G4VGK8_SCHMA Loading...

DDB1- and CUL4-associated factor 7

AlphaFold DB , UniProt , Accession G4VGK8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 365 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	41.3	Very low	42.6	Very low	249 Å²	249	148.5 Å²	148.5	100%	1.227	87%	0.868	S	S	*	*				0	99.8	0	-73.3	175.1	-178.9	0	0	105.5
2	S	40.2	Very low	42.1	Very low	108 Å²	108	145.6 Å²	145.6	76%	0.755	86%	0.857	S	S	*	*			trans	-141.9	114.8	-162.7	46.8	0	0	0	0	105.9
3	D	44.1	Very low	42.1	Very low	171 Å²	171	147.3 Å²	147.3	91%	0.914	86%	0.857	S	S	*	*			trans	-132.1	110.2	173.9	-80.2	-38.1	0	0	0	109
4	T	43	Very low	41.7	Very low	136 Å²	136	145 Å²	145	83%	0.834	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-88.7	139	161.7	16.8	0	0	0	0	108.3
5	P	48.3	Very low	41.5	Very low	134 Å²	134	142.9 Å²	142.9	87%	0.87	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-87.2	139.2	173.7	4.7	13.6	0	0	0	111.7
6	G	46.8	Very low	41.3	Very low	72 Å²	72	144.6 Å²	144.6	74%	0.742	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-76.1	160	-170.2	0	0	0	0	0	116.9
7	V	40.8	Very low	41.1	Very low	144 Å²	144	146.6 Å²	146.6	87%	0.873	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-74.4	135.3	169.3	175	0	0	0	0	109.8
8	I	47.1	Very low	40.6	Very low	157 Å²	157	144.6 Å²	144.6	81%	0.805	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-90.5	130.7	175.3	-58.1	174.1	0	0	0	109.6
9	P	39.9	Very low	40.4	Very low	112 Å²	112	143.3 Å²	143.3	73%	0.727	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-92	149.5	-179.1	34.7	-32.3	0	0	0	113.8
10	N	38.5	Very low	40.1	Very low	169 Å²	169	143.3 Å²	143.3	90%	0.904	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-64.7	134.2	172.5	-86.5	-21.2	0	0	0	112.6
11	M	38.8	Very low	39.9	Very low	182 Å²	182	141.9 Å²	141.9	90%	0.897	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-82.8	142.4	168.4	-71	-167.3	-156.7	0	0	111.9
12	P	36.6	Very low	39.9	Very low	113 Å²	113	134.7 Å²	134.7	73%	0.734	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-97.8	139.9	168.1	35.1	-26.7	0	0	0	111.7
13	I	41.7	Very low	39.5	Very low	168 Å²	168	139.6 Å²	139.6	86%	0.862	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-98.6	116.8	166.5	-63.9	176.2	0	0	0	108.3
14	V	36.8	Very low	39.4	Very low	115 Å²	115	136.4 Å²	136.4	70%	0.697	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-89.8	129.3	170.4	177	0	0	0	0	108.6
15	S	38.8	Very low	39.1	Very low	114 Å²	114	137.6 Å²	137.6	80%	0.797	82%	0.815	S	S	*	*			trans	-136.4	130.3	154.1	57.9	0	0	0	0	109.7
16	H	37.9	Very low	39.1	Very low	169 Å²	169	135.3 Å²	135.3	78%	0.782	81%	0.808	S	S	*	*			trans	-86.9	148.1	-178.1	-82.8	-82	0	0	0	111.8
17	Q	37.5	Very low	39.5	Very low	179 Å²	179	138.4 Å²	138.4	84%	0.836	81%	0.813	S	S	*	*			trans	134.4	102.6	130.7	-66.8	-164.8	-4.5	0	0	114.4
18	S	33.7	Very low	40.5	Very low	111 Å²	111	141.5 Å²	141.5	78%	0.776	82%	0.815	S	S	*	*			trans	23.9	113.9	144.1	58.1	0	0	0	0	120.5
19	S	36.8	Very low	41.7	Very low	120 Å²	120	139.6 Å²	139.6	84%	0.839	80%	0.797	S	S	*	*				-165.4	146.5	120.2	51.2	0	0	0	0	110.2
20	T	34	Very low	43.4	Very low	143 Å²	143	139.8 Å²	139.8	88%	0.877	79%	0.786	S	S	*	*			trans	-69.4	122	-173.2	42.6	0	0	0	0	113.3
21	S	36.5	Very low	45.9	Very low	114 Å²	114	138 Å²	138	80%	0.797	77%	0.773	S	S	*	*			trans	-163.4	125.6	153.3	61.6	0	0	0	0	112.9
22	A	39.8	Very low	48.6	Very low	98 Å²	98	132.8 Å²	132.8	81%	0.81	75%	0.748	S	S	*	*			trans	34.1	106.7	157.6	0	0	0	0	0	119.3	S24	A22-S24 PolarHBondContact O-N 3.06Å
23	K	33.4	Very low	51.5	Low	211 Å²	211	128 Å²	128	92%	0.917	72%	0.715	S	S	*	*			trans	-68.7	98.2	156.8	-74	-177.8	176.8	-179.8	0	108.9	N25	K23-N25 PolarHBondContact O-N 3.44Å
24	S	42	Very low	54.1	Low	103 Å²	103	125.3 Å²	125.3	72%	0.72	69%	0.694	S	S	*	*			trans	-72.2	116.1	161.3	57.5	0	0	0	0	108.5	A22 A26	A22-S24 PolarHBondContact O-N 3.06Å; S24-A26 PolarHBondContact O-N 2.9Å
25	N	36.5	Very low	57	Low	161 Å²	161	120.9 Å²	120.9	86%	0.861	67%	0.665	S	S	*	*			trans	-66.3	87.9	164.4	-89.2	-11.4	0	0	0	108.3	K23 T27	K23-N25 PolarHBondContact O-N 3.44Å; N25-T27 PolarHBondContact O-N 3.19Å
26	A	48.4	Very low	59.9	Low	87 Å²	87	120 Å²	120	72%	0.719	65%	0.651	S	S	*	*			trans	-75.7	99.2	166.4	0	0	0	0	0	107.8	S24 K28	S24-A26 PolarHBondContact O-N 2.9Å; A26-K28 PolarHBondContact O-N 3.27Å
27	T	54.1	Low	62.7	Low	136 Å²	136	112 Å²	112	83%	0.834	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-54.3	122	168.8	-3.9	0	0	0	0	108.2	N25 R29	N25-T27 PolarHBondContact O-N 3.19Å; T27-R29 PolarHBondContact O-N 3.39Å; T27-R29 VanDerWaalsContact O-N 3.07Å
28	K	63	Low	65.6	Low	210 Å²	210	108.1 Å²	108.1	91%	0.913	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-57.5	116.3	176.3	-75.8	-173	176.9	-172.5	0	108.7	A26	A26-K28 PolarHBondContact O-N 3.27Å
29	R	70.5	Confident	68.6	Low	116 Å²	116	104.3 Å²	104.3	44%	0.438	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-67.3	141.9	178.7	-163.9	173.6	-175	163.9	5.3	109.5	T27 Y33 D76	T27-R29 PolarHBondContact O-N 3.39Å; T27-R29 VanDerWaalsContact O-N 3.07Å; R29-Y33 WeakPolarHBondContact CG-OH 3.36Å; R29-D76 IonicContact CZ-OD1 3.8Å; R29-D76 IonicContact NH2-OD1 3.3Å; R29-D76 PolarHBondContact NH2-OD1 2.84Å; R29-D76 IonicContact NH2-OD2 3.53Å; R29-D76 PolarHBondContact NH2-OD2 3.06Å
30	K	76.8	Confident	71.5	Confident	116 Å²	116	101.6 Å²	101.6	50%	0.504	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-61.4	143.2	174.2	-65.7	-179.8	-177.2	171.4	0	109.3	Y33 E80	K30-Y33 HydrophobicContact CB-CD1 4.5Å; K30-Y33 HydrophobicContact CB-CE1 3.94Å; K30-Y33 HydrophobicContact CB-CE2 4.12Å; K30-Y33 HydrophobicContact CD-CD1 4.32Å; K30-Y33 HydrophobicContact CD-CE1 4.04Å; K30-Y33 HydrophobicContact CG-CE1 4.46Å; K30-Y33 WeakPolarHBondContact O-CE2 3.42Å; K30-E80 IonicContact NZ-OE1 2.88Å
31	E	90.1	Very high	74.5	Confident	132 Å²	132	95 Å²	95	62%	0.617	51%	0.513	S	S	*	.	S	Bend	trans	-96.2	-12	177	-67.8	174.2	168.2	0	0	112.2	R364	E31-R364 HydrophobicContact CB-CB 4.26Å; E31-R364 WeakPolarHBondContact O-CB 3.5Å; E31-R364 PolarHBondContact O-N 2.93Å
32	I	95.6	Very high	77.4	Confident	73 Å²	73	93.8 Å²	93.8	37%	0.374	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	129.6	179.5	-58.3	171.2	0	0	0	108.2	Y333 I362 L363	I32-Y333 HydrophobicContact CD1-CD2 4.49Å; I32-Y333 HydrophobicContact CD1-CE2 3.63Å; I32-I362 WeakPolarHBondContact CA-O 3.13Å; I32-L363 HydrophobicContact CB-CD2 4.35Å; I32-L363 HydrophobicContact CD1-CD2 4.26Å; I32-L363 HydrophobicContact CG1-CD2 3.85Å; I32-L363 HydrophobicContact CG2-CD2 3.82Å
33	Y	97.2	Very high	80.2	Confident	13 Å²	13	89.2 Å²	89.2	5%	0.051	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	140	171.9	-61.5	-91.8	0	0	0	109	R29 K30 L74 G79 W351 E361 I362	R29-Y33 WeakPolarHBondContact CG-OH 3.36Å; K30-Y33 HydrophobicContact CB-CD1 4.5Å; K30-Y33 HydrophobicContact CB-CE1 3.94Å; K30-Y33 HydrophobicContact CB-CE2 4.12Å; K30-Y33 HydrophobicContact CD-CD1 4.32Å; K30-Y33 HydrophobicContact CD-CE1 4.04Å; K30-Y33 HydrophobicContact CG-CE1 4.46Å; K30-Y33 WeakPolarHBondContact O-CE2 3.42Å; Y33-L74 HydrophobicContact CD1-CD1 3.59Å; Y33-L74 HydrophobicContact CD1-CD2 3.87Å; Y33-L74 HydrophobicContact CD1-CG 4.39Å; Y33-L74 HydrophobicContact CD2-CD2 3.68Å; Y33-L74 HydrophobicContact CE1-CD1 4.09Å; Y33-L74 HydrophobicContact CE1-CD2 3.97Å; Y33-L74 HydrophobicContact CE2-CD2 3.8Å; Y33-L74 HydrophobicContact CG-CD1 3.93Å; Y33-L74 HydrophobicContact CG-CD2 3.7Å; Y33-G79 WeakPolarHBondContact CD1-O 3.42Å; Y33-W351 AromaticContact CD2-CH2 3.81Å; Y33-W351 HydrophobicContact CD2-CH2 3.81Å; Y33-W351 AromaticContact CD2-CZ3 3.89Å; Y33-W351 HydrophobicContact CD2-CZ3 3.89Å; Y33-W351 AromaticContact CE2-CH2 3.63Å; Y33-W351 HydrophobicContact CE2-CH2 3.63Å; Y33-W351 HydrophobicContact CE2-CZ3 4.2Å; Y33-E361 CarbonylContact O-C 3.53Å; Y33-E361 WeakPolarHBondContact O-CA 3.14Å; Y33-I362 HydrophobicContact CD2-CD1 4.28Å; Y33-I362 HydrophobicContact CD2-CG1 4.25Å; Y33-I362 HydrophobicContact CG-CG1 4.48Å; Y33-I362 PolarHBondContact N-O 3.24Å; Y33-I362 PolarHBondContact O-N 3.15Å
34	R	97.4	Very high	83.3	Confident	111 Å²	111	79.2 Å²	79.2	42%	0.419	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	136.2	-176.4	-175.4	-178.4	-63.6	176.2	-0.9	110.7	Y356 L360 E361	R34-Y356 PolarHBondContact NE-OH 2.92Å; R34-Y356 PolarHBondContact NH2-OH 3.07Å; R34-Y356 VanDerWaalsContact NH2-OH 3.14Å; R34-L360 CarbonylContact C-O 3.58Å; R34-L360 WeakPolarHBondContact CA-O 3.47Å; R34-E361 HydrophobicContact CB-CG 4.16Å; R34-E361 HydrophobicContact CG-CG 3.97Å; R34-E361 IonicContact CZ-OE1 2.65Å; R34-E361 IonicContact NE-OE1 3.31Å; R34-E361 PolarHBondContact NE-OE1 2.99Å; R34-E361 IonicContact NH2-OE1 3.93Å; R34-E361 PolarHBondContact NH2-OE1 2.87Å
35	Y	98.2	Very high	86	Confident	22 Å²	22	75.1 Å²	75.1	9%	0.086	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.8	165.6	172.9	-110.2	0	0	0	109.3	A37 V58 Q70 I72 F81 V83 S359 L360	Y35-A37 HydrophobicContact CD1-CB 4.49Å; Y35-A37 HydrophobicContact CE1-CB 3.81Å; Y35-V58 HydrophobicContact CE1-CG2 4.34Å; Y35-Q70 PolarHBondContact OH-OE1 3.35Å; Y35-I72 HydrophobicContact CD1-CD1 3.48Å; Y35-I72 VanDerWaalsContact CD1-CD1 3.48Å; Y35-I72 HydrophobicContact CD2-CD1 4.35Å; Y35-I72 HydrophobicContact CE1-CD1 4.01Å; Y35-I72 HydrophobicContact CE1-CG2 4.16Å; Y35-I72 HydrophobicContact CE2-CG2 4.35Å; Y35-I72 HydrophobicContact CG-CD1 3.68Å; Y35-F81 HydrophobicContact CD2-CB 3.72Å; Y35-F81 HydrophobicContact CD2-CG 4.45Å; Y35-F81 HydrophobicContact CG-CB 4.16Å; Y35-F81 HydrophobicContact CG-CG 4.41Å; Y35-V83 HydrophobicContact CE2-CG2 3.99Å; Y35-S359 WeakPolarHBondContact O-CA 3.45Å; Y35-L360 HydrophobicContact CD1-CB 4.42Å; Y35-L360 PolarHBondContact N-O 2.94Å; Y35-L360 PolarHBondContact O-N 3.45Å
36	N	98.2	Very high	88.9	Confident	94 Å²	94	67.8 Å²	67.8	50%	0.503	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	109.5	173.6	-61	-67.9	0	0	0	108.8	N358 S359	N36-N358 CarbonylContact C-O 3.55Å; N36-S359 PolarHBondContact OD1-OG 2.81Å
37	A	98	Very high	91.3	Very high	2 Å²	2	63.8 Å²	63.8	2%	0.017	31%	0.309	C	S	.	.			trans	-71.3	153.8	172.3	0	0	0	0	0	110.6	Y35 W39 I41 N358	Y35-A37 HydrophobicContact CD1-CB 4.49Å; Y35-A37 HydrophobicContact CE1-CB 3.81Å; A37-W39 WeakPolarHBondContact CB-O 3.07Å; A37-W39 PolarHBondContact O-N 3.47Å; A37-I41 HydrophobicContact CB-CD1 3.91Å; A37-I41 HydrophobicContact CB-CG1 3.75Å; A37-N358 WeakPolarHBondContact CB-O 3.29Å; A37-N358 PolarHBondContact N-O 2.94Å; A37-N358 WeakPolarHBondContact O-CB 3.37Å; A37-N358 PolarHBondContact O-ND2 3.07Å; A37-N358 VanDerWaalsContact O-ND2 3.09Å
38	P	96.9	Very high	93.3	Very high	97 Å²	97	58.2 Å²	58.2	63%	0.63	28%	0.275	S	S	*	.	S	Bend	trans	-75.8	4.4	175	-7.5	23.3	0	0	0	114.2
39	W	97.3	Very high	94.7	Very high	32 Å²	32	50.2 Å²	50.2	12%	0.121	24%	0.239	C	C	.	.	S	Bend	trans	-150.7	165.3	-177.7	45.3	82.4	0	0	0	109.5	A37 I41 S60 I62 K68 Q70 N358	A37-W39 WeakPolarHBondContact CB-O 3.07Å; A37-W39 PolarHBondContact O-N 3.47Å; W39-I41 PolarHBondContact O-N 3.16Å; W39-S60 VanDerWaalsContact NE1-CB 3.3Å; W39-I62 HydrophobicContact CB-CD1 4.42Å; W39-I62 HydrophobicContact CB-CG1 4.21Å; W39-K68 HydrophobicContact CH2-CD 4.06Å; W39-K68 HydrophobicContact CZ2-CB 4.27Å; W39-K68 HydrophobicContact CZ2-CD 4.43Å; W39-K68 HydrophobicContact CZ3-CD 4.18Å; W39-Q70 HydrophobicContact CH2-CG 4.09Å; W39-Q70 VanDerWaalsContact CH2-NE2 3.32Å; W39-Q70 HydrophobicContact CZ2-CG 3.68Å; W39-N358 WeakPolarHBondContact O-CA 3.37Å; W39-N358 WeakPolarHBondContact O-CB 3.39Å
40	C	97.6	Very high	95.7	Very high	63 Å²	63	48.5 Å²	48.5	43%	0.426	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	136.2	173	-66.7	0	0	0	0	110.8	S60 F61 N357	C40-S60 CarbonylContact O-C 3.53Å; C40-S60 WeakPolarHBondContact O-CA 3.34Å; C40-F61 HydrophobicContact CB-CB 4.14Å; C40-F61 PolarHBondContact O-N 2.75Å; C40-N357 CarbonylContact C-O 3.55Å; C40-N357 VanDerWaalsContact CA-O 3.28Å; C40-N357 WeakPolarHBondContact CA-O 3.18Å
41	I	98.1	Very high	96.5	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.015	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	123.9	178.1	-59.7	178.3	0	0	0	108.1	A37 W39 V58 G59 C355 N357 L360	A37-I41 HydrophobicContact CB-CD1 3.91Å; A37-I41 HydrophobicContact CB-CG1 3.75Å; W39-I41 PolarHBondContact O-N 3.16Å; I41-V58 HydrophobicContact CD1-CG1 4.46Å; I41-V58 HydrophobicContact CG2-CB 4.21Å; I41-V58 HydrophobicContact CG2-CG1 4.48Å; I41-G59 WeakPolarHBondContact CA-O 3.33Å; I41-C355 HydrophobicContact CB-CB 4.26Å; I41-C355 HydrophobicContact CG2-CB 3.9Å; I41-N357 PolarHBondContact N-O 3.28Å; I41-L360 HydrophobicContact CD1-CB 3.85Å
42	F	96.8	Very high	96.7	Very high	90 Å²	90	44.4 Å²	44.4	40%	0.395	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	-38.4	179.5	-167.3	-129.3	0	0	0	113	G59 F61 P92 T93	F42-G59 PolarHBondContact N-O 3.33Å; F42-F61 HydrophobicContact CB-CB 3.98Å; F42-F61 HydrophobicContact CB-CD2 4.37Å; F42-F61 AromaticContact CD2-CD2 3.71Å; F42-F61 HydrophobicContact CD2-CD2 3.71Å; F42-F61 HydrophobicContact CD2-CE2 4.42Å; F42-F61 HydrophobicContact CE2-CD2 4.12Å; F42-F61 HydrophobicContact CE2-CE2 4.41Å; F42-F61 HydrophobicContact CG-CB 4.46Å; F42-F61 AromaticContact CG-CD2 3.94Å; F42-F61 HydrophobicContact CG-CD2 3.94Å; F42-P92 HydrophobicContact CB-CB 4.49Å; F42-P92 HydrophobicContact CD1-CB 3.57Å; F42-P92 HydrophobicContact CE1-CB 4.04Å; F42-P92 HydrophobicContact CG-CB 4.15Å; F42-T93 WeakPolarHBondContact CD1-O 3.46Å
43	S	97.8	Very high	96.6	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.014	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	154	-179.9	47.4	0	0	0	0	111.3	V58 G59 T93 Q341	S43-V58 CarbonylContact O-C 3.56Å; S43-V58 WeakPolarHBondContact O-CA 3.31Å; S43-G59 PolarHBondContact O-N 2.64Å; S43-T93 VanDerWaalsContact CB-O 3.32Å; S43-T93 WeakPolarHBondContact CB-O 3.31Å; S43-T93 WeakPolarHBondContact OG-CB 3.49Å; S43-T93 PolarHBondContact OG-O 2.6Å; S43-T93 PolarHBondContact OG-OG1 2.96Å; S43-Q341 VanDerWaalsContact CA-OE1 3.29Å
