3.74Å; D45-R108 PolarHBondContact OD1-NH1 3.13Å; D45-R108 IonicContact OD1-NH2 2.79Å; D45-R108 PolarHBondContact OD1-NH2 2.66Å; D45-P113 HydrophobicContact CB-CB 4.35Å; D45-P113 HydrophobicContact CB-CG 3.95Å; D45-P113 WeakPolarHBondContact OD1-CG 3.46Å
46	A	93.9	Very high	95.6	Very high	13 Å²	13	41.6 Å²	41.6	11%	0.107	20%	0.201	C	C	.	.	H	α-helix	trans	-64.2	-41.1	175.2	0	0	0	0	0	111.3	S44 K50 L153	S44-A46 PolarHBondContact O-N 3.08Å; A46-K50 WeakPolarHBondContact O-CD 3.47Å; A46-K50 PolarHBondContact O-NZ 3.15Å; A46-L153 HydrophobicContact CB-CB 4.17Å; A46-L153 WeakPolarHBondContact O-CD2 3.44Å
47	N	96	Very high	95.6	Very high	18 Å²	18	42.2 Å²	42.2	10%	0.096	21%	0.205	C	C	.	.	H	α-helix	trans	-91	-44.3	-175.6	-170.9	65.2	0	0	0	114.2	F41 Y42 S44 L49 K50 D51	F41-N47 HydrophobicContact CZ-CB 4.4Å; F41-N47 WeakPolarHBondContact O-CB 3.22Å; Y42-N47 PolarHBondContact O-ND2 2.99Å; S44-N47 PolarHBondContact O-N 3.29Å; S44-N47 PolarHBondContact OG-N 3.41Å; N47-L49 VanDerWaalsContact C-N 3.31Å; N47-L49 PolarHBondContact O-N 2.99Å; N47-L49 VanDerWaalsContact O-N 3.14Å; N47-K50 WeakPolarHBondContact O-CA 3.36Å; N47-K50 WeakPolarHBondContact O-CB 3.17Å; N47-K50 PolarHBondContact O-N 2.93Å; N47-D51 PolarHBondContact O-N 3.39Å
48	I	95.8	Very high	95.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-58.9	-36	-162.7	-166.9	57.4	0	0	0	114.1	F43 S44 K50 L54 L55 V58 L112 P113	F43-I48 HydrophobicContact CD1-CD1 4.37Å; S44-I48 WeakPolarHBondContact O-CB 3.22Å; S44-I48 WeakPolarHBondContact O-CG2 3.42Å; S44-I48 PolarHBondContact O-N 3.04Å; I48-K50 VanDerWaalsContact C-N 3.3Å; I48-K50 PolarHBondContact O-N 3.23Å; I48-L54 HydrophobicContact CD1-CB 4.3Å; I48-L54 HydrophobicContact CD1-CD2 3.67Å; I48-L54 HydrophobicContact CD1-CG 3.62Å; I48-L55 HydrophobicContact CG1-CD1 4.4Å; I48-L55 WeakPolarHBondContact O-CB 3.42Å; I48-V58 HydrophobicContact CD1-CG2 4.19Å; I48-L112 HydrophobicContact CG1-CD2 3.56Å; I48-L112 HydrophobicContact CG2-CD2 4.25Å; I48-P113 HydrophobicContact CG2-CG 3.95Å
49	L	94.1	Very high	95.6	Very high	31 Å²	31	41.5 Å²	41.5	16%	0.162	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-17.3	178.6	-63.4	-175.3	0	0	0	113.6	N47 Q52 L55 P113 W115	N47-L49 VanDerWaalsContact C-N 3.31Å; N47-L49 PolarHBondContact O-N 2.99Å; N47-L49 VanDerWaalsContact O-N 3.14Å; L49-Q52 PolarHBondContact O-NE2 2.96Å; L49-L55 HydrophobicContact CD2-CD1 4.19Å; L49-P113 HydrophobicContact CD1-CB 4.44Å; L49-P113 HydrophobicContact CD1-CG 3.95Å; L49-P113 HydrophobicContact CD2-CG 4.3Å; L49-P113 WeakPolarHBondContact CD2-O 3.44Å; L49-P113 HydrophobicContact CG-CG 3.93Å; L49-W115 HydrophobicContact CB-CE3 4.22Å; L49-W115 HydrophobicContact CD1-CB 4.39Å; L49-W115 HydrophobicContact CD1-CE3 4.3Å
50	K	94	Very high	95.5	Very high	28 Å²	28	46.4 Å²	46.4	12%	0.122	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-37.6	-174.6	-59.4	-173.1	-172	95	0	110.8	A46 N47 I48 Q52 W115 L153 E186	A46-K50 WeakPolarHBondContact O-CD 3.47Å; A46-K50 PolarHBondContact O-NZ 3.15Å; N47-K50 WeakPolarHBondContact O-CA 3.36Å; N47-K50 WeakPolarHBondContact O-CB 3.17Å; N47-K50 PolarHBondContact O-N 2.93Å; I48-K50 VanDerWaalsContact C-N 3.3Å; I48-K50 PolarHBondContact O-N 3.23Å; K50-Q52 PolarHBondContact O-N 2.98Å; K50-Q52 VanDerWaalsContact O-N 3.16Å; K50-Q52 PolarHBondContact O-NE2 2.81Å; K50-W115 HydrophobicContact CG-CZ3 4.12Å; K50-L153 HydrophobicContact CD-CD2 3.66Å; K50-E186 IonicContact NZ-OE1 3.2Å; K50-E186 IonicContact NZ-OE2 3.64Å; K50-E186 PolarHBondContact NZ-OE2 3.28Å
51	D	94.5	Very high	95.3	Very high	46 Å²	46	46.6 Å²	46.6	25%	0.246	24%	0.241	C	C	.	.			trans	-75.1	97.8	169.6	-169	-25.3	0	0	0	111.2	N47 Y53 L54 L55	N47-D51 PolarHBondContact O-N 3.39Å; D51-Y53 PolarHBondContact O-N 2.78Å; D51-Y53 WeakPolarHBondContact OD1-CB 3.24Å; D51-Y53 PolarHBondContact OD1-N 2.93Å; D51-L54 HydrophobicContact CB-CB 4.19Å; D51-L54 PolarHBondContact OD1-N 2.91Å; D51-L54 VanDerWaalsContact OD1-N 3.11Å; D51-L55 WeakPolarHBondContact O-CB 3.31Å; D51-L55 PolarHBondContact O-N 3.13Å
52	Q	93.3	Very high	95	Very high	81 Å²	81	53.5 Å²	53.5	38%	0.379	27%	0.271	S	S	.	.	H	α-helix	trans	-67.6	-23.4	-180	-56	-56.4	-82.5	0	0	113.4	L49 K50 N56	L49-Q52 PolarHBondContact O-NE2 2.96Å; K50-Q52 PolarHBondContact O-N 2.98Å; K50-Q52 VanDerWaalsContact O-N 3.16Å; K50-Q52 PolarHBondContact O-NE2 2.81Å; Q52-N56 WeakPolarHBondContact O-CB 3.49Å; Q52-N56 PolarHBondContact O-N 3.49Å; Q52-N56 PolarHBondContact O-ND2 3.23Å; Q52-N56 PolarHBondContact O-OD1 2.87Å
53	Y	94.8	Very high	94.8	Very high	127 Å²	127	57.9 Å²	57.9	50%	0.498	30%	0.296	S	S	.	.	H	α-helix	trans	-73.9	-52.5	179	174.6	-107.2	0	0	0	109.6	D51 L55 N56 L57 V70 F74	D51-Y53 PolarHBondContact O-N 2.78Å; D51-Y53 WeakPolarHBondContact OD1-CB 3.24Å; D51-Y53 PolarHBondContact OD1-N 2.93Å; Y53-L55 PolarHBondContact O-N 3.14Å; Y53-N56 PolarHBondContact O-N 2.85Å; Y53-L57 HydrophobicContact CD1-CD1 4.22Å; Y53-L57 HydrophobicContact CE1-CD1 3.73Å; Y53-L57 PolarHBondContact O-N 3.22Å; Y53-L57 VanDerWaalsContact O-N 3.14Å; Y53-V70 HydrophobicContact CE1-CG1 4.43Å; Y53-V70 WeakPolarHBondContact OH-CG1 3.48Å; Y53-F74 HydrophobicContact CD1-CE1 4.29Å; Y53-F74 AromaticContact CD1-CZ 3.94Å; Y53-F74 HydrophobicContact CD1-CZ 3.94Å; Y53-F74 AromaticContact CE1-CE1 3.75Å; Y53-F74 HydrophobicContact CE1-CE1 3.75Å; Y53-F74 AromaticContact CE1-CZ 3.85Å; Y53-F74 HydrophobicContact CE1-CZ 3.85Å
54	L	95.6	Very high	94.7	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.1	-39.9	177.1	-173.6	62.4	0	0	0	112.3	Y42 F43 I48 D51 N56 L57 V58 I71 F74	Y42-L54 WeakPolarHBondContact O-CD2 3.46Å; F43-L54 HydrophobicContact CD1-CD2 4.36Å; F43-L54 HydrophobicContact CE1-CD1 3.94Å; F43-L54 HydrophobicContact CE1-CD2 4.48Å; F43-L54 HydrophobicContact CE1-CG 4.42Å; F43-L54 HydrophobicContact CZ-CD1 3.99Å; I48-L54 HydrophobicContact CD1-CB 4.3Å; I48-L54 HydrophobicContact CD1-CD2 3.67Å; I48-L54 HydrophobicContact CD1-CG 3.62Å; D51-L54 HydrophobicContact CB-CB 4.19Å; D51-L54 PolarHBondContact OD1-N 2.91Å; D51-L54 VanDerWaalsContact OD1-N 3.11Å; L54-N56 VanDerWaalsContact C-N 3.26Å; L54-N56 PolarHBondContact O-N 3.14Å; L54-L57 HydrophobicContact CD1-CD1 4.43Å; L54-L57 PolarHBondContact O-N 3.32Å; L54-V58 WeakPolarHBondContact O-CG2 3.43Å; L54-V58 PolarHBondContact O-N 3.32Å; L54-I71 HydrophobicContact CD1-CD1 3.53Å; L54-F74 HydrophobicContact CD1-CE2 4.48Å; L54-F74 HydrophobicContact CD1-CZ 4.2Å
55	L	95.6	Very high	94.8	Very high	11 Å²	11	59.6 Å²	59.6	6%	0.058	30%	0.301	C	S	.	.	H	α-helix	trans	-59.8	-36.2	176.1	-171.7	60.8	0	0	0	112.7	I48 L49 D51 Y53 K59 L112	I48-L55 HydrophobicContact CG1-CD1 4.4Å; I48-L55 WeakPolarHBondContact O-CB 3.42Å; L49-L55 HydrophobicContact CD2-CD1 4.19Å; D51-L55 WeakPolarHBondContact O-CB 3.31Å; D51-L55 PolarHBondContact O-N 3.13Å; Y53-L55 PolarHBondContact O-N 3.14Å; L55-K59 HydrophobicContact CD1-CD 4.37Å; L55-K59 HydrophobicContact CG-CD 4.19Å; L55-K59 WeakPolarHBondContact O-CB 3.33Å; L55-K59 VanDerWaalsContact O-CG 3.26Å; L55-K59 WeakPolarHBondContact O-CG 3.43Å; L55-K59 PolarHBondContact O-N 2.85Å; L55-K59 VanDerWaalsContact O-N 3.15Å; L55-L112 HydrophobicContact CD1-CD1 4.13Å; L55-L112 HydrophobicContact CD1-CD2 4.23Å
56	N	96.3	Very high	94.9	Very high	95 Å²	95	55.7 Å²	55.7	51%	0.508	28%	0.28	S	S	.	.	H	α-helix	trans	-72.9	-36.6	177.1	-73	-10.7	0	0	0	111.9	Q52 Y53 L54 K59 S60	Q52-N56 WeakPolarHBondContact O-CB 3.49Å; Q52-N56 PolarHBondContact O-N 3.49Å; Q52-N56 PolarHBondContact O-ND2 3.23Å; Q52-N56 PolarHBondContact O-OD1 2.87Å; Y53-N56 PolarHBondContact O-N 2.85Å; L54-N56 VanDerWaalsContact C-N 3.26Å; L54-N56 PolarHBondContact O-N 3.14Å; N56-K59 PolarHBondContact O-N 3.33Å; N56-S60 PolarHBondContact O-N 2.92Å; N56-S60 PolarHBondContact O-OG 3.4Å
57	L	96.2	Very high	95	Very high	41 Å²	41	59.2 Å²	59.2	22%	0.215	30%	0.297	C	S	.	.	H	α-helix	trans	-60.7	-52.1	173.6	-67.3	172.6	0	0	0	110.8	Y53 L54 K59 S60 V66 V70	Y53-L57 HydrophobicContact CD1-CD1 4.22Å; Y53-L57 HydrophobicContact CE1-CD1 3.73Å; Y53-L57 PolarHBondContact O-N 3.22Å; Y53-L57 VanDerWaalsContact O-N 3.14Å; L54-L57 HydrophobicContact CD1-CD1 4.43Å; L54-L57 PolarHBondContact O-N 3.32Å; L57-K59 PolarHBondContact O-N 3.17Å; L57-S60 WeakPolarHBondContact O-CB 3.48Å; L57-S60 PolarHBondContact O-N 3.24Å; L57-V66 HydrophobicContact CB-CG1 3.93Å; L57-V66 HydrophobicContact CB-CG2 3.94Å; L57-V66 HydrophobicContact CD1-CG1 3.97Å; L57-V66 HydrophobicContact CG-CG1 4.47Å; L57-V70 HydrophobicContact CD1-CG1 3.61Å
58	V	96.4	Very high	95	Very high	9 Å²	9	58.5 Å²	58.5	6%	0.055	29%	0.294	C	S	.	.	H	α-helix	trans	-60.7	-32.4	178.9	178	0	0	0	0	112.2	F43 I48 L54 G64 V66 L112	F43-V58 HydrophobicContact CD1-CG2 4.26Å; F43-V58 HydrophobicContact CE1-CG2 3.76Å; I48-V58 HydrophobicContact CD1-CG2 4.19Å; L54-V58 WeakPolarHBondContact O-CG2 3.43Å; L54-V58 PolarHBondContact O-N 3.32Å; V58-G64 WeakPolarHBondContact O-CA 3.38Å; V58-V66 HydrophobicContact CB-CG2 4.39Å; V58-V66 HydrophobicContact CG2-CG2 3.65Å; V58-L112 HydrophobicContact CG1-CD1 4.01Å; V58-L112 HydrophobicContact CG1-CD2 4.13Å; V58-L112 HydrophobicContact CG1-CG 4.2Å
59	K	95.5	Very high	95	Very high	132 Å²	132	61.8 Å²	61.8	57%	0.574	32%	0.316	S	S	*	.	H	α-helix	trans	-83.2	-9.6	177.3	-73.7	176.6	178.9	176.6	0	114.8	L55 N56 L57 L112	L55-K59 HydrophobicContact CD1-CD 4.37Å; L55-K59 HydrophobicContact CG-CD 4.19Å; L55-K59 WeakPolarHBondContact O-CB 3.33Å; L55-K59 VanDerWaalsContact O-CG 3.26Å; L55-K59 WeakPolarHBondContact O-CG 3.43Å; L55-K59 PolarHBondContact O-N 2.85Å; L55-K59 VanDerWaalsContact O-N 3.15Å; N56-K59 PolarHBondContact O-N 3.33Å; L57-K59 PolarHBondContact O-N 3.17Å; K59-L112 HydrophobicContact CG-CD1 4.22Å
60	S	94.8	Very high	95.1	Very high	104 Å²	104	61.9 Å²	61.9	73%	0.727	32%	0.318	S	S	*	.	H	α-helix	trans	-76.9	-28.2	179.1	-63.7	0	0	0	0	112.2	N56 L57	N56-S60 PolarHBondContact O-N 2.92Å; N56-S60 PolarHBondContact O-OG 3.4Å; L57-S60 WeakPolarHBondContact O-CB 3.48Å; L57-S60 PolarHBondContact O-N 3.24Å
61	S	92.6	Very high	95.2	Very high	36 Å²	36	60.5 Å²	60.5	25%	0.252	31%	0.312	S	S	.	.	S	Bend	trans	-98.7	147.8	171.8	57.3	0	0	0	0	110.4	D63 G64 W65	S61-D63 VanDerWaalsContact C-N 3.27Å; S61-D63 PolarHBondContact O-N 3.32Å; S61-G64 VanDerWaalsContact OG-C 3.31Å; S61-G64 WeakPolarHBondContact OG-CA 3.5Å; S61-G64 PolarHBondContact OG-N 2.93Å; S61-W65 WeakPolarHBondContact CB-O 3.44Å; S61-W65 PolarHBondContact OG-N 3.48Å; S61-W65 PolarHBondContact OG-O 3.28Å
62	K	91.2	Very high	95.3	Very high	210 Å²	210	58.9 Å²	58.9	91%	0.913	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-34	179.1	-68.3	179.8	-179.9	176	0	112.1
63	D	92.9	Very high	95.4	Very high	107 Å²	107	57.8 Å²	57.8	57%	0.572	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	11.6	-171.5	-43.6	-68.6	0	0	0	113.4	S61 W65 R107	S61-D63 VanDerWaalsContact C-N 3.27Å; S61-D63 PolarHBondContact O-N 3.32Å; D63-W65 PolarHBondContact O-N 3.02Å; D63-R107 VanDerWaalsContact O-CD 3.26Å; D63-R107 WeakPolarHBondContact O-CD 3.44Å
64	G	94.6	Very high	95.4	Very high	13 Å²	13	53 Å²	53	13%	0.134	29%	0.288	C	S	.	.			trans	80.4	4.6	173.8	0	0	0	0	0	116.8	V58 S61 R107	V58-G64 WeakPolarHBondContact O-CA 3.38Å; S61-G64 VanDerWaalsContact OG-C 3.31Å; S61-G64 WeakPolarHBondContact OG-CA 3.5Å; S61-G64 PolarHBondContact OG-N 2.93Å; G64-R107 WeakPolarHBondContact O-CB 3.06Å
65	W	96.9	Very high	95.4	Very high	61 Å²	61	61.7 Å²	61.7	23%	0.231	33%	0.326	C	S	.	.			trans	-61.2	136.2	175	-65.7	114.7	0	0	0	113.2	S61 D63 E98 R107	S61-W65 WeakPolarHBondContact CB-O 3.44Å; S61-W65 PolarHBondContact OG-N 3.48Å; S61-W65 PolarHBondContact OG-O 3.28Å; D63-W65 PolarHBondContact O-N 3.02Å; W65-E98 HydrophobicContact CH2-CG 4.19Å; W65-R107 HydrophobicContact CD2-CB 4.11Å; W65-R107 HydrophobicContact CD2-CG 4.11Å; W65-R107 HydrophobicContact CE3-CB 3.8Å; W65-R107 HydrophobicContact CE3-CG 3.82Å; W65-R107 HydrophobicContact CH2-CG 3.88Å; W65-R107 HydrophobicContact CZ2-CG 4.17Å; W65-R107 VanDerWaalsContact CZ2-CZ 3.49Å; W65-R107 HydrophobicContact CZ3-CB 4.14Å; W65-R107 HydrophobicContact CZ3-CG 3.7Å
66	V	97.1	Very high	95.3	Very high	6 Å²	6	64.6 Å²	64.6	4%	0.036	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	138.7	174.6	-176.8	0	0	0	0	109.5	F43 L57 V58 L68 I71 T105 I106	F43-V66 HydrophobicContact CE1-CG2 4.33Å; F43-V66 HydrophobicContact CZ-CB 4.46Å; F43-V66 HydrophobicContact CZ-CG2 4.48Å; L57-V66 HydrophobicContact CB-CG1 3.93Å; L57-V66 HydrophobicContact CB-CG2 3.94Å; L57-V66 HydrophobicContact CD1-CG1 3.97Å; L57-V66 HydrophobicContact CG-CG1 4.47Å; V58-V66 HydrophobicContact CB-CG2 4.39Å; V58-V66 HydrophobicContact CG2-CG2 3.65Å; V66-L68 PolarHBondContact O-N 3.29Å; V66-I71 HydrophobicContact CG1-CD1 3.88Å; V66-I71 HydrophobicContact CG1-CG1 3.96Å; V66-T105 CarbonylContact O-C 3.56Å; V66-T105 WeakPolarHBondContact O-CA 3.24Å; V66-I106 PolarHBondContact N-O 2.92Å; V66-I106 PolarHBondContact O-N 2.82Å
67	D	96.8	Very high	95.2	Very high	87 Å²	87	60.1 Å²	60.1	47%	0.465	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	129.9	179.7	-60	-24.3	0	0	0	112.2	S69 V70 I71 T105	D67-S69 PolarHBondContact O-N 2.83Å; D67-V70 HydrophobicContact CB-CB 4.33Å; D67-V70 HydrophobicContact CB-CG2 3.95Å; D67-V70 WeakPolarHBondContact O-CB 3.48Å; D67-V70 PolarHBondContact O-N 2.72Å; D67-V70 VanDerWaalsContact O-N 3.09Å; D67-I71 PolarHBondContact O-N 2.92Å; D67-T105 WeakPolarHBondContact OD1-CG2 3.37Å
68	L	96.5	Very high	95.2	Very high	4 Å²	4	62.7 Å²	62.7	2%	0.021	33%	0.325	C	S	.	.	H	α-helix	trans	-62.4	-33	179.5	-175.9	60.6	0	0	0	111.7	V66 V70 I71 A72 L84 I87 R88 L91 N104 I106	V66-L68 PolarHBondContact O-N 3.29Å; L68-V70 VanDerWaalsContact C-N 3.33Å; L68-V70 PolarHBondContact O-N 2.79Å; L68-I71 PolarHBondContact O-N 3.36Å; L68-A72 VanDerWaalsContact O-CB 3.24Å; L68-A72 WeakPolarHBondContact O-CB 3.19Å; L68-A72 PolarHBondContact O-N 3.37Å; L68-L84 HydrophobicContact CG-CD2 4.47Å; L68-I87 HydrophobicContact CD1-CG2 3.78Å; L68-R88 HydrophobicContact CD2-CB 4.03Å; L68-L91 HydrophobicContact CD1-CD1 3.92Å; L68-N104 WeakPolarHBondContact CB-O 3.5Å; L68-N104 PolarHBondContact N-O 2.8Å; L68-I106 HydrophobicContact CD1-CD1 4.07Å; L68-I106 HydrophobicContact CD1-CG2 4.01Å
69	S	95.9	Very high	95	Very high	68 Å²	68	66.9 Å²	66.9	48%	0.476	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-37.4	174.8	57.3	0	0	0	0	112.7	D67 S73	D67-S69 PolarHBondContact O-N 2.83Å; S69-S73 PolarHBondContact O-N 3.28Å
70	V	96	Very high	95	Very high	33 Å²	33	62.5 Å²	62.5	20%	0.2	34%	0.337	C	S	.	.	H	α-helix	trans	-69.2	-44	176.3	175.7	0	0	0	0	110	Y53 L57 D67 L68 S73 F74	Y53-V70 HydrophobicContact CE1-CG1 4.43Å; Y53-V70 WeakPolarHBondContact OH-CG1 3.48Å; L57-V70 HydrophobicContact CD1-CG1 3.61Å; D67-V70 HydrophobicContact CB-CB 4.33Å; D67-V70 HydrophobicContact CB-CG2 3.95Å; D67-V70 WeakPolarHBondContact O-CB 3.48Å; D67-V70 PolarHBondContact O-N 2.72Å; D67-V70 VanDerWaalsContact O-N 3.09Å; L68-V70 VanDerWaalsContact C-N 3.33Å; L68-V70 PolarHBondContact O-N 2.79Å; V70-S73 WeakPolarHBondContact O-CB 3.43Å; V70-S73 PolarHBondContact O-N 3.31Å; V70-S73 VanDerWaalsContact O-N 3.16Å; V70-S73 PolarHBondContact O-OG 3.38Å; V70-F74 HydrophobicContact CG1-CE1 4.36Å; V70-F74 VanDerWaalsContact O-CD1 3.22Å; V70-F74 WeakPolarHBondContact O-CD1 3.33Å; V70-F74 WeakPolarHBondContact O-CE1 3.48Å
71	I	96.1	Very high	94.9	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65.7	-41.6	176.7	-59.4	-60.8	0	0	0	111.6	Y42 F43 L54 V66 D67 L68 S73 F74 L77 I106	Y42-I71 HydrophobicContact CD2-CG2 4.29Å; F43-I71 HydrophobicContact CE2-CD1 4.05Å; F43-I71 HydrophobicContact CE2-CG1 4.29Å; F43-I71 HydrophobicContact CZ-CD1 3.81Å; F43-I71 HydrophobicContact CZ-CG1 4.18Å; L54-I71 HydrophobicContact CD1-CD1 3.53Å; V66-I71 HydrophobicContact CG1-CD1 3.88Å; V66-I71 HydrophobicContact CG1-CG1 3.96Å; D67-I71 PolarHBondContact O-N 2.92Å; L68-I71 PolarHBondContact O-N 3.36Å; I71-S73 PolarHBondContact O-N 3.25Å; I71-S73 VanDerWaalsContact O-N 3.15Å; I71-F74 HydrophobicContact CD1-CE1 4.21Å; I71-F74 HydrophobicContact CD1-CE2 4.46Å; I71-F74 HydrophobicContact CD1-CZ 3.99Å; I71-F74 VanDerWaalsContact O-CB 3.31Å; I71-F74 WeakPolarHBondContact O-CB 3.24Å; I71-F74 WeakPolarHBondContact O-CD1 3.42Å; I71-F74 PolarHBondContact O-N 3Å; I71-L77 HydrophobicContact CG2-CD2 3.91Å; I71-I106 HydrophobicContact CB-CD1 4.39Å; I71-I106 HydrophobicContact CG1-CD1 4.11Å; I71-I106 HydrophobicContact CG1-CG1 4.42Å; I71-I106 HydrophobicContact CG2-CD1 4.25Å
72	A	95.4	Very high	94.9	Very high	11 Å²	11	62.7 Å²	62.7	9%	0.091	33%	0.333	C	S	.	.	H	α-helix	trans	-61.4	-19.1	173.9	0	0	0	0	0	113.6	L68 F74 Q78 L84 I87	L68-A72 VanDerWaalsContact O-CB 3.24Å; L68-A72 WeakPolarHBondContact O-CB 3.19Å; L68-A72 PolarHBondContact O-N 3.37Å; A72-F74 VanDerWaalsContact C-N 3.26Å; A72-F74 PolarHBondContact O-N 2.65Å; A72-Q78 WeakPolarHBondContact O-CG 3.23Å; A72-L84 HydrophobicContact CB-CD2 3.33Å; A72-I87 HydrophobicContact CB-CD1 3.66Å
73	S	95.6	Very high	95.1	Very high	58 Å²	58	56.1 Å²	56.1	41%	0.406	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-8.4	173	82.1	0	0	0	0	114.2	S69 V70 I71 K75 Q78	S69-S73 PolarHBondContact O-N 3.28Å; V70-S73 WeakPolarHBondContact O-CB 3.43Å; V70-S73 PolarHBondContact O-N 3.31Å; V70-S73 VanDerWaalsContact O-N 3.16Å; V70-S73 PolarHBondContact O-OG 3.38Å; I71-S73 PolarHBondContact O-N 3.25Å; I71-S73 VanDerWaalsContact O-N 3.15Å; S73-K75 PolarHBondContact O-N 2.91Å; S73-Q78 PolarHBondContact O-NE2 3.2Å