44	M	98.1	Very high	96.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	159	177.7	57.7	148.8	172.7	0	0	111.8	A57 V58 Q341 A353 C355 L360	M44-A57 CarbonylContact C-O 3.49Å; M44-A57 WeakPolarHBondContact CA-O 3.39Å; M44-V58 HydrophobicContact CB-CG1 4.04Å; M44-Q341 HydrophobicContact CE-CB 3.92Å; M44-Q341 HydrophobicContact CE-CG 4.31Å; M44-Q341 WeakPolarHBondContact CE-O 3.25Å; M44-Q341 PolarHBondContact O-NE2 2.68Å; M44-Q341 VanDerWaalsContact O-NE2 3.16Å; M44-Q341 PolarHBondContact O-OE1 3.27Å; M44-A353 HydrophobicContact CE-CB 4.16Å; M44-A353 WeakPolarHBondContact CE-O 3.2Å; M44-A353 HydrophobicContact SD-CB 3.68Å; M44-C355 HydrophobicContact CE-CB 4.11Å; M44-C355 HydrophobicContact CG-CB 4.49Å; M44-C355 HydrophobicContact SD-CB 4.37Å; M44-L360 HydrophobicContact CB-CD1 4.42Å; M44-L360 HydrophobicContact CE-CD1 4.46Å; M44-L360 HydrophobicContact CG-CD1 4.37Å; M44-L360 HydrophobicContact SD-CD1 3.23Å; M44-L360 WeakPolarHBondContact SD-CD1 3.49Å
45	N	98.5	Very high	96.6	Very high	18 Å²	18	40.2 Å²	40.2	10%	0.096	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	146.6	169.8	-153.3	-95.4	0	0	0	112.9	L56 A57 I96 W98	N45-L56 VanDerWaalsContact O-CA 3.3Å; N45-L56 WeakPolarHBondContact O-CA 3.18Å; N45-A57 PolarHBondContact N-O 2.93Å; N45-A57 PolarHBondContact O-N 3.1Å; N45-I96 HydrophobicContact CB-CG2 4.45Å; N45-I96 WeakPolarHBondContact CB-O 3.45Å; N45-W98 PolarHBondContact O-NE1 2.92Å
46	W	98.3	Very high	96.6	Very high	6 Å²	6	39.1 Å²	39.1	2%	0.023	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	138.4	173.7	-71.4	101.8	0	0	0	111.4	F54 L56 Q343 W351 A353 I362	W46-F54 HydrophobicContact CH2-CD1 4.15Å; W46-F54 AromaticContact CZ3-CD1 3.94Å; W46-F54 HydrophobicContact CZ3-CD1 3.94Å; W46-L56 HydrophobicContact CD2-CD2 3.63Å; W46-L56 HydrophobicContact CD2-CG 3.95Å; W46-L56 HydrophobicContact CE3-CD1 3.81Å; W46-L56 HydrophobicContact CE3-CD2 3.79Å; W46-L56 HydrophobicContact CE3-CG 3.59Å; W46-L56 HydrophobicContact CG-CD2 4.1Å; W46-L56 HydrophobicContact CH2-CD1 4.11Å; W46-L56 HydrophobicContact CH2-CD2 4.35Å; W46-L56 HydrophobicContact CZ2-CD2 4.21Å; W46-L56 HydrophobicContact CZ3-CD1 3.56Å; W46-L56 HydrophobicContact CZ3-CD2 4.12Å; W46-L56 HydrophobicContact CZ3-CG 3.89Å; W46-Q343 PolarHBondContact NE1-O 3.42Å; W46-Q343 VanDerWaalsContact NE1-O 3.14Å; W46-W351 HydrophobicContact CH2-CB 4.34Å; W46-W351 HydrophobicContact CZ2-CB 4.26Å; W46-A353 HydrophobicContact CZ2-CB 3.66Å; W46-A353 VanDerWaalsContact NE1-CB 3.31Å; W46-I362 HydrophobicContact CH2-CB 3.83Å; W46-I362 HydrophobicContact CH2-CD1 4.03Å; W46-I362 HydrophobicContact CH2-CG2 3.36Å; W46-I362 HydrophobicContact CZ2-CB 4.06Å; W46-I362 HydrophobicContact CZ2-CG2 3.56Å; W46-I362 HydrophobicContact CZ3-CG2 4.31Å
47	S	97.9	Very high	96.6	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.021	18%	0.179	C	C	.	.			trans	-69.6	137.8	164	-161.9	0	0	0	0	110.6	R55	S47-R55 WeakPolarHBondContact CB-O 3.26Å; S47-R55 PolarHBondContact N-O 2.74Å; S47-R55 PolarHBondContact OG-NE 2.75Å; S47-R55 VanDerWaalsContact OG-NE 3.16Å; S47-R55 PolarHBondContact OG-NH2 3.25Å
48	V	96.1	Very high	96.7	Very high	19 Å²	19	34.6 Å²	34.6	12%	0.115	18%	0.178	C	C	.	.			trans	-96.4	4	178.6	-55.2	0	0	0	0	113.4	P50 I99 T102 S346 T347	V48-P50 WeakPolarHBondContact O-CD 3.09Å; V48-I99 WeakPolarHBondContact CG2-O 3.3Å; V48-T102 HydrophobicContact CB-CG2 4.5Å; V48-S346 WeakPolarHBondContact CG1-OG 3.46Å; V48-T347 HydrophobicContact CB-CG2 4.34Å; V48-T347 WeakPolarHBondContact O-CG2 3.38Å
49	R	93.7	Very high	96.8	Very high	42 Å²	42	30 Å²	30	16%	0.158	15%	0.148	C	C	.	.			trans	-76.1	122.3	178.2	-83.9	-169.9	64.9	151.8	-0.4	111.1	D51 K52 D108	R49-D51 VanDerWaalsContact C-N 3.25Å; R49-D51 WeakPolarHBondContact CB-OD1 3.1Å; R49-D51 IonicContact CZ-OD1 2.96Å; R49-D51 IonicContact CZ-OD2 3.69Å; R49-D51 IonicContact NE-OD1 3.47Å; R49-D51 PolarHBondContact NE-OD1 2.89Å; R49-D51 IonicContact NE-OD2 3.53Å; R49-D51 VanDerWaalsContact NH2-CG 3.35Å; R49-D51 IonicContact NH2-OD1 2.68Å; R49-D51 PolarHBondContact NH2-OD1 3.04Å; R49-D51 IonicContact NH2-OD2 3.88Å; R49-D51 PolarHBondContact NH2-OD2 3.41Å; R49-D51 PolarHBondContact O-N 2.73Å; R49-K52 HydrophobicContact CB-CB 4.17Å; R49-K52 HydrophobicContact CB-CG 4.24Å; R49-K52 PolarHBondContact O-N 3.22Å; R49-K52 VanDerWaalsContact O-N 3.16Å; R49-D108 WeakPolarHBondContact CD-OD1 3.08Å; R49-D108 IonicContact NH1-OD2 3.99Å
50	P	91.9	Very high	96.8	Very high	80 Å²	80	28.5 Å²	28.5	52%	0.519	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-27.6	179.2	-24.7	34.5	0	0	0	114.6	V48 K52 T102	V48-P50 WeakPolarHBondContact O-CD 3.09Å; P50-K52 VanDerWaalsContact C-N 3.27Å; P50-K52 PolarHBondContact O-N 3.09Å; P50-T102 WeakPolarHBondContact CD-O 3.28Å; P50-T102 WeakPolarHBondContact CG-O 3.26Å
51	D	92.7	Very high	96.8	Very high	81 Å²	81	29.9 Å²	29.9	43%	0.433	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-5.7	179.1	67.6	-54.2	0	0	0	113.6	R49 C104	R49-D51 VanDerWaalsContact C-N 3.25Å; R49-D51 WeakPolarHBondContact CB-OD1 3.1Å; R49-D51 IonicContact CZ-OD1 2.96Å; R49-D51 IonicContact CZ-OD2 3.69Å; R49-D51 IonicContact NE-OD1 3.47Å; R49-D51 PolarHBondContact NE-OD1 2.89Å; R49-D51 IonicContact NE-OD2 3.53Å; R49-D51 VanDerWaalsContact NH2-CG 3.35Å; R49-D51 IonicContact NH2-OD1 2.68Å; R49-D51 PolarHBondContact NH2-OD1 3.04Å; R49-D51 IonicContact NH2-OD2 3.88Å; R49-D51 PolarHBondContact NH2-OD2 3.41Å; R49-D51 PolarHBondContact O-N 2.73Å; D51-C104 PolarHBondContact OD1-SG 2.87Å
52	K	94.2	Very high	96.7	Very high	82 Å²	82	31.2 Å²	31.2	36%	0.357	15%	0.148	S	C	.	.	S	Bend	trans	-123.4	63.1	-177.4	-58.3	-66.2	-178.8	-177.7	0	110.4	R49 P50 R55	R49-K52 HydrophobicContact CB-CB 4.17Å; R49-K52 HydrophobicContact CB-CG 4.24Å; R49-K52 PolarHBondContact O-N 3.22Å; R49-K52 VanDerWaalsContact O-N 3.16Å; P50-K52 VanDerWaalsContact C-N 3.27Å; P50-K52 PolarHBondContact O-N 3.09Å; K52-R55 HydrophobicContact CB-CB 4.17Å; K52-R55 VanDerWaalsContact O-CB 3.31Å; K52-R55 WeakPolarHBondContact O-CB 3.41Å; K52-R55 PolarHBondContact O-N 3.31Å
53	R	94.2	Very high	96.5	Very high	104 Å²	104	35.4 Å²	35.4	39%	0.392	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	139.3	-178.2	-165.2	175.4	-171.1	-106.6	-20.1	111.5	R55 D76 Q348	R53-R55 PolarHBondContact O-N 2.94Å; R53-D76 IonicContact CZ-OD2 3.93Å; R53-D76 IonicContact NH1-OD1 2.6Å; R53-D76 IonicContact NH1-OD2 3.75Å; R53-D76 PolarHBondContact NH1-OD2 3.39Å; R53-Q348 VanDerWaalsContact CG-OE1 3.25Å
54	F	96.3	Very high	96.1	Very high	2 Å²	2	41 Å²	41	1%	0.009	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	24	179.8	-63.6	-56.8	0	0	0	116.3	W46 L56 Y73 L74 D76 Q348 W351 I362	W46-F54 HydrophobicContact CH2-CD1 4.15Å; W46-F54 AromaticContact CZ3-CD1 3.94Å; W46-F54 HydrophobicContact CZ3-CD1 3.94Å; F54-L56 WeakPolarHBondContact O-CD1 3.45Å; F54-Y73 WeakPolarHBondContact O-CA 3.41Å; F54-L74 HydrophobicContact CB-CB 3.65Å; F54-L74 HydrophobicContact CD2-CB 4.12Å; F54-L74 HydrophobicContact CD2-CD2 3.95Å; F54-L74 HydrophobicContact CD2-CG 4.44Å; F54-L74 HydrophobicContact CE2-CD2 4.03Å; F54-L74 HydrophobicContact CG-CB 4.08Å; F54-L74 HydrophobicContact CG-CD2 4.33Å; F54-L74 PolarHBondContact O-N 3.06Å; F54-D76 VanDerWaalsContact CD2-OD1 3.29Å; F54-D76 WeakPolarHBondContact CD2-OD1 3.47Å; F54-D76 WeakPolarHBondContact CE2-OD1 3.43Å; F54-Q348 VanDerWaalsContact N-NE2 3.17Å; F54-W351 AromaticContact CE1-CD1 3.87Å; F54-W351 AromaticContact CE1-CD2 3.69Å; F54-W351 HydrophobicContact CE1-CD2 3.69Å; F54-W351 AromaticContact CE1-CE2 3.67Å; F54-W351 HydrophobicContact CE1-CE3 4.32Å; F54-W351 AromaticContact CE1-CG 3.82Å; F54-W351 HydrophobicContact CE1-CG 3.82Å; F54-W351 HydrophobicContact CE1-CZ2 4.29Å; F54-W351 AromaticContact CE1-NE1 3.76Å; F54-W351 HydrophobicContact CZ-CD2 4.14Å; F54-W351 AromaticContact CZ-CE2 3.63Å; F54-W351 AromaticContact CZ-CZ2 3.9Å; F54-W351 HydrophobicContact CZ-CZ2 3.9Å; F54-W351 AromaticContact CZ-NE1 3.73Å; F54-I362 HydrophobicContact CD1-CD1 3.87Å; F54-I362 HydrophobicContact CE1-CD1 4.09Å
55	R	98	Very high	95.7	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.008	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	133.6	175	-175	173.1	66.9	168.1	6.8	110.8	S47 K52 R53 I71 I72 W98 D108	S47-R55 WeakPolarHBondContact CB-O 3.26Å; S47-R55 PolarHBondContact N-O 2.74Å; S47-R55 PolarHBondContact OG-NE 2.75Å; S47-R55 VanDerWaalsContact OG-NE 3.16Å; S47-R55 PolarHBondContact OG-NH2 3.25Å; K52-R55 HydrophobicContact CB-CB 4.17Å; K52-R55 VanDerWaalsContact O-CB 3.31Å; K52-R55 WeakPolarHBondContact O-CB 3.41Å; K52-R55 PolarHBondContact O-N 3.31Å; R53-R55 PolarHBondContact O-N 2.94Å; R55-I71 HydrophobicContact CG-CG2 3.93Å; R55-I72 CarbonylContact C-O 3.58Å; R55-I72 WeakPolarHBondContact CA-O 3.25Å; R55-W98 HydrophobicContact CG-CH2 4.2Å; R55-W98 HydrophobicContact CG-CZ2 4.07Å; R55-W98 VanDerWaalsContact CZ-CZ3 3.45Å; R55-D108 IonicContact CZ-OD1 2.74Å; R55-D108 IonicContact CZ-OD2 3.97Å; R55-D108 VanDerWaalsContact CZ-OD2 3.3Å; R55-D108 IonicContact NH1-OD1 3.96Å; R55-D108 IonicContact NH1-OD2 3.63Å; R55-D108 PolarHBondContact NH1-OD2 3.25Å; R55-D108 VanDerWaalsContact NH2-CG 3.33Å; R55-D108 IonicContact NH2-OD1 3.25Å; R55-D108 PolarHBondContact NH2-OD1 2.85Å; R55-D108 IonicContact NH2-OD2 3.65Å; R55-D108 PolarHBondContact NH2-OD2 3.22Å; R55-D108 VanDerWaalsContact NH2-OD2 3.1Å
56	L	98.6	Very high	95.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	156.7	172.3	-60.1	102.2	0	0	0	110.4	N45 W46 F54 I71 I72 F81 A353 L360 I362	N45-L56 VanDerWaalsContact O-CA 3.3Å; N45-L56 WeakPolarHBondContact O-CA 3.18Å; W46-L56 HydrophobicContact CD2-CD2 3.63Å; W46-L56 HydrophobicContact CD2-CG 3.95Å; W46-L56 HydrophobicContact CE3-CD1 3.81Å; W46-L56 HydrophobicContact CE3-CD2 3.79Å; W46-L56 HydrophobicContact CE3-CG 3.59Å; W46-L56 HydrophobicContact CG-CD2 4.1Å; W46-L56 HydrophobicContact CH2-CD1 4.11Å; W46-L56 HydrophobicContact CH2-CD2 4.35Å; W46-L56 HydrophobicContact CZ2-CD2 4.21Å; W46-L56 HydrophobicContact CZ3-CD1 3.56Å; W46-L56 HydrophobicContact CZ3-CD2 4.12Å; W46-L56 HydrophobicContact CZ3-CG 3.89Å; F54-L56 WeakPolarHBondContact O-CD1 3.45Å; L56-I71 WeakPolarHBondContact O-CA 3.34Å; L56-I72 HydrophobicContact CB-CG1 4.21Å; L56-I72 PolarHBondContact N-O 3.5Å; L56-I72 PolarHBondContact O-N 2.81Å; L56-I72 VanDerWaalsContact O-O 3.13Å; L56-F81 HydrophobicContact CD1-CE1 3.91Å; L56-F81 HydrophobicContact CD1-CZ 4.42Å; L56-A353 HydrophobicContact CD2-CB 3.86Å; L56-L360 HydrophobicContact CD1-CD2 4.17Å; L56-L360 HydrophobicContact CD2-CD1 4.37Å; L56-L360 HydrophobicContact CD2-CD2 4.18Å; L56-I362 HydrophobicContact CD1-CG2 4.25Å
57	A	98.7	Very high	95.6	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	141.2	161.4	0	0	0	0	0	108.7	M44 N45 V69 Q70 I96 W98 L110	M44-A57 CarbonylContact C-O 3.49Å; M44-A57 WeakPolarHBondContact CA-O 3.39Å; N45-A57 PolarHBondContact N-O 2.93Å; N45-A57 PolarHBondContact O-N 3.1Å; A57-V69 HydrophobicContact CB-CG1 4.5Å; A57-Q70 CarbonylContact C-O 3.52Å; A57-Q70 VanDerWaalsContact CA-O 3.28Å; A57-Q70 WeakPolarHBondContact CA-O 3.35Å; A57-I96 HydrophobicContact CB-CG2 3.77Å; A57-W98 HydrophobicContact CB-CZ2 3.83Å; A57-L110 HydrophobicContact CB-CD1 3.81Å; A57-L110 HydrophobicContact CB-CD2 4.08Å
58	V	98.7	Very high	95.6	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	136.6	176.2	-61.3	0	0	0	0	110.1	Y35 I41 S43 M44 V69 Q70 I72 L360	Y35-V58 HydrophobicContact CE1-CG2 4.34Å; I41-V58 HydrophobicContact CD1-CG1 4.46Å; I41-V58 HydrophobicContact CG2-CB 4.21Å; I41-V58 HydrophobicContact CG2-CG1 4.48Å; S43-V58 CarbonylContact O-C 3.56Å; S43-V58 WeakPolarHBondContact O-CA 3.31Å; M44-V58 HydrophobicContact CB-CG1 4.04Å; V58-V69 CarbonylContact O-C 3.47Å; V58-V69 WeakPolarHBondContact O-CA 3.49Å; V58-Q70 HydrophobicContact CG2-CB 3.82Å; V58-Q70 PolarHBondContact N-O 2.94Å; V58-Q70 PolarHBondContact O-N 3.49Å; V58-I72 HydrophobicContact CG1-CD1 4.29Å; V58-L360 HydrophobicContact CG1-CD1 4.49Å; V58-L360 HydrophobicContact CG1-CD2 4.19Å
59	G	98.5	Very high	95.7	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	141.4	178.9	0	0	0	0	0	111.6	I41 F42 S43 T93	I41-G59 WeakPolarHBondContact CA-O 3.33Å; F42-G59 PolarHBondContact N-O 3.33Å; S43-G59 PolarHBondContact O-N 2.64Å; G59-T93 WeakPolarHBondContact CA-OG1 3.37Å
60	S	98.3	Very high	95.9	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.007	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	154.5	178.7	70.8	0	0	0	0	113.4	W39 C40 N67 K68 P92	W39-S60 VanDerWaalsContact NE1-CB 3.3Å; C40-S60 CarbonylContact O-C 3.53Å; C40-S60 WeakPolarHBondContact O-CA 3.34Å; S60-N67 PolarHBondContact O-OD1 3.35Å; S60-N67 VanDerWaalsContact O-OD1 3.06Å; S60-N67 VanDerWaalsContact OG-CA 3.24Å; S60-N67 WeakPolarHBondContact OG-CA 3.39Å; S60-N67 VanDerWaalsContact OG-CB 3.31Å; S60-N67 WeakPolarHBondContact OG-CB 3.5Å; S60-N67 PolarHBondContact OG-OD1 3.12Å; S60-K68 PolarHBondContact N-O 3.4Å; S60-K68 PolarHBondContact OG-N 3.34Å; S60-K68 PolarHBondContact OG-O 2.89Å; S60-P92 WeakPolarHBondContact O-CA 3.4Å; S60-P92 WeakPolarHBondContact O-CB 3.49Å
61	F	97	Very high	96.2	Very high	93 Å²	93	47.8 Å²	47.8	41%	0.408	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	102.3	152.8	-165.3	-91.7	0	0	0	108.5	C40 F42 E63 P92	C40-F61 HydrophobicContact CB-CB 4.14Å; C40-F61 PolarHBondContact O-N 2.75Å; F42-F61 HydrophobicContact CB-CB 3.98Å; F42-F61 HydrophobicContact CB-CD2 4.37Å; F42-F61 AromaticContact CD2-CD2 3.71Å; F42-F61 HydrophobicContact CD2-CD2 3.71Å; F42-F61 HydrophobicContact CD2-CE2 4.42Å; F42-F61 HydrophobicContact CE2-CD2 4.12Å; F42-F61 HydrophobicContact CE2-CE2 4.41Å; F42-F61 HydrophobicContact CG-CB 4.46Å; F42-F61 AromaticContact CG-CD2 3.94Å; F42-F61 HydrophobicContact CG-CD2 3.94Å; F61-E63 HydrophobicContact CE1-CG 4.28Å; F61-P92 HydrophobicContact CD2-CB 3.92Å; F61-P92 HydrophobicContact CD2-CG 3.77Å; F61-P92 HydrophobicContact CE2-CB 4.47Å; F61-P92 HydrophobicContact CE2-CG 4.06Å; F61-P92 HydrophobicContact CG-CG 4.4Å
62	I	96.9	Very high	96.5	Very high	31 Å²	31	43.9 Å²	43.9	16%	0.159	20%	0.196	C	C	.	.			trans	-124	130.2	171.4	-55.5	172.2	0	0	0	106.4	W39 E64 N66 N67	W39-I62 HydrophobicContact CB-CD1 4.42Å; W39-I62 HydrophobicContact CB-CG1 4.21Å; I62-E64 VanDerWaalsContact C-N 3.26Å; I62-E64 WeakPolarHBondContact CG2-OE2 3.45Å; I62-E64 PolarHBondContact O-N 2.82Å; I62-N66 WeakPolarHBondContact CG2-OD1 3.41Å; I62-N67 PolarHBondContact N-OD1 3.39Å; I62-N67 PolarHBondContact O-ND2 2.87Å; I62-N67 PolarHBondContact O-OD1 3.07Å
63	E	92.1	Very high	96.7	Very high	177 Å²	177	43.8 Å²	43.8	83%	0.827	19%	0.194	S	C	*	.	S	Bend	trans	-65.4	-32.5	-175.4	-66	-177	177.7	0	0	111.6	F61	F61-E63 HydrophobicContact CE1-CG 4.28Å
64	E	90.6	Very high	96.8	Very high	121 Å²	121	39.1 Å²	39.1	57%	0.565	18%	0.176	S	C	*	.	S	Bend	trans	-79.2	165.8	176.3	-55.5	90	171.3	0	0	113.9	I62 N66 N67	I62-E64 VanDerWaalsContact C-N 3.26Å; I62-E64 WeakPolarHBondContact CG2-OE2 3.45Å; I62-E64 PolarHBondContact O-N 2.82Å; E64-N66 PolarHBondContact O-N 3.25Å; E64-N66 PolarHBondContact O-OD1 2.93Å; E64-N67 PolarHBondContact O-ND2 3.01Å; E64-N67 VanDerWaalsContact O-ND2 3.14Å
65	Y	89.7	Confident	96.8	Very high	128 Å²	128	40.5 Å²	40.5	50%	0.502	18%	0.184	S	C	.	.	S	Bend	trans	-75	56.5	178.4	-165.3	-96.8	0	0	0	112.4	H90 Y91	Y65-H90 WeakPolarHBondContact CA-O 3.46Å; Y65-H90 HydrophobicContact CD2-CB 4.17Å; Y65-H90 HydrophobicContact CE1-CB 4.04Å; Y65-H90 AromaticContact CE1-CD2 3.33Å; Y65-H90 WeakPolarHBondContact CE1-CD2 3.36Å; Y65-H90 AromaticContact CE1-CG 3.75Å; Y65-H90 AromaticContact CE1-NE2 3.97Å; Y65-H90 HydrophobicContact CE2-CB 3.5Å; Y65-H90 VanDerWaalsContact CE2-CB 3.5Å; Y65-H90 AromaticContact CE2-CG 3.97Å; Y65-H90 VanDerWaalsContact CZ-CB 3.4Å; Y65-H90 AromaticContact CZ-CD2 3.42Å; Y65-H90 VanDerWaalsContact CZ-CD2 3.42Å; Y65-H90 AromaticContact CZ-CG 3.31Å; Y65-H90 AromaticContact CZ-ND1 3.88Å; Y65-H90 WeakPolarHBondContact OH-CB 3.45Å; Y65-H90 PolarHBondContact OH-CD2 3.21Å; Y65-H90 VanDerWaalsContact OH-CD2 3.27Å; Y65-H90 PolarHBondContact OH-CE1 3.36Å; Y65-H90 PolarHBondContact OH-ND1 2.99Å; Y65-Y91 HydrophobicContact CD2-CD1 4.46Å; Y65-Y91 AromaticContact CD2-CE1 3.91Å; Y65-Y91 HydrophobicContact CD2-CE1 3.91Å; Y65-Y91 HydrophobicContact CD2-CE2 4.02Å; Y65-Y91 AromaticContact CD2-CZ 3.66Å; Y65-Y91 HydrophobicContact CE2-CD2 4.16Å; Y65-Y91 HydrophobicContact CE2-CE1 4.22Å; Y65-Y91 AromaticContact CE2-CE2 3.48Å; Y65-Y91 HydrophobicContact CE2-CE2 3.48Å; Y65-Y91 VanDerWaalsContact CE2-CE2 3.48Å; Y65-Y91 AromaticContact CE2-CZ 3.51Å
66	N	94.9	Very high	96.3	Very high	82 Å²	82	43.1 Å²	43.1	44%	0.439	20%	0.198	S	C	.	.			trans	-153.2	32.4	-175.4	64.1	-4.7	0	0	0	112.1	I62 E64	I62-N66 WeakPolarHBondContact CG2-OD1 3.41Å; E64-N66 PolarHBondContact O-N 3.25Å; E64-N66 PolarHBondContact O-OD1 2.93Å
67	N	97.9	Very high	95.9	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.011	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	163.3	176	-78.6	-86.9	0	0	0	111.9	S60 I62 E64 H89 Y91 P92	S60-N67 PolarHBondContact O-OD1 3.35Å; S60-N67 VanDerWaalsContact O-OD1 3.06Å; S60-N67 VanDerWaalsContact OG-CA 3.24Å; S60-N67 WeakPolarHBondContact OG-CA 3.39Å; S60-N67 VanDerWaalsContact OG-CB 3.31Å; S60-N67 WeakPolarHBondContact OG-CB 3.5Å; S60-N67 PolarHBondContact OG-OD1 3.12Å; I62-N67 PolarHBondContact N-OD1 3.39Å; I62-N67 PolarHBondContact O-ND2 2.87Å; I62-N67 PolarHBondContact O-OD1 3.07Å; E64-N67 PolarHBondContact O-ND2 3.01Å; E64-N67 VanDerWaalsContact O-ND2 3.14Å; N67-H89 CarbonylContact C-O 3.55Å; N67-H89 VanDerWaalsContact CA-O 3.23Å; N67-H89 WeakPolarHBondContact CA-O 3.29Å; N67-H89 HydrophobicContact CB-CB 4.41Å; N67-H89 VanDerWaalsContact CB-O 3.25Å; N67-H89 WeakPolarHBondContact CB-O 3.44Å; N67-H89 PolarHBondContact N-O 3.33Å; N67-H89 PolarHBondContact O-N 3.2Å; N67-Y91 WeakPolarHBondContact CB-O 3.23Å; N67-Y91 VanDerWaalsContact CG-C 3.45Å; N67-P92 VanDerWaalsContact ND2-CD 3.33Å; N67-P92 WeakPolarHBondContact ND2-CD 3.44Å
68	K	98	Very high	95.6	Very high	84 Å²	84	58.5 Å²	58.5	37%	0.365	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	149.5	-173.8	-60.9	-179.3	-175.4	175.6	0	110.4	W39 S60 T86 F87	W39-K68 HydrophobicContact CH2-CD 4.06Å; W39-K68 HydrophobicContact CZ2-CB 4.27Å; W39-K68 HydrophobicContact CZ2-CD 4.43Å; W39-K68 HydrophobicContact CZ3-CD 4.18Å; S60-K68 PolarHBondContact N-O 3.4Å; S60-K68 PolarHBondContact OG-N 3.34Å; S60-K68 PolarHBondContact OG-O 2.89Å; K68-T86 HydrophobicContact CB-CG2 4.28Å; K68-T86 HydrophobicContact CD-CG2 4.06Å; K68-F87 WeakPolarHBondContact CA-O 3.06Å
69	V	98.5	Very high	95.4	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	135.9	163.9	178	0	0	0	0	107.9	A57 V58 T86 F87 H89 T93 I96 L110 T112	A57-V69 HydrophobicContact CB-CG1 4.5Å; V58-V69 CarbonylContact O-C 3.47Å; V58-V69 WeakPolarHBondContact O-CA 3.49Å; V69-T86 WeakPolarHBondContact O-CA 3.49Å; V69-F87 HydrophobicContact CB-CD1 4.27Å; V69-F87 HydrophobicContact CB-CD2 4.21Å; V69-F87 HydrophobicContact CB-CE1 3.66Å; V69-F87 HydrophobicContact CB-CE2 3.6Å; V69-F87 HydrophobicContact CB-CZ 3.32Å; V69-F87 HydrophobicContact CG1-CE1 3.56Å; V69-F87 HydrophobicContact CG1-CE2 4.12Å; V69-F87 HydrophobicContact CG1-CZ 3.33Å; V69-F87 HydrophobicContact CG2-CE2 4Å; V69-F87 HydrophobicContact CG2-CZ 4.04Å; V69-F87 PolarHBondContact N-O 3.48Å; V69-F87 PolarHBondContact O-N 2.95Å; V69-H89 HydrophobicContact CG2-CB 4.25Å; V69-T93 HydrophobicContact CG2-CG2 3.78Å; V69-I96 HydrophobicContact CG1-CD1 4.08Å; V69-I96 HydrophobicContact CG2-CD1 4.23Å; V69-L110 HydrophobicContact CG1-CD2 4.18Å; V69-T112 HydrophobicContact CG2-CG2 4.39Å
70	Q	98.4	Very high	95.2	Very high	13 Å²	13	64 Å²	64	6%	0.061	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137.5	176	-80.4	-171.2	-41	0	0	110.9	Y35 W39 A57 V58 I72 S85 T86	Y35-Q70 PolarHBondContact OH-OE1 3.35Å; W39-Q70 HydrophobicContact CH2-CG 4.09Å; W39-Q70 VanDerWaalsContact CH2-NE2 3.32Å; W39-Q70 HydrophobicContact CZ2-CG 3.68Å; A57-Q70 CarbonylContact C-O 3.52Å; A57-Q70 VanDerWaalsContact CA-O 3.28Å; A57-Q70 WeakPolarHBondContact CA-O 3.35Å; V58-Q70 HydrophobicContact CG2-CB 3.82Å; V58-Q70 PolarHBondContact N-O 2.94Å; V58-Q70 PolarHBondContact O-N 3.49Å; Q70-I72 HydrophobicContact CB-CG2 4.33Å; Q70-S85 WeakPolarHBondContact CA-O 3.27Å; Q70-T86 HydrophobicContact CG-CG2 3.7Å; Q70-T86 VanDerWaalsContact CG-OG1 3.3Å; Q70-T86 WeakPolarHBondContact CG-OG1 3.35Å; Q70-T86 PolarHBondContact NE2-OG1 3.16Å
71	I	98.6	Very high	95.2	Very high	0 Å²	0	65 Å²	65	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.5	169.2	-57.4	177.5	0	0	0	106.7	R55 L56 Q84 S85 F87 W98 I122 V128	R55-I71 HydrophobicContact CG-CG2 3.93Å; L56-I71 WeakPolarHBondContact O-CA 3.34Å; I71-Q84 HydrophobicContact CB-CB 4.42Å; I71-Q84 HydrophobicContact CG2-CB 4.19Å; I71-Q84 WeakPolarHBondContact O-CB 3.48Å; I71-Q84 PolarHBondContact O-N 2.93Å; I71-S85 WeakPolarHBondContact CD1-OG 3.24Å; I71-S85 PolarHBondContact N-O 2.7Å; I71-S85 PolarHBondContact O-N 3.34Å; I71-F87 HydrophobicContact CD1-CE1 4.45Å; I71-F87 HydrophobicContact CG1-CE1 4.43Å; I71-W98 HydrophobicContact CD1-CH2 3.93Å; I71-W98 HydrophobicContact CG1-CH2 4.23Å; I71-W98 HydrophobicContact CG1-CZ2 4.49Å; I71-W98 HydrophobicContact CG2-CH2 3.86Å; I71-W98 HydrophobicContact CG2-CZ2 4.14Å; I71-I122 HydrophobicContact CD1-CD1 4.03Å; I71-I122 HydrophobicContact CD1-CG1 3.39Å; I71-V128 HydrophobicContact CD1-CG2 3.92Å
72	I	98.4	Very high	95.2	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	157.1	-178.2	67.6	176.7	0	0	0	109.9	Y35 R55 L56 V58 Q70 F81 V82 V83 L360	Y35-I72 HydrophobicContact CD1-CD1 3.48Å; Y35-I72 VanDerWaalsContact CD1-CD1 3.48Å; Y35-I72 HydrophobicContact CD2-CD1 4.35Å; Y35-I72 HydrophobicContact CE1-CD1 4.01Å; Y35-I72 HydrophobicContact CE1-CG2 4.16Å; Y35-I72 HydrophobicContact CE2-CG2 4.35Å; Y35-I72 HydrophobicContact CG-CD1 3.68Å; R55-I72 CarbonylContact C-O 3.58Å; R55-I72 WeakPolarHBondContact CA-O 3.25Å; L56-I72 HydrophobicContact CB-CG1 4.21Å; L56-I72 PolarHBondContact N-O 3.5Å; L56-I72 PolarHBondContact O-N 2.81Å; L56-I72 VanDerWaalsContact O-O 3.13Å; V58-I72 HydrophobicContact CG1-CD1 4.29Å; Q70-I72 HydrophobicContact CB-CG2 4.33Å; I72-F81 HydrophobicContact CB-CD1 4.47Å; I72-F81 HydrophobicContact CD1-CD1 3.91Å; I72-F81 HydrophobicContact CD1-CE1 4.23Å; I72-F81 HydrophobicContact CG1-CD1 4.16Å; I72-V82 CarbonylContact C-O 3.56Å; I72-V82 VanDerWaalsContact CA-O 3.24Å; I72-V82 WeakPolarHBondContact CA-O 3.09Å; I72-V83 HydrophobicContact CG2-CG2 4.1Å; I72-L360 HydrophobicContact CD1-CD2 3.56Å
73	Y	97.8	Very high	95.3	Very high	80 Å²	80	64.1 Å²	64.1	31%	0.314	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	152.3	170.2	64.9	-85.6	0	0	0	110.7	F54 D75 F81 V82 Q84	F54-Y73 WeakPolarHBondContact O-CA 3.41Å; Y73-D75 HydrophobicContact CE2-CB 4.42Å; Y73-D75 PolarHBondContact O-N 2.87Å; Y73-F81 CarbonylContact O-C 3.56Å; Y73-F81 WeakPolarHBondContact O-CA 3.24Å; Y73-V82 HydrophobicContact CD1-CB 4.37Å; Y73-V82 HydrophobicContact CE1-CB 3.81Å; Y73-V82 HydrophobicContact CE1-CG1 3.87Å; Y73-V82 HydrophobicContact CE2-CB 4.01Å; Y73-V82 HydrophobicContact CE2-CG2 4.24Å; Y73-V82 PolarHBondContact N-O 2.99Å; Y73-V82 PolarHBondContact O-N 3.48Å; Y73-Q84 HydrophobicContact CD1-CB 4.12Å; Y73-Q84 HydrophobicContact CE1-CB 4.16Å
74	L	97.6	Very high	95.5	Very high	6 Å²	6	57.8 Å²	57.8	3%	0.031	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	118.5	170.6	-179.7	66.2	0	0	0	109.2	Y33 F54 D76 F81 I362	Y33-L74 HydrophobicContact CD1-CD1 3.59Å; Y33-L74 HydrophobicContact CD1-CD2 3.87Å; Y33-L74 HydrophobicContact CD1-CG 4.39Å; Y33-L74 HydrophobicContact CD2-CD2 3.68Å; Y33-L74 HydrophobicContact CE1-CD1 4.09Å; Y33-L74 HydrophobicContact CE1-CD2 3.97Å; Y33-L74 HydrophobicContact CE2-CD2 3.8Å; Y33-L74 HydrophobicContact CG-CD1 3.93Å; Y33-L74 HydrophobicContact CG-CD2 3.7Å; F54-L74 HydrophobicContact CB-CB 3.65Å; F54-L74 HydrophobicContact CD2-CB 4.12Å; F54-L74 HydrophobicContact CD2-CD2 3.95Å; F54-L74 HydrophobicContact CD2-CG 4.44Å; F54-L74 HydrophobicContact CE2-CD2 4.03Å; F54-L74 HydrophobicContact CG-CB 4.08Å; F54-L74 HydrophobicContact CG-CD2 4.33Å; F54-L74 PolarHBondContact O-N 3.06Å; L74-D76 PolarHBondContact O-N 2.8Å; L74-F81 HydrophobicContact CB-CD1 4.23Å; L74-F81 HydrophobicContact CB-CE1 3.99Å; L74-F81 HydrophobicContact CB-CZ 4.3Å; L74-F81 HydrophobicContact CD1-CD2 4.28Å; L74-F81 HydrophobicContact CD1-CE2 4.39Å; L74-I362 HydrophobicContact CD2-CD1 3.99Å
75	D	95.5	Very high	95.9	Very high	31 Å²	31	52.8 Å²	52.8	17%	0.166	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	107.9	162.3	-178.2	-29.5	0	0	0	107.3	Y73 E77 Q78 G79 E80 V82	Y73-D75 HydrophobicContact CE2-CB 4.42Å; Y73-D75 PolarHBondContact O-N 2.87Å; D75-E77 VanDerWaalsContact C-N 3.27Å; D75-E77 PolarHBondContact O-N 2.69Å; D75-E77 WeakPolarHBondContact OD1-CB 3.25Å; D75-E77 PolarHBondContact OD1-N 3.45Å; D75-Q78 HydrophobicContact CB-CB 4.17Å; D75-Q78 HydrophobicContact CB-CG 4.47Å; D75-Q78 PolarHBondContact O-N 2.8Å; D75-Q78 PolarHBondContact OD1-N 2.87Å; D75-Q78 VanDerWaalsContact OD1-N 3.07Å; D75-Q78 VanDerWaalsContact OD2-CD 3.28Å; D75-Q78 WeakPolarHBondContact OD2-CG 3.48Å; D75-Q78 PolarHBondContact OD2-NE2 2.85Å; D75-G79 VanDerWaalsContact O-CA 3.31Å; D75-G79 WeakPolarHBondContact O-CA 3.5Å; D75-G79 PolarHBondContact O-N 3.23Å; D75-E80 PolarHBondContact N-O 2.76Å; D75-E80 PolarHBondContact O-N 3.06Å; D75-V82 HydrophobicContact CB-CG2 3.98Å
76	D	88.5	Confident	96.2	Very high	56 Å²	56	49.9 Å²	49.9	30%	0.299	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-29.5	-177	-83.3	-30.6	0	0	0	114.1	R29 R53 F54 L74	R29-D76 IonicContact CZ-OD1 3.8Å; R29-D76 IonicContact NH2-OD1 3.3Å; R29-D76 PolarHBondContact NH2-OD1 2.84Å; R29-D76 IonicContact NH2-OD2 3.53Å; R29-D76 PolarHBondContact NH2-OD2 3.06Å; R53-D76 IonicContact CZ-OD2 3.93Å; R53-D76 IonicContact NH1-OD1 2.6Å; R53-D76 IonicContact NH1-OD2 3.75Å; R53-D76 PolarHBondContact NH1-OD2 3.39Å; F54-D76 VanDerWaalsContact CD2-OD1 3.29Å; F54-D76 WeakPolarHBondContact CD2-OD1 3.47Å; F54-D76 WeakPolarHBondContact CE2-OD1 3.43Å; L74-D76 PolarHBondContact O-N 2.8Å
77	E	90.4	Very high	96.4	Very high	189 Å²	189	47 Å²	47	88%	0.883	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-40.6	-178.7	-59.7	-171.7	167.5	0	0	110.1	D75	D75-E77 VanDerWaalsContact C-N 3.27Å; D75-E77 PolarHBondContact O-N 2.69Å; D75-E77 WeakPolarHBondContact OD1-CB 3.25Å; D75-E77 PolarHBondContact OD1-N 3.45Å
78	Q	92.4	Very high	96.3	Very high	135 Å²	135	50.5 Å²	50.5	63%	0.631	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-25.3	177.5	-61.2	-176.3	39.9	0	0	112.6	D75 E80	D75-Q78 HydrophobicContact CB-CB 4.17Å; D75-Q78 HydrophobicContact CB-CG 4.47Å; D75-Q78 PolarHBondContact O-N 2.8Å; D75-Q78 PolarHBondContact OD1-N 2.87Å; D75-Q78 VanDerWaalsContact OD1-N 3.07Å; D75-Q78 VanDerWaalsContact OD2-CD 3.28Å; D75-Q78 WeakPolarHBondContact OD2-CG 3.48Å; D75-Q78 PolarHBondContact OD2-NE2 2.85Å; Q78-E80 VanDerWaalsContact C-N 3.29Å; Q78-E80 HydrophobicContact CB-CB 4.49Å
79	G	93.3	Very high	96.3	Very high	10 Å²	10	46.8 Å²	46.8	10%	0.103	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	29.7	-174.4	0	0	0	0	0	113.3	Y33 D75	Y33-G79 WeakPolarHBondContact CD1-O 3.42Å; D75-G79 VanDerWaalsContact O-CA 3.31Å; D75-G79 WeakPolarHBondContact O-CA 3.5Å; D75-G79 PolarHBondContact O-N 3.23Å