74	F	95.8	Very high	95.2	Very high	26 Å²	26	54 Å²	54	11%	0.114	30%	0.296	C	S	.	.	S	Bend	trans	-74.8	128.8	-175.3	-74.4	31.7	0	0	0	110.4	Y42 Y53 L54 V70 I71 A72 K76 L77 Q78	Y42-F74 HydrophobicContact CD1-CD2 4.16Å; Y42-F74 AromaticContact CD2-CD2 3.94Å; Y42-F74 HydrophobicContact CD2-CD2 3.94Å; Y42-F74 HydrophobicContact CD2-CE2 4.47Å; Y42-F74 AromaticContact CE1-CD2 3.92Å; Y42-F74 HydrophobicContact CE1-CD2 3.92Å; Y42-F74 HydrophobicContact CE2-CB 3.85Å; Y42-F74 AromaticContact CE2-CD2 3.68Å; Y42-F74 HydrophobicContact CE2-CD2 3.68Å; Y42-F74 HydrophobicContact CE2-CG 4.11Å; Y42-F74 HydrophobicContact CG-CD2 4.18Å; Y42-F74 HydrophobicContact CG-CE2 4.47Å; Y42-F74 AromaticContact CZ-CD2 3.68Å; Y42-F74 WeakPolarHBondContact OH-CB 3.47Å; Y53-F74 HydrophobicContact CD1-CE1 4.29Å; Y53-F74 AromaticContact CD1-CZ 3.94Å; Y53-F74 HydrophobicContact CD1-CZ 3.94Å; Y53-F74 AromaticContact CE1-CE1 3.75Å; Y53-F74 HydrophobicContact CE1-CE1 3.75Å; Y53-F74 AromaticContact CE1-CZ 3.85Å; Y53-F74 HydrophobicContact CE1-CZ 3.85Å; L54-F74 HydrophobicContact CD1-CE2 4.48Å; L54-F74 HydrophobicContact CD1-CZ 4.2Å; V70-F74 HydrophobicContact CG1-CE1 4.36Å; V70-F74 VanDerWaalsContact O-CD1 3.22Å; V70-F74 WeakPolarHBondContact O-CD1 3.33Å; V70-F74 WeakPolarHBondContact O-CE1 3.48Å; I71-F74 HydrophobicContact CD1-CE1 4.21Å; I71-F74 HydrophobicContact CD1-CE2 4.46Å; I71-F74 HydrophobicContact CD1-CZ 3.99Å; I71-F74 VanDerWaalsContact O-CB 3.31Å; I71-F74 WeakPolarHBondContact O-CB 3.24Å; I71-F74 WeakPolarHBondContact O-CD1 3.42Å; I71-F74 PolarHBondContact O-N 3Å; A72-F74 VanDerWaalsContact C-N 3.26Å; A72-F74 PolarHBondContact O-N 2.65Å; F74-K76 VanDerWaalsContact C-N 3.3Å; F74-K76 PolarHBondContact O-N 3.5Å; F74-L77 WeakPolarHBondContact O-CA 3.5Å; F74-L77 PolarHBondContact O-N 2.91Å; F74-Q78 PolarHBondContact O-N 3.1Å
75	K	94.9	Very high	95.2	Very high	183 Å²	183	56.4 Å²	56.4	80%	0.796	31%	0.311	S	S	*	.	H	α-helix	trans	-50.8	-38.8	-169.1	-64.9	-173.3	176.5	-171.8	0	115.8	S73 S79	S73-K75 PolarHBondContact O-N 2.91Å; K75-S79 PolarHBondContact O-N 3.4Å
76	K	93.5	Very high	95.1	Very high	73 Å²	73	55.5 Å²	55.5	32%	0.317	31%	0.312	S	S	.	.	H	α-helix	trans	-71.9	-40.2	178.2	-62.6	-166.9	165.8	-157.7	0	111.6	Q38 Y42 F74 S79 E138	Q38-K76 HydrophobicContact CG-CB 4.21Å; Q38-K76 VanDerWaalsContact OE1-CB 3.26Å; Q38-K76 VanDerWaalsContact OE1-CD 3.27Å; Y42-K76 WeakPolarHBondContact OH-CB 3.28Å; F74-K76 VanDerWaalsContact C-N 3.3Å; F74-K76 PolarHBondContact O-N 3.5Å; K76-S79 PolarHBondContact O-N 3.11Å; K76-S79 PolarHBondContact O-OG 3.32Å; K76-E138 VanDerWaalsContact CE-OE1 3.28Å; K76-E138 WeakPolarHBondContact CE-OE1 3.39Å; K76-E138 IonicContact NZ-OE1 3.7Å; K76-E138 PolarHBondContact NZ-OE1 3.19Å
77	L	95.4	Very high	95	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-67.5	-42.3	175.2	-172	54.8	0	0	0	111.8	I35 Q38 Y42 I71 F74 S79 L80 T81 I87	I35-L77 HydrophobicContact CB-CD1 4.47Å; I35-L77 HydrophobicContact CG1-CD1 4.25Å; I35-L77 HydrophobicContact CG2-CD1 4.1Å; Q38-L77 HydrophobicContact CG-CB 4.5Å; Y42-L77 HydrophobicContact CE2-CB 4.17Å; Y42-L77 PolarHBondContact OH-N 2.97Å; I71-L77 HydrophobicContact CG2-CD2 3.91Å; F74-L77 WeakPolarHBondContact O-CA 3.5Å; F74-L77 PolarHBondContact O-N 2.91Å; L77-S79 PolarHBondContact O-N 3.13Å; L77-L80 HydrophobicContact CD1-CD1 4.41Å; L77-L80 WeakPolarHBondContact O-CB 3.18Å; L77-L80 PolarHBondContact O-N 3.42Å; L77-T81 PolarHBondContact O-N 3.27Å; L77-T81 VanDerWaalsContact O-O 3.13Å; L77-I87 HydrophobicContact CD1-CD1 4.47Å; L77-I87 HydrophobicContact CD2-CD1 4.12Å; L77-I87 HydrophobicContact CD2-CG2 4.39Å; L77-I87 HydrophobicContact CG-CD1 4.15Å
78	Q	95.1	Very high	94.9	Very high	96 Å²	96	54.7 Å²	54.7	45%	0.449	30%	0.302	S	S	.	.	H	α-helix	trans	-55.5	-32.6	171.7	-72.6	-171.1	-29	0	0	113.4	A72 S73 F74 L80 T81	A72-Q78 WeakPolarHBondContact O-CG 3.23Å; S73-Q78 PolarHBondContact O-NE2 3.2Å; F74-Q78 PolarHBondContact O-N 3.1Å; Q78-L80 PolarHBondContact O-N 2.89Å; Q78-T81 WeakPolarHBondContact CA-O 3.19Å
79	S	93.4	Very high	94.8	Very high	97 Å²	97	61.2 Å²	61.2	68%	0.678	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-12	177.3	74.2	0	0	0	0	114.2	K75 K76 L77	K75-S79 PolarHBondContact O-N 3.4Å; K76-S79 PolarHBondContact O-N 3.11Å; K76-S79 PolarHBondContact O-OG 3.32Å; L77-S79 PolarHBondContact O-N 3.13Å
80	L	94.1	Very high	94.8	Very high	40 Å²	40	58.2 Å²	58.2	21%	0.209	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-48.5	173.5	-61.3	174.1	0	0	0	111	M31 K34 I35 Q38 L77 Q78	M31-L80 VanDerWaalsContact CE-O 3.31Å; M31-L80 WeakPolarHBondContact CE-O 3.27Å; M31-L80 HydrophobicContact SD-CB 3.96Å; M31-L80 HydrophobicContact SD-CD2 4.13Å; K34-L80 HydrophobicContact CB-CD1 3.94Å; K34-L80 HydrophobicContact CB-CD2 3.97Å; K34-L80 HydrophobicContact CD-CD2 4.13Å; I35-L80 HydrophobicContact CG1-CB 4.23Å; I35-L80 HydrophobicContact CG1-CD1 4.28Å; Q38-L80 HydrophobicContact CB-CD1 4.06Å; Q38-L80 HydrophobicContact CG-CD1 4.41Å; L77-L80 HydrophobicContact CD1-CD1 4.41Å; L77-L80 WeakPolarHBondContact O-CB 3.18Å; L77-L80 PolarHBondContact O-N 3.42Å; Q78-L80 PolarHBondContact O-N 2.89Å
81	T	94.1	Very high	94.8	Very high	24 Å²	24	56.7 Å²	56.7	15%	0.147	30%	0.302	C	S	.	.			trans	-158.4	154.6	177.7	-176.1	0	0	0	0	111.7	I35 L77 Q78 D83 I87	I35-T81 HydrophobicContact CD1-CG2 3.58Å; I35-T81 HydrophobicContact CG1-CG2 4.13Å; L77-T81 PolarHBondContact O-N 3.27Å; L77-T81 VanDerWaalsContact O-O 3.13Å; Q78-T81 WeakPolarHBondContact CA-O 3.19Å; T81-D83 PolarHBondContact OG1-N 3.04Å; T81-D83 VanDerWaalsContact OG1-N 3.1Å; T81-I87 HydrophobicContact CG2-CD1 3.94Å; T81-I87 HydrophobicContact CG2-CG1 3.42Å; T81-I87 VanDerWaalsContact CG2-CG1 3.42Å
82	T	92.1	Very high	94.7	Very high	119 Å²	119	61.9 Å²	61.9	73%	0.73	33%	0.334	S	S	*	.			trans	-108.3	-7.6	169.1	52.4	0	0	0	0	113
83	D	94.4	Very high	94.6	Very high	73 Å²	73	65 Å²	65	39%	0.39	36%	0.359	S	S	.	.			trans	-86.3	115	-179.5	-176.1	2.5	0	0	0	111.3	T81 S85 V86 I87	T81-D83 PolarHBondContact OG1-N 3.04Å; T81-D83 VanDerWaalsContact OG1-N 3.1Å; D83-S85 PolarHBondContact O-N 3.21Å; D83-S85 WeakPolarHBondContact OD1-CB 3.48Å; D83-S85 PolarHBondContact OD1-N 3.44Å; D83-S85 PolarHBondContact OD1-OG 3.07Å; D83-V86 HydrophobicContact CB-CB 4.42Å; D83-V86 HydrophobicContact CB-CG2 4.08Å; D83-V86 PolarHBondContact O-N 3.3Å; D83-I87 WeakPolarHBondContact O-CG1 3.47Å; D83-I87 PolarHBondContact O-N 2.83Å
84	L	95	Very high	94.6	Very high	63 Å²	63	62.9 Å²	62.9	33%	0.33	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-28.8	176.1	-60.9	179.2	0	0	0	112.6	L68 A72 I87 R88	L68-L84 HydrophobicContact CG-CD2 4.47Å; A72-L84 HydrophobicContact CB-CD2 3.33Å; L84-I87 PolarHBondContact O-N 3.3Å; L84-R88 VanDerWaalsContact O-CB 3.26Å; L84-R88 WeakPolarHBondContact O-CB 3.22Å; L84-R88 PolarHBondContact O-N 2.8Å
85	S	94.5	Very high	94.6	Very high	63 Å²	63	67.2 Å²	67.2	44%	0.441	37%	0.373	S	S	.	.	H	α-helix	trans	-66.4	-46.5	-179.7	-40.1	0	0	0	0	110.8	D83 R88 Q89	D83-S85 PolarHBondContact O-N 3.21Å; D83-S85 WeakPolarHBondContact OD1-CB 3.48Å; D83-S85 PolarHBondContact OD1-N 3.44Å; D83-S85 PolarHBondContact OD1-OG 3.07Å; S85-R88 PolarHBondContact O-N 3.1Å; S85-Q89 WeakPolarHBondContact O-CB 3.31Å; S85-Q89 PolarHBondContact O-N 2.89Å
86	V	94.6	Very high	94.7	Very high	42 Å²	42	63.3 Å²	63.3	26%	0.255	36%	0.356	S	S	.	.	H	α-helix	trans	-64.2	-41	175.6	179	0	0	0	0	110.9	I35 D83 S90	I35-V86 HydrophobicContact CD1-CG1 3.81Å; D83-V86 HydrophobicContact CB-CB 4.42Å; D83-V86 HydrophobicContact CB-CG2 4.08Å; D83-V86 PolarHBondContact O-N 3.3Å; V86-S90 VanDerWaalsContact O-CB 3.31Å; V86-S90 WeakPolarHBondContact O-CB 3.42Å; V86-S90 PolarHBondContact O-N 2.8Å; V86-S90 PolarHBondContact O-OG 3.13Å
87	I	95.9	Very high	94.9	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-48.4	176.6	-56.5	168.4	0	0	0	110.4	I35 L68 A72 L77 T81 D83 L84 Q89 S90 L91	I35-I87 HydrophobicContact CG2-CB 4.43Å; I35-I87 HydrophobicContact CG2-CG1 4.45Å; I35-I87 HydrophobicContact CG2-CG2 4.03Å; L68-I87 HydrophobicContact CD1-CG2 3.78Å; A72-I87 HydrophobicContact CB-CD1 3.66Å; L77-I87 HydrophobicContact CD1-CD1 4.47Å; L77-I87 HydrophobicContact CD2-CD1 4.12Å; L77-I87 HydrophobicContact CD2-CG2 4.39Å; L77-I87 HydrophobicContact CG-CD1 4.15Å; T81-I87 HydrophobicContact CG2-CD1 3.94Å; T81-I87 HydrophobicContact CG2-CG1 3.42Å; T81-I87 VanDerWaalsContact CG2-CG1 3.42Å; D83-I87 WeakPolarHBondContact O-CG1 3.47Å; D83-I87 PolarHBondContact O-N 2.83Å; L84-I87 PolarHBondContact O-N 3.3Å; I87-Q89 PolarHBondContact O-N 3.27Å; I87-S90 PolarHBondContact O-N 2.84Å; I87-L91 HydrophobicContact CG2-CD1 3.88Å; I87-L91 HydrophobicContact CG2-CG 4.24Å; I87-L91 WeakPolarHBondContact O-CB 3.38Å; I87-L91 VanDerWaalsContact O-CG 3.31Å; I87-L91 WeakPolarHBondContact O-CG 3.45Å; I87-L91 PolarHBondContact O-N 2.93Å
88	R	95.6	Very high	94.9	Very high	75 Å²	75	63.6 Å²	63.6	28%	0.283	36%	0.359	S	S	.	.	H	α-helix	trans	-56.7	-50.5	178.4	-176.5	-171.1	-65	131.4	-8.3	111.5	L68 L84 S85 S90 L91 T92 V99 G103 N104	L68-R88 HydrophobicContact CD2-CB 4.03Å; L84-R88 VanDerWaalsContact O-CB 3.26Å; L84-R88 WeakPolarHBondContact O-CB 3.22Å; L84-R88 PolarHBondContact O-N 2.8Å; S85-R88 PolarHBondContact O-N 3.1Å; R88-S90 PolarHBondContact O-N 3.05Å; R88-L91 PolarHBondContact O-N 3.32Å; R88-T92 PolarHBondContact O-N 3.07Å; R88-T92 PolarHBondContact O-OG1 3.5Å; R88-T92 VanDerWaalsContact O-OG1 3.11Å; R88-V99 HydrophobicContact CG-CG1 4.27Å; R88-G103 PolarHBondContact NE-O 3.35Å; R88-G103 PolarHBondContact NH2-O 3.21Å; R88-N104 PolarHBondContact NH2-OD1 2.92Å; R88-N104 VanDerWaalsContact NH2-OD1 3.12Å
89	Q	94.3	Very high	95	Very high	142 Å²	142	60.6 Å²	60.6	66%	0.664	35%	0.347	S	S	*	.	H	α-helix	trans	-62.6	-41.4	179.2	-172.9	-179.8	14.1	0	0	112	S85 I87 T92	S85-Q89 WeakPolarHBondContact O-CB 3.31Å; S85-Q89 PolarHBondContact O-N 2.89Å; I87-Q89 PolarHBondContact O-N 3.27Å; Q89-T92 WeakPolarHBondContact O-CB 3.42Å; Q89-T92 PolarHBondContact O-N 2.53Å
90	S	95.4	Very high	95.1	Very high	4 Å²	4	56.9 Å²	56.9	3%	0.028	32%	0.321	C	S	.	.	H	α-helix	trans	-61.7	-44.6	175.7	-60	0	0	0	0	111.5	N32 I36 V86 I87 R88 T92 A93	N32-S90 PolarHBondContact OD1-OG 3.14Å; I36-S90 VanDerWaalsContact CD1-O 3.27Å; I36-S90 WeakPolarHBondContact CD1-O 3.47Å; I36-S90 WeakPolarHBondContact CG1-O 3.19Å; V86-S90 VanDerWaalsContact O-CB 3.31Å; V86-S90 WeakPolarHBondContact O-CB 3.42Å; V86-S90 PolarHBondContact O-N 2.8Å; V86-S90 PolarHBondContact O-OG 3.13Å; I87-S90 PolarHBondContact O-N 2.84Å; R88-S90 PolarHBondContact O-N 3.05Å; S90-T92 VanDerWaalsContact C-N 3.27Å; S90-T92 PolarHBondContact O-N 3.26Å; S90-A93 PolarHBondContact O-N 3.33Å; S90-A93 VanDerWaalsContact O-N 3.16Å
91	L	96	Very high	95.1	Very high	1 Å²	1	64.9 Å²	64.9	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-68.5	-22.2	-177.4	-71.1	179.3	0	0	0	113.9	C39 L68 I87 R88 A93 S94 I97 V99 I106	C39-L91 HydrophobicContact CB-CD2 3.61Å; L68-L91 HydrophobicContact CD1-CD1 3.92Å; I87-L91 HydrophobicContact CG2-CD1 3.88Å; I87-L91 HydrophobicContact CG2-CG 4.24Å; I87-L91 WeakPolarHBondContact O-CB 3.38Å; I87-L91 VanDerWaalsContact O-CG 3.31Å; I87-L91 WeakPolarHBondContact O-CG 3.45Å; I87-L91 PolarHBondContact O-N 2.93Å; R88-L91 PolarHBondContact O-N 3.32Å; L91-A93 PolarHBondContact O-N 3.19Å; L91-A93 VanDerWaalsContact O-N 3.13Å; L91-S94 WeakPolarHBondContact O-CB 3.47Å; L91-S94 PolarHBondContact O-N 3.19Å; L91-I97 HydrophobicContact CD1-CG2 4.45Å; L91-I97 HydrophobicContact CD2-CB 4.47Å; L91-I97 HydrophobicContact CD2-CG2 4.35Å; L91-V99 HydrophobicContact CB-CG2 3.65Å; L91-I106 HydrophobicContact CD1-CD1 3.85Å; L91-I106 HydrophobicContact CD1-CG2 3.99Å
92	T	94.1	Very high	95.1	Very high	110 Å²	110	70 Å²	70	68%	0.675	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.1	171.7	-49	0	0	0	0	112.9	R88 Q89 S90	R88-T92 PolarHBondContact O-N 3.07Å; R88-T92 PolarHBondContact O-OG1 3.5Å; R88-T92 VanDerWaalsContact O-OG1 3.11Å; Q89-T92 WeakPolarHBondContact O-CB 3.42Å; Q89-T92 PolarHBondContact O-N 2.53Å; S90-T92 VanDerWaalsContact C-N 3.27Å; S90-T92 PolarHBondContact O-N 3.26Å
93	A	94	Very high	95.2	Very high	75 Å²	75	64.6 Å²	64.6	62%	0.62	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	1.3	175.7	0	0	0	0	0	114.5	I36 S90 L91	I36-A93 HydrophobicContact CD1-CB 4.1Å; S90-A93 PolarHBondContact O-N 3.33Å; S90-A93 VanDerWaalsContact O-N 3.16Å; L91-A93 PolarHBondContact O-N 3.19Å; L91-A93 VanDerWaalsContact O-N 3.13Å
94	S	95.5	Very high	95.2	Very high	15 Å²	15	65.4 Å²	65.4	11%	0.105	36%	0.356	C	S	.	.			trans	-77.4	142.7	175.8	-177.8	0	0	0	0	111.3	E40 L91 K96 I97	E40-S94 WeakPolarHBondContact CG-OG 3.18Å; E40-S94 PolarHBondContact OE1-OG 3.18Å; L91-S94 WeakPolarHBondContact O-CB 3.47Å; L91-S94 PolarHBondContact O-N 3.19Å; S94-K96 PolarHBondContact OG-N 2.93Å; S94-I97 PolarHBondContact OG-N 3.03Å
95	T	95.3	Very high	95.3	Very high	117 Å²	117	63.9 Å²	63.9	72%	0.718	35%	0.349	S	S	*	.	S	Bend	trans	-94.4	-4.5	174.4	59.3	0	0	0	0	113.5
96	K	96.4	Very high	95.4	Very high	100 Å²	100	60.9 Å²	60.9	44%	0.435	33%	0.328	S	S	.	.	S	Bend	trans	-118	-17.9	-175.5	-57.3	-176.8	-168.4	126.3	0	113.9	E40 S94 V109	E40-K96 HydrophobicContact CG-CB 4.24Å; E40-K96 HydrophobicContact CG-CD 4.37Å; E40-K96 IonicContact OE2-NZ 3.14Å; E40-K96 PolarHBondContact OE2-NZ 2.87Å; S94-K96 PolarHBondContact OG-N 2.93Å; K96-V109 PolarHBondContact O-N 3.4Å
97	I	97.1	Very high	95.5	Very high	6 Å²	6	61.8 Å²	61.8	3%	0.031	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.1	-179.2	-53.8	-58.9	0	0	0	108.6	E40 F43 L91 S94 I106 R107	E40-I97 HydrophobicContact CG-CG1 4.23Å; F43-I97 HydrophobicContact CB-CD1 3.61Å; F43-I97 HydrophobicContact CD2-CD1 3.61Å; F43-I97 HydrophobicContact CE2-CD1 4.48Å; F43-I97 HydrophobicContact CG-CD1 3.76Å; L91-I97 HydrophobicContact CD1-CG2 4.45Å; L91-I97 HydrophobicContact CD2-CB 4.47Å; L91-I97 HydrophobicContact CD2-CG2 4.35Å; S94-I97 PolarHBondContact OG-N 3.03Å; I97-I106 HydrophobicContact CG2-CB 3.92Å; I97-I106 HydrophobicContact CG2-CD1 4.12Å; I97-I106 HydrophobicContact CG2-CG1 4.47Å; I97-I106 HydrophobicContact CG2-CG2 4.47Å; I97-R107 WeakPolarHBondContact CA-O 3.39Å
98	E	96.4	Very high	95.6	Very high	74 Å²	74	63 Å²	63	35%	0.346	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	138.9	172.5	-170.4	-175.9	160.5	0	0	109.2	W65 I106 R107 V109	W65-E98 HydrophobicContact CH2-CG 4.19Å; E98-I106 CarbonylContact O-C 3.36Å; E98-I106 VanDerWaalsContact O-CA 3.22Å; E98-I106 WeakPolarHBondContact O-CA 3.5Å; E98-R107 HydrophobicContact CB-CG 3.98Å; E98-R107 PolarHBondContact N-O 3.46Å; E98-R107 PolarHBondContact O-N 3.38Å; E98-R107 IonicContact OE1-CZ 2.63Å; E98-R107 IonicContact OE1-NE 2.7Å; E98-R107 IonicContact OE1-NH2 3.18Å; E98-R107 PolarHBondContact OE1-NH2 3.44Å; E98-R107 IonicContact OE2-CZ 3.69Å; E98-R107 IonicContact OE2-NE 2.72Å; E98-R107 PolarHBondContact OE2-NE 2.83Å; E98-R107 IonicContact OE2-NH2 3.4Å; E98-R107 PolarHBondContact OE2-NH2 2.73Å; E98-V109 HydrophobicContact CB-CG2 4.09Å
99	V	96.7	Very high	95.6	Very high	33 Å²	33	63.2 Å²	63.2	20%	0.2	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	135.6	175.5	-176	0	0	0	0	107.9	R88 L91 I106	R88-V99 HydrophobicContact CG-CG1 4.27Å; L91-V99 HydrophobicContact CB-CG2 3.65Å; V99-I106 HydrophobicContact CB-CG2 4.42Å; V99-I106 HydrophobicContact CG1-CG2 4.36Å; V99-I106 HydrophobicContact CG2-CG2 4.03Å
100	S	95.9	Very high	95.7	Very high	18 Å²	18	60.7 Å²	60.7	13%	0.126	33%	0.332	C	S	.	.			trans	-68.5	162.4	177.8	55.3	0	0	0	0	112.8	D102 G103 T105	S100-D102 VanDerWaalsContact C-N 3.28Å; S100-D102 PolarHBondContact O-N 3.4Å; S100-G103 WeakPolarHBondContact O-CA 3.4Å; S100-G103 PolarHBondContact O-N 2.91Å; S100-T105 WeakPolarHBondContact CB-OG1 3.32Å; S100-T105 PolarHBondContact N-O 3.18Å; S100-T105 PolarHBondContact OG-N 3.26Å; S100-T105 VanDerWaalsContact OG-N 3.13Å; S100-T105 PolarHBondContact OG-O 2.89Å; S100-T105 VanDerWaalsContact OG-O 3.06Å; S100-T105 PolarHBondContact OG-OG1 2.83Å
101	E	94.3	Very high	95.6	Very high	208 Å²	208	65.8 Å²	65.8	97%	0.972	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-39.9	179.5	-61.8	179.8	-179	0	0	112.4	G103	E101-G103 PolarHBondContact O-N 3.42Å
102	D	93.7	Very high	95.6	Very high	133 Å²	133	68.8 Å²	68.8	71%	0.711	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-12.1	173.8	-63.7	-36.1	0	0	0	113.6	S100 N104	S100-D102 VanDerWaalsContact C-N 3.28Å; S100-D102 PolarHBondContact O-N 3.4Å; D102-N104 HydrophobicContact CB-CB 4.44Å; D102-N104 PolarHBondContact O-N 3.05Å; D102-N104 PolarHBondContact O-ND2 3.41Å
103	G	93.3	Very high	95.6	Very high	5 Å²	5	65.2 Å²	65.2	5%	0.052	36%	0.359	C	S	.	.	S	Bend	trans	68	11	-176.2	0	0	0	0	0	115	R88 S100 E101	R88-G103 PolarHBondContact NE-O 3.35Å; R88-G103 PolarHBondContact NH2-O 3.21Å; S100-G103 WeakPolarHBondContact O-CA 3.4Å; S100-G103 PolarHBondContact O-N 2.91Å; E101-G103 PolarHBondContact O-N 3.42Å
104	N	95	Very high	95.6	Very high	89 Å²	89	67.7 Å²	67.7	48%	0.476	37%	0.367	S	S	.	.	S	Bend	trans	-103	-16.9	-171.1	-68.4	-34.9	0	0	0	114	L68 R88 D102	L68-N104 WeakPolarHBondContact CB-O 3.5Å; L68-N104 PolarHBondContact N-O 2.8Å; R88-N104 PolarHBondContact NH2-OD1 2.92Å; R88-N104 VanDerWaalsContact NH2-OD1 3.12Å; D102-N104 HydrophobicContact CB-CB 4.44Å; D102-N104 PolarHBondContact O-N 3.05Å; D102-N104 PolarHBondContact O-ND2 3.41Å
105	T	96.7	Very high	95.4	Very high	31 Å²	31	72 Å²	72	19%	0.19	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	152.3	177.7	55.2	0	0	0	0	110.4	V66 D67 S100	V66-T105 CarbonylContact O-C 3.56Å; V66-T105 WeakPolarHBondContact O-CA 3.24Å; D67-T105 WeakPolarHBondContact OD1-CG2 3.37Å; S100-T105 WeakPolarHBondContact CB-OG1 3.32Å; S100-T105 PolarHBondContact N-O 3.18Å; S100-T105 PolarHBondContact OG-N 3.26Å; S100-T105 VanDerWaalsContact OG-N 3.13Å; S100-T105 PolarHBondContact OG-O 2.89Å; S100-T105 VanDerWaalsContact OG-O 3.06Å; S100-T105 PolarHBondContact OG-OG1 2.83Å
106	I	97.4	Very high	95	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	151.4	176.7	64.5	173	0	0	0	110.6	F43 V66 L68 I71 L91 I97 E98 V99	F43-I106 HydrophobicContact CE2-CD1 3.74Å; F43-I106 HydrophobicContact CE2-CG1 4.27Å; F43-I106 HydrophobicContact CZ-CD1 4.18Å; F43-I106 HydrophobicContact CZ-CG1 4.23Å; V66-I106 PolarHBondContact N-O 2.92Å; V66-I106 PolarHBondContact O-N 2.82Å; L68-I106 HydrophobicContact CD1-CD1 4.07Å; L68-I106 HydrophobicContact CD1-CG2 4.01Å; I71-I106 HydrophobicContact CB-CD1 4.39Å; I71-I106 HydrophobicContact CG1-CD1 4.11Å; I71-I106 HydrophobicContact CG1-CG1 4.42Å; I71-I106 HydrophobicContact CG2-CD1 4.25Å; L91-I106 HydrophobicContact CD1-CD1 3.85Å; L91-I106 HydrophobicContact CD1-CG2 3.99Å; I97-I106 HydrophobicContact CG2-CB 3.92Å; I97-I106 HydrophobicContact CG2-CD1 4.12Å; I97-I106 HydrophobicContact CG2-CG1 4.47Å; I97-I106 HydrophobicContact CG2-CG2 4.47Å; E98-I106 CarbonylContact O-C 3.36Å; E98-I106 VanDerWaalsContact O-CA 3.22Å; E98-I106 WeakPolarHBondContact O-CA 3.5Å; V99-I106 HydrophobicContact CB-CG2 4.42Å; V99-I106 HydrophobicContact CG1-CG2 4.36Å; V99-I106 HydrophobicContact CG2-CG2 4.03Å
107	R	96.9	Very high	94.5	Very high	62 Å²	62	73.5 Å²	73.5	23%	0.234	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	167.8	174.8	68.2	174.4	177	-163.1	-8	111.7	D63 G64 W65 I97 E98	D63-R107 VanDerWaalsContact O-CD 3.26Å; D63-R107 WeakPolarHBondContact O-CD 3.44Å; G64-R107 WeakPolarHBondContact O-CB 3.06Å; W65-R107 HydrophobicContact CD2-CB 4.11Å; W65-R107 HydrophobicContact CD2-CG 4.11Å; W65-R107 HydrophobicContact CE3-CB 3.8Å; W65-R107 HydrophobicContact CE3-CG 3.82Å; W65-R107 HydrophobicContact CH2-CG 3.88Å; W65-R107 HydrophobicContact CZ2-CG 4.17Å; W65-R107 VanDerWaalsContact CZ2-CZ 3.49Å; W65-R107 HydrophobicContact CZ3-CB 4.14Å; W65-R107 HydrophobicContact CZ3-CG 3.7Å; I97-R107 WeakPolarHBondContact CA-O 3.39Å; E98-R107 HydrophobicContact CB-CG 3.98Å; E98-R107 PolarHBondContact N-O 3.46Å; E98-R107 PolarHBondContact O-N 3.38Å; E98-R107 IonicContact OE1-CZ 2.63Å; E98-R107 IonicContact OE1-NE 2.7Å; E98-R107 IonicContact OE1-NH2 3.18Å; E98-R107 PolarHBondContact OE1-NH2 3.44Å; E98-R107 IonicContact OE2-CZ 3.69Å; E98-R107 IonicContact OE2-NE 2.72Å; E98-R107 PolarHBondContact OE2-NE 2.83Å; E98-R107 IonicContact OE2-NH2 3.4Å; E98-R107 PolarHBondContact OE2-NH2 2.73Å
108	R	97.2	Very high	94	Very high	25 Å²	25	75.3 Å²	75.3	9%	0.094	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	139.6	164.4	-74.5	171.3	52	120.5	1.4	110.1	F43 D45 D110 P111	F43-R108 HydrophobicContact CB-CG 3.75Å; F43-R108 HydrophobicContact CD1-CG 3.81Å; F43-R108 HydrophobicContact CG-CG 4.12Å; F43-R108 WeakPolarHBondContact O-CD 3.37Å; F43-R108 PolarHBondContact O-NH1 2.87Å; D45-R108 IonicContact OD1-CZ 3.33Å; D45-R108 VanDerWaalsContact OD1-CZ 3.23Å; D45-R108 IonicContact OD1-NH1 3.74Å; D45-R108 PolarHBondContact OD1-NH1 3.13Å; D45-R108 IonicContact OD1-NH2 2.79Å; D45-R108 PolarHBondContact OD1-NH2 2.66Å; R108-D110 VanDerWaalsContact CB-O 3.27Å; R108-D110 WeakPolarHBondContact CB-O 3.21Å; R108-D110 PolarHBondContact NE-O 3Å; R108-D110 PolarHBondContact NH2-O 3.4Å; R108-P111 PolarHBondContact NH2-O 2.95Å
109	V	96.7	Very high	93.8	Very high	80 Å²	80	72.2 Å²	72.2	49%	0.485	38%	0.382	S	S	.	.	S	Bend	trans	-69.7	-47.6	164.1	177	0	0	0	0	109.6	K96 E98	K96-V109 PolarHBondContact O-N 3.4Å; E98-V109 HydrophobicContact CB-CG2 4.09Å
110	D	95.2	Very high	93.4	Very high	88 Å²	88	71.6 Å²	71.6	47%	0.471	38%	0.376	S	S	.	.	S	Bend	trans	-78.8	137.4	179.3	-65.5	-50.2	0	0	0	112.5	R108	R108-D110 VanDerWaalsContact CB-O 3.27Å; R108-D110 WeakPolarHBondContact CB-O 3.21Å; R108-D110 PolarHBondContact NE-O 3Å; R108-D110 PolarHBondContact NH2-O 3.4Å
111	P	94.9	Very high	93.2	Very high	111 Å²	111	77.7 Å²	77.7	72%	0.721	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-59.6	156.5	177.9	26.9	-35.7	0	0	0	111.9	R108	R108-P111 PolarHBondContact NH2-O 2.95Å
112	L	95.6	Very high	93.2	Very high	65 Å²	65	71.2 Å²	71.2	34%	0.34	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-58.9	129.9	178.3	-76.9	176.8	0	0	0	111.1	I48 L55 V58 K59	I48-L112 HydrophobicContact CG1-CD2 3.56Å; I48-L112 HydrophobicContact CG2-CD2 4.25Å; L55-L112 HydrophobicContact CD1-CD1 4.13Å; L55-L112 HydrophobicContact CD1-CD2 4.23Å; V58-L112 HydrophobicContact CG1-CD1 4.01Å; V58-L112 HydrophobicContact CG1-CD2 4.13Å; V58-L112 HydrophobicContact CG1-CG 4.2Å; K59-L112 HydrophobicContact CG-CD1 4.22Å
113	P	94	Very high	93.3	Very high	34 Å²	34	65.1 Å²	65.1	22%	0.221	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-69.7	156.4	-179.5	30.5	-37	0	0	0	111.2	D45 I48 L49	D45-P113 HydrophobicContact CB-CB 4.35Å; D45-P113 HydrophobicContact CB-CG 3.95Å; D45-P113 WeakPolarHBondContact OD1-CG 3.46Å; I48-P113 HydrophobicContact CG2-CG 3.95Å; L49-P113 HydrophobicContact CD1-CB 4.44Å; L49-P113 HydrophobicContact CD1-CG 3.95Å; L49-P113 HydrophobicContact CD2-CG 4.3Å; L49-P113 WeakPolarHBondContact CD2-O 3.44Å; L49-P113 HydrophobicContact CG-CG 3.93Å
114	T	93.4	Very high	93.5	Very high	128 Å²	128	64.9 Å²	64.9	79%	0.785	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-81	153	169.1	57.2	0	0	0	0	110.5	D116	T114-D116 PolarHBondContact O-N 2.73Å
115	W	90.5	Very high	93.6	Very high	104 Å²	104	60.7 Å²	60.7	39%	0.394	31%	0.306	S	S	.	.			trans	-68.8	106.2	176.5	178	-83.8	0	0	0	110.7	L49 K50 V119 Y120 D166	L49-W115 HydrophobicContact CB-CE3 4.22Å; L49-W115 HydrophobicContact CD1-CB 4.39Å; L49-W115 HydrophobicContact CD1-CE3 4.3Å; K50-W115 HydrophobicContact CG-CZ3 4.12Å; W115-V119 HydrophobicContact CH2-CG1 4.2Å; W115-V119 HydrophobicContact CZ2-CG1 3.64Å; W115-Y120 HydrophobicContact CZ2-CE2 4Å; W115-Y120 AromaticContact CZ2-CZ 3.82Å; W115-Y120 WeakPolarHBondContact CZ2-OH 3.41Å; W115-D166 HydrophobicContact CH2-CB 4.14Å
116	D	87.5	Confident	93.6	Very high	90 Å²	90	59.2 Å²	59.2	48%	0.481	30%	0.297	S	S	.	.			trans	-83.5	131.6	172	-174.2	7.7	0	0	0	111.4	T114 S118 V119	T114-D116 PolarHBondContact O-N 2.73Å; D116-S118 VanDerWaalsContact C-N 3.3Å; D116-S118 VanDerWaalsContact CG-OG 3.31Å; D116-S118 WeakPolarHBondContact OD1-CB 3.17Å; D116-S118 PolarHBondContact OD1-N 3.44Å; D116-S118 WeakPolarHBondContact OD2-CB 3.41Å; D116-S118 PolarHBondContact OD2-OG 3.01Å; D116-V119 WeakPolarHBondContact O-CG1 3.05Å
117	K	86.6	Confident	93.6	Very high	159 Å²	159	59.2 Å²	59.2	69%	0.691	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-75.8	-17.9	172.6	-64.8	176.6	-173.2	167.1	0	112.3	V119 Y120	K117-V119 PolarHBondContact O-N 3Å; K117-V119 VanDerWaalsContact O-N 3.13Å; K117-Y120 VanDerWaalsContact O-CD2 3.28Å; K117-Y120 WeakPolarHBondContact O-CD2 3.46Å; K117-Y120 PolarHBondContact O-N 2.71Å
118	S	86.6	Confident	93.4	Very high	44 Å²	44	59.7 Å²	59.7	31%	0.308	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-61.4	-22.1	179.1	91.3	0	0	0	0	112.7	D116 Y120 Y121	D116-S118 VanDerWaalsContact C-N 3.3Å; D116-S118 VanDerWaalsContact CG-OG 3.31Å; D116-S118 WeakPolarHBondContact OD1-CB 3.17Å; D116-S118 PolarHBondContact OD1-N 3.44Å; D116-S118 WeakPolarHBondContact OD2-CB 3.41Å; D116-S118 PolarHBondContact OD2-OG 3.01Å; S118-Y120 PolarHBondContact O-N 3.04Å; S118-Y121 WeakPolarHBondContact O-CB 3.36Å; S118-Y121 PolarHBondContact O-N 3.03Å
119	V	91.1	Very high	93.3	Very high	10 Å²	10	59.5 Å²	59.5	6%	0.061	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-45.8	-38.4	173.6	70.4	0	0	0	0	112.7	W115 D116 K117 Y121 R122 T123 E186	W115-V119 HydrophobicContact CH2-CG1 4.2Å; W115-V119 HydrophobicContact CZ2-CG1 3.64Å; D116-V119 WeakPolarHBondContact O-CG1 3.05Å; K117-V119 PolarHBondContact O-N 3Å; K117-V119 VanDerWaalsContact O-N 3.13Å; V119-Y121 VanDerWaalsContact C-N 3.33Å; V119-Y121 PolarHBondContact O-N 2.84Å; V119-R122 CarbonylContact O-C 3.57Å; V119-R122 WeakPolarHBondContact O-CG 3.4Å; V119-R122 PolarHBondContact O-N 3.06Å; V119-T123 WeakPolarHBondContact O-CB 3.21Å; V119-T123 PolarHBondContact O-N 3.11Å; V119-T123 PolarHBondContact O-OG1 2.7Å; V119-E186 HydrophobicContact CG2-CG 4.35Å; V119-E186 WeakPolarHBondContact CG2-OE1 3.29Å
120	Y	90	Very high	93.2	Very high	19 Å²	19	58.5 Å²	58.5	8%	0.075	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-67.4	-29.1	179.2	-65.2	-64.5	0	0	0	113.3	W115 K117 S118 R122 L212 H214	W115-Y120 HydrophobicContact CZ2-CE2 4Å; W115-Y120 AromaticContact CZ2-CZ 3.82Å; W115-Y120 WeakPolarHBondContact CZ2-OH 3.41Å; K117-Y120 VanDerWaalsContact O-CD2 3.28Å; K117-Y120 WeakPolarHBondContact O-CD2 3.46Å; K117-Y120 PolarHBondContact O-N 2.71Å; S118-Y120 PolarHBondContact O-N 3.04Å; Y120-R122 VanDerWaalsContact C-N 3.35Å; Y120-L212 WeakPolarHBondContact CB-O 3.37Å; Y120-L212 HydrophobicContact CD1-CD2 3.81Å; Y120-L212 HydrophobicContact CD1-CG 4.01Å; Y120-L212 WeakPolarHBondContact CD1-O 3.49Å; Y120-L212 HydrophobicContact CE1-CD2 3.93Å; Y120-L212 HydrophobicContact CE1-CG 4.39Å; Y120-H214 HydrophobicContact CD1-CB 3.91Å; Y120-H214 HydrophobicContact CD2-CB 3.76Å; Y120-H214 HydrophobicContact CE1-CB 3.81Å; Y120-H214 AromaticContact CE1-CE1 3.05Å; Y120-H214 WeakPolarHBondContact CE1-CE1 3.45Å; Y120-H214 AromaticContact CE1-CG 3.98Å; Y120-H214 AromaticContact CE1-ND1 3.66Å; Y120-H214 HydrophobicContact CE2-CB 3.67Å; Y120-H214 AromaticContact CE2-CD2 4Å; Y120-H214 AromaticContact CE2-CE1 3.83Å; Y120-H214 AromaticContact CE2-CG 3.6Å; Y120-H214 AromaticContact CE2-ND1 3.81Å; Y120-H214 HydrophobicContact CG-CB 3.91Å; Y120-H214 AromaticContact CZ-CE1 2.91Å; Y120-H214 AromaticContact CZ-CG 3.48Å; Y120-H214 VanDerWaalsContact CZ-CG 3.48Å; Y120-H214 AromaticContact CZ-ND1 3.2Å; Y120-H214 PolarHBondContact OH-CE1 3.33Å; Y120-H214 PolarHBondContact OH-ND1 2.94Å; Y120-H214 PolarHBondContact OH-NE2 3.24Å
121	Y	90.7	Very high	92.7	Very high	147 Å²	147	63.6 Å²	63.6	58%	0.576	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-81.2	-13.1	178	-58.8	-62	0	0	0	114.2	S118 V119 R190 L211	S118-Y121 WeakPolarHBondContact O-CB 3.36Å; S118-Y121 PolarHBondContact O-N 3.03Å; V119-Y121 VanDerWaalsContact C-N 3.33Å; V119-Y121 PolarHBondContact O-N 2.84Å; Y121-R190 WeakPolarHBondContact O-CB 3.42Å; Y121-R190 WeakPolarHBondContact O-CG 3.38Å; Y121-R190 PolarHBondContact O-NH1 2.94Å; Y121-L211 WeakPolarHBondContact O-CD2 3.42Å
122	R	94.3	Very high	92.1	Very high	72 Å²	72	66.4 Å²	66.4	27%	0.272	33%	0.327	S	S	.	.	S	Bend	trans	-117.3	5.6	177.3	70.7	-178	-162.7	-177.9	-4.5	113.7	V119 Y120 E186 F187 P188	V119-R122 CarbonylContact O-C 3.57Å; V119-R122 WeakPolarHBondContact O-CG 3.4Å; V119-R122 PolarHBondContact O-N 3.06Å; Y120-R122 VanDerWaalsContact C-N 3.35Å; R122-E186 HydrophobicContact CG-CG 4.38Å; R122-E186 IonicContact CZ-OE1 3.32Å; R122-E186 IonicContact NE-OE1 2.85Å; R122-E186 PolarHBondContact NE-OE1 3.03Å; R122-E186 VanDerWaalsContact NE-OE1 3.13Å; R122-E186 IonicContact NH2-OE1 3.53Å; R122-E186 PolarHBondContact NH2-OE1 3.21Å; R122-F187 WeakPolarHBondContact CD-O 3.43Å; R122-F187 WeakPolarHBondContact CG-O 3.46Å; R122-F187 PolarHBondContact O-N 2.84Å; R122-P188 WeakPolarHBondContact CD-O 3.18Å; R122-P188 PolarHBondContact NH1-O 3.02Å
123	T	96.6	Very high	91.7	Very high	5 Å²	5	65.1 Å²	65.1	3%	0.031	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.2	176.4	-57.5	0	0	0	0	109.5	V119 V184 V185 E186 L212	V119-T123 WeakPolarHBondContact O-CB 3.21Å; V119-T123 PolarHBondContact O-N 3.11Å; V119-T123 PolarHBondContact O-OG1 2.7Å; T123-V184 HydrophobicContact CG2-CG1 3.47Å; T123-V184 VanDerWaalsContact CG2-CG1 3.47Å; T123-V185 CarbonylContact C-O 3.27Å; T123-V185 WeakPolarHBondContact CA-O 3.46Å; T123-V185 WeakPolarHBondContact CG2-O 3.41Å; T123-E186 HydrophobicContact CG2-CB 4.43Å; T123-L212 HydrophobicContact CG2-CB 3.9Å; T123-L212 HydrophobicContact CG2-CD2 3.67Å; T123-L212 HydrophobicContact CG2-CG 4.42Å; T123-L212 PolarHBondContact O-N 2.73Å
124	I	97	Very high	91.6	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	155.3	174	77.9	-179.6	0	0	0	109.9	L126 F144 V184 V185 F187 A193 A196 I197 Y210 L211	I124-L126 HydrophobicContact CD1-CD1 4.38Å; I124-L126 HydrophobicContact CD1-CD2 3.72Å; I124-L126 HydrophobicContact CD1-CG 4.04Å; I124-L126 HydrophobicContact CG1-CD2 4.25Å; I124-L126 HydrophobicContact CG1-CG 4.26Å; I124-F144 HydrophobicContact CD1-CZ 4.04Å; I124-V184 WeakPolarHBondContact O-CA 3.25Å; I124-V185 HydrophobicContact CG1-CB 4.01Å; I124-V185 PolarHBondContact N-O 2.59Å; I124-V185 PolarHBondContact O-N 2.95Å; I124-F187 HydrophobicContact CD1-CE2 3.76Å; I124-F187 HydrophobicContact CD1-CZ 4.23Å; I124-F187 HydrophobicContact CG1-CE2 3.94Å; I124-F187 HydrophobicContact CG2-CD2 4.46Å; I124-F187 HydrophobicContact CG2-CE2 4.18Å; I124-A193 HydrophobicContact CG2-CB 3.82Å; I124-A193 WeakPolarHBondContact CG2-O 3.21Å; I124-A196 HydrophobicContact CD1-CB 3.91Å; I124-I197 HydrophobicContact CB-CG1 4.22Å; I124-I197 HydrophobicContact CD1-CG1 4.48Å; I124-I197 HydrophobicContact CG2-CD1 3.95Å; I124-I197 HydrophobicContact CG2-CG1 3.8Å; I124-Y210 CarbonylContact C-O 3.58Å; I124-Y210 VanDerWaalsContact CA-O 3.24Å; I124-Y210 WeakPolarHBondContact CA-O 3.47Å; I124-Y210 WeakPolarHBondContact CB-O 3.44Å; I124-L211 HydrophobicContact CG2-CD2 4.35Å
125	I	96.8	Very high	91.6	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	131.5	163.8	-177.4	173.6	0	0	0	109	H174 L177 C182 A183 V184 Y208 A209 Y210 L212	I125-H174 HydrophobicContact CD1-CB 3.83Å; I125-L177 HydrophobicContact CD1-CD1 4.07Å; I125-L177 HydrophobicContact CD1-CD2 3.59Å; I125-L177 HydrophobicContact CD1-CG 3.57Å; I125-C182 HydrophobicContact CD1-CB 4.48Å; I125-A183 WeakPolarHBondContact CA-O 3.27Å; I125-V184 HydrophobicContact CG1-CG2 4.46Å; I125-Y208 HydrophobicContact CG2-CE1 3.99Å; I125-A209 WeakPolarHBondContact O-CA 3.26Å; I125-Y210 PolarHBondContact N-O 2.91Å; I125-Y210 PolarHBondContact O-N 2.94Å; I125-Y210 VanDerWaalsContact O-N 3.1Å; I125-L212 HydrophobicContact CB-CD1 4.32Å
126	L	97.4	Very high	91.9	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	135.4	170.7	-55.7	-179.8	0	0	0	108.4	I124 F129 F144 C182 A183 V185 S200 W204 I207 Y208 A209	I124-L126 HydrophobicContact CD1-CD1 4.38Å; I124-L126 HydrophobicContact CD1-CD2 3.72Å; I124-L126 HydrophobicContact CD1-CG 4.04Å; I124-L126 HydrophobicContact CG1-CD2 4.25Å; I124-L126 HydrophobicContact CG1-CG 4.26Å; L126-F129 HydrophobicContact CB-CE1 4.19Å; L126-F129 HydrophobicContact CB-CE2 4.04Å; L126-F129 HydrophobicContact CB-CZ 3.49Å; L126-F129 VanDerWaalsContact CB-CZ 3.49Å; L126-F129 HydrophobicContact CD1-CE1 4.34Å; L126-F129 HydrophobicContact CD1-CZ 4.18Å; L126-F144 HydrophobicContact CD1-CE2 3.88Å; L126-F144 HydrophobicContact CD1-CZ 3.9Å; L126-C182 CarbonylContact O-C 3.59Å; L126-C182 WeakPolarHBondContact O-CA 3.34Å; L126-A183 HydrophobicContact CB-CB 4.26Å; L126-A183 PolarHBondContact N-O 2.96Å; L126-A183 PolarHBondContact O-N 3.21Å; L126-V185 HydrophobicContact CD1-CG2 4.48Å; L126-S200 WeakPolarHBondContact CD2-OG 3.21Å; L126-W204 HydrophobicContact CD1-CH2 4.35Å; L126-W204 HydrophobicContact CD1-CZ3 3.93Å; L126-I207 HydrophobicContact CB-CD1 4.17Å; L126-I207 HydrophobicContact CD2-CD1 4.36Å; L126-Y208 CarbonylContact C-O 3.55Å; L126-Y208 VanDerWaalsContact CA-O 3.24Å; L126-Y208 WeakPolarHBondContact CA-O 3.24Å; L126-A209 HydrophobicContact CD2-CB 3.57Å
127	S	96	Very high	92.2	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	177.6	170.1	-168.7	0	0	0	0	109.4	F129 K180 I181 C182 I207 Y208	S127-F129 VanDerWaalsContact C-N 3.27Å; S127-F129 PolarHBondContact O-N 3.24Å; S127-K180 WeakPolarHBondContact OG-CB 3.42Å; S127-I181 WeakPolarHBondContact CB-O 3.27Å; S127-I181 PolarHBondContact OG-O 3.14Å; S127-C182 PolarHBondContact OG-SG 3.5Å; S127-C182 VanDerWaalsContact OG-SG 3.41Å; S127-I207 WeakPolarHBondContact O-CG1 3.43Å; S127-Y208 PolarHBondContact N-O 3.21Å; S127-Y208 WeakPolarHBondContact O-CA 3.4Å; S127-Y208 WeakPolarHBondContact O-CB 3.22Å; S127-Y208 PolarHBondContact O-N 3.24Å
128	E	94.4	Very high	92.6	Very high	72 Å²	72	55.7 Å²	55.7	34%	0.336	28%	0.282	S	S	.	.			trans	61.1	40.4	-178	-41.9	-164.4	164.6	0	0	111.4	Q176 K180	E128-Q176 HydrophobicContact CG-CG 4.3Å; E128-Q176 PolarHBondContact OE1-NE2 2.82Å; E128-K180 HydrophobicContact CG-CD 3.77Å; E128-K180 IonicContact OE1-NZ 3.42Å; E128-K180 PolarHBondContact OE1-NZ 2.71Å; E128-K180 IonicContact OE2-NZ 2.63Å
129	F	94.9	Very high	93.1	Very high	21 Å²	21	55.1 Å²	55.1	9%	0.092	28%	0.278	C	S	.	.			trans	-63.6	150.1	172	-61.6	-96.4	0	0	0	110.9	L126 S127 S133 V135 I140 I181 A183 W204 I207	L126-F129 HydrophobicContact CB-CE1 4.19Å; L126-F129 HydrophobicContact CB-CE2 4.04Å; L126-F129 HydrophobicContact CB-CZ 3.49Å; L126-F129 VanDerWaalsContact CB-CZ 3.49Å; L126-F129 HydrophobicContact CD1-CE1 4.34Å; L126-F129 HydrophobicContact CD1-CZ 4.18Å; S127-F129 VanDerWaalsContact C-N 3.27Å; S127-F129 PolarHBondContact O-N 3.24Å; F129-S133 VanDerWaalsContact CB-OG 3.27Å; F129-S133 WeakPolarHBondContact CB-OG 3.47Å; F129-V135 HydrophobicContact CB-CG2 3.94Å; F129-V135 HydrophobicContact CD1-CG2 3.87Å; F129-V135 HydrophobicContact CD2-CG1 4.27Å; F129-V135 HydrophobicContact CD2-CG2 3.99Å; F129-V135 HydrophobicContact CE1-CG1 4.35Å; F129-V135 HydrophobicContact CE1-CG2 4.3Å; F129-V135 HydrophobicContact CE2-CG1 3.93Å; F129-V135 HydrophobicContact CE2-CG2 4.42Å; F129-V135 HydrophobicContact CG-CG2 3.69Å; F129-V135 HydrophobicContact CZ-CG1 3.96Å; F129-I140 HydrophobicContact CZ-CD1 4.32Å; F129-I181 HydrophobicContact CD2-CG2 4.18Å; F129-A183 HydrophobicContact CE2-CB 4.37Å; F129-A183 HydrophobicContact CZ-CB 3.9Å; F129-W204 HydrophobicContact CD1-CD2 4.21Å; F129-W204 HydrophobicContact CD1-CG 4.45Å; F129-W204 HydrophobicContact CE1-CD2 4.37Å; F129-W204 HydrophobicContact CE1-CE3 4.48Å; F129-W204 HydrophobicContact CE1-CH2 4.37Å; F129-W204 HydrophobicContact CE1-CZ2 4.24Å; F129-W204 HydrophobicContact CE1-CZ3 4.49Å; F129-I207 HydrophobicContact CD1-CD1 3.71Å; F129-I207 HydrophobicContact CE1-CD1 3.75Å; F129-I207 HydrophobicContact CG-CD1 4.25Å; F129-I207 HydrophobicContact CZ-CD1 4.32Å