80	E	95.1	Very high	96	Very high	104 Å²	104	50.3 Å²	50.3	49%	0.486	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	149	-176.4	-66.6	-62.3	147.6	0	0	110.4	K30 D75 Q78	K30-E80 IonicContact NZ-OE1 2.88Å; D75-E80 PolarHBondContact N-O 2.76Å; D75-E80 PolarHBondContact O-N 3.06Å; Q78-E80 VanDerWaalsContact C-N 3.29Å; Q78-E80 HydrophobicContact CB-CB 4.49Å
81	F	97.9	Very high	95.8	Very high	24 Å²	24	55.2 Å²	55.2	11%	0.105	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135.4	176.2	-81.8	-84.4	0	0	0	111.5	Y35 L56 I72 Y73 L74 L360 I362	Y35-F81 HydrophobicContact CD2-CB 3.72Å; Y35-F81 HydrophobicContact CD2-CG 4.45Å; Y35-F81 HydrophobicContact CG-CB 4.16Å; Y35-F81 HydrophobicContact CG-CG 4.41Å; L56-F81 HydrophobicContact CD1-CE1 3.91Å; L56-F81 HydrophobicContact CD1-CZ 4.42Å; I72-F81 HydrophobicContact CB-CD1 4.47Å; I72-F81 HydrophobicContact CD1-CD1 3.91Å; I72-F81 HydrophobicContact CD1-CE1 4.23Å; I72-F81 HydrophobicContact CG1-CD1 4.16Å; Y73-F81 CarbonylContact O-C 3.56Å; Y73-F81 WeakPolarHBondContact O-CA 3.24Å; L74-F81 HydrophobicContact CB-CD1 4.23Å; L74-F81 HydrophobicContact CB-CE1 3.99Å; L74-F81 HydrophobicContact CB-CZ 4.3Å; L74-F81 HydrophobicContact CD1-CD2 4.28Å; L74-F81 HydrophobicContact CD1-CE2 4.39Å; F81-L360 HydrophobicContact CZ-CD2 4.43Å; F81-I362 HydrophobicContact CE2-CG1 4.28Å; F81-I362 HydrophobicContact CZ-CD1 3.84Å; F81-I362 HydrophobicContact CZ-CG1 3.89Å; F81-I362 HydrophobicContact CZ-CG2 3.95Å
82	V	97.7	Very high	95.7	Very high	42 Å²	42	56.5 Å²	56.5	26%	0.255	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	134.2	175.1	-178.3	0	0	0	0	109.2	I72 Y73 D75 Q84	I72-V82 CarbonylContact C-O 3.56Å; I72-V82 VanDerWaalsContact CA-O 3.24Å; I72-V82 WeakPolarHBondContact CA-O 3.09Å; Y73-V82 HydrophobicContact CD1-CB 4.37Å; Y73-V82 HydrophobicContact CE1-CB 3.81Å; Y73-V82 HydrophobicContact CE1-CG1 3.87Å; Y73-V82 HydrophobicContact CE2-CB 4.01Å; Y73-V82 HydrophobicContact CE2-CG2 4.24Å; Y73-V82 PolarHBondContact N-O 2.99Å; Y73-V82 PolarHBondContact O-N 3.48Å; D75-V82 HydrophobicContact CB-CG2 3.98Å; V82-Q84 PolarHBondContact O-N 2.88Å
83	V	97.8	Very high	95.7	Very high	62 Å²	62	56.6 Å²	56.6	38%	0.376	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	116.4	171.6	-179	0	0	0	0	108.5	Y35 I72	Y35-V83 HydrophobicContact CE2-CG2 3.99Å; I72-V83 HydrophobicContact CG2-CG2 4.1Å
84	Q	97	Very high	95.6	Very high	44 Å²	44	54.1 Å²	54.1	21%	0.206	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-46.9	177.1	-170.4	-172.6	-65.3	0	0	110.9	I71 Y73 V82 S126	I71-Q84 HydrophobicContact CB-CB 4.42Å; I71-Q84 HydrophobicContact CG2-CB 4.19Å; I71-Q84 WeakPolarHBondContact O-CB 3.48Å; I71-Q84 PolarHBondContact O-N 2.93Å; Y73-Q84 HydrophobicContact CD1-CB 4.12Å; Y73-Q84 HydrophobicContact CE1-CB 4.16Å; V82-Q84 PolarHBondContact O-N 2.88Å; Q84-S126 WeakPolarHBondContact CG-OG 3.33Å; Q84-S126 PolarHBondContact NE2-OG 3.37Å
85	S	97.7	Very high	95.7	Very high	17 Å²	17	55.3 Å²	55.3	12%	0.119	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	158.4	-178.9	62.8	0	0	0	0	111.8	Q70 I71 S126 V128	Q70-S85 WeakPolarHBondContact CA-O 3.27Å; I71-S85 WeakPolarHBondContact CD1-OG 3.24Å; I71-S85 PolarHBondContact N-O 2.7Å; I71-S85 PolarHBondContact O-N 3.34Å; S85-S126 WeakPolarHBondContact CB-O 3.48Å; S85-V128 VanDerWaalsContact OG-CG2 3.23Å; S85-V128 WeakPolarHBondContact OG-CG2 3.41Å
86	T	97.7	Very high	95.8	Very high	67 Å²	67	53.9 Å²	53.9	41%	0.411	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	129.7	175.1	-53.9	0	0	0	0	108.4	K68 V69 Q70	K68-T86 HydrophobicContact CB-CG2 4.28Å; K68-T86 HydrophobicContact CD-CG2 4.06Å; V69-T86 WeakPolarHBondContact O-CA 3.49Å; Q70-T86 HydrophobicContact CG-CG2 3.7Å; Q70-T86 VanDerWaalsContact CG-OG1 3.3Å; Q70-T86 WeakPolarHBondContact CG-OG1 3.35Å; Q70-T86 PolarHBondContact NE2-OG1 3.16Å
87	F	97.6	Very high	96.3	Very high	20 Å²	20	52.3 Å²	52.3	9%	0.088	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	155.8	177.1	60.5	-85.8	0	0	0	111.2	K68 V69 I71 L110 W120 V128	K68-F87 WeakPolarHBondContact CA-O 3.06Å; V69-F87 HydrophobicContact CB-CD1 4.27Å; V69-F87 HydrophobicContact CB-CD2 4.21Å; V69-F87 HydrophobicContact CB-CE1 3.66Å; V69-F87 HydrophobicContact CB-CE2 3.6Å; V69-F87 HydrophobicContact CB-CZ 3.32Å; V69-F87 HydrophobicContact CG1-CE1 3.56Å; V69-F87 HydrophobicContact CG1-CE2 4.12Å; V69-F87 HydrophobicContact CG1-CZ 3.33Å; V69-F87 HydrophobicContact CG2-CE2 4Å; V69-F87 HydrophobicContact CG2-CZ 4.04Å; V69-F87 PolarHBondContact N-O 3.48Å; V69-F87 PolarHBondContact O-N 2.95Å; I71-F87 HydrophobicContact CD1-CE1 4.45Å; I71-F87 HydrophobicContact CG1-CE1 4.43Å; F87-L110 HydrophobicContact CE1-CD2 4.33Å; F87-L110 HydrophobicContact CZ-CD2 3.89Å; F87-W120 HydrophobicContact CD2-CD2 4.08Å; F87-W120 AromaticContact CD2-CE3 3.77Å; F87-W120 HydrophobicContact CD2-CE3 3.77Å; F87-W120 AromaticContact CD2-CH2 3.83Å; F87-W120 HydrophobicContact CD2-CH2 3.83Å; F87-W120 HydrophobicContact CD2-CZ2 4.15Å; F87-W120 AromaticContact CD2-CZ3 3.63Å; F87-W120 HydrophobicContact CD2-CZ3 3.63Å; F87-W120 AromaticContact CE2-CD2 3.51Å; F87-W120 HydrophobicContact CE2-CD2 3.51Å; F87-W120 AromaticContact CE2-CE2 3.53Å; F87-W120 AromaticContact CE2-CE3 3.71Å; F87-W120 HydrophobicContact CE2-CE3 3.71Å; F87-W120 HydrophobicContact CE2-CG 4.05Å; F87-W120 AromaticContact CE2-CH2 3.95Å; F87-W120 HydrophobicContact CE2-CH2 3.95Å; F87-W120 AromaticContact CE2-CZ2 3.77Å; F87-W120 HydrophobicContact CE2-CZ2 3.77Å; F87-W120 AromaticContact CE2-CZ3 3.91Å; F87-W120 HydrophobicContact CE2-CZ3 3.91Å; F87-W120 HydrophobicContact CZ-CD2 4.13Å; F87-W120 HydrophobicContact CZ-CG 4.2Å; F87-V128 HydrophobicContact CD1-CB 3.86Å; F87-V128 HydrophobicContact CD1-CG1 3.68Å; F87-V128 HydrophobicContact CD1-CG2 3.96Å; F87-V128 HydrophobicContact CE1-CB 4.34Å; F87-V128 HydrophobicContact CE1-CG1 3.73Å; F87-V128 HydrophobicContact CE1-CG2 4.29Å; F87-V128 HydrophobicContact CG-CB 4.3Å; F87-V128 HydrophobicContact CG-CG1 4.07Å; F87-V128 HydrophobicContact CZ-CG1 4.15Å
88	A	97.1	Very high	96.7	Very high	76 Å²	76	43.6 Å²	43.6	63%	0.628	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	144	-177.3	0	0	0	0	0	111.5
89	H	96.9	Very high	96.9	Very high	6 Å²	6	37.2 Å²	37.2	3%	0.028	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	143.8	169.6	-160.4	-85.3	0	0	0	108.2	N67 V69 Y91 T112 W120	N67-H89 CarbonylContact C-O 3.55Å; N67-H89 VanDerWaalsContact CA-O 3.23Å; N67-H89 WeakPolarHBondContact CA-O 3.29Å; N67-H89 HydrophobicContact CB-CB 4.41Å; N67-H89 VanDerWaalsContact CB-O 3.25Å; N67-H89 WeakPolarHBondContact CB-O 3.44Å; N67-H89 PolarHBondContact N-O 3.33Å; N67-H89 PolarHBondContact O-N 3.2Å; V69-H89 HydrophobicContact CG2-CB 4.25Å; H89-Y91 PolarHBondContact ND1-O 2.83Å; H89-T112 PolarHBondContact CD2-OG1 3.37Å; H89-T112 PolarHBondContact NE2-OG1 3.19Å; H89-W120 AromaticContact CD2-CZ2 3.83Å
90	H	92.4	Very high	97	Very high	75 Å²	75	37.8 Å²	37.8	35%	0.347	21%	0.205	S	C	.	.	S	Bend	trans	-71.3	-45.5	-171.4	-69.1	153.6	0	0	0	113.2	Y65 R118	Y65-H90 WeakPolarHBondContact CA-O 3.46Å; Y65-H90 HydrophobicContact CD2-CB 4.17Å; Y65-H90 HydrophobicContact CE1-CB 4.04Å; Y65-H90 AromaticContact CE1-CD2 3.33Å; Y65-H90 WeakPolarHBondContact CE1-CD2 3.36Å; Y65-H90 AromaticContact CE1-CG 3.75Å; Y65-H90 AromaticContact CE1-NE2 3.97Å; Y65-H90 HydrophobicContact CE2-CB 3.5Å; Y65-H90 VanDerWaalsContact CE2-CB 3.5Å; Y65-H90 AromaticContact CE2-CG 3.97Å; Y65-H90 VanDerWaalsContact CZ-CB 3.4Å; Y65-H90 AromaticContact CZ-CD2 3.42Å; Y65-H90 VanDerWaalsContact CZ-CD2 3.42Å; Y65-H90 AromaticContact CZ-CG 3.31Å; Y65-H90 AromaticContact CZ-ND1 3.88Å; Y65-H90 WeakPolarHBondContact OH-CB 3.45Å; Y65-H90 PolarHBondContact OH-CD2 3.21Å; Y65-H90 VanDerWaalsContact OH-CD2 3.27Å; Y65-H90 PolarHBondContact OH-CE1 3.36Å; Y65-H90 PolarHBondContact OH-ND1 2.99Å; H90-R118 PolarHBondContact ND1-NH2 3.18Å
91	Y	94.6	Very high	97	Very high	116 Å²	116	33.2 Å²	33.2	46%	0.455	18%	0.184	S	C	.	.	S	Bend	trans	-121.7	167.2	179.6	-65.4	-76.5	0	0	0	110.7	Y65 N67 H89 T93 D115	Y65-Y91 HydrophobicContact CD2-CD1 4.46Å; Y65-Y91 AromaticContact CD2-CE1 3.91Å; Y65-Y91 HydrophobicContact CD2-CE1 3.91Å; Y65-Y91 HydrophobicContact CD2-CE2 4.02Å; Y65-Y91 AromaticContact CD2-CZ 3.66Å; Y65-Y91 HydrophobicContact CE2-CD2 4.16Å; Y65-Y91 HydrophobicContact CE2-CE1 4.22Å; Y65-Y91 AromaticContact CE2-CE2 3.48Å; Y65-Y91 HydrophobicContact CE2-CE2 3.48Å; Y65-Y91 VanDerWaalsContact CE2-CE2 3.48Å; Y65-Y91 AromaticContact CE2-CZ 3.51Å; N67-Y91 WeakPolarHBondContact CB-O 3.23Å; N67-Y91 VanDerWaalsContact CG-C 3.45Å; H89-Y91 PolarHBondContact ND1-O 2.83Å; Y91-T93 PolarHBondContact O-N 3.31Å; Y91-D115 HydrophobicContact CD2-CB 3.96Å; Y91-D115 HydrophobicContact CE2-CB 4.11Å
92	P	97	Very high	96.7	Very high	27 Å²	27	35.9 Å²	35.9	18%	0.175	20%	0.202	C	C	.	.			trans	-55	135.9	169.5	-24.3	35.3	0	0	0	110.3	F42 S60 F61 N67 S94	F42-P92 HydrophobicContact CB-CB 4.49Å; F42-P92 HydrophobicContact CD1-CB 3.57Å; F42-P92 HydrophobicContact CE1-CB 4.04Å; F42-P92 HydrophobicContact CG-CB 4.15Å; S60-P92 WeakPolarHBondContact O-CA 3.4Å; S60-P92 WeakPolarHBondContact O-CB 3.49Å; F61-P92 HydrophobicContact CD2-CB 3.92Å; F61-P92 HydrophobicContact CD2-CG 3.77Å; F61-P92 HydrophobicContact CE2-CB 4.47Å; F61-P92 HydrophobicContact CE2-CG 4.06Å; F61-P92 HydrophobicContact CG-CG 4.4Å; N67-P92 VanDerWaalsContact ND2-CD 3.33Å; N67-P92 WeakPolarHBondContact ND2-CD 3.44Å; P92-S94 PolarHBondContact O-N 2.93Å
93	T	97.6	Very high	96.4	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.012	22%	0.224	C	C	.	.			trans	-74.1	113.2	-179.1	40.6	0	0	0	0	110	F42 S43 G59 V69 Y91 K95 I96 T112 S113	F42-T93 WeakPolarHBondContact CD1-O 3.46Å; S43-T93 VanDerWaalsContact CB-O 3.32Å; S43-T93 WeakPolarHBondContact CB-O 3.31Å; S43-T93 WeakPolarHBondContact OG-CB 3.49Å; S43-T93 PolarHBondContact OG-O 2.6Å; S43-T93 PolarHBondContact OG-OG1 2.96Å; G59-T93 WeakPolarHBondContact CA-OG1 3.37Å; V69-T93 HydrophobicContact CG2-CG2 3.78Å; Y91-T93 PolarHBondContact O-N 3.31Å; T93-K95 PolarHBondContact O-N 2.98Å; T93-I96 HydrophobicContact CG2-CD1 4.45Å; T93-I96 HydrophobicContact CG2-CG1 4.25Å; T93-I96 WeakPolarHBondContact OG1-CD1 3.37Å; T93-T112 HydrophobicContact CG2-CG2 4.18Å; T93-S113 CarbonylContact C-O 3.57Å; T93-S113 WeakPolarHBondContact CA-O 3.14Å
94	S	96.9	Very high	96.1	Very high	27 Å²	27	40.7 Å²	40.7	19%	0.189	22%	0.22	C	C	.	.	S	Bend	trans	-62.6	-30.1	179.6	53.1	0	0	0	0	112.2	P92 S113 L146	P92-S94 PolarHBondContact O-N 2.93Å; S94-S113 PolarHBondContact N-O 2.71Å; S94-S113 WeakPolarHBondContact OG-CB 3.4Å; S94-S113 PolarHBondContact OG-O 3.14Å; S94-S113 PolarHBondContact OG-OG 3.39Å; S94-L146 WeakPolarHBondContact CB-O 3.49Å; S94-L146 PolarHBondContact OG-O 2.92Å
95	K	98.2	Very high	95.8	Very high	32 Å²	32	41.9 Å²	41.9	14%	0.139	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	156.2	169.1	-162.4	160.2	175.3	-173.4	0	110	T93 M97 S113 S148 F149 D202	T93-K95 PolarHBondContact O-N 2.98Å; K95-M97 HydrophobicContact CG-CG 4.35Å; K95-S113 PolarHBondContact N-OG 3.17Å; K95-S113 PolarHBondContact O-N 3.32Å; K95-S113 VanDerWaalsContact O-N 3.1Å; K95-S113 PolarHBondContact O-OG 2.85Å; K95-S148 WeakPolarHBondContact CD-OG 3.43Å; K95-S148 PolarHBondContact NZ-OG 2.96Å; K95-S148 VanDerWaalsContact NZ-OG 3.14Å; K95-F149 HydrophobicContact CB-CD1 3.79Å; K95-F149 HydrophobicContact CB-CE1 3.72Å; K95-F149 WeakPolarHBondContact CD-O 3.23Å; K95-F149 WeakPolarHBondContact CE-O 3.46Å; K95-F149 HydrophobicContact CG-CD1 4.28Å; K95-F149 HydrophobicContact CG-CE1 4.11Å; K95-F149 PolarHBondContact NZ-O 2.87Å; K95-F149 WeakPolarHBondContact O-CE1 3.21Å; K95-D202 IonicContact NZ-OD1 3.61Å; K95-D202 PolarHBondContact NZ-OD1 3.03Å
96	I	98.6	Very high	95.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	137.1	172.8	-61.9	179.5	0	0	0	106.4	N45 A57 V69 T93 L110 A111 T112	N45-I96 HydrophobicContact CB-CG2 4.45Å; N45-I96 WeakPolarHBondContact CB-O 3.45Å; A57-I96 HydrophobicContact CB-CG2 3.77Å; V69-I96 HydrophobicContact CG1-CD1 4.08Å; V69-I96 HydrophobicContact CG2-CD1 4.23Å; T93-I96 HydrophobicContact CG2-CD1 4.45Å; T93-I96 HydrophobicContact CG2-CG1 4.25Å; T93-I96 WeakPolarHBondContact OG1-CD1 3.37Å; I96-L110 HydrophobicContact CG2-CD1 3.6Å; I96-L110 HydrophobicContact CG2-CD2 4.31Å; I96-L110 HydrophobicContact CG2-CG 4.11Å; I96-A111 WeakPolarHBondContact CA-O 3.44Å; I96-T112 HydrophobicContact CG1-CG2 4.13Å; I96-T112 HydrophobicContact CG2-CG2 4.47Å
97	M	98.6	Very high	95.1	Very high	23 Å²	23	39.7 Å²	39.7	11%	0.113	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	143.4	172.5	-64.6	-176.9	61.2	0	0	110.4	K95 A111 F149 D150 W151	K95-M97 HydrophobicContact CG-CG 4.35Å; M97-A111 PolarHBondContact N-O 3.24Å; M97-A111 PolarHBondContact O-N 3.43Å; M97-F149 HydrophobicContact CB-CE2 3.71Å; M97-F149 HydrophobicContact CB-CZ 3.73Å; M97-F149 HydrophobicContact CG-CE2 3.88Å; M97-F149 HydrophobicContact CG-CZ 3.84Å; M97-F149 HydrophobicContact SD-CD2 4.23Å; M97-F149 HydrophobicContact SD-CE2 3.9Å; M97-F149 HydrophobicContact SD-CZ 4.39Å; M97-D150 VanDerWaalsContact CE-OD1 3.31Å; M97-D150 WeakPolarHBondContact CE-OD1 3.5Å; M97-W151 HydrophobicContact CE-CB 4.16Å