130	P	93.2	Very high	93.4	Very high	59 Å²	59	54.7 Å²	54.7	38%	0.383	28%	0.275	S	S	.	.			trans	-57.7	148.4	175	-24.6	34.4	0	0	0	112.9	N132 S133 W204	P130-N132 PolarHBondContact O-N 2.92Å; P130-N132 VanDerWaalsContact O-N 3.11Å; P130-S133 VanDerWaalsContact O-CB 3.29Å; P130-S133 WeakPolarHBondContact O-CB 3.29Å; P130-S133 PolarHBondContact O-N 3.15Å; P130-S133 PolarHBondContact O-OG 2.83Å; P130-W204 HydrophobicContact CG-CB 4.31Å
131	E	85.6	Confident	93.7	Very high	195 Å²	195	58 Å²	58	91%	0.911	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-32.8	-171.6	-62.8	-179.5	167.3	0	0	114.1
132	N	83.1	Confident	94	Very high	170 Å²	170	56.8 Å²	56.8	91%	0.909	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	10.4	-179.8	-63.1	-29	0	0	0	114.1	P130	P130-N132 PolarHBondContact O-N 2.92Å; P130-N132 VanDerWaalsContact O-N 3.11Å
133	S	87.2	Confident	94.1	Very high	38 Å²	38	54.6 Å²	54.6	27%	0.266	28%	0.284	S	S	.	.			trans	-82.7	129.7	-177.7	62.7	0	0	0	0	112.5	F129 P130 V135	F129-S133 VanDerWaalsContact CB-OG 3.27Å; F129-S133 WeakPolarHBondContact CB-OG 3.47Å; P130-S133 VanDerWaalsContact O-CB 3.29Å; P130-S133 WeakPolarHBondContact O-CB 3.29Å; P130-S133 PolarHBondContact O-N 3.15Å; P130-S133 PolarHBondContact O-OG 2.83Å; S133-V135 PolarHBondContact O-N 2.66Å; S133-V135 WeakPolarHBondContact OG-CG2 3.43Å
134	N	90.1	Very high	94.2	Very high	125 Å²	125	54.3 Å²	54.3	67%	0.668	28%	0.282	S	S	*	.			trans	-81.2	94.1	171.8	-171.7	-1.1	0	0	0	109.8	T136 S139	N134-T136 PolarHBondContact O-N 2.96Å; N134-T136 WeakPolarHBondContact OD1-CG2 3.17Å; N134-S139 WeakPolarHBondContact O-CB 3.47Å; N134-S139 PolarHBondContact O-OG 2.65Å
135	V	94.2	Very high	94.2	Very high	13 Å²	13	57.6 Å²	57.6	8%	0.079	30%	0.302	C	S	.	.			trans	-92.8	86	-177.1	-173	0	0	0	0	110.3	F129 S133 I140 V156 I181	F129-V135 HydrophobicContact CB-CG2 3.94Å; F129-V135 HydrophobicContact CD1-CG2 3.87Å; F129-V135 HydrophobicContact CD2-CG1 4.27Å; F129-V135 HydrophobicContact CD2-CG2 3.99Å; F129-V135 HydrophobicContact CE1-CG1 4.35Å; F129-V135 HydrophobicContact CE1-CG2 4.3Å; F129-V135 HydrophobicContact CE2-CG1 3.93Å; F129-V135 HydrophobicContact CE2-CG2 4.42Å; F129-V135 HydrophobicContact CG-CG2 3.69Å; F129-V135 HydrophobicContact CZ-CG1 3.96Å; S133-V135 PolarHBondContact O-N 2.66Å; S133-V135 WeakPolarHBondContact OG-CG2 3.43Å; V135-I140 HydrophobicContact CG1-CD1 3.65Å; V135-V156 HydrophobicContact CG1-CG1 4.07Å; V135-V156 HydrophobicContact CG1-CG2 4.35Å; V135-I181 HydrophobicContact CB-CD1 3.68Å; V135-I181 HydrophobicContact CB-CG1 4.5Å; V135-I181 HydrophobicContact CG1-CD1 3.81Å; V135-I181 HydrophobicContact CG1-CG1 4.14Å; V135-I181 HydrophobicContact CG2-CD1 4.28Å
136	T	95.9	Very high	94.2	Very high	47 Å²	47	64.7 Å²	64.7	29%	0.288	34%	0.337	S	S	.	.			trans	-114	169	173	56.3	0	0	0	0	111.1	N134 E138 S139 I140	N134-T136 PolarHBondContact O-N 2.96Å; N134-T136 WeakPolarHBondContact OD1-CG2 3.17Å; T136-E138 PolarHBondContact O-N 3.16Å; T136-S139 PolarHBondContact N-OG 3.27Å; T136-S139 VanDerWaalsContact N-OG 3.09Å; T136-S139 PolarHBondContact O-OG 2.75Å; T136-S139 WeakPolarHBondContact OG1-CB 3.47Å; T136-S139 PolarHBondContact OG1-N 2.93Å; T136-S139 VanDerWaalsContact OG1-N 3.12Å; T136-S139 PolarHBondContact OG1-OG 2.86Å; T136-S139 VanDerWaalsContact OG1-OG 3.06Å; T136-I140 VanDerWaalsContact O-CD1 3.3Å; T136-I140 WeakPolarHBondContact O-CD1 3.41Å; T136-I140 WeakPolarHBondContact O-CG1 3.37Å; T136-I140 PolarHBondContact O-N 2.82Å
137	V	95.6	Very high	94.2	Very high	36 Å²	36	68.1 Å²	68.1	22%	0.218	36%	0.355	C	S	.	.	H	α-helix	trans	-63.7	-39.4	174.7	172.5	0	0	0	0	109.4	Q141 V154 V156	V137-Q141 WeakPolarHBondContact O-CB 3.47Å; V137-Q141 PolarHBondContact O-N 2.63Å; V137-V154 HydrophobicContact CB-CG1 4.36Å; V137-V154 HydrophobicContact CG1-CB 4.05Å; V137-V154 HydrophobicContact CG1-CG1 4.08Å; V137-V156 HydrophobicContact CG2-CB 4.39Å; V137-V156 HydrophobicContact CG2-CG2 4.04Å
138	E	94.9	Very high	94.2	Very high	96 Å²	96	70.7 Å²	70.7	45%	0.449	38%	0.382	S	S	.	.	H	α-helix	trans	-68.5	-50.1	-177.2	-63.8	63.1	-139.1	0	0	111.3	K76 T136 I140 Q141 E142	K76-E138 VanDerWaalsContact CE-OE1 3.28Å; K76-E138 WeakPolarHBondContact CE-OE1 3.39Å; K76-E138 IonicContact NZ-OE1 3.7Å; K76-E138 PolarHBondContact NZ-OE1 3.19Å; T136-E138 PolarHBondContact O-N 3.16Å; E138-I140 VanDerWaalsContact C-N 3.34Å; E138-I140 PolarHBondContact O-N 3.32Å; E138-Q141 PolarHBondContact O-N 2.88Å; E138-E142 VanDerWaalsContact O-CB 3.27Å; E138-E142 WeakPolarHBondContact O-CB 3.27Å; E138-E142 PolarHBondContact O-N 2.85Å
139	S	96.2	Very high	94.3	Very high	32 Å²	32	68.4 Å²	68.4	22%	0.224	37%	0.371	C	S	.	.	H	α-helix	trans	-64.7	-36.5	-179.2	63.9	0	0	0	0	113	N134 T136 F143	N134-S139 WeakPolarHBondContact O-CB 3.47Å; N134-S139 PolarHBondContact O-OG 2.65Å; T136-S139 PolarHBondContact N-OG 3.27Å; T136-S139 VanDerWaalsContact N-OG 3.09Å; T136-S139 PolarHBondContact O-OG 2.75Å; T136-S139 WeakPolarHBondContact OG1-CB 3.47Å; T136-S139 PolarHBondContact OG1-N 2.93Å; T136-S139 VanDerWaalsContact OG1-N 3.12Å; T136-S139 PolarHBondContact OG1-OG 2.86Å; T136-S139 VanDerWaalsContact OG1-OG 3.06Å; S139-F143 VanDerWaalsContact O-CB 3.27Å; S139-F143 WeakPolarHBondContact O-CB 3.42Å; S139-F143 PolarHBondContact O-N 2.76Å
140	I	97.3	Very high	94.4	Very high	1 Å²	1	70.7 Å²	70.7	1%	0.005	39%	0.388	C	S	.	.	H	α-helix	trans	-72	-40.8	176.9	-68.2	164.8	0	0	0	110.9	F129 V135 T136 E138 F144 V154 V156 A183 V185	F129-I140 HydrophobicContact CZ-CD1 4.32Å; V135-I140 HydrophobicContact CG1-CD1 3.65Å; T136-I140 VanDerWaalsContact O-CD1 3.3Å; T136-I140 WeakPolarHBondContact O-CD1 3.41Å; T136-I140 WeakPolarHBondContact O-CG1 3.37Å; T136-I140 PolarHBondContact O-N 2.82Å; E138-I140 VanDerWaalsContact C-N 3.34Å; E138-I140 PolarHBondContact O-N 3.32Å; I140-F144 HydrophobicContact CG2-CD2 3.85Å; I140-F144 HydrophobicContact CG2-CE2 3.82Å; I140-F144 VanDerWaalsContact O-CD2 3.24Å; I140-F144 WeakPolarHBondContact O-CD2 3.21Å; I140-F144 PolarHBondContact O-N 3.28Å; I140-V154 HydrophobicContact CB-CG1 3.96Å; I140-V154 HydrophobicContact CG2-CG1 3.77Å; I140-V154 HydrophobicContact CG2-CG2 4.19Å; I140-V156 HydrophobicContact CD1-CG2 3.75Å; I140-A183 HydrophobicContact CD1-CB 3.39Å; I140-V185 HydrophobicContact CG2-CG2 3.71Å
141	Q	96.8	Very high	94.6	Very high	90 Å²	90	68.9 Å²	68.9	42%	0.421	38%	0.376	S	S	.	.	H	α-helix	trans	-63.9	-45.1	175.4	-178.5	175.2	-33.5	0	0	111.2	V137 E138 T145 P151 V154	V137-Q141 WeakPolarHBondContact O-CB 3.47Å; V137-Q141 PolarHBondContact O-N 2.63Å; E138-Q141 PolarHBondContact O-N 2.88Å; Q141-T145 VanDerWaalsContact O-CB 3.25Å; Q141-T145 WeakPolarHBondContact O-CB 3.43Å; Q141-T145 PolarHBondContact O-N 3.37Å; Q141-T145 PolarHBondContact O-OG1 2.9Å; Q141-P151 HydrophobicContact CB-CG 4.44Å; Q141-P151 HydrophobicContact CG-CG 4.2Å; Q141-V154 HydrophobicContact CB-CG2 4.15Å
142	E	96.8	Very high	95.1	Very high	121 Å²	121	61.6 Å²	61.6	57%	0.565	35%	0.347	S	S	*	.	H	α-helix	trans	-61.1	-51.2	176.5	-178.6	171.9	-152	0	0	111.4	E138 F144 T145 M146	E138-E142 VanDerWaalsContact O-CB 3.27Å; E138-E142 WeakPolarHBondContact O-CB 3.27Å; E138-E142 PolarHBondContact O-N 2.85Å; E142-F144 PolarHBondContact O-N 3.41Å; E142-T145 PolarHBondContact O-N 3.33Å; E142-T145 VanDerWaalsContact O-N 3.16Å; E142-M146 HydrophobicContact CG-CG 4.31Å; E142-M146 HydrophobicContact CG-SD 3.89Å; E142-M146 WeakPolarHBondContact O-CB 3.35Å; E142-M146 WeakPolarHBondContact O-CG 3.39Å; E142-M146 PolarHBondContact O-N 2.7Å
143	F	97.1	Very high	95.8	Very high	25 Å²	25	53.8 Å²	53.8	11%	0.11	31%	0.305	C	S	.	.	H	α-helix	trans	-51.7	-51.3	177.5	171.4	-102.5	0	0	0	112.3	S139 N147 L199 H203 W204	S139-F143 VanDerWaalsContact O-CB 3.27Å; S139-F143 WeakPolarHBondContact O-CB 3.42Å; S139-F143 PolarHBondContact O-N 2.76Å; F143-N147 PolarHBondContact O-N 3.18Å; F143-N147 PolarHBondContact O-ND2 3.37Å; F143-L199 HydrophobicContact CZ-CB 4.45Å; F143-H203 AromaticContact CD2-CD2 3.67Å; F143-H203 AromaticContact CD2-NE2 3.87Å; F143-H203 HydrophobicContact CE2-CB 3.7Å; F143-H203 AromaticContact CE2-CD2 3.22Å; F143-H203 WeakPolarHBondContact CE2-CD2 3.2Å; F143-H203 AromaticContact CE2-CG 3.35Å; F143-H203 AromaticContact CE2-ND1 3.94Å; F143-H203 AromaticContact CE2-NE2 3.79Å; F143-H203 HydrophobicContact CZ-CB 3.6Å; F143-H203 AromaticContact CZ-CD2 3.73Å; F143-H203 AromaticContact CZ-CG 3.77Å; F143-W204 AromaticContact CD1-CH2 3.47Å; F143-W204 HydrophobicContact CD1-CH2 3.47Å; F143-W204 VanDerWaalsContact CD1-CH2 3.47Å; F143-W204 HydrophobicContact CD1-CZ2 4.22Å; F143-W204 HydrophobicContact CD1-CZ3 4.06Å; F143-W204 AromaticContact CE1-CH2 3.62Å; F143-W204 HydrophobicContact CE1-CH2 3.62Å; F143-W204 HydrophobicContact CE1-CZ2 4.47Å; F143-W204 AromaticContact CE1-CZ3 3.73Å; F143-W204 HydrophobicContact CE1-CZ3 3.73Å; F143-W204 HydrophobicContact CG-CH2 4.03Å; F143-W204 HydrophobicContact CG-CZ2 4.33Å; F143-W204 HydrophobicContact CZ-CH2 4.3Å; F143-W204 HydrophobicContact CZ-CZ3 4.33Å
144	F	97.9	Very high	96.3	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-71.7	-34	-178.9	-76.3	-56.1	0	0	0	113	I124 L126 I140 E142 N147 G148 H149 P151 V185 F187 A196 S200 W204	I124-F144 HydrophobicContact CD1-CZ 4.04Å; L126-F144 HydrophobicContact CD1-CE2 3.88Å; L126-F144 HydrophobicContact CD1-CZ 3.9Å; I140-F144 HydrophobicContact CG2-CD2 3.85Å; I140-F144 HydrophobicContact CG2-CE2 3.82Å; I140-F144 VanDerWaalsContact O-CD2 3.24Å; I140-F144 WeakPolarHBondContact O-CD2 3.21Å; I140-F144 PolarHBondContact O-N 3.28Å; E142-F144 PolarHBondContact O-N 3.41Å; F144-N147 PolarHBondContact O-N 2.72Å; F144-G148 PolarHBondContact O-N 3.44Å; F144-H149 CarbonylContact C-O 3.59Å; F144-H149 WeakPolarHBondContact CB-O 3.3Å; F144-H149 CarbonylContact O-C 3.51Å; F144-H149 VanDerWaalsContact O-C 3.27Å; F144-H149 WeakPolarHBondContact O-CA 3.48Å; F144-H149 PolarHBondContact O-N 3.11Å; F144-P151 HydrophobicContact CB-CG 4.36Å; F144-V185 HydrophobicContact CD2-CG1 4.13Å; F144-V185 HydrophobicContact CE2-CG1 4.2Å; F144-V185 HydrophobicContact CE2-CG2 4.24Å; F144-F187 HydrophobicContact CB-CE1 4.29Å; F144-F187 HydrophobicContact CD1-CE1 4.21Å; F144-F187 HydrophobicContact CD1-CZ 4.01Å; F144-F187 HydrophobicContact CD2-CZ 4.04Å; F144-F187 HydrophobicContact CE1-CZ 4.15Å; F144-F187 HydrophobicContact CE2-CZ 4.16Å; F144-F187 HydrophobicContact CG-CE1 4.1Å; F144-F187 AromaticContact CG-CZ 3.97Å; F144-F187 HydrophobicContact CG-CZ 3.97Å; F144-F187 HydrophobicContact CZ-CZ 4.22Å; F144-A196 HydrophobicContact CD1-CB 4Å; F144-A196 HydrophobicContact CE1-CB 3.52Å; F144-A196 HydrophobicContact CZ-CB 4.14Å; F144-S200 WeakPolarHBondContact CZ-OG 3.3Å; F144-W204 HydrophobicContact CZ-CZ3 4.44Å
145	T	97.2	Very high	96.6	Very high	68 Å²	68	48.2 Å²	48.2	42%	0.417	27%	0.27	S	S	.	.	H	α-helix	trans	-66.7	-45.1	176	-56.7	0	0	0	0	111.6	Q141 E142 N147 G148 P150	Q141-T145 VanDerWaalsContact O-CB 3.25Å; Q141-T145 WeakPolarHBondContact O-CB 3.43Å; Q141-T145 PolarHBondContact O-N 3.37Å; Q141-T145 PolarHBondContact O-OG1 2.9Å; E142-T145 PolarHBondContact O-N 3.33Å; E142-T145 VanDerWaalsContact O-N 3.16Å; T145-N147 VanDerWaalsContact C-N 3.26Å; T145-N147 PolarHBondContact O-N 3.16Å; T145-G148 PolarHBondContact O-N 2.98Å; T145-P150 HydrophobicContact CG2-CB 4.4Å
146	M	96.7	Very high	96.7	Very high	150 Å²	150	48.8 Å²	48.8	74%	0.739	27%	0.273	S	S	*	.	H	α-helix	trans	-61.2	-33.9	175.9	-75.3	179.6	61.4	0	0	112.8	E142 G148	E142-M146 HydrophobicContact CG-CG 4.31Å; E142-M146 HydrophobicContact CG-SD 3.89Å; E142-M146 WeakPolarHBondContact O-CB 3.35Å; E142-M146 WeakPolarHBondContact O-CG 3.39Å; E142-M146 PolarHBondContact O-N 2.7Å; M146-G148 PolarHBondContact O-N 2.92Å
147	N	96.8	Very high	96.7	Very high	71 Å²	71	47.9 Å²	47.9	38%	0.38	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	16.2	176.3	-72.6	-87.7	0	0	0	113.2	F143 F144 T145 H149 L199	F143-N147 PolarHBondContact O-N 3.18Å; F143-N147 PolarHBondContact O-ND2 3.37Å; F144-N147 PolarHBondContact O-N 2.72Å; T145-N147 VanDerWaalsContact C-N 3.26Å; T145-N147 PolarHBondContact O-N 3.16Å; N147-H149 VanDerWaalsContact C-N 3.34Å; N147-H149 PolarHBondContact O-CD2 3.41Å; N147-H149 PolarHBondContact O-N 3.27Å; N147-L199 HydrophobicContact CB-CD1 3.98Å; N147-L199 HydrophobicContact CB-CD2 4.48Å
148	G	96.7	Very high	96.6	Very high	54 Å²	54	50.2 Å²	50.2	56%	0.557	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	10.7	172.5	0	0	0	0	0	115.8	F144 T145 M146 P150	F144-G148 PolarHBondContact O-N 3.44Å; T145-G148 PolarHBondContact O-N 2.98Å; M146-G148 PolarHBondContact O-N 2.92Å; G148-P150 VanDerWaalsContact C-CD 3.49Å; G148-P150 WeakPolarHBondContact O-CD 3.39Å
149	H	96.2	Very high	96.5	Very high	25 Å²	25	48.1 Å²	48.1	12%	0.116	27%	0.269	C	S	.	.			trans	-124.6	65.8	-179.3	-63.8	-63.6	0	0	0	111.2	F144 N147 F187 D192 K195	F144-H149 CarbonylContact C-O 3.59Å; F144-H149 WeakPolarHBondContact CB-O 3.3Å; F144-H149 CarbonylContact O-C 3.51Å; F144-H149 VanDerWaalsContact O-C 3.27Å; F144-H149 WeakPolarHBondContact O-CA 3.48Å; F144-H149 PolarHBondContact O-N 3.11Å; N147-H149 VanDerWaalsContact C-N 3.34Å; N147-H149 PolarHBondContact O-CD2 3.41Å; N147-H149 PolarHBondContact O-N 3.27Å; H149-F187 HydrophobicContact CB-CD1 4.49Å; H149-F187 HydrophobicContact CB-CE1 4.26Å; H149-F187 VanDerWaalsContact O-CE1 3.31Å; H149-F187 WeakPolarHBondContact O-CE1 3.49Å; H149-D192 IonicContact CE1-OD1 2.81Å; H149-D192 PolarHBondContact CE1-OD1 2.83Å; H149-D192 IonicContact ND1-OD1 2.59Å; H149-D192 PolarHBondContact ND1-OD1 3.11Å; H149-K195 WeakPolarHBondContact CE1-CD 3.35Å; H149-K195 WeakPolarHBondContact NE2-CD 3.49Å
150	P	96.9	Very high	96.3	Very high	69 Å²	69	54.1 Å²	54.1	45%	0.448	30%	0.298	S	S	.	.			trans	-59.8	126.1	-176.8	24.9	-34.3	0	0	0	111.7	T145 G148	T145-P150 HydrophobicContact CG2-CB 4.4Å; G148-P150 VanDerWaalsContact C-CD 3.49Å; G148-P150 WeakPolarHBondContact O-CD 3.39Å
151	P	97.5	Very high	96.1	Very high	20 Å²	20	62.2 Å²	62.2	13%	0.13	33%	0.329	C	S	.	.			trans	-78.2	147.8	-179.9	31.4	-33.7	0	0	0	111.7	Q141 F144 V154 V185 E186 F187	Q141-P151 HydrophobicContact CB-CG 4.44Å; Q141-P151 HydrophobicContact CG-CG 4.2Å; F144-P151 HydrophobicContact CB-CG 4.36Å; P151-V154 HydrophobicContact CB-CG2 3.91Å; P151-V154 HydrophobicContact CG-CG2 3.54Å; P151-V185 HydrophobicContact CB-CG1 3.5Å; P151-V185 HydrophobicContact CG-CG1 4.3Å; P151-E186 CarbonylContact C-O 3.46Å; P151-E186 WeakPolarHBondContact CA-O 3.42Å; P151-F187 HydrophobicContact CB-CD1 4.37Å; P151-F187 HydrophobicContact CB-CE1 4.16Å
152	S	96.3	Very high	95.8	Very high	42 Å²	42	67.3 Å²	67.3	29%	0.294	35%	0.35	S	S	.	.	S	Bend	trans	-78.3	-30.6	173.9	-52.7	0	0	0	0	112.9	E186 P188	S152-E186 PolarHBondContact N-O 3.25Å; S152-P188 WeakPolarHBondContact OG-CD 3.44Å
153	L	96.9	Very high	95.6	Very high	7 Å²	7	62.6 Å²	62.6	4%	0.037	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	132.1	176.1	173.2	65.4	0	0	0	110.7	F41 A46 K50 R155 V185 E186	F41-L153 HydrophobicContact CE2-CD1 3.9Å; F41-L153 HydrophobicContact CZ-CD1 3.54Å; A46-L153 HydrophobicContact CB-CB 4.17Å; A46-L153 WeakPolarHBondContact O-CD2 3.44Å; K50-L153 HydrophobicContact CD-CD2 3.66Å; L153-R155 HydrophobicContact CD1-CG 4.26Å; L153-R155 HydrophobicContact CD2-CG 4.4Å; L153-R155 HydrophobicContact CG-CG 4.25Å; L153-V185 WeakPolarHBondContact O-CA 3.46Å; L153-E186 HydrophobicContact CB-CB 4.16Å; L153-E186 PolarHBondContact N-O 2.67Å; L153-E186 PolarHBondContact O-N 2.63Å
154	V	97.6	Very high	95.4	Very high	9 Å²	9	63.3 Å²	63.3	6%	0.055	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	128.8	172.3	175.6	0	0	0	0	109.4	V137 I140 Q141 P151 V185	V137-V154 HydrophobicContact CB-CG1 4.36Å; V137-V154 HydrophobicContact CG1-CB 4.05Å; V137-V154 HydrophobicContact CG1-CG1 4.08Å; I140-V154 HydrophobicContact CB-CG1 3.96Å; I140-V154 HydrophobicContact CG2-CG1 3.77Å; I140-V154 HydrophobicContact CG2-CG2 4.19Å; Q141-V154 HydrophobicContact CB-CG2 4.15Å; P151-V154 HydrophobicContact CB-CG2 3.91Å; P151-V154 HydrophobicContact CG-CG2 3.54Å; V154-V185 HydrophobicContact CG1-CG2 4.41Å; V154-V185 HydrophobicContact CG2-CG1 4.05Å; V154-V185 HydrophobicContact CG2-CG2 4.37Å
155	R	96.5	Very high	95	Very high	37 Å²	37	66.3 Å²	66.3	14%	0.14	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	110.9	176.8	-80.2	165	47.5	172.8	-7.1	110.9	L153 P164 D166 A183 V184	L153-R155 HydrophobicContact CD1-CG 4.26Å; L153-R155 HydrophobicContact CD2-CG 4.4Å; L153-R155 HydrophobicContact CG-CG 4.25Å; R155-P164 VanDerWaalsContact NH2-CB 3.29Å; R155-D166 IonicContact CZ-OD1 3.33Å; R155-D166 IonicContact CZ-OD2 2.86Å; R155-D166 IonicContact NH1-OD1 3.13Å; R155-D166 IonicContact NH1-OD2 2.73Å; R155-D166 PolarHBondContact NH1-OD2 3.39Å; R155-D166 IonicContact NH2-OD1 2.73Å; R155-D166 PolarHBondContact NH2-OD1 2.98Å; R155-D166 VanDerWaalsContact NH2-OD1 3.11Å; R155-D166 IonicContact NH2-OD2 2.82Å; R155-D166 PolarHBondContact NH2-OD2 3.48Å; R155-A183 WeakPolarHBondContact O-CA 3.37Å; R155-V184 HydrophobicContact CB-CB 4.48Å; R155-V184 PolarHBondContact N-O 3.01Å; R155-V184 PolarHBondContact O-N 2.88Å
156	V	96.4	Very high	94.6	Very high	24 Å²	24	64.1 Å²	64.1	15%	0.145	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	128.7	171.2	-177.6	0	0	0	0	110.2	V135 V137 I140 F158 I181 A183	V135-V156 HydrophobicContact CG1-CG1 4.07Å; V135-V156 HydrophobicContact CG1-CG2 4.35Å; V137-V156 HydrophobicContact CG2-CB 4.39Å; V137-V156 HydrophobicContact CG2-CG2 4.04Å; I140-V156 HydrophobicContact CD1-CG2 3.75Å; V156-F158 HydrophobicContact CG1-CD2 4.44Å; V156-F158 HydrophobicContact CG1-CE1 4.26Å; V156-F158 HydrophobicContact CG1-CE2 3.87Å; V156-F158 HydrophobicContact CG1-CZ 3.76Å; V156-I181 HydrophobicContact CG1-CD1 4.25Å; V156-I181 HydrophobicContact CG1-CG1 4.2Å; V156-A183 HydrophobicContact CG2-CB 4.45Å
157	L	95.5	Very high	94.4	Very high	28 Å²	28	57.1 Å²	57.1	15%	0.147	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	117	-178.8	-58	173.7	0	0	0	108.4	P164 L167 L177 I181 C182 V184	L157-P164 HydrophobicContact CD2-CG 4.02Å; L157-L167 HydrophobicContact CD1-CD1 3.5Å; L157-L177 HydrophobicContact CD1-CD2 3.77Å; L157-I181 WeakPolarHBondContact O-CA 3.28Å; L157-C182 HydrophobicContact CB-CB 4.42Å; L157-C182 PolarHBondContact N-O 2.87Å; L157-C182 PolarHBondContact O-N 3.16Å; L157-V184 HydrophobicContact CD1-CG2 4.05Å
158	F	93.9	Very high	94.1	Very high	85 Å²	85	59.5 Å²	59.5	37%	0.373	31%	0.314	S	S	.	.			trans	-86.6	153.9	179.3	-64.7	-84	0	0	0	111.7	V156 R161 I181	V156-F158 HydrophobicContact CG1-CD2 4.44Å; V156-F158 HydrophobicContact CG1-CE1 4.26Å; V156-F158 HydrophobicContact CG1-CE2 3.87Å; V156-F158 HydrophobicContact CG1-CZ 3.76Å; F158-R161 HydrophobicContact CB-CG 4.36Å; F158-I181 HydrophobicContact CD1-CD1 3.76Å; F158-I181 HydrophobicContact CD1-CG1 4.21Å; F158-I181 HydrophobicContact CE1-CD1 3.54Å; F158-I181 HydrophobicContact CE1-CG1 4.38Å; F158-I181 HydrophobicContact CZ-CD1 4.46Å
159	P	93.7	Very high	93.6	Very high	53 Å²	53	61.4 Å²	61.4	34%	0.344	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	150.2	172.5	-27.7	35.2	0	0	0	113.3	R161 V179	P159-R161 PolarHBondContact O-N 3.11Å; P159-V179 WeakPolarHBondContact CB-O 3.3Å
160	N	92.1	Very high	93.2	Very high	157 Å²	157	60.2 Å²	60.2	84%	0.84	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	10.4	172.9	-54.3	-34.4	0	0	0	115.5	G178	N160-G178 PolarHBondContact N-O 3.23Å
161	R	91.9	Very high	92.9	Very high	171 Å²	171	60.7 Å²	60.7	65%	0.645	30%	0.296	S	S	*	.	S	Bend	trans	-91.8	152.9	172.5	-63.9	-164.3	179.4	-172.5	0.8	111.7	F158 P159 I163	F158-R161 HydrophobicContact CB-CG 4.36Å; P159-R161 PolarHBondContact O-N 3.11Å; R161-I163 PolarHBondContact O-N 3.26Å
162	K	91.2	Very high	92.3	Very high	198 Å²	198	64.3 Å²	64.3	86%	0.861	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-57.8	120	175.2	-177.1	179.9	-179.2	180	0	110.3
163	I	92.3	Very high	92	Very high	21 Å²	21	63.1 Å²	63.1	11%	0.108	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-71.8	132.4	178.3	-63.9	167	0	0	0	109.7	R161 L167 Q171 L177	R161-I163 PolarHBondContact O-N 3.26Å; I163-L167 HydrophobicContact CG2-CB 3.82Å; I163-Q171 HydrophobicContact CD1-CB 4.29Å; I163-Q171 HydrophobicContact CD1-CG 3.73Å; I163-L177 HydrophobicContact CD1-CB 4.37Å; I163-L177 WeakPolarHBondContact CD1-O 3.19Å
164	P	92.5	Very high	91.6	Very high	40 Å²	40	62.9 Å²	62.9	26%	0.26	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-51.1	146.1	173	-33.5	40.8	0	0	0	114	R155 L157 D166 L167 K168	R155-P164 VanDerWaalsContact NH2-CB 3.29Å; L157-P164 HydrophobicContact CD2-CG 4.02Å; P164-D166 VanDerWaalsContact C-N 3.28Å; P164-D166 WeakPolarHBondContact CB-OD1 3.27Å; P164-D166 PolarHBondContact O-N 3.02Å; P164-L167 PolarHBondContact O-N 3.35Å; P164-L167 VanDerWaalsContact O-N 3.11Å; P164-K168 PolarHBondContact O-N 3.37Å
165	S	89.8	Confident	91.2	Very high	64 Å²	64	65.4 Å²	65.4	45%	0.448	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-34.1	-171.8	42.2	0	0	0	0	113.7
166	D	89.7	Confident	90.9	Very high	22 Å²	22	64.7 Å²	64.7	12%	0.118	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-37.9	176.1	62.2	-34.7	0	0	0	112.7	W115 R155 P164 H214	W115-D166 HydrophobicContact CH2-CB 4.14Å; R155-D166 IonicContact CZ-OD1 3.33Å; R155-D166 IonicContact CZ-OD2 2.86Å; R155-D166 IonicContact NH1-OD1 3.13Å; R155-D166 IonicContact NH1-OD2 2.73Å; R155-D166 PolarHBondContact NH1-OD2 3.39Å; R155-D166 IonicContact NH2-OD1 2.73Å; R155-D166 PolarHBondContact NH2-OD1 2.98Å; R155-D166 VanDerWaalsContact NH2-OD1 3.11Å; R155-D166 IonicContact NH2-OD2 2.82Å; R155-D166 PolarHBondContact NH2-OD2 3.48Å; P164-D166 VanDerWaalsContact C-N 3.28Å; P164-D166 WeakPolarHBondContact CB-OD1 3.27Å; P164-D166 PolarHBondContact O-N 3.02Å; D166-H214 PolarHBondContact O-NE2 3.38Å
167	L	92.2	Very high	90.6	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.01	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-6.5	-177.1	-63.3	-176.2	0	0	0	115.1	L157 I163 P164 R169 S170 Q171 L177 V184 L212	L157-L167 HydrophobicContact CD1-CD1 3.5Å; I163-L167 HydrophobicContact CG2-CB 3.82Å; P164-L167 PolarHBondContact O-N 3.35Å; P164-L167 VanDerWaalsContact O-N 3.11Å; L167-R169 PolarHBondContact O-N 3.09Å; L167-R169 VanDerWaalsContact O-N 3.15Å; L167-S170 CarbonylContact O-C 3.45Å; L167-S170 WeakPolarHBondContact O-CA 3.42Å; L167-S170 WeakPolarHBondContact O-CB 3.5Å; L167-S170 PolarHBondContact O-N 3.06Å; L167-Q171 PolarHBondContact O-N 3.12Å; L167-L177 HydrophobicContact CD1-CD2 4.38Å; L167-V184 HydrophobicContact CD1-CG2 3.9Å; L167-L212 HydrophobicContact CD2-CD1 4.13Å; L167-L212 HydrophobicContact CD2-CD2 3.62Å; L167-L212 HydrophobicContact CD2-CG 4.46Å
168	K	89.4	Confident	90.3	Very high	121 Å²	121	62.8 Å²	62.8	53%	0.526	31%	0.31	S	S	.	.	H	α-helix	trans	-55	-35.6	-178.5	-73.5	-175.7	174.4	-173.1	0	113.8	P164	P164-K168 PolarHBondContact O-N 3.37Å
169	R	86.7	Confident	90.2	Very high	94 Å²	94	63.2 Å²	63.2	36%	0.355	32%	0.32	S	S	.	.	H	α-helix	trans	-79.1	-27.9	175.7	-57.3	-164.7	-167.5	90.8	15.2	112.7	L167 H214 G215	L167-R169 PolarHBondContact O-N 3.09Å; L167-R169 VanDerWaalsContact O-N 3.15Å; R169-H214 PolarHBondContact NH1-NE2 3.04Å; R169-G215 WeakPolarHBondContact CD-O 3.44Å
170	S	89	Confident	90.2	Very high	0 Å²	0	65 Å²	65	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-70.5	-31.2	174.8	-59.2	0	0	0	0	111.9	L167 I172 L173 H174 C213 H214	L167-S170 CarbonylContact O-C 3.45Å; L167-S170 WeakPolarHBondContact O-CA 3.42Å; L167-S170 WeakPolarHBondContact O-CB 3.5Å; L167-S170 PolarHBondContact O-N 3.06Å; S170-I172 PolarHBondContact O-N 2.67Å; S170-L173 PolarHBondContact O-N 3.37Å; S170-L173 VanDerWaalsContact O-N 3.07Å; S170-H174 PolarHBondContact O-CD2 3.04Å; S170-H174 PolarHBondContact O-N 2.7Å; S170-C213 WeakPolarHBondContact CA-O 3.49Å; S170-C213 WeakPolarHBondContact CB-O 3.41Å; S170-C213 PolarHBondContact OG-O 3.42Å; S170-H214 PolarHBondContact OG-CE1 2.72Å
171	Q	89.9	Confident	90.3	Very high	80 Å²	80	59.6 Å²	59.6	37%	0.374	29%	0.293	S	S	.	.	H	α-helix	trans	-56.4	-34.9	175.9	-170.2	-170.4	11.1	0	0	113.5	I163 L167 L173 H174 L177	I163-Q171 HydrophobicContact CD1-CB 4.29Å; I163-Q171 HydrophobicContact CD1-CG 3.73Å; L167-Q171 PolarHBondContact O-N 3.12Å; Q171-L173 PolarHBondContact O-N 3.19Å; Q171-H174 CarbonylContact O-C 3.51Å; Q171-L177 HydrophobicContact CB-CB 4.25Å; Q171-L177 HydrophobicContact CG-CB 4.08Å; Q171-L177 PolarHBondContact NE2-O 2.72Å
172	I	85.6	Confident	90.5	Very high	95 Å²	95	51.5 Å²	51.5	49%	0.487	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-34.4	179.7	-57.5	173	0	0	0	111	S170	S170-I172 PolarHBondContact O-N 2.67Å
173	L	88.4	Confident	90.8	Very high	18 Å²	18	42 Å²	42	9%	0.094	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-49.5	-179.1	-58.1	176.7	0	0	0	110.8	S170 Q171 C213 T249 L251	S170-L173 PolarHBondContact O-N 3.37Å; S170-L173 VanDerWaalsContact O-N 3.07Å; Q171-L173 PolarHBondContact O-N 3.19Å; L173-C213 HydrophobicContact CB-CB 4.41Å; L173-C213 HydrophobicContact CD1-CB 3.39Å; L173-T249 VanDerWaalsContact CD2-OG1 3.23Å; L173-T249 WeakPolarHBondContact CD2-OG1 3.46Å; L173-L251 WeakPolarHBondContact O-CD1 3.31Å
174	H	90	Very high	91.1	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	22%	0.218	C	C	.	.			trans	-99	87.3	178.7	-52.6	-75.2	0	0	0	110.3	I125 S170 Q171 Q176 L177 Y208 L211 C213	I125-H174 HydrophobicContact CD1-CB 3.83Å; S170-H174 PolarHBondContact O-CD2 3.04Å; S170-H174 PolarHBondContact O-N 2.7Å; Q171-H174 CarbonylContact O-C 3.51Å; H174-Q176 PolarHBondContact O-N 3.23Å; H174-L177 HydrophobicContact CB-CD1 4.06Å; H174-L177 HydrophobicContact CB-CG 4.22Å; H174-L177 WeakPolarHBondContact O-CB 3.02Å; H174-L177 PolarHBondContact O-N 3.35Å; H174-Y208 AromaticContact ND1-CE1 3.78Å; H174-Y208 AromaticContact ND1-CZ 3.78Å; H174-Y208 PolarHBondContact ND1-OH 3.05Å; H174-L211 PolarHBondContact CE1-O 2.86Å; H174-L211 VanDerWaalsContact CE1-O 3.3Å; H174-C213 PolarHBondContact NE2-N 2.84Å
175	S	89	Confident	91.3	Very high	62 Å²	62	39.6 Å²	39.6	43%	0.434	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-14.8	-178.5	34.7	0	0	0	0	114.7	L177 V179	S175-L177 VanDerWaalsContact C-N 3.3Å; S175-V179 WeakPolarHBondContact O-CG2 3.38Å
176	Q	89.9	Confident	91.7	Very high	22 Å²	22	36.8 Å²	36.8	10%	0.103	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-30.6	172.3	-71.2	75.5	5.7	0	0	112.5	E128 H174 G178 V179 K180 C182 Y208	E128-Q176 HydrophobicContact CG-CG 4.3Å; E128-Q176 PolarHBondContact OE1-NE2 2.82Å; H174-Q176 PolarHBondContact O-N 3.23Å; Q176-G178 PolarHBondContact O-N 2.86Å; Q176-G178 VanDerWaalsContact O-N 3.16Å; Q176-V179 PolarHBondContact O-N 2.68Å; Q176-K180 HydrophobicContact CG-CD 4.37Å; Q176-K180 PolarHBondContact O-N 2.78Å; Q176-C182 VanDerWaalsContact C-SG 3.57Å; Q176-C182 PolarHBondContact O-SG 2.96Å; Q176-C182 VanDerWaalsContact O-SG 3.37Å; Q176-Y208 HydrophobicContact CG-CD1 4.32Å; Q176-Y208 HydrophobicContact CG-CG 4.34Å
177	L	90.4	Very high	92	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-61.1	117.4	-176	-75.7	171.9	0	0	0	111.7	I125 L157 I163 L167 Q171 H174 S175 V179 C182 V184	I125-L177 HydrophobicContact CD1-CD1 4.07Å; I125-L177 HydrophobicContact CD1-CD2 3.59Å; I125-L177 HydrophobicContact CD1-CG 3.57Å; L157-L177 HydrophobicContact CD1-CD2 3.77Å; I163-L177 HydrophobicContact CD1-CB 4.37Å; I163-L177 WeakPolarHBondContact CD1-O 3.19Å; L167-L177 HydrophobicContact CD1-CD2 4.38Å; Q171-L177 HydrophobicContact CB-CB 4.25Å; Q171-L177 HydrophobicContact CG-CB 4.08Å; Q171-L177 PolarHBondContact NE2-O 2.72Å; H174-L177 HydrophobicContact CB-CD1 4.06Å; H174-L177 HydrophobicContact CB-CG 4.22Å; H174-L177 WeakPolarHBondContact O-CB 3.02Å; H174-L177 PolarHBondContact O-N 3.35Å; S175-L177 VanDerWaalsContact C-N 3.3Å; L177-V179 VanDerWaalsContact C-N 3.26Å; L177-V179 PolarHBondContact O-N 2.8Å; L177-C182 HydrophobicContact CD2-CB 4.1Å; L177-V184 HydrophobicContact CD2-CG2 4.27Å
178	G	88.8	Confident	92.2	Very high	12 Å²	12	38.6 Å²	38.6	12%	0.124	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	-9.1	-177.5	0	0	0	0	0	115.1	N160 Q176	N160-G178 PolarHBondContact N-O 3.23Å; Q176-G178 PolarHBondContact O-N 2.86Å; Q176-G178 VanDerWaalsContact O-N 3.16Å
179	V	91.9	Very high	92.4	Very high	95 Å²	95	35.8 Å²	35.8	58%	0.576	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-45.4	178.6	-177.8	0	0	0	0	111.1	P159 S175 Q176 L177	P159-V179 WeakPolarHBondContact CB-O 3.3Å; S175-V179 WeakPolarHBondContact O-CG2 3.38Å; Q176-V179 PolarHBondContact O-N 2.68Å; L177-V179 VanDerWaalsContact C-N 3.26Å; L177-V179 PolarHBondContact O-N 2.8Å
180	K	93	Very high	92.8	Very high	90 Å²	90	36 Å²	36	39%	0.391	19%	0.191	S	C	.	.	B	Isolated β-bridge	trans	-112.9	162.9	175.3	-67.6	-172.2	179.7	178.8	0	109.9	S127 E128 Q176 C182	S127-K180 WeakPolarHBondContact OG-CB 3.42Å; E128-K180 HydrophobicContact CG-CD 3.77Å; E128-K180 IonicContact OE1-NZ 3.42Å; E128-K180 PolarHBondContact OE1-NZ 2.71Å; E128-K180 IonicContact OE2-NZ 2.63Å; Q176-K180 HydrophobicContact CG-CD 4.37Å; Q176-K180 PolarHBondContact O-N 2.78Å; K180-C182 PolarHBondContact O-N 3.3Å; K180-C182 PolarHBondContact O-SG 3.11Å
181	I	95	Very high	93.1	Very high	44 Å²	44	39.7 Å²	39.7	23%	0.226	22%	0.215	C	C	.	.			trans	-61.2	128.8	167.7	-169.6	166.6	0	0	0	109	S127 F129 V135 V156 L157 F158	S127-I181 WeakPolarHBondContact CB-O 3.27Å; S127-I181 PolarHBondContact OG-O 3.14Å; F129-I181 HydrophobicContact CD2-CG2 4.18Å; V135-I181 HydrophobicContact CB-CD1 3.68Å; V135-I181 HydrophobicContact CB-CG1 4.5Å; V135-I181 HydrophobicContact CG1-CD1 3.81Å; V135-I181 HydrophobicContact CG1-CG1 4.14Å; V135-I181 HydrophobicContact CG2-CD1 4.28Å; V156-I181 HydrophobicContact CG1-CD1 4.25Å; V156-I181 HydrophobicContact CG1-CG1 4.2Å; L157-I181 WeakPolarHBondContact O-CA 3.28Å; F158-I181 HydrophobicContact CD1-CD1 3.76Å; F158-I181 HydrophobicContact CD1-CG1 4.21Å; F158-I181 HydrophobicContact CE1-CD1 3.54Å; F158-I181 HydrophobicContact CE1-CG1 4.38Å; F158-I181 HydrophobicContact CZ-CD1 4.46Å
182	C	96.4	Very high	93.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	141.3	-178.4	-60.1	0	0	0	0	109.7	I125 L126 S127 L157 Q176 L177 K180	I125-C182 HydrophobicContact CD1-CB 4.48Å; L126-C182 CarbonylContact O-C 3.59Å; L126-C182 WeakPolarHBondContact O-CA 3.34Å; S127-C182 PolarHBondContact OG-SG 3.5Å; S127-C182 VanDerWaalsContact OG-SG 3.41Å; L157-C182 HydrophobicContact CB-CB 4.42Å; L157-C182 PolarHBondContact N-O 2.87Å; L157-C182 PolarHBondContact O-N 3.16Å; Q176-C182 VanDerWaalsContact C-SG 3.57Å; Q176-C182 PolarHBondContact O-SG 2.96Å; Q176-C182 VanDerWaalsContact O-SG 3.37Å; L177-C182 HydrophobicContact CD2-CB 4.1Å; K180-C182 PolarHBondContact O-N 3.3Å; K180-C182 PolarHBondContact O-SG 3.11Å
183	A	97.4	Very high	93.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.6	162.1	0	0	0	0	0	109.4	I125 L126 F129 I140 R155 V156 V185	I125-A183 WeakPolarHBondContact CA-O 3.27Å; L126-A183 HydrophobicContact CB-CB 4.26Å; L126-A183 PolarHBondContact N-O 2.96Å; L126-A183 PolarHBondContact O-N 3.21Å; F129-A183 HydrophobicContact CE2-CB 4.37Å; F129-A183 HydrophobicContact CZ-CB 3.9Å; I140-A183 HydrophobicContact CD1-CB 3.39Å; R155-A183 WeakPolarHBondContact O-CA 3.37Å; V156-A183 HydrophobicContact CG2-CB 4.45Å; A183-V185 HydrophobicContact CB-CG2 4.2Å
184	V	97.2	Very high	94.3	Very high	9 Å²	9	35.1 Å²	35.1	6%	0.055	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118	170.8	179.2	0	0	0	0	106.8	T123 I124 I125 R155 L157 L167 L177 L212	T123-V184 HydrophobicContact CG2-CG1 3.47Å; T123-V184 VanDerWaalsContact CG2-CG1 3.47Å; I124-V184 WeakPolarHBondContact O-CA 3.25Å; I125-V184 HydrophobicContact CG1-CG2 4.46Å; R155-V184 HydrophobicContact CB-CB 4.48Å; R155-V184 PolarHBondContact N-O 3.01Å; R155-V184 PolarHBondContact O-N 2.88Å; L157-V184 HydrophobicContact CD1-CG2 4.05Å; L167-V184 HydrophobicContact CD1-CG2 3.9Å; L177-V184 HydrophobicContact CD2-CG2 4.27Å; V184-L212 HydrophobicContact CG1-CD2 4Å
185	V	98.1	Very high	94.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	115.3	-169.6	-175.7	0	0	0	0	109.1	T123 I124 L126 I140 F144 P151 L153 V154 A183 F187	T123-V185 CarbonylContact C-O 3.27Å; T123-V185 WeakPolarHBondContact CA-O 3.46Å; T123-V185 WeakPolarHBondContact CG2-O 3.41Å; I124-V185 HydrophobicContact CG1-CB 4.01Å; I124-V185 PolarHBondContact N-O 2.59Å; I124-V185 PolarHBondContact O-N 2.95Å; L126-V185 HydrophobicContact CD1-CG2 4.48Å; I140-V185 HydrophobicContact CG2-CG2 3.71Å; F144-V185 HydrophobicContact CD2-CG1 4.13Å; F144-V185 HydrophobicContact CE2-CG1 4.2Å; F144-V185 HydrophobicContact CE2-CG2 4.24Å; P151-V185 HydrophobicContact CB-CG1 3.5Å; P151-V185 HydrophobicContact CG-CG1 4.3Å; L153-V185 WeakPolarHBondContact O-CA 3.46Å; V154-V185 HydrophobicContact CG1-CG2 4.41Å; V154-V185 HydrophobicContact CG2-CG1 4.05Å; V154-V185 HydrophobicContact CG2-CG2 4.37Å; A183-V185 HydrophobicContact CB-CG2 4.2Å; V185-F187 HydrophobicContact CB-CE2 4.06Å; V185-F187 HydrophobicContact CB-CZ 4.38Å; V185-F187 HydrophobicContact CG1-CD2 4.3Å; V185-F187 HydrophobicContact CG1-CE1 4.27Å; V185-F187 HydrophobicContact CG1-CE2 3.52Å; V185-F187 HydrophobicContact CG1-CZ 3.49Å; V185-F187 VanDerWaalsContact CG1-CZ 3.49Å
186	E	97.5	Very high	95	Very high	5 Å²	5	37.2 Å²	37.2	2%	0.023	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.9	176.2	-179	176.3	-175.9	0	0	109.8	K50 V119 R122 T123 P151 S152 L153	K50-E186 IonicContact NZ-OE1 3.2Å; K50-E186 IonicContact NZ-OE2 3.64Å; K50-E186 PolarHBondContact NZ-OE2 3.28Å; V119-E186 HydrophobicContact CG2-CG 4.35Å; V119-E186 WeakPolarHBondContact CG2-OE1 3.29Å; R122-E186 HydrophobicContact CG-CG 4.38Å; R122-E186 IonicContact CZ-OE1 3.32Å; R122-E186 IonicContact NE-OE1 2.85Å; R122-E186 PolarHBondContact NE-OE1 3.03Å; R122-E186 VanDerWaalsContact NE-OE1 3.13Å; R122-E186 IonicContact NH2-OE1 3.53Å; R122-E186 PolarHBondContact NH2-OE1 3.21Å; T123-E186 HydrophobicContact CG2-CB 4.43Å; P151-E186 CarbonylContact C-O 3.46Å; P151-E186 WeakPolarHBondContact CA-O 3.42Å; S152-E186 PolarHBondContact N-O 3.25Å; L153-E186 HydrophobicContact CB-CB 4.16Å; L153-E186 PolarHBondContact N-O 2.67Å; L153-E186 PolarHBondContact O-N 2.63Å