98	W	98.1	Very high	95	Very high	6 Å²	6	39.4 Å²	39.4	2%	0.023	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	153.4	169.1	-62.7	82.9	0	0	0	109.8	N45 R55 A57 I71 L110 I122	N45-W98 PolarHBondContact O-NE1 2.92Å; R55-W98 HydrophobicContact CG-CH2 4.2Å; R55-W98 HydrophobicContact CG-CZ2 4.07Å; R55-W98 VanDerWaalsContact CZ-CZ3 3.45Å; A57-W98 HydrophobicContact CB-CZ2 3.83Å; I71-W98 HydrophobicContact CD1-CH2 3.93Å; I71-W98 HydrophobicContact CG1-CH2 4.23Å; I71-W98 HydrophobicContact CG1-CZ2 4.49Å; I71-W98 HydrophobicContact CG2-CH2 3.86Å; I71-W98 HydrophobicContact CG2-CZ2 4.14Å; W98-L110 HydrophobicContact CD2-CD1 3.54Å; W98-L110 HydrophobicContact CE3-CB 4.42Å; W98-L110 HydrophobicContact CE3-CD1 4Å; W98-L110 HydrophobicContact CG-CD1 3.83Å; W98-L110 HydrophobicContact CH2-CD1 4.47Å; W98-L110 HydrophobicContact CZ2-CD1 4.06Å; W98-L110 HydrophobicContact CZ3-CD1 4.43Å; W98-I122 HydrophobicContact CH2-CD1 4.4Å; W98-I122 HydrophobicContact CH2-CG1 4.44Å; W98-I122 HydrophobicContact CZ3-CD1 3.82Å; W98-I122 HydrophobicContact CZ3-CG1 4.16Å
99	I	97.3	Very high	94.9	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.18	C	C	.	.			trans	-53.1	134	168.8	-174.8	165.1	0	0	0	109.6	V48 D101 F106 L109 W151 P156 T175	V48-I99 WeakPolarHBondContact CG2-O 3.3Å; I99-D101 HydrophobicContact CG1-CB 4.33Å; I99-D101 HydrophobicContact CG2-CB 4.14Å; I99-D101 PolarHBondContact O-N 2.89Å; I99-F106 HydrophobicContact CD1-CB 3.56Å; I99-F106 HydrophobicContact CD1-CD1 4.37Å; I99-F106 HydrophobicContact CD1-CD2 4.3Å; I99-F106 HydrophobicContact CD1-CG 3.84Å; I99-L109 HydrophobicContact CB-CB 4.03Å; I99-L109 HydrophobicContact CD1-CB 4.49Å; I99-L109 HydrophobicContact CD1-CD1 4.05Å; I99-L109 HydrophobicContact CG2-CB 4.01Å; I99-L109 WeakPolarHBondContact CG2-O 3.28Å; I99-L109 PolarHBondContact N-O 2.79Å; I99-W151 HydrophobicContact CB-CE3 4.3Å; I99-W151 HydrophobicContact CB-CH2 3.62Å; I99-W151 HydrophobicContact CB-CZ2 3.84Å; I99-W151 HydrophobicContact CB-CZ3 3.85Å; I99-W151 HydrophobicContact CD1-CH2 4.33Å; I99-W151 HydrophobicContact CD1-CZ2 3.9Å; I99-W151 HydrophobicContact CG1-CH2 4.04Å; I99-W151 HydrophobicContact CG1-CZ2 3.71Å; I99-P156 HydrophobicContact CD1-CB 4.1Å; I99-P156 HydrophobicContact CG1-CB 4.05Å; I99-T175 HydrophobicContact CD1-CG2 4.28Å
100	P	96	Very high	95	Very high	23 Å²	23	35.5 Å²	35.5	15%	0.149	18%	0.179	C	C	.	.			trans	-74.3	50.7	-177.4	29	-35.3	0	0	0	113	W151 N152 E153 P156	P100-W151 VanDerWaalsContact CD-CG 3.42Å; P100-W151 HydrophobicContact CG-CB 4.31Å; P100-W151 HydrophobicContact CG-CG 4.05Å; P100-N152 WeakPolarHBondContact CG-O 3.4Å; P100-E153 HydrophobicContact CB-CB 4.33Å; P100-E153 HydrophobicContact CB-CG 4.14Å; P100-P156 HydrophobicContact CG-CB 4.39Å; P100-P156 HydrophobicContact CG-CG 4.37Å
101	D	94.1	Very high	95.3	Very high	7 Å²	7	31.9 Å²	31.9	4%	0.037	16%	0.162	C	C	.	.			trans	-101.6	89.8	-176.3	-177.7	17.8	0	0	0	112.3	I99 K103 C104 I105 F106	I99-D101 HydrophobicContact CG1-CB 4.33Å; I99-D101 HydrophobicContact CG2-CB 4.14Å; I99-D101 PolarHBondContact O-N 2.89Å; D101-K103 PolarHBondContact O-N 2.87Å; D101-K103 PolarHBondContact OD1-N 2.8Å; D101-K103 VanDerWaalsContact OD1-N 3.09Å; D101-C104 VanDerWaalsContact CG-N 3.35Å; D101-C104 PolarHBondContact OD1-N 2.59Å; D101-C104 WeakPolarHBondContact OD2-CA 3.32Å; D101-C104 PolarHBondContact OD2-N 2.81Å; D101-I105 PolarHBondContact OD1-N 3.45Å; D101-I105 PolarHBondContact OD2-N 2.63Å; D101-F106 HydrophobicContact CB-CB 4.41Å; D101-F106 HydrophobicContact CB-CD2 4.02Å; D101-F106 PolarHBondContact OD2-N 3.23Å
102	T	92	Very high	95.5	Very high	81 Å²	81	26.4 Å²	26.4	50%	0.497	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-3.5	177.3	56.1	0	0	0	0	113.7	V48 P50	V48-T102 HydrophobicContact CB-CG2 4.5Å; P50-T102 WeakPolarHBondContact CD-O 3.28Å; P50-T102 WeakPolarHBondContact CG-O 3.26Å
103	K	91.7	Very high	95.5	Very high	163 Å²	163	25.1 Å²	25.1	71%	0.709	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.5	-1.9	-176.6	-65.9	-179.9	-177.2	172.8	0	113.3	D101 I105	D101-K103 PolarHBondContact O-N 2.87Å; D101-K103 PolarHBondContact OD1-N 2.8Å; D101-K103 VanDerWaalsContact OD1-N 3.09Å; K103-I105 VanDerWaalsContact C-N 3.28Å; K103-I105 HydrophobicContact CB-CD1 3.58Å; K103-I105 HydrophobicContact CB-CG1 3.71Å; K103-I105 HydrophobicContact CD-CD1 3.82Å; K103-I105 HydrophobicContact CG-CD1 4.35Å; K103-I105 PolarHBondContact O-N 2.72Å
104	C	90.7	Very high	95.3	Very high	42 Å²	42	25.3 Å²	25.3	28%	0.284	14%	0.135	S	C	.	.	S	Bend	trans	56.6	41	-177.7	-51.5	0	0	0	0	112.5	D51 D101	D51-C104 PolarHBondContact OD1-SG 2.87Å; D101-C104 VanDerWaalsContact CG-N 3.35Å; D101-C104 PolarHBondContact OD1-N 2.59Å; D101-C104 WeakPolarHBondContact OD2-CA 3.32Å; D101-C104 PolarHBondContact OD2-N 2.81Å
105	I	90.3	Very high	95.1	Very high	69 Å²	69	25.1 Å²	25.1	35%	0.354	13%	0.132	S	C	.	.			trans	-87.3	-29.2	178.6	-63.7	170.2	0	0	0	111.7	D101 K103 Q177 V178	D101-I105 PolarHBondContact OD1-N 3.45Å; D101-I105 PolarHBondContact OD2-N 2.63Å; K103-I105 VanDerWaalsContact C-N 3.28Å; K103-I105 HydrophobicContact CB-CD1 3.58Å; K103-I105 HydrophobicContact CB-CG1 3.71Å; K103-I105 HydrophobicContact CD-CD1 3.82Å; K103-I105 HydrophobicContact CG-CD1 4.35Å; K103-I105 PolarHBondContact O-N 2.72Å; I105-Q177 HydrophobicContact CG2-CB 4.45Å; I105-Q177 HydrophobicContact CG2-CG 4.05Å; I105-V178 VanDerWaalsContact O-CG2 3.25Å; I105-V178 WeakPolarHBondContact O-CG2 3.33Å; I105-V178 PolarHBondContact O-N 3.39Å
106	F	90.7	Very high	94.9	Very high	25 Å²	25	25.6 Å²	25.6	11%	0.11	13%	0.133	C	C	.	.	S	Bend	trans	-101.5	161.7	-178.1	-62.9	-83.8	0	0	0	110.4	I99 D101 P156 T175 E176 Q177	I99-F106 HydrophobicContact CD1-CB 3.56Å; I99-F106 HydrophobicContact CD1-CD1 4.37Å; I99-F106 HydrophobicContact CD1-CD2 4.3Å; I99-F106 HydrophobicContact CD1-CG 3.84Å; D101-F106 HydrophobicContact CB-CB 4.41Å; D101-F106 HydrophobicContact CB-CD2 4.02Å; D101-F106 PolarHBondContact OD2-N 3.23Å; F106-P156 HydrophobicContact CD2-CB 4.41Å; F106-P156 HydrophobicContact CD2-CG 4.38Å; F106-P156 HydrophobicContact CE2-CB 4.04Å; F106-P156 HydrophobicContact CE2-CG 3.74Å; F106-P156 HydrophobicContact CZ-CB 4.16Å; F106-P156 HydrophobicContact CZ-CG 4.09Å; F106-T175 VanDerWaalsContact CD1-OG1 3.24Å; F106-T175 WeakPolarHBondContact CD1-OG1 3.33Å; F106-T175 VanDerWaalsContact CE1-OG1 3.27Å; F106-T175 WeakPolarHBondContact CE1-OG1 3.43Å; F106-E176 WeakPolarHBondContact CD1-O 3.39Å; F106-Q177 HydrophobicContact CE1-CG 4.23Å
107	P	91.6	Very high	94.8	Very high	13 Å²	13	25.6 Å²	25.6	8%	0.084	13%	0.133	C	C	.	.			trans	-53.4	156.1	166.9	-26.6	35.1	0	0	0	112.6	L109 E176	P107-L109 HydrophobicContact CB-CD2 4.02Å; P107-L109 HydrophobicContact CB-CG 4.06Å; P107-L109 PolarHBondContact O-N 2.85Å; P107-E176 WeakPolarHBondContact CD-O 3.27Å
108	D	94.2	Very high	94.7	Very high	13 Å²	13	25.1 Å²	25.1	7%	0.07	13%	0.13	C	C	.	.			trans	-73.9	92.7	176.4	-158.4	5.9	0	0	0	109.9	R49 R55 R121 I122	R49-D108 WeakPolarHBondContact CD-OD1 3.08Å; R49-D108 IonicContact NH1-OD2 3.99Å; R55-D108 IonicContact CZ-OD1 2.74Å; R55-D108 IonicContact CZ-OD2 3.97Å; R55-D108 VanDerWaalsContact CZ-OD2 3.3Å; R55-D108 IonicContact NH1-OD1 3.96Å; R55-D108 IonicContact NH1-OD2 3.63Å; R55-D108 PolarHBondContact NH1-OD2 3.25Å; R55-D108 VanDerWaalsContact NH2-CG 3.33Å; R55-D108 IonicContact NH2-OD1 3.25Å; R55-D108 PolarHBondContact NH2-OD1 2.85Å; R55-D108 IonicContact NH2-OD2 3.65Å; R55-D108 PolarHBondContact NH2-OD2 3.22Å; R55-D108 VanDerWaalsContact NH2-OD2 3.1Å; D108-R121 WeakPolarHBondContact O-CA 3.25Å; D108-I122 HydrophobicContact CB-CB 4.11Å; D108-I122 WeakPolarHBondContact O-CD1 3.24Å; D108-I122 PolarHBondContact O-N 3.14Å
109	L	96.3	Very high	94.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	141.8	-174.5	-58	179.2	0	0	0	111.7	I99 P107 V119 W120 R121 W151 T175 V185	I99-L109 HydrophobicContact CB-CB 4.03Å; I99-L109 HydrophobicContact CD1-CB 4.49Å; I99-L109 HydrophobicContact CD1-CD1 4.05Å; I99-L109 HydrophobicContact CG2-CB 4.01Å; I99-L109 WeakPolarHBondContact CG2-O 3.28Å; I99-L109 PolarHBondContact N-O 2.79Å; P107-L109 HydrophobicContact CB-CD2 4.02Å; P107-L109 HydrophobicContact CB-CG 4.06Å; P107-L109 PolarHBondContact O-N 2.85Å; L109-V119 HydrophobicContact CB-CG1 4.11Å; L109-V119 HydrophobicContact CD1-CG1 4.14Å; L109-V119 HydrophobicContact CD2-CG1 4.15Å; L109-V119 HydrophobicContact CG-CG1 4.35Å; L109-W120 CarbonylContact C-O 3.53Å; L109-W120 VanDerWaalsContact CA-O 3.29Å; L109-W120 WeakPolarHBondContact CA-O 3.49Å; L109-R121 HydrophobicContact CD2-CB 3.94Å; L109-R121 HydrophobicContact CD2-CG 4.37Å; L109-W151 HydrophobicContact CB-CH2 3.87Å; L109-W151 HydrophobicContact CD1-CH2 4.41Å; L109-T175 HydrophobicContact CD1-CG2 4.09Å; L109-V185 HydrophobicContact CD1-CG2 3.85Å; L109-V185 HydrophobicContact CD2-CG2 3.99Å
110	L	98	Very high	94.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131.6	173	-175.8	78.5	0	0	0	108.2	A57 V69 F87 I96 W98 T112 V119 W120 I122	A57-L110 HydrophobicContact CB-CD1 3.81Å; A57-L110 HydrophobicContact CB-CD2 4.08Å; V69-L110 HydrophobicContact CG1-CD2 4.18Å; F87-L110 HydrophobicContact CE1-CD2 4.33Å; F87-L110 HydrophobicContact CZ-CD2 3.89Å; I96-L110 HydrophobicContact CG2-CD1 3.6Å; I96-L110 HydrophobicContact CG2-CD2 4.31Å; I96-L110 HydrophobicContact CG2-CG 4.11Å; W98-L110 HydrophobicContact CD2-CD1 3.54Å; W98-L110 HydrophobicContact CE3-CB 4.42Å; W98-L110 HydrophobicContact CE3-CD1 4Å; W98-L110 HydrophobicContact CG-CD1 3.83Å; W98-L110 HydrophobicContact CH2-CD1 4.47Å; W98-L110 HydrophobicContact CZ2-CD1 4.06Å; W98-L110 HydrophobicContact CZ3-CD1 4.43Å; L110-T112 HydrophobicContact CD2-CG2 4.34Å; L110-T112 HydrophobicContact CG-CG2 4.5Å; L110-V119 CarbonylContact O-C 3.58Å; L110-V119 WeakPolarHBondContact O-CA 3.29Å; L110-W120 HydrophobicContact CB-CB 4.39Å; L110-W120 PolarHBondContact N-O 3.2Å; L110-W120 VanDerWaalsContact O-CD1 3.29Å; L110-W120 PolarHBondContact O-N 2.77Å; L110-I122 HydrophobicContact CB-CD1 3.82Å
111	A	98.4	Very high	94.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	141.5	172.3	0	0	0	0	0	110.4	I96 M97 L117 R118 F149 W151 I159	I96-A111 WeakPolarHBondContact CA-O 3.44Å; M97-A111 PolarHBondContact N-O 3.24Å; M97-A111 PolarHBondContact O-N 3.43Å; A111-L117 HydrophobicContact CB-CD1 4.33Å; A111-R118 CarbonylContact C-O 3.58Å; A111-R118 VanDerWaalsContact CA-O 3.25Å; A111-R118 WeakPolarHBondContact CA-O 3.43Å; A111-F149 HydrophobicContact CB-CE2 3.54Å; A111-F149 HydrophobicContact CB-CZ 3.56Å; A111-F149 WeakPolarHBondContact O-CZ 3.41Å; A111-W151 HydrophobicContact CB-CE3 3.82Å; A111-W151 HydrophobicContact CB-CH2 4.45Å; A111-W151 HydrophobicContact CB-CZ3 3.56Å; A111-I159 HydrophobicContact CB-CD1 4.14Å
112	T	98.5	Very high	94.7	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142.1	173.9	69.7	0	0	0	0	110.5	V69 H89 T93 I96 L110 R118 W120	V69-T112 HydrophobicContact CG2-CG2 4.39Å; H89-T112 PolarHBondContact CD2-OG1 3.37Å; H89-T112 PolarHBondContact NE2-OG1 3.19Å; T93-T112 HydrophobicContact CG2-CG2 4.18Å; I96-T112 HydrophobicContact CG1-CG2 4.13Å; I96-T112 HydrophobicContact CG2-CG2 4.47Å; L110-T112 HydrophobicContact CD2-CG2 4.34Å; L110-T112 HydrophobicContact CG-CG2 4.5Å; T112-R118 PolarHBondContact N-O 2.67Å; T112-R118 PolarHBondContact O-N 2.87Å; T112-W120 PolarHBondContact OG1-NE1 2.87Å
113	S	97.3	Very high	94.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	155.9	174	58.4	0	0	0	0	111.8	T93 S94 K95 F149	T93-S113 CarbonylContact C-O 3.57Å; T93-S113 WeakPolarHBondContact CA-O 3.14Å; S94-S113 PolarHBondContact N-O 2.71Å; S94-S113 WeakPolarHBondContact OG-CB 3.4Å; S94-S113 PolarHBondContact OG-O 3.14Å; S94-S113 PolarHBondContact OG-OG 3.39Å; K95-S113 PolarHBondContact N-OG 3.17Å; K95-S113 PolarHBondContact O-N 3.32Å; K95-S113 VanDerWaalsContact O-N 3.1Å; K95-S113 PolarHBondContact O-OG 2.85Å; S113-F149 WeakPolarHBondContact OG-CD1 3.32Å
114	G	94.6	Very high	94.6	Very high	6 Å²	6	27.5 Å²	27.5	6%	0.062	14%	0.135	C	C	.	.	S	Bend	trans	-178	-112.4	177.5	0	0	0	0	0	108.3	Y116 P145 L146	G114-Y116 PolarHBondContact N-O 2.93Å; G114-P145 WeakPolarHBondContact O-CA 3.37Å; G114-L146 PolarHBondContact O-N 2.78Å
115	D	92.1	Very high	94.7	Very high	24 Å²	24	31 Å²	31	13%	0.128	15%	0.15	C	C	.	.	S	Bend	trans	-65.2	-38.5	164.6	56.2	-28.4	0	0	0	112.9	Y91 R118	Y91-D115 HydrophobicContact CD2-CB 3.96Å; Y91-D115 HydrophobicContact CE2-CB 4.11Å; D115-R118 VanDerWaalsContact CG-NH2 3.33Å; D115-R118 IonicContact OD1-CZ 3.64Å; D115-R118 VanDerWaalsContact OD1-CZ 3.3Å; D115-R118 IonicContact OD1-NH1 3.85Å; D115-R118 PolarHBondContact OD1-NH1 3.33Å; D115-R118 IonicContact OD1-NH2 2.73Å; D115-R118 PolarHBondContact OD1-NH2 2.88Å; D115-R118 IonicContact OD2-CZ 3.44Å; D115-R118 IonicContact OD2-NH1 3.3Å; D115-R118 IonicContact OD2-NH2 3.35Å; D115-R118 PolarHBondContact OD2-NH2 2.84Å
116	Y	94.4	Very high	94.8	Very high	42 Å²	42	29.7 Å²	29.7	17%	0.165	15%	0.147	C	C	.	.	S	Bend	trans	-137.4	161	177.7	-57.1	-67.2	0	0	0	110.4	G114 R118 L133 N135 C143	G114-Y116 PolarHBondContact N-O 2.93Å; Y116-R118 PolarHBondContact O-NH1 2.72Å; Y116-L133 HydrophobicContact CD2-CD1 3.98Å; Y116-L133 HydrophobicContact CG-CD1 4.01Å; Y116-N135 HydrophobicContact CD1-CB 3.74Å; Y116-N135 HydrophobicContact CE1-CB 3.85Å; Y116-N135 VanDerWaalsContact CE1-OD1 3.26Å; Y116-N135 WeakPolarHBondContact CE1-OD1 3.33Å; Y116-C143 HydrophobicContact CD1-CB 4.36Å; Y116-C143 HydrophobicContact CE1-CB 3.58Å
117	L	96.4	Very high	94.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	127.5	165.4	178.6	68.5	0	0	0	108.4	A111 L134 L146 F149 I159 T161 W171	A111-L117 HydrophobicContact CB-CD1 4.33Å; L117-L134 HydrophobicContact CB-CB 4.06Å; L117-L134 HydrophobicContact CB-CD1 4.42Å; L117-L134 HydrophobicContact CD2-CB 4.36Å; L117-L134 HydrophobicContact CD2-CD1 3.43Å; L117-L134 VanDerWaalsContact CD2-CD1 3.43Å; L117-L134 HydrophobicContact CG-CB 4.41Å; L117-L134 HydrophobicContact CG-CD1 3.85Å; L117-L134 WeakPolarHBondContact O-CB 3.38Å; L117-L134 PolarHBondContact O-N 2.9Å; L117-L146 HydrophobicContact CB-CD1 3.77Å; L117-F149 HydrophobicContact CD1-CD1 4.2Å; L117-F149 HydrophobicContact CD1-CD2 4.22Å; L117-F149 HydrophobicContact CD1-CE1 4.42Å; L117-F149 HydrophobicContact CD1-CE2 4.46Å; L117-F149 HydrophobicContact CD1-CG 4.07Å; L117-I159 HydrophobicContact CD1-CG2 4.44Å; L117-I159 HydrophobicContact CD2-CB 4.18Å; L117-I159 HydrophobicContact CD2-CD1 4.27Å; L117-I159 HydrophobicContact CD2-CG2 3.62Å; L117-T161 HydrophobicContact CB-CG2 4.15Å; L117-T161 HydrophobicContact CD1-CG2 4.38Å; L117-T161 HydrophobicContact CD2-CG2 3.68Å; L117-T161 HydrophobicContact CG-CG2 4.29Å; L117-W171 HydrophobicContact CD2-CG 4.18Å
118	R	96.7	Very high	95.2	Very high	13 Å²	13	34.5 Å²	34.5	5%	0.049	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	140.1	177.2	-71.3	172.8	-176.1	82.7	-4.4	109.9	H90 A111 T112 D115 Y116 W120 C132 L133	H90-R118 PolarHBondContact ND1-NH2 3.18Å; A111-R118 CarbonylContact C-O 3.58Å; A111-R118 VanDerWaalsContact CA-O 3.25Å; A111-R118 WeakPolarHBondContact CA-O 3.43Å; T112-R118 PolarHBondContact N-O 2.67Å; T112-R118 PolarHBondContact O-N 2.87Å; D115-R118 VanDerWaalsContact CG-NH2 3.33Å; D115-R118 IonicContact OD1-CZ 3.64Å; D115-R118 VanDerWaalsContact OD1-CZ 3.3Å; D115-R118 IonicContact OD1-NH1 3.85Å; D115-R118 PolarHBondContact OD1-NH1 3.33Å; D115-R118 IonicContact OD1-NH2 2.73Å; D115-R118 PolarHBondContact OD1-NH2 2.88Å; D115-R118 IonicContact OD2-CZ 3.44Å; D115-R118 IonicContact OD2-NH1 3.3Å; D115-R118 IonicContact OD2-NH2 3.35Å; D115-R118 PolarHBondContact OD2-NH2 2.84Å; Y116-R118 PolarHBondContact O-NH1 2.72Å; R118-W120 HydrophobicContact CB-CZ2 4Å; R118-W120 VanDerWaalsContact CD-CZ2 3.47Å; R118-W120 HydrophobicContact CG-CZ2 4.35Å; R118-C132 CarbonylContact C-O 3.6Å; R118-C132 WeakPolarHBondContact CA-O 3.16Å; R118-L133 HydrophobicContact CG-CD1 3.48Å; R118-L133 VanDerWaalsContact CG-CD1 3.48Å
119	V	97.3	Very high	95.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.3	170.2	-175.1	0	0	0	0	108.5	L109 L110 E131 C132 L134 W151 L173 V185	L109-V119 HydrophobicContact CB-CG1 4.11Å; L109-V119 HydrophobicContact CD1-CG1 4.14Å; L109-V119 HydrophobicContact CD2-CG1 4.15Å; L109-V119 HydrophobicContact CG-CG1 4.35Å; L110-V119 CarbonylContact O-C 3.58Å; L110-V119 WeakPolarHBondContact O-CA 3.29Å; V119-E131 PolarHBondContact O-N 3.21Å; V119-C132 HydrophobicContact CB-CB 3.95Å; V119-C132 HydrophobicContact CG2-CB 4.29Å; V119-C132 PolarHBondContact N-O 3.24Å; V119-C132 PolarHBondContact O-N 2.88Å; V119-C132 VanDerWaalsContact O-N 3.13Å; V119-L134 HydrophobicContact CG2-CD1 4.28Å; V119-W151 HydrophobicContact CG1-CH2 4.41Å; V119-L173 HydrophobicContact CG2-CD1 4.36Å; V119-V185 HydrophobicContact CG1-CG1 4.39Å
120	W	96.9	Very high	95.1	Very high	21 Å²	21	41.5 Å²	41.5	8%	0.08	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	136.9	-177.6	-48.2	84.9	0	0	0	109.1	F87 H89 L109 L110 T112 R118 V128 K129 N130	F87-W120 HydrophobicContact CD2-CD2 4.08Å; F87-W120 AromaticContact CD2-CE3 3.77Å; F87-W120 HydrophobicContact CD2-CE3 3.77Å; F87-W120 AromaticContact CD2-CH2 3.83Å; F87-W120 HydrophobicContact CD2-CH2 3.83Å; F87-W120 HydrophobicContact CD2-CZ2 4.15Å; F87-W120 AromaticContact CD2-CZ3 3.63Å; F87-W120 HydrophobicContact CD2-CZ3 3.63Å; F87-W120 AromaticContact CE2-CD2 3.51Å; F87-W120 HydrophobicContact CE2-CD2 3.51Å; F87-W120 AromaticContact CE2-CE2 3.53Å; F87-W120 AromaticContact CE2-CE3 3.71Å; F87-W120 HydrophobicContact CE2-CE3 3.71Å; F87-W120 HydrophobicContact CE2-CG 4.05Å; F87-W120 AromaticContact CE2-CH2 3.95Å; F87-W120 HydrophobicContact CE2-CH2 3.95Å; F87-W120 AromaticContact CE2-CZ2 3.77Å; F87-W120 HydrophobicContact CE2-CZ2 3.77Å; F87-W120 AromaticContact CE2-CZ3 3.91Å; F87-W120 HydrophobicContact CE2-CZ3 3.91Å; F87-W120 HydrophobicContact CZ-CD2 4.13Å; F87-W120 HydrophobicContact CZ-CG 4.2Å; H89-W120 AromaticContact CD2-CZ2 3.83Å; L109-W120 CarbonylContact C-O 3.53Å; L109-W120 VanDerWaalsContact CA-O 3.29Å; L109-W120 WeakPolarHBondContact CA-O 3.49Å; L110-W120 HydrophobicContact CB-CB 4.39Å; L110-W120 PolarHBondContact N-O 3.2Å; L110-W120 VanDerWaalsContact O-CD1 3.29Å; L110-W120 PolarHBondContact O-N 2.77Å; T112-W120 PolarHBondContact OG1-NE1 2.87Å; R118-W120 HydrophobicContact CB-CZ2 4Å; R118-W120 VanDerWaalsContact CD-CZ2 3.47Å; R118-W120 HydrophobicContact CG-CZ2 4.35Å; W120-V128 HydrophobicContact CB-CG1 3.87Å; W120-V128 HydrophobicContact CE3-CG1 4.27Å; W120-K129 CarbonylContact C-O 3.52Å; W120-K129 VanDerWaalsContact CA-O 3.25Å; W120-K129 WeakPolarHBondContact CA-O 3.42Å; W120-N130 HydrophobicContact CE3-CB 3.72Å; W120-N130 HydrophobicContact CH2-CB 4.34Å; W120-N130 WeakPolarHBondContact CH2-ND2 3.48Å; W120-N130 HydrophobicContact CZ3-CB 3.64Å
121	R	95.4	Very high	94.8	Very high	46 Å²	46	42.4 Å²	42.4	17%	0.174	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	133.6	170.4	179.6	-173.2	-54.5	-97.6	-3.9	109.9	D108 L109 N123 V128 K129 E131	D108-R121 WeakPolarHBondContact O-CA 3.25Å; L109-R121 HydrophobicContact CD2-CB 3.94Å; L109-R121 HydrophobicContact CD2-CG 4.37Å; R121-N123 VanDerWaalsContact CD-OD1 3.29Å; R121-N123 WeakPolarHBondContact CD-OD1 3.19Å; R121-V128 WeakPolarHBondContact O-CA 3.3Å; R121-K129 PolarHBondContact N-O 2.95Å; R121-K129 PolarHBondContact O-N 2.91Å; R121-E131 HydrophobicContact CB-CG 3.36Å; R121-E131 IonicContact CZ-OE2 3.61Å; R121-E131 IonicContact NE-OE1 3.1Å; R121-E131 PolarHBondContact NE-OE1 2.67Å; R121-E131 IonicContact NE-OE2 3.3Å; R121-E131 PolarHBondContact NE-OE2 2.71Å; R121-E131 IonicContact NH2-OE2 2.85Å; R121-E131 PolarHBondContact NH2-OE2 2.96Å
122	I	95.6	Very high	94.4	Very high	10 Å²	10	43 Å²	43	5%	0.051	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	112.7	170.2	-61	71.5	0	0	0	106.9	I71 W98 D108 L110 V128	I71-I122 HydrophobicContact CD1-CD1 4.03Å; I71-I122 HydrophobicContact CD1-CG1 3.39Å; W98-I122 HydrophobicContact CH2-CD1 4.4Å; W98-I122 HydrophobicContact CH2-CG1 4.44Å; W98-I122 HydrophobicContact CZ3-CD1 3.82Å; W98-I122 HydrophobicContact CZ3-CG1 4.16Å; D108-I122 HydrophobicContact CB-CB 4.11Å; D108-I122 WeakPolarHBondContact O-CD1 3.24Å; D108-I122 PolarHBondContact O-N 3.14Å; L110-I122 HydrophobicContact CB-CD1 3.82Å; I122-V128 HydrophobicContact CG1-CG2 4.32Å
123	N	92.9	Very high	94.2	Very high	48 Å²	48	47.1 Å²	47.1	26%	0.257	23%	0.233	S	C	.	.			trans	-79.1	164.7	177.6	-66.7	-33.1	0	0	0	110.8	R121 D125 S126 E127	R121-N123 VanDerWaalsContact CD-OD1 3.29Å; R121-N123 WeakPolarHBondContact CD-OD1 3.19Å; N123-D125 WeakPolarHBondContact CB-OD1 3.34Å; N123-D125 PolarHBondContact O-N 3.49Å; N123-S126 WeakPolarHBondContact O-CA 3.14Å; N123-S126 PolarHBondContact O-N 3.09Å; N123-E127 HydrophobicContact CB-CB 4.31Å; N123-E127 PolarHBondContact N-O 2.79Å; N123-E127 PolarHBondContact ND2-OE2 2.95Å
124	E	89.2	Confident	93.9	Very high	206 Å²	206	47.3 Å²	47.3	96%	0.963	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-29.8	-179.2	-65.1	-174.1	164.3	0	0	113.1	S126	E124-S126 PolarHBondContact O-N 2.96Å
125	D	91.8	Very high	93.6	Very high	115 Å²	115	49.6 Å²	49.6	62%	0.615	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	6.7	174.4	65.6	-8.2	0	0	0	113.5	N123 E127	N123-D125 WeakPolarHBondContact CB-OD1 3.34Å; N123-D125 PolarHBondContact O-N 3.49Å; D125-E127 PolarHBondContact O-N 2.86Å; D125-E127 VanDerWaalsContact OD1-CB 3.25Å; D125-E127 WeakPolarHBondContact OD1-CB 3.11Å; D125-E127 PolarHBondContact OD1-N 3.27Å
126	S	91.8	Very high	93	Very high	41 Å²	41	51.4 Å²	51.4	29%	0.287	25%	0.254	S	S	.	.	S	Bend	trans	67.7	8.9	-175.1	-56.2	0	0	0	0	115.6	Q84 S85 N123 E124	Q84-S126 WeakPolarHBondContact CG-OG 3.33Å; Q84-S126 PolarHBondContact NE2-OG 3.37Å; S85-S126 WeakPolarHBondContact CB-O 3.48Å; N123-S126 WeakPolarHBondContact O-CA 3.14Å; N123-S126 PolarHBondContact O-N 3.09Å; E124-S126 PolarHBondContact O-N 2.96Å
127	E	94.5	Very high	92.1	Very high	114 Å²	114	51.8 Å²	51.8	53%	0.533	26%	0.259	S	S	.	.			trans	-63.7	135.3	167.8	-170.5	-173.1	-155.7	0	0	109.6	N123 D125	N123-E127 HydrophobicContact CB-CB 4.31Å; N123-E127 PolarHBondContact N-O 2.79Å; N123-E127 PolarHBondContact ND2-OE2 2.95Å; D125-E127 PolarHBondContact O-N 2.86Å; D125-E127 VanDerWaalsContact OD1-CB 3.25Å; D125-E127 WeakPolarHBondContact OD1-CB 3.11Å; D125-E127 PolarHBondContact OD1-N 3.27Å
128	V	96.7	Very high	90.7	Very high	25 Å²	25	60.9 Å²	60.9	15%	0.152	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	117.7	176.2	-173.1	0	0	0	0	109.1	I71 S85 F87 W120 R121 I122	I71-V128 HydrophobicContact CD1-CG2 3.92Å; S85-V128 VanDerWaalsContact OG-CG2 3.23Å; S85-V128 WeakPolarHBondContact OG-CG2 3.41Å; F87-V128 HydrophobicContact CD1-CB 3.86Å; F87-V128 HydrophobicContact CD1-CG1 3.68Å; F87-V128 HydrophobicContact CD1-CG2 3.96Å; F87-V128 HydrophobicContact CE1-CB 4.34Å; F87-V128 HydrophobicContact CE1-CG1 3.73Å; F87-V128 HydrophobicContact CE1-CG2 4.29Å; F87-V128 HydrophobicContact CG-CB 4.3Å; F87-V128 HydrophobicContact CG-CG1 4.07Å; F87-V128 HydrophobicContact CZ-CG1 4.15Å; W120-V128 HydrophobicContact CB-CG1 3.87Å; W120-V128 HydrophobicContact CE3-CG1 4.27Å; R121-V128 WeakPolarHBondContact O-CA 3.3Å; I122-V128 HydrophobicContact CG1-CG2 4.32Å
129	K	94.7	Very high	89.3	Confident	100 Å²	100	68 Å²	68	44%	0.435	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	135	-179.7	-173.7	-178.2	172.1	-162.6	0	110.4	W120 R121 E131	W120-K129 CarbonylContact C-O 3.52Å; W120-K129 VanDerWaalsContact CA-O 3.25Å; W120-K129 WeakPolarHBondContact CA-O 3.42Å; R121-K129 PolarHBondContact N-O 2.95Å; R121-K129 PolarHBondContact O-N 2.91Å; K129-E131 PolarHBondContact O-N 2.85Å
130	N	93.6	Very high	88	Confident	60 Å²	60	70.2 Å²	70.2	32%	0.321	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	110.5	167.7	-166.9	-62.9	0	0	0	108.6	W120	W120-N130 HydrophobicContact CE3-CB 3.72Å; W120-N130 HydrophobicContact CH2-CB 4.34Å; W120-N130 WeakPolarHBondContact CH2-ND2 3.48Å; W120-N130 HydrophobicContact CZ3-CB 3.64Å
131	E	91.1	Very high	86.5	Confident	20 Å²	20	76.9 Å²	76.9	9%	0.093	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-42.9	-179.7	-71.5	-77.2	132	0	0	111.5	V119 R121 K129 V184 V185	V119-E131 PolarHBondContact O-N 3.21Å; R121-E131 HydrophobicContact CB-CG 3.36Å; R121-E131 IonicContact CZ-OE2 3.61Å; R121-E131 IonicContact NE-OE1 3.1Å; R121-E131 PolarHBondContact NE-OE1 2.67Å; R121-E131 IonicContact NE-OE2 3.3Å; R121-E131 PolarHBondContact NE-OE2 2.71Å; R121-E131 IonicContact NH2-OE2 2.85Å; R121-E131 PolarHBondContact NH2-OE2 2.96Å; K129-E131 PolarHBondContact O-N 2.85Å; E131-V184 HydrophobicContact CB-CG1 4.4Å; E131-V184 WeakPolarHBondContact O-CG1 3.42Å; E131-V185 HydrophobicContact CB-CB 3.98Å; E131-V185 HydrophobicContact CB-CG2 4.31Å; E131-V185 HydrophobicContact CG-CG2 4.43Å; E131-V185 PolarHBondContact OE2-N 2.93Å
132	C	91.6	Very high	85.2	Confident	11 Å²	11	84.1 Å²	84.1	7%	0.074	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	129.9	-171.6	-157.1	0	0	0	0	111.1	R118 V119 V185	R118-C132 CarbonylContact C-O 3.6Å; R118-C132 WeakPolarHBondContact CA-O 3.16Å; V119-C132 HydrophobicContact CB-CB 3.95Å; V119-C132 HydrophobicContact CG2-CB 4.29Å; V119-C132 PolarHBondContact N-O 3.24Å; V119-C132 PolarHBondContact O-N 2.88Å; V119-C132 VanDerWaalsContact O-N 3.13Å; C132-V185 HydrophobicContact CB-CG1 4.34Å; C132-V185 WeakPolarHBondContact CB-O 3.47Å; C132-V185 PolarHBondContact SG-O 2.63Å
133	L	93.2	Very high	84.6	Confident	88 Å²	88	85.9 Å²	85.9	46%	0.461	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	116	167.3	-178.9	74.2	0	0	0	108.3	Y116 R118	Y116-L133 HydrophobicContact CD2-CD1 3.98Å; Y116-L133 HydrophobicContact CG-CD1 4.01Å; R118-L133 HydrophobicContact CG-CD1 3.48Å; R118-L133 VanDerWaalsContact CG-CD1 3.48Å
134	L	92.4	Very high	84.5	Confident	4 Å²	4	84.7 Å²	84.7	2%	0.021	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	99.6	-176.7	-64.9	165.7	0	0	0	108.8	L117 V119 W171 L173	L117-L134 HydrophobicContact CB-CB 4.06Å; L117-L134 HydrophobicContact CB-CD1 4.42Å; L117-L134 HydrophobicContact CD2-CB 4.36Å; L117-L134 HydrophobicContact CD2-CD1 3.43Å; L117-L134 VanDerWaalsContact CD2-CD1 3.43Å; L117-L134 HydrophobicContact CG-CB 4.41Å; L117-L134 HydrophobicContact CG-CD1 3.85Å; L117-L134 WeakPolarHBondContact O-CB 3.38Å; L117-L134 PolarHBondContact O-N 2.9Å; V119-L134 HydrophobicContact CG2-CD1 4.28Å; L134-W171 HydrophobicContact CB-CD2 4.11Å; L134-W171 HydrophobicContact CB-CE3 3.77Å; L134-W171 HydrophobicContact CB-CH2 3.94Å; L134-W171 HydrophobicContact CB-CZ2 4.31Å; L134-W171 HydrophobicContact CB-CZ3 3.67Å; L134-W171 HydrophobicContact CD1-CD2 4.46Å; L134-W171 HydrophobicContact CD1-CE3 4.46Å; L134-W171 HydrophobicContact CD2-CE3 3.82Å; L134-W171 HydrophobicContact CD2-CZ3 4.15Å; L134-W171 HydrophobicContact CG-CE3 4.2Å; L134-W171 HydrophobicContact CG-CZ3 4.46Å; L134-L173 HydrophobicContact CD1-CD2 3.54Å; L134-L173 HydrophobicContact CD2-CD2 4.21Å; L134-L173 HydrophobicContact CG-CD2 4.5Å
135	N	87.7	Confident	84.7	Confident	54 Å²	54	77.8 Å²	77.8	29%	0.289	40%	0.402	S	S	.	.			trans	-122.5	123.8	179.5	179.7	12.8	0	0	0	110.1	Y116 N137	Y116-N135 HydrophobicContact CD1-CB 3.74Å; Y116-N135 HydrophobicContact CE1-CB 3.85Å; Y116-N135 VanDerWaalsContact CE1-OD1 3.26Å; Y116-N135 WeakPolarHBondContact CE1-OD1 3.33Å; N135-N137 PolarHBondContact ND2-O 2.79Å; N135-N137 VanDerWaalsContact ND2-O 3.11Å; N135-N137 PolarHBondContact OD1-N 2.89Å; N135-N137 PolarHBondContact OD1-O 3.02Å
136	N	80.2	Confident	84.9	Confident	61 Å²	61	73.1 Å²	73.1	33%	0.326	38%	0.377	S	S	.	.			trans	-90.8	-17.3	178.6	-169.2	19.1	0	0	0	112.2	K138 W171 V189 Q192	N136-K138 PolarHBondContact O-N 3.47Å; N136-W171 HydrophobicContact CB-CH2 3.82Å; N136-W171 HydrophobicContact CB-CZ2 4.33Å; N136-V189 HydrophobicContact CB-CG2 3.97Å; N136-Q192 PolarHBondContact ND2-OE1 3.03Å