187	F	97.4	Very high	95.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.			trans	-107.6	161.2	174.8	-64.2	-89.8	0	0	0	110.3	R122 I124 F144 H149 P151 V185 N189 D192 A193 A196	R122-F187 WeakPolarHBondContact CD-O 3.43Å; R122-F187 WeakPolarHBondContact CG-O 3.46Å; R122-F187 PolarHBondContact O-N 2.84Å; I124-F187 HydrophobicContact CD1-CE2 3.76Å; I124-F187 HydrophobicContact CD1-CZ 4.23Å; I124-F187 HydrophobicContact CG1-CE2 3.94Å; I124-F187 HydrophobicContact CG2-CD2 4.46Å; I124-F187 HydrophobicContact CG2-CE2 4.18Å; F144-F187 HydrophobicContact CB-CE1 4.29Å; F144-F187 HydrophobicContact CD1-CE1 4.21Å; F144-F187 HydrophobicContact CD1-CZ 4.01Å; F144-F187 HydrophobicContact CD2-CZ 4.04Å; F144-F187 HydrophobicContact CE1-CZ 4.15Å; F144-F187 HydrophobicContact CE2-CZ 4.16Å; F144-F187 HydrophobicContact CG-CE1 4.1Å; F144-F187 AromaticContact CG-CZ 3.97Å; F144-F187 HydrophobicContact CG-CZ 3.97Å; F144-F187 HydrophobicContact CZ-CZ 4.22Å; H149-F187 HydrophobicContact CB-CD1 4.49Å; H149-F187 HydrophobicContact CB-CE1 4.26Å; H149-F187 VanDerWaalsContact O-CE1 3.31Å; H149-F187 WeakPolarHBondContact O-CE1 3.49Å; P151-F187 HydrophobicContact CB-CD1 4.37Å; P151-F187 HydrophobicContact CB-CE1 4.16Å; V185-F187 HydrophobicContact CB-CE2 4.06Å; V185-F187 HydrophobicContact CB-CZ 4.38Å; V185-F187 HydrophobicContact CG1-CD2 4.3Å; V185-F187 HydrophobicContact CG1-CE1 4.27Å; V185-F187 HydrophobicContact CG1-CE2 3.52Å; V185-F187 HydrophobicContact CG1-CZ 3.49Å; V185-F187 VanDerWaalsContact CG1-CZ 3.49Å; F187-N189 PolarHBondContact O-N 3.29Å; F187-D192 HydrophobicContact CB-CB 4.06Å; F187-D192 HydrophobicContact CD1-CB 4.17Å; F187-D192 HydrophobicContact CG-CB 4.31Å; F187-A193 HydrophobicContact CB-CB 4.35Å; F187-A193 HydrophobicContact CD2-CB 3.83Å; F187-A193 HydrophobicContact CG-CB 4.35Å; F187-A196 HydrophobicContact CD2-CB 4.43Å; F187-A196 HydrophobicContact CE1-CB 3.81Å; F187-A196 HydrophobicContact CE2-CB 3.6Å; F187-A196 HydrophobicContact CZ-CB 3.24Å
188	P	94.9	Very high	95.5	Very high	63 Å²	63	41.4 Å²	41.4	41%	0.409	22%	0.218	S	C	.	.	S	Bend	trans	-58	-37.4	178.3	-24.6	33.7	0	0	0	112.8	R122 S152	R122-P188 WeakPolarHBondContact CD-O 3.18Å; R122-P188 PolarHBondContact NH1-O 3.02Å; S152-P188 WeakPolarHBondContact OG-CD 3.44Å
189	N	94.8	Very high	95.9	Very high	62 Å²	62	43.1 Å²	43.1	33%	0.332	22%	0.223	S	C	.	.	S	Bend	trans	-140	166.8	-173.4	64.9	68.3	0	0	0	112.5	F187 P191 D192 A193	F187-N189 PolarHBondContact O-N 3.29Å; N189-P191 VanDerWaalsContact OD1-CD 3.22Å; N189-P191 WeakPolarHBondContact OD1-CD 3.26Å; N189-D192 PolarHBondContact ND2-OD2 2.92Å; N189-D192 WeakPolarHBondContact OD1-CB 3.19Å; N189-D192 PolarHBondContact OD1-N 2.7Å; N189-D192 PolarHBondContact OD1-OD2 2.98Å; N189-A193 PolarHBondContact O-N 3.32Å
190	R	94.5	Very high	96.1	Very high	99 Å²	99	38.6 Å²	38.6	37%	0.374	20%	0.196	S	C	.	.	H	α-helix	trans	-67.8	-43.7	179.8	170.5	175.4	-176.5	74.6	-2	114.4	Y121 D192 A193 L194	Y121-R190 WeakPolarHBondContact O-CB 3.42Å; Y121-R190 WeakPolarHBondContact O-CG 3.38Å; Y121-R190 PolarHBondContact O-NH1 2.94Å; R190-D192 VanDerWaalsContact C-N 3.32Å; R190-D192 PolarHBondContact O-N 3.2Å; R190-A193 WeakPolarHBondContact O-CB 3.17Å; R190-A193 PolarHBondContact O-N 3.23Å; R190-L194 HydrophobicContact CG-CD1 4.2Å; R190-L194 HydrophobicContact CG-CG 4.44Å; R190-L194 PolarHBondContact O-N 3.24Å
191	P	95.6	Very high	96.2	Very high	77 Å²	77	37.9 Å²	37.9	50%	0.5	19%	0.191	S	C	.	.	H	α-helix	trans	-53.5	-43.6	175.9	-31.1	36.1	0	0	0	114.1	N189 L194 K195	N189-P191 VanDerWaalsContact OD1-CD 3.22Å; N189-P191 WeakPolarHBondContact OD1-CD 3.26Å; P191-L194 PolarHBondContact O-N 2.88Å; P191-K195 WeakPolarHBondContact O-CG 3.46Å; P191-K195 PolarHBondContact O-N 3.14Å
192	D	96.7	Very high	96.2	Very high	26 Å²	26	40.9 Å²	40.9	14%	0.139	22%	0.216	C	C	.	.	H	α-helix	trans	-65	-41.5	177.5	-69.6	-28.1	0	0	0	111.8	H149 F187 N189 R190 L194 K195 A196	H149-D192 IonicContact CE1-OD1 2.81Å; H149-D192 PolarHBondContact CE1-OD1 2.83Å; H149-D192 IonicContact ND1-OD1 2.59Å; H149-D192 PolarHBondContact ND1-OD1 3.11Å; F187-D192 HydrophobicContact CB-CB 4.06Å; F187-D192 HydrophobicContact CD1-CB 4.17Å; F187-D192 HydrophobicContact CG-CB 4.31Å; N189-D192 PolarHBondContact ND2-OD2 2.92Å; N189-D192 WeakPolarHBondContact OD1-CB 3.19Å; N189-D192 PolarHBondContact OD1-N 2.7Å; N189-D192 PolarHBondContact OD1-OD2 2.98Å; R190-D192 VanDerWaalsContact C-N 3.32Å; R190-D192 PolarHBondContact O-N 3.2Å; D192-L194 VanDerWaalsContact C-N 3.3Å; D192-L194 PolarHBondContact O-N 3.09Å; D192-K195 PolarHBondContact O-N 3.38Å; D192-A196 VanDerWaalsContact O-CB 3.24Å; D192-A196 WeakPolarHBondContact O-CB 3.37Å; D192-A196 PolarHBondContact O-N 2.88Å
193	A	96.2	Very high	96.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-37.4	173.9	0	0	0	0	0	112.9	I124 F187 N189 R190 I197 L211	I124-A193 HydrophobicContact CG2-CB 3.82Å; I124-A193 WeakPolarHBondContact CG2-O 3.21Å; F187-A193 HydrophobicContact CB-CB 4.35Å; F187-A193 HydrophobicContact CD2-CB 3.83Å; F187-A193 HydrophobicContact CG-CB 4.35Å; N189-A193 PolarHBondContact O-N 3.32Å; R190-A193 WeakPolarHBondContact O-CB 3.17Å; R190-A193 PolarHBondContact O-N 3.23Å; A193-I197 WeakPolarHBondContact O-CG1 3.27Å; A193-I197 PolarHBondContact O-N 3.42Å; A193-L211 HydrophobicContact CB-CD2 4.2Å
194	L	95.2	Very high	96	Very high	71 Å²	71	48.1 Å²	48.1	37%	0.372	25%	0.248	S	C	.	.	H	α-helix	trans	-70.4	-42.9	176.2	-68.3	174.6	0	0	0	112.1	R190 P191 D192 A196 I197 N198 L211	R190-L194 HydrophobicContact CG-CD1 4.2Å; R190-L194 HydrophobicContact CG-CG 4.44Å; R190-L194 PolarHBondContact O-N 3.24Å; P191-L194 PolarHBondContact O-N 2.88Å; D192-L194 VanDerWaalsContact C-N 3.3Å; D192-L194 PolarHBondContact O-N 3.09Å; L194-A196 VanDerWaalsContact C-N 3.33Å; L194-A196 PolarHBondContact O-N 3.34Å; L194-I197 PolarHBondContact O-N 2.98Å; L194-N198 PolarHBondContact O-N 3.15Å; L194-L211 HydrophobicContact CD2-CD1 4.06Å; L194-L211 HydrophobicContact CD2-CG 4.45Å
195	K	96.7	Very high	95.6	Very high	107 Å²	107	49.7 Å²	49.7	47%	0.465	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-41.9	174.1	-69.3	174.5	-178.2	177.8	0	111.4	H149 P191 D192 I197 N198 L199	H149-K195 WeakPolarHBondContact CE1-CD 3.35Å; H149-K195 WeakPolarHBondContact NE2-CD 3.49Å; P191-K195 WeakPolarHBondContact O-CG 3.46Å; P191-K195 PolarHBondContact O-N 3.14Å; D192-K195 PolarHBondContact O-N 3.38Å; K195-I197 VanDerWaalsContact C-N 3.32Å; K195-I197 PolarHBondContact O-N 3.38Å; K195-N198 PolarHBondContact O-N 3.46Å; K195-N198 VanDerWaalsContact O-N 3.1Å; K195-L199 WeakPolarHBondContact O-CG 3.31Å; K195-L199 PolarHBondContact O-N 2.96Å
196	A	97.2	Very high	95.3	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-59.8	-36.6	176.5	0	0	0	0	0	113.4	I124 F144 F187 D192 L194 S200	I124-A196 HydrophobicContact CD1-CB 3.91Å; F144-A196 HydrophobicContact CD1-CB 4Å; F144-A196 HydrophobicContact CE1-CB 3.52Å; F144-A196 HydrophobicContact CZ-CB 4.14Å; F187-A196 HydrophobicContact CD2-CB 4.43Å; F187-A196 HydrophobicContact CE1-CB 3.81Å; F187-A196 HydrophobicContact CE2-CB 3.6Å; F187-A196 HydrophobicContact CZ-CB 3.24Å; D192-A196 VanDerWaalsContact O-CB 3.24Å; D192-A196 WeakPolarHBondContact O-CB 3.37Å; D192-A196 PolarHBondContact O-N 2.88Å; L194-A196 VanDerWaalsContact C-N 3.33Å; L194-A196 PolarHBondContact O-N 3.34Å; A196-S200 VanDerWaalsContact O-CB 3.31Å; A196-S200 WeakPolarHBondContact O-CB 3.35Å; A196-S200 PolarHBondContact O-N 3.18Å; A196-S200 PolarHBondContact O-OG 3.42Å
197	I	96.2	Very high	95.1	Very high	12 Å²	12	59.8 Å²	59.8	6%	0.062	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-45.1	172.9	-71.6	163.4	0	0	0	110.9	I124 A193 L194 K195 S200 R201 A209 L211	I124-I197 HydrophobicContact CB-CG1 4.22Å; I124-I197 HydrophobicContact CD1-CG1 4.48Å; I124-I197 HydrophobicContact CG2-CD1 3.95Å; I124-I197 HydrophobicContact CG2-CG1 3.8Å; A193-I197 WeakPolarHBondContact O-CG1 3.27Å; A193-I197 PolarHBondContact O-N 3.42Å; L194-I197 PolarHBondContact O-N 2.98Å; K195-I197 VanDerWaalsContact C-N 3.32Å; K195-I197 PolarHBondContact O-N 3.38Å; I197-S200 PolarHBondContact O-N 3.22Å; I197-R201 WeakPolarHBondContact O-CG 3.27Å; I197-R201 PolarHBondContact O-N 3.13Å; I197-R201 VanDerWaalsContact O-N 3.13Å; I197-A209 HydrophobicContact CG2-CB 4.19Å; I197-A209 WeakPolarHBondContact CG2-O 3.44Å; I197-L211 HydrophobicContact CD1-CD2 4.37Å; I197-L211 HydrophobicContact CD1-CG 3.96Å
198	N	95.6	Very high	95	Very high	98 Å²	98	60.7 Å²	60.7	52%	0.524	31%	0.314	S	S	.	.	H	α-helix	trans	-66.5	-48	179.7	-66.7	-18.4	0	0	0	111.2	L194 K195 S200 R201 S202	L194-N198 PolarHBondContact O-N 3.15Å; K195-N198 PolarHBondContact O-N 3.46Å; K195-N198 VanDerWaalsContact O-N 3.1Å; N198-S200 VanDerWaalsContact C-N 3.28Å; N198-S200 PolarHBondContact O-N 3.16Å; N198-R201 PolarHBondContact O-N 2.91Å; N198-R201 VanDerWaalsContact O-N 3.11Å; N198-S202 PolarHBondContact O-N 2.95Å; N198-S202 PolarHBondContact O-OG 3.24Å
199	L	96.5	Very high	95.1	Very high	47 Å²	47	57.7 Å²	57.7	25%	0.246	29%	0.294	C	S	.	.	H	α-helix	trans	-55.5	-42.1	174.4	-72	166.9	0	0	0	112.3	F143 N147 K195 R201 S202 H203	F143-L199 HydrophobicContact CZ-CB 4.45Å; N147-L199 HydrophobicContact CB-CD1 3.98Å; N147-L199 HydrophobicContact CB-CD2 4.48Å; K195-L199 WeakPolarHBondContact O-CG 3.31Å; K195-L199 PolarHBondContact O-N 2.96Å; L199-R201 PolarHBondContact O-N 3.2Å; L199-S202 PolarHBondContact O-N 3.37Å; L199-H203 WeakPolarHBondContact O-CB 3.46Å; L199-H203 PolarHBondContact O-N 2.91Å
200	S	96	Very high	95	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.2	-44.3	177.1	-58.7	0	0	0	0	111.9	L126 F144 A196 I197 N198 H203 W204 I207	L126-S200 WeakPolarHBondContact CD2-OG 3.21Å; F144-S200 WeakPolarHBondContact CZ-OG 3.3Å; A196-S200 VanDerWaalsContact O-CB 3.31Å; A196-S200 WeakPolarHBondContact O-CB 3.35Å; A196-S200 PolarHBondContact O-N 3.18Å; A196-S200 PolarHBondContact O-OG 3.42Å; I197-S200 PolarHBondContact O-N 3.22Å; N198-S200 VanDerWaalsContact C-N 3.28Å; N198-S200 PolarHBondContact O-N 3.16Å; S200-H203 PolarHBondContact O-N 2.99Å; S200-W204 PolarHBondContact O-N 3.47Å; S200-I207 WeakPolarHBondContact O-CG2 3.45Å
201	R	95.5	Very high	95	Very high	75 Å²	75	54 Å²	54	28%	0.283	28%	0.279	S	S	.	.	H	α-helix	trans	-67.2	-37.6	178	-68	167.8	-176.9	-167.5	-0.5	111.9	I197 N198 L199 G205 I207 A209	I197-R201 WeakPolarHBondContact O-CG 3.27Å; I197-R201 PolarHBondContact O-N 3.13Å; I197-R201 VanDerWaalsContact O-N 3.13Å; N198-R201 PolarHBondContact O-N 2.91Å; N198-R201 VanDerWaalsContact O-N 3.11Å; L199-R201 PolarHBondContact O-N 3.2Å; R201-G205 WeakPolarHBondContact O-CA 3.44Å; R201-G205 PolarHBondContact O-N 3.22Å; R201-I207 HydrophobicContact CG-CG2 4.25Å; R201-A209 HydrophobicContact CG-CB 4.25Å; R201-A209 PolarHBondContact NE-O 3.49Å; R201-A209 PolarHBondContact NH2-O 3.46Å
202	S	95	Very high	94.9	Very high	108 Å²	108	50.7 Å²	50.7	76%	0.755	26%	0.257	S	S	*	.	H	α-helix	trans	-67.4	-38	174.3	-63.3	0	0	0	0	112.9	N198 L199	N198-S202 PolarHBondContact O-N 2.95Å; N198-S202 PolarHBondContact O-OG 3.24Å; L199-S202 PolarHBondContact O-N 3.37Å
203	H	94.6	Very high	94.3	Very high	112 Å²	112	51.8 Å²	51.8	52%	0.519	27%	0.266	S	S	.	.	H	α-helix	trans	-85	-44.5	-175.1	-175.3	57.8	0	0	0	113.9	F143 L199 S200	F143-H203 AromaticContact CD2-CD2 3.67Å; F143-H203 AromaticContact CD2-NE2 3.87Å; F143-H203 HydrophobicContact CE2-CB 3.7Å; F143-H203 AromaticContact CE2-CD2 3.22Å; F143-H203 WeakPolarHBondContact CE2-CD2 3.2Å; F143-H203 AromaticContact CE2-CG 3.35Å; F143-H203 AromaticContact CE2-ND1 3.94Å; F143-H203 AromaticContact CE2-NE2 3.79Å; F143-H203 HydrophobicContact CZ-CB 3.6Å; F143-H203 AromaticContact CZ-CD2 3.73Å; F143-H203 AromaticContact CZ-CG 3.77Å; L199-H203 WeakPolarHBondContact O-CB 3.46Å; L199-H203 PolarHBondContact O-N 2.91Å; S200-H203 PolarHBondContact O-N 2.99Å
204	W	94.1	Very high	93.5	Very high	39 Å²	39	54.6 Å²	54.6	15%	0.148	28%	0.279	C	S	.	.	H	α-helix	trans	-102.3	-0.5	-177.9	-64.7	-62.8	0	0	0	114	L126 F129 P130 F143 F144 S200 K206 I207	L126-W204 HydrophobicContact CD1-CH2 4.35Å; L126-W204 HydrophobicContact CD1-CZ3 3.93Å; F129-W204 HydrophobicContact CD1-CD2 4.21Å; F129-W204 HydrophobicContact CD1-CG 4.45Å; F129-W204 HydrophobicContact CE1-CD2 4.37Å; F129-W204 HydrophobicContact CE1-CE3 4.48Å; F129-W204 HydrophobicContact CE1-CH2 4.37Å; F129-W204 HydrophobicContact CE1-CZ2 4.24Å; F129-W204 HydrophobicContact CE1-CZ3 4.49Å; P130-W204 HydrophobicContact CG-CB 4.31Å; F143-W204 AromaticContact CD1-CH2 3.47Å; F143-W204 HydrophobicContact CD1-CH2 3.47Å; F143-W204 VanDerWaalsContact CD1-CH2 3.47Å; F143-W204 HydrophobicContact CD1-CZ2 4.22Å; F143-W204 HydrophobicContact CD1-CZ3 4.06Å; F143-W204 AromaticContact CE1-CH2 3.62Å; F143-W204 HydrophobicContact CE1-CH2 3.62Å; F143-W204 HydrophobicContact CE1-CZ2 4.47Å; F143-W204 AromaticContact CE1-CZ3 3.73Å; F143-W204 HydrophobicContact CE1-CZ3 3.73Å; F143-W204 HydrophobicContact CG-CH2 4.03Å; F143-W204 HydrophobicContact CG-CZ2 4.33Å; F143-W204 HydrophobicContact CZ-CH2 4.3Å; F143-W204 HydrophobicContact CZ-CZ3 4.33Å; F144-W204 HydrophobicContact CZ-CZ3 4.44Å; S200-W204 PolarHBondContact O-N 3.47Å; W204-K206 PolarHBondContact O-N 3.26Å; W204-I207 HydrophobicContact CB-CB 3.89Å; W204-I207 HydrophobicContact CB-CD1 3.88Å; W204-I207 HydrophobicContact CB-CG1 4.34Å; W204-I207 HydrophobicContact CB-CG2 4.22Å; W204-I207 HydrophobicContact CD2-CD1 3.76Å; W204-I207 HydrophobicContact CE3-CD1 3.39Å; W204-I207 HydrophobicContact CG-CD1 4.01Å; W204-I207 HydrophobicContact CZ3-CD1 4.19Å
205	G	90.4	Very high	92.1	Very high	42 Å²	42	51.7 Å²	51.7	43%	0.433	27%	0.266	S	S	.	.	S	Bend	trans	70.8	-112.6	177.3	0	0	0	0	0	113	R201 I207	R201-G205 WeakPolarHBondContact O-CA 3.44Å; R201-G205 PolarHBondContact O-N 3.22Å; G205-I207 PolarHBondContact O-N 2.96Å
206	K	90.1	Very high	90.4	Very high	205 Å²	205	54.3 Å²	54.3	89%	0.891	29%	0.285	S	S	*	.	S	Bend	trans	-76.1	35.8	-175.8	-66.3	-175.9	179.1	176.5	0	113.8	W204	W204-K206 PolarHBondContact O-N 3.26Å
207	I	94.9	Very high	88.2	Confident	12 Å²	12	61.8 Å²	61.8	6%	0.062	32%	0.318	C	S	.	.			trans	-71.8	143.1	178.8	-163.7	174.5	0	0	0	111.6	L126 S127 F129 S200 R201 W204 G205 A209	L126-I207 HydrophobicContact CB-CD1 4.17Å; L126-I207 HydrophobicContact CD2-CD1 4.36Å; S127-I207 WeakPolarHBondContact O-CG1 3.43Å; F129-I207 HydrophobicContact CD1-CD1 3.71Å; F129-I207 HydrophobicContact CE1-CD1 3.75Å; F129-I207 HydrophobicContact CG-CD1 4.25Å; F129-I207 HydrophobicContact CZ-CD1 4.32Å; S200-I207 WeakPolarHBondContact O-CG2 3.45Å; R201-I207 HydrophobicContact CG-CG2 4.25Å; W204-I207 HydrophobicContact CB-CB 3.89Å; W204-I207 HydrophobicContact CB-CD1 3.88Å; W204-I207 HydrophobicContact CB-CG1 4.34Å; W204-I207 HydrophobicContact CB-CG2 4.22Å; W204-I207 HydrophobicContact CD2-CD1 3.76Å; W204-I207 HydrophobicContact CE3-CD1 3.39Å; W204-I207 HydrophobicContact CG-CD1 4.01Å; W204-I207 HydrophobicContact CZ3-CD1 4.19Å; G205-I207 PolarHBondContact O-N 2.96Å; I207-A209 HydrophobicContact CG2-CB 3.96Å; I207-A209 PolarHBondContact O-N 3.32Å; I207-A209 VanDerWaalsContact O-N 3.07Å
208	Y	94.8	Very high	85.5	Confident	19 Å²	19	69.2 Å²	69.2	8%	0.075	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	90.7	167.2	-176.6	-89.6	0	0	0	109	I125 L126 S127 H174 Q176 Y210 L251	I125-Y208 HydrophobicContact CG2-CE1 3.99Å; L126-Y208 CarbonylContact C-O 3.55Å; L126-Y208 VanDerWaalsContact CA-O 3.24Å; L126-Y208 WeakPolarHBondContact CA-O 3.24Å; S127-Y208 PolarHBondContact N-O 3.21Å; S127-Y208 WeakPolarHBondContact O-CA 3.4Å; S127-Y208 WeakPolarHBondContact O-CB 3.22Å; S127-Y208 PolarHBondContact O-N 3.24Å; H174-Y208 AromaticContact ND1-CE1 3.78Å; H174-Y208 AromaticContact ND1-CZ 3.78Å; H174-Y208 PolarHBondContact ND1-OH 3.05Å; Q176-Y208 HydrophobicContact CG-CD1 4.32Å; Q176-Y208 HydrophobicContact CG-CG 4.34Å; Y208-Y210 AromaticContact CD1-CD2 3.86Å; Y208-Y210 HydrophobicContact CD1-CD2 3.86Å; Y208-Y210 HydrophobicContact CD1-CE2 4.35Å; Y208-Y210 AromaticContact CD2-CD2 3.79Å; Y208-Y210 HydrophobicContact CD2-CD2 3.79Å; Y208-Y210 AromaticContact CD2-CE2 3.46Å; Y208-Y210 HydrophobicContact CD2-CE2 3.46Å; Y208-Y210 VanDerWaalsContact CD2-CE2 3.46Å; Y208-Y210 AromaticContact CE1-CD2 3.7Å; Y208-Y210 HydrophobicContact CE1-CD2 3.7Å; Y208-Y210 HydrophobicContact CE1-CE2 4.37Å; Y208-Y210 AromaticContact CE2-CD2 3.61Å; Y208-Y210 HydrophobicContact CE2-CD2 3.61Å; Y208-Y210 AromaticContact CE2-CE2 3.48Å; Y208-Y210 HydrophobicContact CE2-CE2 3.48Å; Y208-Y210 VanDerWaalsContact CE2-CE2 3.48Å; Y208-Y210 AromaticContact CG-CD2 3.89Å; Y208-Y210 HydrophobicContact CG-CD2 3.89Å; Y208-Y210 AromaticContact CG-CE2 3.9Å; Y208-Y210 HydrophobicContact CG-CE2 3.9Å; Y208-Y210 AromaticContact CZ-CD2 3.56Å; Y208-Y210 AromaticContact CZ-CE2 3.95Å; Y208-L251 WeakPolarHBondContact OH-CD1 3.37Å
209	A	95.9	Very high	82.5	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	114.8	177.8	0	0	0	0	0	111.7	I125 L126 I197 R201 I207	I125-A209 WeakPolarHBondContact O-CA 3.26Å; L126-A209 HydrophobicContact CD2-CB 3.57Å; I197-A209 HydrophobicContact CG2-CB 4.19Å; I197-A209 WeakPolarHBondContact CG2-O 3.44Å; R201-A209 HydrophobicContact CG-CB 4.25Å; R201-A209 PolarHBondContact NE-O 3.49Å; R201-A209 PolarHBondContact NH2-O 3.46Å; I207-A209 HydrophobicContact CG2-CB 3.96Å; I207-A209 PolarHBondContact O-N 3.32Å; I207-A209 VanDerWaalsContact O-N 3.07Å
210	Y	93.6	Very high	79.5	Confident	47 Å²	47	77.1 Å²	77.1	18%	0.184	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	160.8	-176.8	-65.5	-87.8	0	0	0	111.4	I124 I125 Y208	I124-Y210 CarbonylContact C-O 3.58Å; I124-Y210 VanDerWaalsContact CA-O 3.24Å; I124-Y210 WeakPolarHBondContact CA-O 3.47Å; I124-Y210 WeakPolarHBondContact CB-O 3.44Å; I125-Y210 PolarHBondContact N-O 2.91Å; I125-Y210 PolarHBondContact O-N 2.94Å; I125-Y210 VanDerWaalsContact O-N 3.1Å; Y208-Y210 AromaticContact CD1-CD2 3.86Å; Y208-Y210 HydrophobicContact CD1-CD2 3.86Å; Y208-Y210 HydrophobicContact CD1-CE2 4.35Å; Y208-Y210 AromaticContact CD2-CD2 3.79Å; Y208-Y210 HydrophobicContact CD2-CD2 3.79Å; Y208-Y210 AromaticContact CD2-CE2 3.46Å; Y208-Y210 HydrophobicContact CD2-CE2 3.46Å; Y208-Y210 VanDerWaalsContact CD2-CE2 3.46Å; Y208-Y210 AromaticContact CE1-CD2 3.7Å; Y208-Y210 HydrophobicContact CE1-CD2 3.7Å; Y208-Y210 HydrophobicContact CE1-CE2 4.37Å; Y208-Y210 AromaticContact CE2-CD2 3.61Å; Y208-Y210 HydrophobicContact CE2-CD2 3.61Å; Y208-Y210 AromaticContact CE2-CE2 3.48Å; Y208-Y210 HydrophobicContact CE2-CE2 3.48Å; Y208-Y210 VanDerWaalsContact CE2-CE2 3.48Å; Y208-Y210 AromaticContact CG-CD2 3.89Å; Y208-Y210 HydrophobicContact CG-CD2 3.89Å; Y208-Y210 AromaticContact CG-CE2 3.9Å; Y208-Y210 HydrophobicContact CG-CE2 3.9Å; Y208-Y210 AromaticContact CZ-CD2 3.56Å; Y208-Y210 AromaticContact CZ-CE2 3.95Å