137	N	75.4	Confident	85.2	Confident	50 Å²	50	72.2 Å²	72.2	27%	0.267	37%	0.37	S	S	.	.			trans	-90.1	100.8	178.4	-156.6	-17.6	0	0	0	111.5	N135 N139 S140 Y142	N135-N137 PolarHBondContact ND2-O 2.79Å; N135-N137 VanDerWaalsContact ND2-O 3.11Å; N135-N137 PolarHBondContact OD1-N 2.89Å; N135-N137 PolarHBondContact OD1-O 3.02Å; N137-N139 PolarHBondContact OD1-N 2.85Å; N137-S140 VanDerWaalsContact ND2-CB 3.32Å; N137-S140 WeakPolarHBondContact ND2-CB 3.28Å; N137-S140 PolarHBondContact ND2-OG 3.1Å; N137-S140 PolarHBondContact OD1-N 2.78Å; N137-S140 VanDerWaalsContact OD1-N 3.08Å; N137-Y142 PolarHBondContact ND2-O 3.16Å
138	K	67.1	Low	85.4	Confident	192 Å²	192	66.8 Å²	66.8	84%	0.835	35%	0.345	S	S	*	.	S	Bend	trans	-88.6	-14.3	177	-64.5	-174.1	-179.2	179.2	0	113.9	N136	N136-K138 PolarHBondContact O-N 3.47Å
139	N	65.6	Low	85.5	Confident	161 Å²	161	65.6 Å²	65.6	86%	0.861	34%	0.337	S	S	*	.	S	Bend	trans	-122.3	-0.2	-165.5	-66.5	-21.7	0	0	0	114.1	N137	N137-N139 PolarHBondContact OD1-N 2.85Å
140	S	70.1	Confident	85.7	Confident	47 Å²	47	61.4 Å²	61.4	33%	0.329	32%	0.32	S	S	.	.			trans	-143	139	-179.9	142.5	0	0	0	0	109.9	N137 Y142	N137-S140 VanDerWaalsContact ND2-CB 3.32Å; N137-S140 WeakPolarHBondContact ND2-CB 3.28Å; N137-S140 PolarHBondContact ND2-OG 3.1Å; N137-S140 PolarHBondContact OD1-N 2.78Å; N137-S140 VanDerWaalsContact OD1-N 3.08Å; S140-Y142 PolarHBondContact O-N 2.83Å; S140-Y142 WeakPolarHBondContact OG-CA 3.41Å; S140-Y142 WeakPolarHBondContact OG-CB 3.37Å; S140-Y142 PolarHBondContact OG-N 2.91Å; S140-Y142 PolarHBondContact OG-O 3.45Å
141	D	66	Low	85.9	Confident	162 Å²	162	58.6 Å²	58.6	87%	0.866	31%	0.305	S	S	*	.	S	Bend	trans	-70	-10.5	173.4	-63.4	-36.2	0	0	0	112.5
142	Y	68.9	Low	86.2	Confident	197 Å²	197	57.6 Å²	57.6	77%	0.773	30%	0.3	S	S	*	.			trans	-97.5	121.8	177.2	-61.2	-80.4	0	0	0	110.8	N137 S140	N137-Y142 PolarHBondContact ND2-O 3.16Å; S140-Y142 PolarHBondContact O-N 2.83Å; S140-Y142 WeakPolarHBondContact OG-CA 3.41Å; S140-Y142 WeakPolarHBondContact OG-CB 3.37Å; S140-Y142 PolarHBondContact OG-N 2.91Å; S140-Y142 PolarHBondContact OG-O 3.45Å
143	C	81.5	Confident	86.4	Confident	47 Å²	47	60.4 Å²	60.4	32%	0.318	31%	0.312	S	S	.	.			trans	-117.6	139.8	167.8	-169.6	0	0	0	0	108.7	Y116	Y116-C143 HydrophobicContact CD1-CB 4.36Å; Y116-C143 HydrophobicContact CE1-CB 3.58Å
144	A	91.2	Very high	86.5	Confident	24 Å²	24	60 Å²	60	20%	0.198	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-70.5	128.8	172.7	0	0	0	0	0	109	S163 I164 D165	A144-S163 WeakPolarHBondContact CB-OG 3.34Å; A144-I164 HydrophobicContact CB-CG1 3.88Å; A144-D165 HydrophobicContact CB-CB 3.57Å
145	P	93.6	Very high	86.6	Confident	60 Å²	60	61.4 Å²	61.4	39%	0.39	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-60.6	139.9	-178.7	24.8	-35.7	0	0	0	111.5	G114 I164	G114-P145 WeakPolarHBondContact O-CA 3.37Å; P145-I164 HydrophobicContact CG-CD1 3.61Å; P145-I164 HydrophobicContact CG-CG1 3.91Å; P145-I164 HydrophobicContact CG-CG2 4.36Å; P145-I164 PolarHBondContact O-N 2.84Å
146	L	97.2	Very high	86.9	Confident	17 Å²	17	59.6 Å²	59.6	9%	0.089	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	125.8	174.4	-58	-176.4	0	0	0	109.6	S94 G114 L117 T161 S162	S94-L146 WeakPolarHBondContact CB-O 3.49Å; S94-L146 PolarHBondContact OG-O 2.92Å; G114-L146 PolarHBondContact O-N 2.78Å; L117-L146 HydrophobicContact CB-CD1 3.77Å; L146-T161 HydrophobicContact CD1-CG2 3.91Å; L146-S162 CarbonylContact C-O 3.56Å; L146-S162 VanDerWaalsContact CA-O 3.29Å; L146-S162 WeakPolarHBondContact CA-O 3.33Å
147	T	98	Very high	87.6	Confident	22 Å²	22	59 Å²	59	14%	0.135	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-30.4	-179.8	52.3	0	0	0	0	112.3	S162 I164 V200 Y201	T147-S162 PolarHBondContact N-O 2.87Å; T147-S162 VanDerWaalsContact OG1-C 3.32Å; T147-S162 WeakPolarHBondContact OG1-CB 3.35Å; T147-S162 PolarHBondContact OG1-O 2.94Å; T147-S162 PolarHBondContact OG1-OG 2.86Å; T147-I164 HydrophobicContact CG2-CG2 3.41Å; T147-I164 VanDerWaalsContact CG2-CG2 3.41Å; T147-V200 VanDerWaalsContact CB-O 3.29Å; T147-V200 WeakPolarHBondContact CB-O 3.34Å; T147-V200 VanDerWaalsContact CG2-O 3.27Å; T147-V200 WeakPolarHBondContact CG2-O 3.3Å; T147-V200 PolarHBondContact OG1-O 2.9Å; T147-Y201 HydrophobicContact CG2-CD1 4.37Å
148	S	98.5	Very high	88.6	Confident	1 Å²	1	57 Å²	57	1%	0.007	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	174.4	179.1	-168.8	0	0	0	0	110.4	K95 S162 D202	K95-S148 WeakPolarHBondContact CD-OG 3.43Å; K95-S148 PolarHBondContact NZ-OG 2.96Å; K95-S148 VanDerWaalsContact NZ-OG 3.14Å; S148-S162 VanDerWaalsContact CB-OG 3.31Å; S148-S162 WeakPolarHBondContact CB-OG 3.43Å; S148-S162 PolarHBondContact N-OG 3.15Å; S148-S162 PolarHBondContact O-N 3.36Å; S148-S162 PolarHBondContact O-OG 2.71Å; S148-D202 VanDerWaalsContact CB-OD1 3.25Å; S148-D202 WeakPolarHBondContact CB-OD1 3.49Å; S148-D202 PolarHBondContact OG-OD1 2.73Å
149	F	98.7	Very high	90.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	165.1	165.9	74.6	-86.1	0	0	0	110.6	K95 M97 A111 S113 L117 I159 G160 T161	K95-F149 HydrophobicContact CB-CD1 3.79Å; K95-F149 HydrophobicContact CB-CE1 3.72Å; K95-F149 WeakPolarHBondContact CD-O 3.23Å; K95-F149 WeakPolarHBondContact CE-O 3.46Å; K95-F149 HydrophobicContact CG-CD1 4.28Å; K95-F149 HydrophobicContact CG-CE1 4.11Å; K95-F149 PolarHBondContact NZ-O 2.87Å; K95-F149 WeakPolarHBondContact O-CE1 3.21Å; M97-F149 HydrophobicContact CB-CE2 3.71Å; M97-F149 HydrophobicContact CB-CZ 3.73Å; M97-F149 HydrophobicContact CG-CE2 3.88Å; M97-F149 HydrophobicContact CG-CZ 3.84Å; M97-F149 HydrophobicContact SD-CD2 4.23Å; M97-F149 HydrophobicContact SD-CE2 3.9Å; M97-F149 HydrophobicContact SD-CZ 4.39Å; A111-F149 HydrophobicContact CB-CE2 3.54Å; A111-F149 HydrophobicContact CB-CZ 3.56Å; A111-F149 WeakPolarHBondContact O-CZ 3.41Å; S113-F149 WeakPolarHBondContact OG-CD1 3.32Å; L117-F149 HydrophobicContact CD1-CD1 4.2Å; L117-F149 HydrophobicContact CD1-CD2 4.22Å; L117-F149 HydrophobicContact CD1-CE1 4.42Å; L117-F149 HydrophobicContact CD1-CE2 4.46Å; L117-F149 HydrophobicContact CD1-CG 4.07Å; F149-I159 HydrophobicContact CB-CG2 4.18Å; F149-I159 HydrophobicContact CD2-CG2 3.76Å; F149-I159 HydrophobicContact CG-CG2 4.36Å; F149-G160 CarbonylContact C-O 3.58Å; F149-G160 WeakPolarHBondContact CA-O 3.23Å; F149-G160 WeakPolarHBondContact CB-O 3.49Å; F149-T161 HydrophobicContact CB-CG2 3.79Å
150	D	98.7	Very high	91.7	Very high	12 Å²	12	40.1 Å²	40.1	6%	0.064	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	140	170.2	-167.5	40.2	0	0	0	110.6	M97 I159 G160 I203 A204 F205	M97-D150 VanDerWaalsContact CE-OD1 3.31Å; M97-D150 WeakPolarHBondContact CE-OD1 3.5Å; D150-I159 WeakPolarHBondContact O-CA 3.12Å; D150-G160 PolarHBondContact N-O 3.22Å; D150-G160 PolarHBondContact O-N 3.17Å; D150-I203 WeakPolarHBondContact CB-O 3.36Å; D150-A204 HydrophobicContact CB-CB 4.38Å; D150-A204 WeakPolarHBondContact OD2-CA 3.27Å; D150-F205 HydrophobicContact CB-CD2 4.2Å; D150-F205 WeakPolarHBondContact O-CE2 3.01Å; D150-F205 PolarHBondContact OD2-N 3.43Å
151	W	97.9	Very high	93	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124.7	177.2	-151.4	-34.3	0	0	0	108.4	M97 I99 P100 L109 A111 V119 E153 P156 I158 I159 L173 T175	M97-W151 HydrophobicContact CE-CB 4.16Å; I99-W151 HydrophobicContact CB-CE3 4.3Å; I99-W151 HydrophobicContact CB-CH2 3.62Å; I99-W151 HydrophobicContact CB-CZ2 3.84Å; I99-W151 HydrophobicContact CB-CZ3 3.85Å; I99-W151 HydrophobicContact CD1-CH2 4.33Å; I99-W151 HydrophobicContact CD1-CZ2 3.9Å; I99-W151 HydrophobicContact CG1-CH2 4.04Å; I99-W151 HydrophobicContact CG1-CZ2 3.71Å; P100-W151 VanDerWaalsContact CD-CG 3.42Å; P100-W151 HydrophobicContact CG-CB 4.31Å; P100-W151 HydrophobicContact CG-CG 4.05Å; L109-W151 HydrophobicContact CB-CH2 3.87Å; L109-W151 HydrophobicContact CD1-CH2 4.41Å; A111-W151 HydrophobicContact CB-CE3 3.82Å; A111-W151 HydrophobicContact CB-CH2 4.45Å; A111-W151 HydrophobicContact CB-CZ3 3.56Å; V119-W151 HydrophobicContact CG1-CH2 4.41Å; W151-E153 PolarHBondContact O-N 2.76Å; W151-E153 VanDerWaalsContact O-N 3.13Å; W151-P156 PolarHBondContact NE1-O 3.3Å; W151-I158 VanDerWaalsContact CD1-O 3.28Å; W151-I159 HydrophobicContact CB-CG1 4.36Å; W151-I159 HydrophobicContact CD2-CD1 3.65Å; W151-I159 HydrophobicContact CD2-CG1 3.87Å; W151-I159 HydrophobicContact CE3-CD1 3.93Å; W151-I159 HydrophobicContact CG-CD1 4.06Å; W151-I159 HydrophobicContact CG-CG1 3.75Å; W151-I159 HydrophobicContact CH2-CD1 4.32Å; W151-I159 HydrophobicContact CZ2-CD1 4.07Å; W151-I159 HydrophobicContact CZ3-CD1 4.26Å; W151-L173 HydrophobicContact CZ2-CD1 3.82Å; W151-T175 HydrophobicContact CZ2-CG2 4.3Å
152	N	97.6	Very high	94.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.16	C	C	.	.			trans	-64.2	117.1	-179.1	-169.6	-58.2	0	0	0	110.9	P100 V154 D155 I158 F205 G211 R212	P100-N152 WeakPolarHBondContact CG-O 3.4Å; N152-V154 PolarHBondContact O-N 3.21Å; N152-V154 WeakPolarHBondContact OD1-CA 3.49Å; N152-V154 WeakPolarHBondContact OD1-CB 3.34Å; N152-V154 PolarHBondContact OD1-N 3.09Å; N152-D155 WeakPolarHBondContact CB-O 3.44Å; N152-D155 CarbonylContact O-C 3.58Å; N152-D155 PolarHBondContact OD1-N 3.44Å; N152-I158 HydrophobicContact CB-CB 3.94Å; N152-I158 HydrophobicContact CB-CG2 4.36Å; N152-I158 WeakPolarHBondContact CB-O 3.35Å; N152-I158 PolarHBondContact N-O 3.04Å; N152-F205 HydrophobicContact CB-CD1 4.43Å; N152-F205 HydrophobicContact CB-CD2 3.84Å; N152-F205 HydrophobicContact CB-CE2 3.98Å; N152-F205 HydrophobicContact CB-CG 4.08Å; N152-F205 HydrophobicContact CB-CZ 4.37Å; N152-F205 WeakPolarHBondContact ND2-CD1 3.47Å; N152-F205 WeakPolarHBondContact ND2-CG 3.47Å; N152-G211 PolarHBondContact ND2-O 2.76Å; N152-G211 PolarHBondContact OD1-O 2.82Å; N152-R212 PolarHBondContact ND2-O 2.82Å; N152-R212 VanDerWaalsContact ND2-O 3.15Å
153	E	95.1	Very high	95.9	Very high	70 Å²	70	21 Å²	21	33%	0.327	13%	0.125	S	C	.	.	S	Bend	trans	-70.4	-18.2	-177.4	-65.9	178.9	170.7	0	0	114	P100 W151 R207 K254	P100-E153 HydrophobicContact CB-CB 4.33Å; P100-E153 HydrophobicContact CB-CG 4.14Å; W151-E153 PolarHBondContact O-N 2.76Å; W151-E153 VanDerWaalsContact O-N 3.13Å; E153-R207 IonicContact OE2-CZ 2.64Å; E153-R207 IonicContact OE2-NE 3.63Å; E153-R207 PolarHBondContact OE2-NE 2.87Å; E153-R207 IonicContact OE2-NH2 2.75Å; E153-R207 PolarHBondContact OE2-NH2 3.03Å; E153-K254 IonicContact OE1-NZ 3.33Å; E153-K254 PolarHBondContact OE1-NZ 3.16Å; E153-K254 IonicContact OE2-NZ 2.76Å
154	V	94.7	Very high	96.6	Very high	79 Å²	79	22.3 Å²	22.3	48%	0.479	13%	0.127	S	C	.	.	S	Bend	trans	-93	-40	179.8	179.1	0	0	0	0	111	N152 G210	N152-V154 PolarHBondContact O-N 3.21Å; N152-V154 WeakPolarHBondContact OD1-CA 3.49Å; N152-V154 WeakPolarHBondContact OD1-CB 3.34Å; N152-V154 PolarHBondContact OD1-N 3.09Å; V154-G210 WeakPolarHBondContact CG1-O 3.15Å
155	D	94.8	Very high	96.8	Very high	34 Å²	34	24.3 Å²	24.3	18%	0.182	14%	0.135	C	C	.	.			trans	-122.5	93.2	176.2	-167.9	-12.1	0	0	0	110.2	N152 N157 I158 R212	N152-D155 WeakPolarHBondContact CB-O 3.44Å; N152-D155 CarbonylContact O-C 3.58Å; N152-D155 PolarHBondContact OD1-N 3.44Å; D155-N157 PolarHBondContact O-N 3.4Å; D155-N157 WeakPolarHBondContact OD1-CB 3.43Å; D155-N157 PolarHBondContact OD1-N 3.34Å; D155-N157 PolarHBondContact OD1-ND2 2.82Å; D155-I158 HydrophobicContact CB-CD1 4.05Å; D155-I158 HydrophobicContact CB-CG1 4.27Å; D155-I158 PolarHBondContact O-N 2.79Å; D155-R212 HydrophobicContact CB-CG 4.24Å; D155-R212 IonicContact OD2-NE 3.73Å; D155-R212 PolarHBondContact OD2-NE 2.85Å
156	P	94.3	Very high	97	Very high	15 Å²	15	23.2 Å²	23.2	10%	0.097	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-1.4	179.6	-24.8	35.7	0	0	0	114.7	I99 P100 F106 W151 I158 T175	I99-P156 HydrophobicContact CD1-CB 4.1Å; I99-P156 HydrophobicContact CG1-CB 4.05Å; P100-P156 HydrophobicContact CG-CB 4.39Å; P100-P156 HydrophobicContact CG-CG 4.37Å; F106-P156 HydrophobicContact CD2-CB 4.41Å; F106-P156 HydrophobicContact CD2-CG 4.38Å; F106-P156 HydrophobicContact CE2-CB 4.04Å; F106-P156 HydrophobicContact CE2-CG 3.74Å; F106-P156 HydrophobicContact CZ-CB 4.16Å; F106-P156 HydrophobicContact CZ-CG 4.09Å; W151-P156 PolarHBondContact NE1-O 3.3Å; P156-I158 VanDerWaalsContact C-N 3.34Å; P156-T175 WeakPolarHBondContact O-CG2 3.24Å
157	N	94.9	Very high	97	Very high	50 Å²	50	23 Å²	23	27%	0.267	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	0.7	170.8	-61.2	-59.4	0	0	0	113.2	D155 A172 L173 T175	D155-N157 PolarHBondContact O-N 3.4Å; D155-N157 WeakPolarHBondContact OD1-CB 3.43Å; D155-N157 PolarHBondContact OD1-N 3.34Å; D155-N157 PolarHBondContact OD1-ND2 2.82Å; N157-A172 CarbonylContact O-C 3.55Å; N157-A172 WeakPolarHBondContact O-CA 3.46Å; N157-L173 VanDerWaalsContact CB-O 3.25Å; N157-L173 WeakPolarHBondContact CB-O 3.34Å; N157-L173 PolarHBondContact O-N 3.19Å; N157-L173 PolarHBondContact OD1-O 2.78Å; N157-T175 PolarHBondContact OD1-N 3.02Å; N157-T175 PolarHBondContact OD1-OG1 3.4Å
158	I	96.7	Very high	97	Very high	6 Å²	6	22 Å²	22	3%	0.031	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	128	-176.8	-56.8	177.2	0	0	0	110.5	W151 N152 D155 P156 I170 W171 F205 R212	W151-I158 VanDerWaalsContact CD1-O 3.28Å; N152-I158 HydrophobicContact CB-CB 3.94Å; N152-I158 HydrophobicContact CB-CG2 4.36Å; N152-I158 WeakPolarHBondContact CB-O 3.35Å; N152-I158 PolarHBondContact N-O 3.04Å; D155-I158 HydrophobicContact CB-CD1 4.05Å; D155-I158 HydrophobicContact CB-CG1 4.27Å; D155-I158 PolarHBondContact O-N 2.79Å; P156-I158 VanDerWaalsContact C-N 3.34Å; I158-I170 HydrophobicContact CG2-CG2 3.77Å; I158-W171 WeakPolarHBondContact CA-O 3.25Å; I158-F205 HydrophobicContact CG2-CE1 4.26Å; I158-F205 HydrophobicContact CG2-CE2 4.3Å; I158-F205 HydrophobicContact CG2-CZ 3.63Å; I158-R212 HydrophobicContact CD1-CG 4.13Å