211	L	94.4	Very high	76.5	Confident	38 Å²	38	86.4 Å²	86.4	20%	0.199	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	145.6	165.3	-73.5	166.4	0	0	0	110.4	Y121 I124 H174 A193 L194 I197 C213	Y121-L211 WeakPolarHBondContact O-CD2 3.42Å; I124-L211 HydrophobicContact CG2-CD2 4.35Å; H174-L211 PolarHBondContact CE1-O 2.86Å; H174-L211 VanDerWaalsContact CE1-O 3.3Å; A193-L211 HydrophobicContact CB-CD2 4.2Å; L194-L211 HydrophobicContact CD2-CD1 4.06Å; L194-L211 HydrophobicContact CD2-CG 4.45Å; I197-L211 HydrophobicContact CD1-CD2 4.37Å; I197-L211 HydrophobicContact CD1-CG 3.96Å; L211-C213 PolarHBondContact O-N 2.82Å
212	L	92.4	Very high	73.5	Confident	7 Å²	7	90 Å²	90	4%	0.037	46%	0.457	C	S	.	.			trans	-76.6	107.5	177.3	-177.7	72.9	0	0	0	110	Y120 T123 I125 L167 V184	Y120-L212 WeakPolarHBondContact CB-O 3.37Å; Y120-L212 HydrophobicContact CD1-CD2 3.81Å; Y120-L212 HydrophobicContact CD1-CG 4.01Å; Y120-L212 WeakPolarHBondContact CD1-O 3.49Å; Y120-L212 HydrophobicContact CE1-CD2 3.93Å; Y120-L212 HydrophobicContact CE1-CG 4.39Å; T123-L212 HydrophobicContact CG2-CB 3.9Å; T123-L212 HydrophobicContact CG2-CD2 3.67Å; T123-L212 HydrophobicContact CG2-CG 4.42Å; T123-L212 PolarHBondContact O-N 2.73Å; I125-L212 HydrophobicContact CB-CD1 4.32Å; L167-L212 HydrophobicContact CD2-CD1 4.13Å; L167-L212 HydrophobicContact CD2-CD2 3.62Å; L167-L212 HydrophobicContact CD2-CG 4.46Å; V184-L212 HydrophobicContact CG1-CD2 4Å
213	C	84.6	Confident	70.4	Confident	49 Å²	49	93.8 Å²	93.8	33%	0.331	46%	0.462	S	S	.	.			trans	-84.2	149.8	176.8	-62	0	0	0	0	111.5	S170 L173 H174 L211	S170-C213 WeakPolarHBondContact CA-O 3.49Å; S170-C213 WeakPolarHBondContact CB-O 3.41Å; S170-C213 PolarHBondContact OG-O 3.42Å; L173-C213 HydrophobicContact CB-CB 4.41Å; L173-C213 HydrophobicContact CD1-CB 3.39Å; H174-C213 PolarHBondContact NE2-N 2.84Å; L211-C213 PolarHBondContact O-N 2.82Å
214	H	79.1	Confident	67.5	Low	58 Å²	58	94.3 Å²	94.3	27%	0.269	48%	0.476	S	S	.	.			trans	-115.2	126	173.3	-164.4	67.3	0	0	0	110.5	Y120 D166 R169 S170	Y120-H214 HydrophobicContact CD1-CB 3.91Å; Y120-H214 HydrophobicContact CD2-CB 3.76Å; Y120-H214 HydrophobicContact CE1-CB 3.81Å; Y120-H214 AromaticContact CE1-CE1 3.05Å; Y120-H214 WeakPolarHBondContact CE1-CE1 3.45Å; Y120-H214 AromaticContact CE1-CG 3.98Å; Y120-H214 AromaticContact CE1-ND1 3.66Å; Y120-H214 HydrophobicContact CE2-CB 3.67Å; Y120-H214 AromaticContact CE2-CD2 4Å; Y120-H214 AromaticContact CE2-CE1 3.83Å; Y120-H214 AromaticContact CE2-CG 3.6Å; Y120-H214 AromaticContact CE2-ND1 3.81Å; Y120-H214 HydrophobicContact CG-CB 3.91Å; Y120-H214 AromaticContact CZ-CE1 2.91Å; Y120-H214 AromaticContact CZ-CG 3.48Å; Y120-H214 VanDerWaalsContact CZ-CG 3.48Å; Y120-H214 AromaticContact CZ-ND1 3.2Å; Y120-H214 PolarHBondContact OH-CE1 3.33Å; Y120-H214 PolarHBondContact OH-ND1 2.94Å; Y120-H214 PolarHBondContact OH-NE2 3.24Å; D166-H214 PolarHBondContact O-NE2 3.38Å; R169-H214 PolarHBondContact NH1-NE2 3.04Å; S170-H214 PolarHBondContact OG-CE1 2.72Å
215	G	65.9	Low	64.7	Low	11 Å²	11	101.5 Å²	101.5	11%	0.113	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-66.4	133.5	172.7	0	0	0	0	0	111.4	R169 K217	R169-G215 WeakPolarHBondContact CD-O 3.44Å; G215-K217 PolarHBondContact O-N 3.18Å
216	N	61.2	Low	61.9	Low	161 Å²	161	108.5 Å²	108.5	86%	0.861	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-55.1	139.6	170.3	-75.4	-17.6	0	0	0	110.1	K218	N216-K218 PolarHBondContact O-N 3.04Å
217	K	51.5	Low	59.3	Low	157 Å²	157	108.1 Å²	108.1	68%	0.683	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-58.3	131.1	166.2	-72.9	-178.9	178.5	-179.6	0	107.3	G215 L219	G215-K217 PolarHBondContact O-N 3.18Å; K217-L219 PolarHBondContact O-N 3.14Å
218	K	39.3	Very low	56.4	Low	169 Å²	169	113.5 Å²	113.5	74%	0.735	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-54.4	125.2	159.7	-79	-170.9	174.7	-172.8	0	106.7	N216 N220	N216-K218 PolarHBondContact O-N 3.04Å; K218-N220 PolarHBondContact O-N 3.43Å
219	L	32.2	Very low	53.8	Low	163 Å²	163	119 Å²	119	85%	0.853	60%	0.599	S	S	*	*			trans	-64.7	114.1	164.9	-80	162.1	0	0	0	106.5	K217 K221	K217-L219 PolarHBondContact O-N 3.14Å; L219-K221 VanDerWaalsContact C-N 3.28Å; L219-K221 PolarHBondContact O-N 3.06Å
220	N	33.5	Very low	50.8	Low	147 Å²	147	123.9 Å²	123.9	79%	0.786	63%	0.631	S	S	*	*			trans	-68.1	95.6	165.3	-79.5	5.4	0	0	0	106.9	K218 N222	K218-N220 PolarHBondContact O-N 3.43Å; N220-N222 PolarHBondContact O-N 2.72Å
221	K	33.7	Very low	47.9	Very low	195 Å²	195	128.3 Å²	128.3	85%	0.848	66%	0.658	S	S	*	*			trans	-62.7	88.9	156.3	-74.9	-174.2	175.1	-173.9	0	106.7	L219	L219-K221 VanDerWaalsContact C-N 3.28Å; L219-K221 PolarHBondContact O-N 3.06Å
222	N	31.8	Very low	45	Very low	151 Å²	151	132.5 Å²	132.5	81%	0.807	69%	0.685	S	S	*	*			trans	175.1	72.6	161.3	-87.7	-12.6	0	0	0	109.1	N220	N220-N222 PolarHBondContact O-N 2.72Å
223	Q	29.9	Very low	42.4	Very low	187 Å²	187	138.3 Å²	138.3	87%	0.874	72%	0.721	S	S	*	*			trans	-130.7	107.1	149.2	-83.6	-169.2	-25.4	0	0	106.3
224	P	35.1	Very low	40.1	Very low	124 Å²	124	143 Å²	143	81%	0.805	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-76.7	135.4	173.6	29.6	-29.9	0	0	0	109.7
225	E	34.1	Very low	38.3	Very low	190 Å²	190	145 Å²	145	89%	0.888	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-66.6	148.8	174.7	-62.9	-179.6	161.7	0	0	111.1	K227	E225-K227 PolarHBondContact O-N 2.92Å
226	H	31.2	Very low	36.7	Very low	188 Å²	188	153.2 Å²	153.2	87%	0.87	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-56	131.1	-174.8	-81.4	-110.1	0	0	0	113.8
227	K	36.9	Very low	35.6	Very low	198 Å²	198	153.2 Å²	153.2	86%	0.861	79%	0.793	S	S	*	*			trans	-166.3	93.7	145.6	-101.9	148.5	-167.2	179.1	0	113.6	E225	E225-K227 PolarHBondContact O-N 2.92Å
228	T	34	Very low	35	Very low	125 Å²	125	152.4 Å²	152.4	77%	0.767	80%	0.801	S	S	*	*			trans	49.3	106.5	130.8	-19.8	0	0	0	0	122
229	V	38.6	Very low	34.9	Very low	135 Å²	135	148.7 Å²	148.7	82%	0.818	80%	0.802	S	S	*	*			trans	81	145.8	132.5	166.2	0	0	0	0	118.6
230	P	34.5	Very low	35.2	Very low	101 Å²	101	147.8 Å²	147.8	66%	0.656	80%	0.798	S	S	*	*				-132	-161.9	-125.2	45.2	-31.7	0	0	0	116.4
231	N	32.4	Very low	35.3	Very low	140 Å²	140	148 Å²	148	75%	0.749	80%	0.799	S	S	*	*			trans	110	119.5	154.6	-72.1	-11.5	0	0	0	119.2
232	T	33.3	Very low	35.7	Very low	126 Å²	126	147 Å²	147	77%	0.773	80%	0.795	S	S	*	*			trans	56.1	135.1	147.9	-1.2	0	0	0	0	118.3
233	T	36.9	Very low	35.9	Very low	130 Å²	130	146.1 Å²	146.1	80%	0.798	80%	0.795	S	S	*	*			cis	-159.5	156.1	30.6	-39.6	0	0	0	0	111.3
234	N	36.4	Very low	36.3	Very low	147 Å²	147	143.8 Å²	143.8	79%	0.786	79%	0.788	S	S	*	*			trans	-75.8	179.8	176	-89.4	-22.3	0	0	0	114
235	P	42.6	Very low	36.7	Very low	100 Å²	100	143 Å²	143	65%	0.649	78%	0.783	S	S	*	*			cis	-140.7	-169.7	-37	36.5	-16.7	0	0	0	114.3
236	K	32.6	Very low	37.1	Very low	184 Å²	184	140.5 Å²	140.5	80%	0.8	77%	0.774	S	S	*	*			trans	92.1	114.5	165.1	-55.5	174.3	-177	178.5	0	116.9
237	D	38.1	Very low	37.5	Very low	160 Å²	160	139.9 Å²	139.9	86%	0.856	76%	0.764	S	S	*	*				-166.2	174.4	93.7	-100.5	-27.1	0	0	0	113
238	V	37.6	Very low	37.7	Very low	140 Å²	140	137.3 Å²	137.3	85%	0.848	75%	0.753	S	S	*	*			trans	-89.2	140.1	-164.6	174.8	0	0	0	0	112.9
239	A	38.5	Very low	38.1	Very low	91 Å²	91	135 Å²	135	75%	0.752	74%	0.739	S	S	*	*			trans	174.2	134.7	131.7	0	0	0	0	0	116.2
240	D	37.8	Very low	38.3	Very low	145 Å²	145	134.4 Å²	134.4	78%	0.775	73%	0.726	S	S	*	*			trans	62.3	112.6	143.3	-137	29	0	0	0	121.8
241	D	34.9	Very low	38.6	Very low	150 Å²	150	131.5 Å²	131.5	80%	0.802	70%	0.704	S	S	*	*			trans	-101.8	98.6	-177.4	-150.2	-1.3	0	0	0	110.1
242	K	41.9	Very low	39.2	Very low	176 Å²	176	132.4 Å²	132.4	77%	0.765	70%	0.698	S	S	*	*			trans	-96.6	107.9	175.2	-80.1	-173.5	178.5	177.8	0	111.5	D244	K242-D244 PolarHBondContact O-N 2.69Å
243	V	37.2	Very low	39.7	Very low	132 Å²	132	131.4 Å²	131.4	80%	0.8	68%	0.679	S	S	*	*			trans	-83.2	105.1	176.7	-179	0	0	0	0	110.9
244	D	38.2	Very low	39.9	Very low	137 Å²	137	130.1 Å²	130.1	73%	0.733	67%	0.667	S	S	*	*			trans	-63.2	134.2	175.7	-82.3	-28	0	0	0	113	K242	K242-D244 PolarHBondContact O-N 2.69Å
245	P	42.4	Very low	40.2	Very low	108 Å²	108	124.3 Å²	124.3	70%	0.701	64%	0.636	S	S	*	*			trans	-71	135.5	-179.6	28	-33.7	0	0	0	112.8	R247	P245-R247 PolarHBondContact O-N 3.08Å
246	I	42.5	Very low	40	Very low	137 Å²	137	124.3 Å²	124.3	70%	0.703	64%	0.638	S	S	*	*			trans	-66.7	105.3	-177.7	-58.3	171.9	0	0	0	110.9	K248	I246-K248 PolarHBondContact O-N 3.45Å
247	R	40	Very low	40.5	Very low	175 Å²	175	120.7 Å²	120.7	66%	0.66	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-53.3	119.1	169.3	-74.7	-176.8	174.9	-171.2	-4	111.1	P245 E277 T279	P245-R247 PolarHBondContact O-N 3.08Å; R247-E277 PolarHBondContact NH2-O 3.35Å; R247-E277 VanDerWaalsContact NH2-O 3.13Å; R247-T279 VanDerWaalsContact CZ-OG1 3.29Å; R247-T279 PolarHBondContact NH1-OG1 3.43Å; R247-T279 PolarHBondContact NH2-OG1 3.41Å
248	K	42.2	Very low	41.1	Very low	144 Å²	144	119.6 Å²	119.6	63%	0.626	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-87.8	131.9	174.4	-63.4	178.2	-175.8	173.3	0	109.9	I246	I246-K248 PolarHBondContact O-N 3.45Å
249	T	41.9	Very low	42	Very low	77 Å²	77	118.2 Å²	118.2	47%	0.472	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-72.5	149.8	171	15.5	0	0	0	0	111.7	L173 R268	L173-T249 VanDerWaalsContact CD2-OG1 3.23Å; L173-T249 WeakPolarHBondContact CD2-OG1 3.46Å; T249-R268 PolarHBondContact O-NH1 3.26Å
250	F	42.1	Very low	42.5	Very low	122 Å²	122	121.5 Å²	121.5	54%	0.535	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-94.7	144.8	-178.5	-63.6	-92.8	0	0	0	111.6
251	L	41.4	Very low	42.5	Very low	40 Å²	40	117 Å²	117	21%	0.209	60%	0.599	C	S	.	*			trans	-104.7	133	160.3	-73.6	179.8	0	0	0	108.8	L173 Y208 V267	L173-L251 WeakPolarHBondContact O-CD1 3.31Å; Y208-L251 WeakPolarHBondContact OH-CD1 3.37Å; L251-V267 PolarHBondContact O-N 3.01Å
252	R	44.5	Very low	43	Very low	160 Å²	160	115 Å²	115	60%	0.604	59%	0.587	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99	134	166.3	-66.6	-173.2	-179.9	-155	0.8	108.5	V264 H266	R252-V264 HydrophobicContact CB-CG1 4.43Å; R252-H266 PolarHBondContact NE-NE2 3.18Å; R252-H266 PolarHBondContact NH2-NE2 3.11Å
253	R	43.4	Very low	43	Very low	104 Å²	104	111.2 Å²	111.2	39%	0.392	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.2	127.8	170.7	173.4	177.1	-172.3	-177.7	-0.7	108	D255 V264 S265 V267	R253-D255 WeakPolarHBondContact CD-OD2 3.45Å; R253-D255 IonicContact CZ-OD1 3.11Å; R253-D255 IonicContact CZ-OD2 2.78Å; R253-D255 VanDerWaalsContact CZ-OD2 3.32Å; R253-D255 IonicContact NE-OD1 3.88Å; R253-D255 PolarHBondContact NE-OD1 3.04Å; R253-D255 IonicContact NE-OD2 3.23Å; R253-D255 PolarHBondContact NE-OD2 3.48Å; R253-D255 IonicContact NH2-OD1 3.65Å; R253-D255 PolarHBondContact NH2-OD1 3.33Å; R253-D255 VanDerWaalsContact NH2-OD1 3.14Å; R253-D255 IonicContact NH2-OD2 2.71Å; R253-V264 CarbonylContact O-C 3.6Å; R253-V264 WeakPolarHBondContact O-CA 3.42Å; R253-S265 WeakPolarHBondContact CB-OG 3.48Å; R253-S265 WeakPolarHBondContact CD-OG 3.31Å; R253-S265 PolarHBondContact N-O 3.03Å; R253-S265 PolarHBondContact O-N 3Å; R253-V267 HydrophobicContact CB-CG2 3.68Å
254	L	42	Very low	43.4	Very low	103 Å²	103	108.1 Å²	108.1	54%	0.539	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.6	119.1	164.4	-71.5	90.9	0	0	0	107.4	I262 H263 V264	L254-I262 HydrophobicContact CD2-CG2 3.96Å; L254-H263 WeakPolarHBondContact CA-O 3.31Å; L254-V264 HydrophobicContact CG-CG2 4.35Å
255	D	42.1	Very low	43.5	Very low	26 Å²	26	103.1 Å²	103.1	14%	0.139	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.2	166.2	-57	-60.3	0	0	0	107.5	R253 F257 H263	R253-D255 WeakPolarHBondContact CD-OD2 3.45Å; R253-D255 IonicContact CZ-OD1 3.11Å; R253-D255 IonicContact CZ-OD2 2.78Å; R253-D255 VanDerWaalsContact CZ-OD2 3.32Å; R253-D255 IonicContact NE-OD1 3.88Å; R253-D255 PolarHBondContact NE-OD1 3.04Å; R253-D255 IonicContact NE-OD2 3.23Å; R253-D255 PolarHBondContact NE-OD2 3.48Å; R253-D255 IonicContact NH2-OD1 3.65Å; R253-D255 PolarHBondContact NH2-OD1 3.33Å; R253-D255 VanDerWaalsContact NH2-OD1 3.14Å; R253-D255 IonicContact NH2-OD2 2.71Å; D255-F257 HydrophobicContact CB-CE2 3.93Å; D255-F257 HydrophobicContact CB-CZ 4.36Å; D255-H263 PolarHBondContact N-O 3.19Å; D255-H263 PolarHBondContact O-N 2.67Å
256	C	39.5	Very low	43.6	Very low	100 Å²	100	103.4 Å²	103.4	68%	0.676	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.9	168.3	-65.1	0	0	0	0	108.7
257	F	42.5	Very low	44	Very low	107 Å²	107	100.4 Å²	100.4	47%	0.469	51%	0.509	S	S	.	.			trans	-94.8	160.4	174.7	-69.9	-90	0	0	0	110.7	D255 N259 N260 S261 H263	D255-F257 HydrophobicContact CB-CE2 3.93Å; D255-F257 HydrophobicContact CB-CZ 4.36Å; F257-N259 WeakPolarHBondContact CB-OD1 3.47Å; F257-N259 PolarHBondContact O-N 2.96Å; F257-N260 PolarHBondContact O-N 3.43Å; F257-N260 VanDerWaalsContact O-N 3.14Å; F257-S261 PolarHBondContact N-O 3.44Å; F257-H263 HydrophobicContact CD2-CB 4.22Å; F257-H263 HydrophobicContact CE2-CB 3.62Å
258	S	50.1	Low	44	Very low	137 Å²	137	95.7 Å²	95.7	96%	0.958	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-6.5	-175.9	49.8	0	0	0	0	115.2
259	N	57.5	Low	43.8	Very low	111 Å²	111	97.1 Å²	97.1	59%	0.594	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	20.1	176.5	64	-12.9	0	0	0	112.9	F257 S261	F257-N259 WeakPolarHBondContact CB-OD1 3.47Å; F257-N259 PolarHBondContact O-N 2.96Å; N259-S261 PolarHBondContact ND2-OG 3.29Å; N259-S261 PolarHBondContact O-N 2.74Å; N259-S261 VanDerWaalsContact O-N 3.09Å; N259-S261 WeakPolarHBondContact OD1-CB 3.5Å; N259-S261 PolarHBondContact OD1-N 3.04Å; N259-S261 VanDerWaalsContact OD1-N 3.08Å; N259-S261 PolarHBondContact OD1-OG 2.93Å
260	N	48.5	Very low	43.7	Very low	161 Å²	161	98.5 Å²	98.5	86%	0.861	51%	0.51	S	S	*	.	S	Bend	trans	58.1	12	-171.6	-87	-0.1	0	0	0	115.4	F257	F257-N260 PolarHBondContact O-N 3.43Å; F257-N260 VanDerWaalsContact O-N 3.14Å
261	S	37.7	Very low	43.5	Very low	49 Å²	49	100.8 Å²	100.8	34%	0.343	53%	0.526	S	S	.	.			trans	-81	135.2	174	84.1	0	0	0	0	111.4	F257 N259	F257-S261 PolarHBondContact N-O 3.44Å; N259-S261 PolarHBondContact ND2-OG 3.29Å; N259-S261 PolarHBondContact O-N 2.74Å; N259-S261 VanDerWaalsContact O-N 3.09Å; N259-S261 WeakPolarHBondContact OD1-CB 3.5Å; N259-S261 PolarHBondContact OD1-N 3.04Å; N259-S261 VanDerWaalsContact OD1-N 3.08Å; N259-S261 PolarHBondContact OD1-OG 2.93Å
262	I	46.2	Very low	43.8	Very low	108 Å²	108	101.1 Å²	101.1	55%	0.554	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	112.2	175.6	-59.4	176.1	0	0	0	108	L254 V264	L254-I262 HydrophobicContact CD2-CG2 3.96Å; I262-V264 HydrophobicContact CG2-CG2 4.21Å
263	H	40.4	Very low	44	Very low	97 Å²	97	98 Å²	98	45%	0.449	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	118.5	169	-170.3	-31.8	0	0	0	109.3	L254 D255 F257	L254-H263 WeakPolarHBondContact CA-O 3.31Å; D255-H263 PolarHBondContact N-O 3.19Å; D255-H263 PolarHBondContact O-N 2.67Å; F257-H263 HydrophobicContact CD2-CB 4.22Å; F257-H263 HydrophobicContact CE2-CB 3.62Å
264	V	45.7	Very low	44.2	Very low	68 Å²	68	95.8 Å²	95.8	41%	0.412	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	119.6	168	-173.2	0	0	0	0	108.5	R252 R253 L254 I262	R252-V264 HydrophobicContact CB-CG1 4.43Å; R253-V264 CarbonylContact O-C 3.6Å; R253-V264 WeakPolarHBondContact O-CA 3.42Å; L254-V264 HydrophobicContact CG-CG2 4.35Å; I262-V264 HydrophobicContact CG2-CG2 4.21Å
265	S	40.2	Very low	44.9	Very low	31 Å²	31	95 Å²	95	22%	0.217	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.2	171	50.2	0	0	0	0	111.1	R253	R253-S265 WeakPolarHBondContact CB-OG 3.48Å; R253-S265 WeakPolarHBondContact CD-OG 3.31Å; R253-S265 PolarHBondContact N-O 3.03Å; R253-S265 PolarHBondContact O-N 3Å
266	H	45.5	Very low	45	Very low	114 Å²	114	102.1 Å²	102.1	53%	0.528	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80	122.2	170.2	-96.8	-130.7	0	0	0	108.6	R252 R268	R252-H266 PolarHBondContact NE-NE2 3.18Å; R252-H266 PolarHBondContact NH2-NE2 3.11Å; H266-R268 PolarHBondContact O-N 3.28Å
267	V	50.3	Low	45.4	Very low	74 Å²	74	104.5 Å²	104.5	45%	0.448	57%	0.572	S	S	.	*	S	Bend	trans	-81.4	5.9	-176.5	-171.1	0	0	0	0	111.9	L251 R253	L251-V267 PolarHBondContact O-N 3.01Å; R253-V267 HydrophobicContact CB-CG2 3.68Å
268	R	40.5	Very low	45.8	Very low	76 Å²	76	101 Å²	101	29%	0.287	56%	0.561	S	S	.	*	S	Bend	trans	-143.8	126.1	170.8	-66.9	-173.6	177	153	2.7	109.5	T249 H266	T249-R268 PolarHBondContact O-NH1 3.26Å; H266-R268 PolarHBondContact O-N 3.28Å
269	E	38.2	Very low	45.9	Very low	174 Å²	174	98.9 Å²	98.9	81%	0.813	54%	0.542	S	S	*	.			trans	-65.7	146.3	170.8	-64.4	-178.7	154.5	0	0	110.6	I271	E269-I271 PolarHBondContact O-N 3.22Å
270	P	38.7	Very low	45.6	Very low	106 Å²	106	97.5 Å²	97.5	69%	0.688	56%	0.555	S	S	*	*			trans	-67.3	122.6	173.6	27.9	-32.8	0	0	0	110.1	G272	P270-G272 PolarHBondContact O-N 3.27Å
271	I	39.8	Very low	45.5	Very low	170 Å²	170	95 Å²	95	87%	0.872	54%	0.536	S	S	*	.	S	Bend	trans	-73.9	83.1	172	-54.5	174.8	0	0	0	107.9	E269	E269-I271 PolarHBondContact O-N 3.22Å
272	G	47.4	Very low	46.2	Very low	47 Å²	47	96.3 Å²	96.3	49%	0.485	55%	0.545	S	S	.	.	S	Bend	trans	84.1	170.6	177.8	0	0	0	0	0	115.5	P270	P270-G272 PolarHBondContact O-N 3.27Å
273	P	47.1	Very low	46.4	Very low	96 Å²	96	97.6 Å²	97.6	62%	0.623	56%	0.561	S	S	*	*	S	Bend	trans	-66.7	153.4	173.7	30	-35	0	0	0	111	T275	P273-T275 PolarHBondContact O-N 2.93Å
274	P	48.8	Very low	47.3	Very low	56 Å²	56	95.1 Å²	95.1	36%	0.364	56%	0.562	S	S	.	*			trans	-70.6	130.2	-174.8	-5.5	20.1	0	0	0	111.4	S278 F281 W285	P274-S278 WeakPolarHBondContact CA-OG 3.48Å; P274-S278 WeakPolarHBondContact CB-OG 3.49Å; P274-F281 HydrophobicContact CB-CE2 4.22Å; P274-F281 HydrophobicContact CB-CZ 4.41Å; P274-F281 HydrophobicContact CG-CZ 4.24Å; P274-W285 HydrophobicContact CB-CH2 3.65Å; P274-W285 HydrophobicContact CB-CZ2 4.46Å; P274-W285 HydrophobicContact CB-CZ3 4.06Å; P274-W285 HydrophobicContact CG-CH2 4.01Å; P274-W285 HydrophobicContact CG-CZ3 3.88Å
275	T	55.7	Low	47.9	Very low	86 Å²	86	93.5 Å²	93.5	53%	0.528	55%	0.548	S	S	.	.			trans	-79.5	178.7	-179.2	58.2	0	0	0	0	113	P273 E277 S278 R286	P273-T275 PolarHBondContact O-N 2.93Å; T275-E277 PolarHBondContact O-N 2.89Å; T275-S278 PolarHBondContact N-OG 3.48Å; T275-S278 WeakPolarHBondContact O-CB 3.47Å; T275-S278 PolarHBondContact O-N 2.92Å; T275-S278 VanDerWaalsContact O-N 3.15Å; T275-S278 PolarHBondContact O-OG 2.82Å; T275-S278 VanDerWaalsContact O-OG 3.08Å; T275-R286 PolarHBondContact O-NH2 3.15Å
276	E	45.7	Very low	48.3	Very low	177 Å²	177	97.6 Å²	97.6	83%	0.827	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-34.6	176.3	-65.4	-164.6	146.5	0	0	113.1	S278 R286	E276-S278 PolarHBondContact O-N 3Å; E276-R286 PolarHBondContact O-NH2 3.22Å
277	E	47	Very low	48.9	Very low	150 Å²	150	96.6 Å²	96.6	70%	0.701	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	1.8	178.5	-58.2	176.6	-170.3	0	0	114.7	R247 T275 T279	R247-E277 PolarHBondContact NH2-O 3.35Å; R247-E277 VanDerWaalsContact NH2-O 3.13Å; T275-E277 PolarHBondContact O-N 2.89Å; E277-T279 PolarHBondContact O-N 3.47Å; E277-T279 VanDerWaalsContact O-N 3.14Å
278	S	50.3	Low	49.3	Very low	32 Å²	32	98.4 Å²	98.4	22%	0.224	56%	0.561	C	S	.	*			trans	-76	100.4	-178.2	-64.8	0	0	0	0	111.9	P274 T275 E276	P274-S278 WeakPolarHBondContact CA-OG 3.48Å; P274-S278 WeakPolarHBondContact CB-OG 3.49Å; T275-S278 PolarHBondContact N-OG 3.48Å; T275-S278 WeakPolarHBondContact O-CB 3.47Å; T275-S278 PolarHBondContact O-N 2.92Å; T275-S278 VanDerWaalsContact O-N 3.15Å; T275-S278 PolarHBondContact O-OG 2.82Å; T275-S278 VanDerWaalsContact O-OG 3.08Å; E276-S278 PolarHBondContact O-N 3Å
279	T	51.6	Low	50	Low	93 Å²	93	97.3 Å²	97.3	57%	0.571	56%	0.56	S	S	*	*			trans	-92.9	148.6	177.3	63.9	0	0	0	0	112	R247 E277	R247-T279 VanDerWaalsContact CZ-OG1 3.29Å; R247-T279 PolarHBondContact NH1-OG1 3.43Å; R247-T279 PolarHBondContact NH2-OG1 3.41Å; E277-T279 PolarHBondContact O-N 3.47Å; E277-T279 VanDerWaalsContact O-N 3.14Å
280	G	51.8	Low	51.1	Low	83 Å²	83	95.3 Å²	95.3	86%	0.856	55%	0.545	S	S	*	.	S	Bend	trans	108.7	8.6	175.2	0	0	0	0	0	114.7
281	F	47.3	Very low	52.1	Low	109 Å²	109	94.4 Å²	94.4	48%	0.478	53%	0.534	S	S	.	.	S	Bend	trans	-103.7	150.6	171.3	-61.2	-85	0	0	0	110.2	P274 W285	P274-F281 HydrophobicContact CB-CE2 4.22Å; P274-F281 HydrophobicContact CB-CZ 4.41Å; P274-F281 HydrophobicContact CG-CZ 4.24Å; F281-W285 HydrophobicContact CB-CB 3.88Å; F281-W285 HydrophobicContact CB-CD2 3.81Å; F281-W285 HydrophobicContact CB-CG 3.38Å; F281-W285 HydrophobicContact CD1-CD2 4.41Å; F281-W285 HydrophobicContact CD2-CD2 4.4Å; F281-W285 HydrophobicContact CD2-CZ2 4.36Å; F281-W285 AromaticContact CG-CD2 3.97Å; F281-W285 HydrophobicContact CG-CD2 3.97Å; F281-W285 HydrophobicContact CG-CE3 4.45Å; F281-W285 HydrophobicContact CG-CG 4.05Å
282	S	51.7	Low	52.9	Low	75 Å²	75	91.6 Å²	91.6	52%	0.524	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-64.5	149	177.9	50	0	0	0	0	112.2	G284 W285	S282-G284 PolarHBondContact O-N 2.84Å; S282-W285 WeakPolarHBondContact O-CB 3.31Å; S282-W285 PolarHBondContact O-N 3.42Å; S282-W285 VanDerWaalsContact O-N 3.11Å
283	P	50.9	Low	53.2	Low	136 Å²	136	96.6 Å²	96.6	88%	0.883	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.8	133	169.5	-25.7	34.9	0	0	0	111
284	G	58.5	Low	53.4	Low	45 Å²	45	96.3 Å²	96.3	46%	0.464	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	-2.1	-177.1	0	0	0	0	0	116.5	S282 R286 E287 L288	S282-G284 PolarHBondContact O-N 2.84Å; G284-R286 PolarHBondContact O-N 2.7Å; G284-R286 VanDerWaalsContact O-N 3.12Å; G284-E287 WeakPolarHBondContact O-CB 3.22Å; G284-E287 PolarHBondContact O-N 2.98Å; G284-L288 PolarHBondContact O-N 3.06Å; G284-L288 VanDerWaalsContact O-N 3.14Å
285	W	57.8	Low	53.5	Low	34 Å²	34	98.3 Å²	98.3	13%	0.129	52%	0.52	C	S	.	.	H	α-helix	trans	-54.8	-32.5	178.9	74	-89.3	0	0	0	114.5	P274 F281 S282 L289	P274-W285 HydrophobicContact CB-CH2 3.65Å; P274-W285 HydrophobicContact CB-CZ2 4.46Å; P274-W285 HydrophobicContact CB-CZ3 4.06Å; P274-W285 HydrophobicContact CG-CH2 4.01Å; P274-W285 HydrophobicContact CG-CZ3 3.88Å; F281-W285 HydrophobicContact CB-CB 3.88Å; F281-W285 HydrophobicContact CB-CD2 3.81Å; F281-W285 HydrophobicContact CB-CG 3.38Å; F281-W285 HydrophobicContact CD1-CD2 4.41Å; F281-W285 HydrophobicContact CD2-CD2 4.4Å; F281-W285 HydrophobicContact CD2-CZ2 4.36Å; F281-W285 AromaticContact CG-CD2 3.97Å; F281-W285 HydrophobicContact CG-CD2 3.97Å; F281-W285 HydrophobicContact CG-CE3 4.45Å; F281-W285 HydrophobicContact CG-CG 4.05Å; S282-W285 WeakPolarHBondContact O-CB 3.31Å; S282-W285 PolarHBondContact O-N 3.42Å; S282-W285 VanDerWaalsContact O-N 3.11Å; W285-L289 HydrophobicContact CE3-CD1 3.65Å; W285-L289 HydrophobicContact CZ3-CD1 3.54Å; W285-L289 PolarHBondContact O-N 2.62Å
286	R	48.8	Very low	52.9	Low	117 Å²	117	100.1 Å²	100.1	44%	0.442	53%	0.525	S	S	.	.	H	α-helix	trans	-66.1	-38.5	176.6	-64.5	-175.6	174.8	120.2	3.8	111.8	T275 E276 G284 L289 R290	T275-R286 PolarHBondContact O-NH2 3.15Å; E276-R286 PolarHBondContact O-NH2 3.22Å; G284-R286 PolarHBondContact O-N 2.7Å; G284-R286 VanDerWaalsContact O-N 3.12Å; R286-L289 PolarHBondContact O-N 3.09Å; R286-R290 WeakPolarHBondContact O-CB 3.21Å; R286-R290 PolarHBondContact O-N 3.21Å
287	E	58.8	Low	53	Low	92 Å²	92	102.2 Å²	102.2	43%	0.43	53%	0.526	S	S	.	.	H	α-helix	trans	-72.3	-39.8	179.4	-139.5	56.3	-142.4	0	0	111.1	G284 R290 L291	G284-E287 WeakPolarHBondContact O-CB 3.22Å; G284-E287 PolarHBondContact O-N 2.98Å; E287-R290 WeakPolarHBondContact O-CB 3.32Å; E287-R290 PolarHBondContact O-N 3.32Å; E287-R290 IonicContact OE1-CZ 3.25Å; E287-R290 VanDerWaalsContact OE1-CZ 3.25Å; E287-R290 IonicContact OE1-NE 2.74Å; E287-R290 PolarHBondContact OE1-NE 2.95Å; E287-R290 IonicContact OE1-NH2 2.87Å; E287-R290 PolarHBondContact OE1-NH2 3.39Å; E287-L291 WeakPolarHBondContact O-CB 3.37Å; E287-L291 WeakPolarHBondContact O-CG 3.49Å; E287-L291 PolarHBondContact O-N 2.86Å
288	L	58.9	Low	53.1	Low	113 Å²	113	101 Å²	101	59%	0.592	52%	0.524	S	S	*	.	H	α-helix	trans	-61	-44.4	171.9	-73.7	170.8	0	0	0	112.1	G284 R290 L291 Q292	G284-L288 PolarHBondContact O-N 3.06Å; G284-L288 VanDerWaalsContact O-N 3.14Å; L288-R290 VanDerWaalsContact C-N 3.32Å; L288-R290 PolarHBondContact O-N 3.1Å; L288-L291 PolarHBondContact O-N 3.43Å; L288-Q292 VanDerWaalsContact O-CB 3.27Å; L288-Q292 WeakPolarHBondContact O-CB 3.49Å; L288-Q292 PolarHBondContact O-N 2.82Å
289	L	55.4	Low	52.5	Low	53 Å²	53	102.7 Å²	102.7	28%	0.277	55%	0.546	S	S	.	.	H	α-helix	trans	-64.1	-35.7	173.3	-91.5	173.9	0	0	0	112.8	W285 R286 R293	W285-L289 HydrophobicContact CE3-CD1 3.65Å; W285-L289 HydrophobicContact CZ3-CD1 3.54Å; W285-L289 PolarHBondContact O-N 2.62Å; R286-L289 PolarHBondContact O-N 3.09Å; L289-R293 VanDerWaalsContact O-CB 3.32Å; L289-R293 WeakPolarHBondContact O-CB 3.41Å; L289-R293 WeakPolarHBondContact O-CD 3.5Å; L289-R293 WeakPolarHBondContact O-CG 3.26Å; L289-R293 PolarHBondContact O-N 3.26Å
290	R	61.6	Low	51.9	Low	132 Å²	132	101.2 Å²	101.2	50%	0.498	54%	0.544	S	S	.	.	H	α-helix	trans	-64.7	-49	176.3	-164	175.7	74.6	82.4	-2.5	110.7	R286 E287 L288 R293 M294	R286-R290 WeakPolarHBondContact O-CB 3.21Å; R286-R290 PolarHBondContact O-N 3.21Å; E287-R290 WeakPolarHBondContact O-CB 3.32Å; E287-R290 PolarHBondContact O-N 3.32Å; E287-R290 IonicContact OE1-CZ 3.25Å; E287-R290 VanDerWaalsContact OE1-CZ 3.25Å; E287-R290 IonicContact OE1-NE 2.74Å; E287-R290 PolarHBondContact OE1-NE 2.95Å; E287-R290 IonicContact OE1-NH2 2.87Å; E287-R290 PolarHBondContact OE1-NH2 3.39Å; L288-R290 VanDerWaalsContact C-N 3.32Å; L288-R290 PolarHBondContact O-N 3.1Å; R290-R293 PolarHBondContact O-N 3.32Å; R290-M294 WeakPolarHBondContact O-CG 3.06Å; R290-M294 PolarHBondContact O-N 2.83Å
291	L	60	Low	51.3	Low	86 Å²	86	107 Å²	107	45%	0.45	55%	0.545	S	S	.	.	H	α-helix	trans	-62.2	-45.3	176.5	-69.3	170.6	0	0	0	112	E287 L288 R293 M294 L295	E287-L291 WeakPolarHBondContact O-CB 3.37Å; E287-L291 WeakPolarHBondContact O-CG 3.49Å; E287-L291 PolarHBondContact O-N 2.86Å; L288-L291 PolarHBondContact O-N 3.43Å; L291-R293 VanDerWaalsContact C-N 3.33Å; L291-R293 PolarHBondContact O-N 3.24Å; L291-M294 PolarHBondContact O-N 3.26Å; L291-M294 VanDerWaalsContact O-N 3.15Å; L291-L295 WeakPolarHBondContact O-CG 3.35Å; L291-L295 PolarHBondContact O-N 3.28Å
292	Q	54.8	Low	50.9	Low	111 Å²	111	108 Å²	108	52%	0.519	56%	0.56	S	S	.	*	H	α-helix	trans	-62.9	-38.8	178.3	-167.6	179.8	9.9	0	0	111.9	L288 L295 I296	L288-Q292 VanDerWaalsContact O-CB 3.27Å; L288-Q292 WeakPolarHBondContact O-CB 3.49Å; L288-Q292 PolarHBondContact O-N 2.82Å; Q292-L295 PolarHBondContact O-N 3.2Å; Q292-I296 HydrophobicContact CG-CD1 4.06Å; Q292-I296 WeakPolarHBondContact O-CB 3.34Å; Q292-I296 WeakPolarHBondContact O-CD1 3.38Å; Q292-I296 VanDerWaalsContact O-CG1 3.28Å; Q292-I296 WeakPolarHBondContact O-CG1 3.24Å; Q292-I296 PolarHBondContact O-N 3.47Å
293	R	54	Low	50.2	Low	152 Å²	152	111.5 Å²	111.5	57%	0.574	57%	0.571	S	S	*	*	H	α-helix	trans	-68.3	-33	174.3	-74.2	171.3	179.7	-175.5	0.2	112.9	L289 R290 L291 R297	L289-R293 VanDerWaalsContact O-CB 3.32Å; L289-R293 WeakPolarHBondContact O-CB 3.41Å; L289-R293 WeakPolarHBondContact O-CD 3.5Å; L289-R293 WeakPolarHBondContact O-CG 3.26Å; L289-R293 PolarHBondContact O-N 3.26Å; R290-R293 PolarHBondContact O-N 3.32Å; L291-R293 VanDerWaalsContact C-N 3.33Å; L291-R293 PolarHBondContact O-N 3.24Å; R293-R297 WeakPolarHBondContact O-CB 3.19Å; R293-R297 PolarHBondContact O-N 3.16Å; R293-R297 VanDerWaalsContact O-N 3.14Å
294	M	51.9	Low	49.5	Very low	91 Å²	91	113.1 Å²	113.1	45%	0.448	57%	0.565	S	S	.	*	H	α-helix	trans	-66.5	-48.6	171.5	-70.4	175.9	66.2	0	0	110.8	R290 L291 I296 R297 D298	R290-M294 WeakPolarHBondContact O-CG 3.06Å; R290-M294 PolarHBondContact O-N 2.83Å; L291-M294 PolarHBondContact O-N 3.26Å; L291-M294 VanDerWaalsContact O-N 3.15Å; M294-I296 VanDerWaalsContact C-N 3.32Å; M294-I296 PolarHBondContact O-N 3.33Å; M294-R297 WeakPolarHBondContact O-CA 3.48Å; M294-R297 WeakPolarHBondContact O-CB 3.45Å; M294-R297 PolarHBondContact O-N 2.78Å; M294-D298 PolarHBondContact O-N 3.13Å
295	L	50.2	Low	48.4	Very low	97 Å²	97	116 Å²	116	51%	0.508	58%	0.578	S	S	.	*	H	α-helix	trans	-61.1	-36	178.5	-69.5	167.7	0	0	0	113.5	L291 Q292 G299	L291-L295 WeakPolarHBondContact O-CG 3.35Å; L291-L295 PolarHBondContact O-N 3.28Å; Q292-L295 PolarHBondContact O-N 3.2Å; L295-G299 PolarHBondContact O-N 3.29Å
296	I	44	Very low	47.4	Very low	124 Å²	124	120.3 Å²	120.3	64%	0.636	61%	0.613	S	S	*	*	H	α-helix	trans	-69.9	-33.8	173.4	-70.2	162.4	0	0	0	111.5	Q292 M294	Q292-I296 HydrophobicContact CG-CD1 4.06Å; Q292-I296 WeakPolarHBondContact O-CB 3.34Å; Q292-I296 WeakPolarHBondContact O-CD1 3.38Å; Q292-I296 VanDerWaalsContact O-CG1 3.28Å; Q292-I296 WeakPolarHBondContact O-CG1 3.24Å; Q292-I296 PolarHBondContact O-N 3.47Å; M294-I296 VanDerWaalsContact C-N 3.32Å; M294-I296 PolarHBondContact O-N 3.33Å
297	R	48.2	Very low	46.4	Very low	221 Å²	221	124.2 Å²	124.2	83%	0.834	64%	0.636	S	S	*	*	H	α-helix	trans	-71.7	-30.8	178.4	-168.3	175.8	-176.4	176.3	0.1	112.6	R293 M294 G299	R293-R297 WeakPolarHBondContact O-CB 3.19Å; R293-R297 PolarHBondContact O-N 3.16Å; R293-R297 VanDerWaalsContact O-N 3.14Å; M294-R297 WeakPolarHBondContact O-CA 3.48Å; M294-R297 WeakPolarHBondContact O-CB 3.45Å; M294-R297 PolarHBondContact O-N 2.78Å; R297-G299 VanDerWaalsContact C-N 3.35Å
298	D	48	Very low	45.1	Very low	125 Å²	125	124.4 Å²	124.4	67%	0.668	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	9.7	179.9	-61.1	-23.5	0	0	0	113.4	M294 A300	M294-D298 PolarHBondContact O-N 3.13Å; D298-A300 VanDerWaalsContact C-N 3.28Å; D298-A300 PolarHBondContact O-N 2.86Å
299	G	37.8	Very low	43.5	Very low	67 Å²	67	128.5 Å²	128.5	69%	0.691	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	70.8	10.5	166.6	0	0	0	0	0	116.6	L295 R297	L295-G299 PolarHBondContact O-N 3.29Å; R297-G299 VanDerWaalsContact C-N 3.35Å
300	A	39	Very low	42.4	Very low	63 Å²	63	134.2 Å²	134.2	52%	0.521	70%	0.7	S	S	.	*	P	Polyproline II helix	trans	-78.5	125.8	-174.9	0	0	0	0	0	112.9	D298 V302	D298-A300 VanDerWaalsContact C-N 3.28Å; D298-A300 PolarHBondContact O-N 2.86Å; A300-V302 PolarHBondContact O-N 2.8Å
301	K	39.9	Very low	40.8	Very low	204 Å²	204	136 Å²	136	89%	0.887	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-70.4	124.2	171.5	-74.2	-180	176.5	177.2	0	110.5
302	V	39.4	Very low	39.3	Very low	130 Å²	130	138 Å²	138	79%	0.788	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-80	127.1	171.2	-178.7	0	0	0	0	109.8	A300	A300-V302 PolarHBondContact O-N 2.8Å
303	I	36.6	Very low	38.2	Very low	148 Å²	148	140.7 Å²	140.7	76%	0.759	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-91.3	132	-178.1	-61.1	168.9	0	0	0	109.2
304	K	35	Very low	37	Very low	171 Å²	171	140.3 Å²	140.3	74%	0.743	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-90.4	141.4	168.7	-66.7	-167.1	179.1	-166.6	0	110	S328	K304-S328 PolarHBondContact NZ-OXT 3.21Å
305	S	35.4	Very low	35.9	Very low	106 Å²	106	143.8 Å²	143.8	74%	0.741	78%	0.778	S	S	*	*			trans	-152.7	153.6	170.3	48.9	0	0	0	0	113.5
306	S	37.7	Very low	34.8	Very low	123 Å²	123	143.1 Å²	143.1	86%	0.86	79%	0.787	S	S	*	*			trans	71.6	117.7	178.3	57.9	0	0	0	0	118.8
307	E	28.7	Very low	34	Very low	199 Å²	199	144.9 Å²	144.9	93%	0.93	80%	0.796	S	S	*	*			trans	-79	157.6	169.4	-68.5	148.5	111.8	0	0	112.2
308	A	29.9	Very low	33	Very low	97 Å²	97	139.3 Å²	139.3	80%	0.802	79%	0.786	S	S	*	*			trans	-144.9	138.8	159	0	0	0	0	0	109.7
309	E	26.3	Very low	32	Very low	198 Å²	198	139 Å²	139	93%	0.925	79%	0.792	S	S	*	*			trans	-61.8	140.7	-171.8	-96.6	170	120	0	0	114.6
310	L	31.1	Very low	31.6	Very low	174 Å²	174	142 Å²	142	91%	0.911	79%	0.791	S	S	*	*			trans	-111.7	110.1	172.8	-86.2	162.8	0	0	0	110.6
311	Q	27.8	Very low	31.2	Very low	170 Å²	170	146.2 Å²	146.2	79%	0.794	81%	0.805	S	S	*	*			trans	-85.6	145.8	165.5	-70.6	-167.6	-21.1	0	0	111
312	P	28.9	Very low	30.7	Very low	128 Å²	128	142.2 Å²	142.2	83%	0.831	80%	0.803	S	S	*	*			trans	-80.7	127.4	-177.6	32	-33.3	0	0	0	111.7
313	L	32.4	Very low	30.2	Very low	166 Å²	166	139.1 Å²	139.1	87%	0.869	80%	0.798	S	S	*	*			trans	-121.5	106.3	170.9	-101.4	136.7	0	0	0	109.9
314	D	28.8	Very low	29.8	Very low	144 Å²	144	137.1 Å²	137.1	77%	0.77	80%	0.803	S	S	*	*			trans	-64.6	151.8	161.8	-77.7	-48	0	0	0	110.5
315	N	28.2	Very low	29.5	Very low	164 Å²	164	135.9 Å²	135.9	88%	0.877	81%	0.81	S	S	*	*			trans	71.1	82.3	171.9	-51.2	-51.6	0	0	0	117.5
316	A	27.6	Very low	29.1	Very low	84 Å²	84	136.9 Å²	136.9	69%	0.694	82%	0.815	S	S	*	*			trans	-139.6	124.2	153.9	0	0	0	0	0	112.5	V318	A316-V318 HydrophobicContact CB-CG2 4.04Å; A316-V318 PolarHBondContact O-N 3.12Å
317	I	27.6	Very low	28.6	Very low	160 Å²	160	135.9 Å²	135.9	82%	0.821	81%	0.814	S	S	*	*			trans	-78.2	103.1	161.4	-66.6	173.6	0	0	0	106.7	C319	I317-C319 PolarHBondContact O-N 3.37Å; I317-C319 VanDerWaalsContact O-N 3.11Å
318	V	27.6	Very low	28.9	Very low	104 Å²	104	133.8 Å²	133.8	63%	0.63	82%	0.821	S	S	*	*			trans	-86	86	-174.8	-175.7	0	0	0	0	110.7	A316 I320	A316-V318 HydrophobicContact CB-CG2 4.04Å; A316-V318 PolarHBondContact O-N 3.12Å; V318-I320 HydrophobicContact CG1-CB 4.42Å; V318-I320 HydrophobicContact CG1-CD1 3.3Å; V318-I320 HydrophobicContact CG1-CG1 3.48Å; V318-I320 VanDerWaalsContact CG1-CG1 3.48Å
319	C	26	Very low	28.8	Very low	118 Å²	118	135.6 Å²	135.6	80%	0.797	82%	0.822	S	S	*	*			trans	-81.7	109.5	150.3	-73.8	0	0	0	0	107.7	I317	I317-C319 PolarHBondContact O-N 3.37Å; I317-C319 VanDerWaalsContact O-N 3.11Å
320	I	29.9	Very low	28.9	Very low	130 Å²	130	132.3 Å²	132.3	67%	0.667	82%	0.817	S	S	*	*			trans	-113	100.1	166.8	-67.9	165.4	0	0	0	108.3	V318	V318-I320 HydrophobicContact CG1-CB 4.42Å; V318-I320 HydrophobicContact CG1-CD1 3.3Å; V318-I320 HydrophobicContact CG1-CG1 3.48Å; V318-I320 VanDerWaalsContact CG1-CG1 3.48Å
321	D	30.6	Very low	28.8	Very low	153 Å²	153	130 Å²	130	82%	0.818	81%	0.812	S	S	*	*			trans	-74.9	136.1	141.3	-99.8	-50	0	0	0	108.3
322	S	30	Very low	28.9	Very low	120 Å²	120	127.6 Å²	127.6	84%	0.839	81%	0.813	S	S	*	*	S	Bend	trans	42.4	85.7	150.3	-52.9	0	0	0	0	118.7
323	G	28.5	Very low	28.9	Very low	65 Å²	65	127.6 Å²	127.6	67%	0.67	81%	0.811	S	S	*	*			trans	-169.8	130.7	165.7	0	0	0	0	0	112.1
324	A	27.2	Very low	28.6	Very low	105 Å²	105	125.1 Å²	125.1	87%	0.868	81%	0.808	S	S	*	*			trans	-89.7	122.4	-175.6	0	0	0	0	0	112.2
325	V	28.7	Very low	28.6	Very low	146 Å²	146	123.7 Å²	123.7	89%	0.885	81%	0.81	S	S	*	*			trans	-143	144.5	154.4	-175.8	0	0	0	0	108.9
326	C	27.9	Very low	28.7	Very low	127 Å²	127	120.6 Å²	120.6	86%	0.858	81%	0.805	S	S	*	*			trans	-70.1	159	-178.4	-56.5	0	0	0	0	113.4
327	A	27.7	Very low	28.8	Very low	102 Å²	102	123.7 Å²	123.7	84%	0.843	81%	0.814	S	S	*	*			trans	-130.3	144.7	162.3	0	0	0	0	0	109.3
328	S	33.3	Very low	28.9	Very low	154 Å²	154	120.4 Å²	120.4	100%	1.077	81%	0.814	S	S	*	*			trans	-61.3	0	-172.5	56.9	0	0	0	0	115.8	K304	K304-S328 PolarHBondContact NZ-OXT 3.21Å

Retrieved 328 of 328 residues in 93.9 ms (Link to these results)

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