159	I	98.2	Very high	96.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	135.9	169	-62.7	-173.9	0	0	0	109.3	A111 L117 F149 D150 W151 T161 W171 L173	A111-I159 HydrophobicContact CB-CD1 4.14Å; L117-I159 HydrophobicContact CD1-CG2 4.44Å; L117-I159 HydrophobicContact CD2-CB 4.18Å; L117-I159 HydrophobicContact CD2-CD1 4.27Å; L117-I159 HydrophobicContact CD2-CG2 3.62Å; F149-I159 HydrophobicContact CB-CG2 4.18Å; F149-I159 HydrophobicContact CD2-CG2 3.76Å; F149-I159 HydrophobicContact CG-CG2 4.36Å; D150-I159 WeakPolarHBondContact O-CA 3.12Å; W151-I159 HydrophobicContact CB-CG1 4.36Å; W151-I159 HydrophobicContact CD2-CD1 3.65Å; W151-I159 HydrophobicContact CD2-CG1 3.87Å; W151-I159 HydrophobicContact CE3-CD1 3.93Å; W151-I159 HydrophobicContact CG-CD1 4.06Å; W151-I159 HydrophobicContact CG-CG1 3.75Å; W151-I159 HydrophobicContact CH2-CD1 4.32Å; W151-I159 HydrophobicContact CZ2-CD1 4.07Å; W151-I159 HydrophobicContact CZ3-CD1 4.26Å; I159-T161 HydrophobicContact CG2-CG2 4.33Å; I159-W171 HydrophobicContact CB-CB 4.47Å; I159-W171 PolarHBondContact N-O 2.8Å; I159-W171 PolarHBondContact O-N 3.4Å; I159-L173 HydrophobicContact CD1-CD1 3.6Å; I159-L173 HydrophobicContact CG1-CD1 3.86Å
160	G	98.3	Very high	96.8	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	134.3	170.5	0	0	0	0	0	110.2	F149 D150 T169	F149-G160 CarbonylContact C-O 3.58Å; F149-G160 WeakPolarHBondContact CA-O 3.23Å; F149-G160 WeakPolarHBondContact CB-O 3.49Å; D150-G160 PolarHBondContact N-O 3.22Å; D150-G160 PolarHBondContact O-N 3.17Å; G160-T169 CarbonylContact C-O 3.5Å; G160-T169 WeakPolarHBondContact CA-O 3.47Å
161	T	98.6	Very high	96.8	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.006	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	141.7	177.7	59.2	0	0	0	0	110.7	L117 L146 F149 I159 C168 T169 W171	L117-T161 HydrophobicContact CB-CG2 4.15Å; L117-T161 HydrophobicContact CD1-CG2 4.38Å; L117-T161 HydrophobicContact CD2-CG2 3.68Å; L117-T161 HydrophobicContact CG-CG2 4.29Å; L146-T161 HydrophobicContact CD1-CG2 3.91Å; F149-T161 HydrophobicContact CB-CG2 3.79Å; I159-T161 HydrophobicContact CG2-CG2 4.33Å; T161-C168 CarbonylContact O-C 3.46Å; T161-C168 VanDerWaalsContact O-CA 3.26Å; T161-C168 WeakPolarHBondContact O-CA 3.4Å; T161-T169 PolarHBondContact N-O 2.88Å; T161-T169 PolarHBondContact O-N 3.03Å; T161-T169 WeakPolarHBondContact OG1-CB 3.39Å; T161-T169 PolarHBondContact OG1-O 3.04Å; T161-W171 VanDerWaalsContact CG2-NE1 3.32Å; T161-W171 PolarHBondContact OG1-NE1 2.81Å
162	S	98.5	Very high	96.7	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	150.4	170	59	0	0	0	0	110.8	L146 T147 S148	L146-S162 CarbonylContact C-O 3.56Å; L146-S162 VanDerWaalsContact CA-O 3.29Å; L146-S162 WeakPolarHBondContact CA-O 3.33Å; T147-S162 PolarHBondContact N-O 2.87Å; T147-S162 VanDerWaalsContact OG1-C 3.32Å; T147-S162 WeakPolarHBondContact OG1-CB 3.35Å; T147-S162 PolarHBondContact OG1-O 2.94Å; T147-S162 PolarHBondContact OG1-OG 2.86Å; S148-S162 VanDerWaalsContact CB-OG 3.31Å; S148-S162 WeakPolarHBondContact CB-OG 3.43Å; S148-S162 PolarHBondContact N-OG 3.15Å; S148-S162 PolarHBondContact O-N 3.36Å; S148-S162 PolarHBondContact O-OG 2.71Å
163	S	97.7	Very high	96.5	Very high	4 Å²	4	23.4 Å²	23.4	3%	0.028	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	156.8	-175	176	0	0	0	0	112	A144 D165 T166 T167 V200	A144-S163 WeakPolarHBondContact CB-OG 3.34Å; S163-D165 WeakPolarHBondContact CB-OD1 3.44Å; S163-D165 PolarHBondContact O-N 3.46Å; S163-D165 PolarHBondContact OG-N 2.93Å; S163-D165 PolarHBondContact OG-OD1 3.13Å; S163-D165 PolarHBondContact OG-OD2 3.01Å; S163-T166 PolarHBondContact O-N 3.08Å; S163-T167 PolarHBondContact N-O 3.4Å; S163-T167 VanDerWaalsContact N-O 3.12Å; S163-V200 PolarHBondContact O-N 3.13Å; S163-V200 VanDerWaalsContact O-N 3.14Å
164	I	96.6	Very high	96.3	Very high	73 Å²	73	24.7 Å²	24.7	37%	0.374	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.8	172.1	67.2	164.3	0	0	0	112.4	A144 P145 T147 T166 E199	A144-I164 HydrophobicContact CB-CG1 3.88Å; P145-I164 HydrophobicContact CG-CD1 3.61Å; P145-I164 HydrophobicContact CG-CG1 3.91Å; P145-I164 HydrophobicContact CG-CG2 4.36Å; P145-I164 PolarHBondContact O-N 2.84Å; T147-I164 HydrophobicContact CG2-CG2 3.41Å; T147-I164 VanDerWaalsContact CG2-CG2 3.41Å; I164-T166 PolarHBondContact O-N 3.11Å; I164-E199 HydrophobicContact CB-CG 4.01Å; I164-E199 HydrophobicContact CG2-CG 4.47Å; I164-E199 WeakPolarHBondContact O-CG 3.23Å
165	D	95.2	Very high	95.5	Very high	66 Å²	66	20.9 Å²	20.9	35%	0.353	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	19.5	178.2	67.5	11.1	0	0	0	114.2	A144 S163 T167	A144-D165 HydrophobicContact CB-CB 3.57Å; S163-D165 WeakPolarHBondContact CB-OD1 3.44Å; S163-D165 PolarHBondContact O-N 3.46Å; S163-D165 PolarHBondContact OG-N 2.93Å; S163-D165 PolarHBondContact OG-OD1 3.13Å; S163-D165 PolarHBondContact OG-OD2 3.01Å; D165-T167 PolarHBondContact O-N 3Å; D165-T167 VanDerWaalsContact OD1-CB 3.31Å; D165-T167 WeakPolarHBondContact OD1-CB 3.33Å; D165-T167 WeakPolarHBondContact OD1-CG2 3.31Å; D165-T167 PolarHBondContact OD1-N 2.92Å; D165-T167 PolarHBondContact OD1-OG1 2.91Å
166	T	97	Very high	94.6	Very high	37 Å²	37	22.2 Å²	22.2	23%	0.227	12%	0.118	C	C	.	.	S	Bend	trans	72.2	0.4	-179	79.9	0	0	0	0	115.3	S163 I164 A195 H196 K198 V200	S163-T166 PolarHBondContact O-N 3.08Å; I164-T166 PolarHBondContact O-N 3.11Å; T166-A195 PolarHBondContact O-N 3.48Å; T166-H196 WeakPolarHBondContact CB-O 3.24Å; T166-H196 PolarHBondContact O-N 2.78Å; T166-K198 WeakPolarHBondContact CA-O 3.37Å; T166-K198 WeakPolarHBondContact CB-O 3.36Å; T166-K198 WeakPolarHBondContact CG2-O 3.34Å; T166-V200 VanDerWaalsContact C-CG2 3.48Å; T166-V200 WeakPolarHBondContact O-CG2 3.45Å
167	T	96.8	Very high	93.2	Very high	14 Å²	14	27.8 Å²	27.8	9%	0.086	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	151.2	-174.5	73.8	0	0	0	0	114.6	S163 D165 Q192 L193 I194	S163-T167 PolarHBondContact N-O 3.4Å; S163-T167 VanDerWaalsContact N-O 3.12Å; D165-T167 PolarHBondContact O-N 3Å; D165-T167 VanDerWaalsContact OD1-CB 3.31Å; D165-T167 WeakPolarHBondContact OD1-CB 3.33Å; D165-T167 WeakPolarHBondContact OD1-CG2 3.31Å; D165-T167 PolarHBondContact OD1-N 2.92Å; D165-T167 PolarHBondContact OD1-OG1 2.91Å; T167-Q192 HydrophobicContact CG2-CG 4.46Å; T167-Q192 PolarHBondContact OG1-NE2 2.76Å; T167-L193 CarbonylContact C-O 3.53Å; T167-L193 WeakPolarHBondContact CA-O 3.32Å; T167-L193 VanDerWaalsContact CB-O 3.23Å; T167-L193 WeakPolarHBondContact CB-O 3.5Å; T167-I194 HydrophobicContact CG2-CG1 4.36Å
168	C	97.7	Very high	91.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	135.2	157.1	-72.6	0	0	0	0	109.1	T161 Q192 L193 A195 I203 F215	T161-C168 CarbonylContact O-C 3.46Å; T161-C168 VanDerWaalsContact O-CA 3.26Å; T161-C168 WeakPolarHBondContact O-CA 3.4Å; C168-Q192 WeakPolarHBondContact O-CA 3.27Å; C168-L193 HydrophobicContact CB-CD2 4.41Å; C168-L193 HydrophobicContact CB-CG 4.27Å; C168-L193 PolarHBondContact N-O 2.87Å; C168-L193 PolarHBondContact O-N 2.94Å; C168-A195 HydrophobicContact CB-CB 4.08Å; C168-A195 VanDerWaalsContact SG-CB 3.55Å; C168-I203 HydrophobicContact CB-CD1 4.2Å; C168-F215 HydrophobicContact CB-CE2 4.35Å
169	T	97.2	Very high	89.6	Confident	8 Å²	8	37.4 Å²	37.4	5%	0.049	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.3	176	-55.4	0	0	0	0	109.7	G160 T161 W171 V189 Q192	G160-T169 CarbonylContact C-O 3.5Å; G160-T169 WeakPolarHBondContact CA-O 3.47Å; T161-T169 PolarHBondContact N-O 2.88Å; T161-T169 PolarHBondContact O-N 3.03Å; T161-T169 WeakPolarHBondContact OG1-CB 3.39Å; T161-T169 PolarHBondContact OG1-O 3.04Å; T169-W171 HydrophobicContact CG2-CD2 4.14Å; T169-W171 HydrophobicContact CG2-CH2 4.47Å; T169-W171 HydrophobicContact CG2-CZ2 3.75Å; T169-V189 HydrophobicContact CG2-CB 4.45Å; T169-V189 HydrophobicContact CG2-CG1 3.85Å; T169-V189 HydrophobicContact CG2-CG2 3.93Å; T169-Q192 HydrophobicContact CG2-CB 4.41Å; T169-Q192 WeakPolarHBondContact OG1-CG 3.41Å
170	I	97.6	Very high	87.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	126.8	176.2	-49.9	-63.1	0	0	0	107.9	I158 E190 S191 I203 F205 F215 L229	I158-I170 HydrophobicContact CG2-CG2 3.77Å; I170-E190 PolarHBondContact O-N 2.99Å; I170-S191 WeakPolarHBondContact CB-OG 3.15Å; I170-S191 WeakPolarHBondContact CG1-OG 3.49Å; I170-S191 PolarHBondContact N-O 2.89Å; I170-S191 PolarHBondContact O-N 2.86Å; I170-I203 HydrophobicContact CD1-CD1 4.5Å; I170-F205 HydrophobicContact CD1-CZ 4.25Å; I170-F215 HydrophobicContact CD1-CD1 4.35Å; I170-F215 HydrophobicContact CD1-CE1 4.06Å; I170-F215 HydrophobicContact CD1-CZ 4.36Å; I170-L229 HydrophobicContact CB-CD2 4.44Å; I170-L229 HydrophobicContact CD1-CD2 3.98Å; I170-L229 HydrophobicContact CG1-CD2 3.62Å; I170-L229 HydrophobicContact CG2-CD1 4.34Å; I170-L229 HydrophobicContact CG2-CD2 4.27Å
171	W	97.1	Very high	84.7	Confident	10 Å²	10	47.6 Å²	47.6	4%	0.038	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.7	-175.9	-57.1	89.2	0	0	0	109.2	L117 L134 N136 I158 I159 T161 T169 R188 V189	L117-W171 HydrophobicContact CD2-CG 4.18Å; L134-W171 HydrophobicContact CB-CD2 4.11Å; L134-W171 HydrophobicContact CB-CE3 3.77Å; L134-W171 HydrophobicContact CB-CH2 3.94Å; L134-W171 HydrophobicContact CB-CZ2 4.31Å; L134-W171 HydrophobicContact CB-CZ3 3.67Å; L134-W171 HydrophobicContact CD1-CD2 4.46Å; L134-W171 HydrophobicContact CD1-CE3 4.46Å; L134-W171 HydrophobicContact CD2-CE3 3.82Å; L134-W171 HydrophobicContact CD2-CZ3 4.15Å; L134-W171 HydrophobicContact CG-CE3 4.2Å; L134-W171 HydrophobicContact CG-CZ3 4.46Å; N136-W171 HydrophobicContact CB-CH2 3.82Å; N136-W171 HydrophobicContact CB-CZ2 4.33Å; I158-W171 WeakPolarHBondContact CA-O 3.25Å; I159-W171 HydrophobicContact CB-CB 4.47Å; I159-W171 PolarHBondContact N-O 2.8Å; I159-W171 PolarHBondContact O-N 3.4Å; T161-W171 VanDerWaalsContact CG2-NE1 3.32Å; T161-W171 PolarHBondContact OG1-NE1 2.81Å; T169-W171 HydrophobicContact CG2-CD2 4.14Å; T169-W171 HydrophobicContact CG2-CH2 4.47Å; T169-W171 HydrophobicContact CG2-CZ2 3.75Å; W171-R188 WeakPolarHBondContact CA-O 3.38Å; W171-V189 HydrophobicContact CD2-CG2 4.41Å; W171-V189 HydrophobicContact CE3-CG2 3.75Å; W171-V189 HydrophobicContact CH2-CG2 3.69Å; W171-V189 HydrophobicContact CZ2-CG2 4.33Å; W171-V189 HydrophobicContact CZ3-CG2 3.35Å
172	A	95.3	Very high	82.6	Confident	17 Å²	17	52.7 Å²	52.7	14%	0.14	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.7	165.4	0	0	0	0	0	108.7	N157 G187 R188 E190	N157-A172 CarbonylContact O-C 3.55Å; N157-A172 WeakPolarHBondContact O-CA 3.46Å; A172-G187 CarbonylContact O-C 3.5Å; A172-G187 WeakPolarHBondContact O-CA 3.43Å; A172-R188 HydrophobicContact CB-CG 4.29Å; A172-R188 PolarHBondContact N-O 3.38Å; A172-R188 PolarHBondContact O-N 2.87Å; A172-E190 HydrophobicContact CB-CB 4.2Å
173	L	94.1	Very high	80.8	Confident	7 Å²	7	57.2 Å²	57.2	4%	0.037	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	147.5	176.8	-54.9	-174.9	0	0	0	110.3	V119 L134 W151 N157 I159 T175 S186	V119-L173 HydrophobicContact CG2-CD1 4.36Å; L134-L173 HydrophobicContact CD1-CD2 3.54Å; L134-L173 HydrophobicContact CD2-CD2 4.21Å; L134-L173 HydrophobicContact CG-CD2 4.5Å; W151-L173 HydrophobicContact CZ2-CD1 3.82Å; N157-L173 VanDerWaalsContact CB-O 3.25Å; N157-L173 WeakPolarHBondContact CB-O 3.34Å; N157-L173 PolarHBondContact O-N 3.19Å; N157-L173 PolarHBondContact OD1-O 2.78Å; I159-L173 HydrophobicContact CD1-CD1 3.6Å; I159-L173 HydrophobicContact CG1-CD1 3.86Å; L173-T175 HydrophobicContact CB-CG2 3.81Å; L173-T175 HydrophobicContact CD1-CG2 4.09Å; L173-S186 CarbonylContact C-O 3.56Å; L173-S186 WeakPolarHBondContact CA-O 3.25Å
174	E	90.6	Very high	79.8	Confident	97 Å²	97	60.8 Å²	60.8	45%	0.453	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	79.7	166.5	-67.9	170.5	-179.7	0	0	106.4	E176 S186 R188	E174-E176 PolarHBondContact O-N 3.1Å; E174-S186 PolarHBondContact N-O 2.96Å; E174-S186 PolarHBondContact OE2-OG 2.67Å; E174-R188 IonicContact OE1-NH1 2.87Å; E174-R188 PolarHBondContact OE1-NH1 3.47Å
175	T	79.3	Confident	79.3	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	33%	0.327	C	S	.	.			trans	-72.5	-18.8	-173.3	55.9	0	0	0	0	113.9	I99 F106 L109 W151 P156 N157 L173	I99-T175 HydrophobicContact CD1-CG2 4.28Å; F106-T175 VanDerWaalsContact CD1-OG1 3.24Å; F106-T175 WeakPolarHBondContact CD1-OG1 3.33Å; F106-T175 VanDerWaalsContact CE1-OG1 3.27Å; F106-T175 WeakPolarHBondContact CE1-OG1 3.43Å; L109-T175 HydrophobicContact CD1-CG2 4.09Å; W151-T175 HydrophobicContact CZ2-CG2 4.3Å; P156-T175 WeakPolarHBondContact O-CG2 3.24Å; N157-T175 PolarHBondContact OD1-N 3.02Å; N157-T175 PolarHBondContact OD1-OG1 3.4Å; L173-T175 HydrophobicContact CB-CG2 3.81Å; L173-T175 HydrophobicContact CD1-CG2 4.09Å
176	E	75.1	Confident	79	Confident	61 Å²	61	56.4 Å²	56.4	29%	0.285	33%	0.326	S	S	.	.			trans	56.1	140.1	-173.7	-56.9	-163.5	145.1	0	0	114	F106 P107 E174 N183	F106-E176 WeakPolarHBondContact CD1-O 3.39Å; P107-E176 WeakPolarHBondContact CD-O 3.27Å; E174-E176 PolarHBondContact O-N 3.1Å; E176-N183 VanDerWaalsContact OE1-CB 3.24Å; E176-N183 WeakPolarHBondContact OE1-CB 3.41Å; E176-N183 PolarHBondContact OE1-ND2 3.16Å; E176-N183 PolarHBondContact OE2-N 2.8Å
177	Q	65	Low	78.8	Confident	132 Å²	132	56 Å²	56	62%	0.617	33%	0.329	S	S	*	.			trans	-79.8	150.5	168.8	-66.1	-176.2	-5	0	0	109	I105 F106 I179	I105-Q177 HydrophobicContact CG2-CB 4.45Å; I105-Q177 HydrophobicContact CG2-CG 4.05Å; F106-Q177 HydrophobicContact CE1-CG 4.23Å; Q177-I179 PolarHBondContact O-N 3.09Å
178	V	60.8	Low	78.6	Confident	95 Å²	95	62.7 Å²	62.7	58%	0.576	35%	0.353	S	S	*	.	S	Bend	trans	-55.8	-18.8	-175.2	170.7	0	0	0	0	113.8	I105	I105-V178 VanDerWaalsContact O-CG2 3.25Å; I105-V178 WeakPolarHBondContact O-CG2 3.33Å; I105-V178 PolarHBondContact O-N 3.39Å
179	I	54.7	Low	78.4	Confident	164 Å²	164	65 Å²	65	84%	0.841	37%	0.366	S	S	*	.	S	Bend	trans	-99.5	95.9	-176.9	-50.4	176.3	0	0	0	110.9	Q177	Q177-I179 PolarHBondContact O-N 3.09Å
180	G	46.7	Very low	78.3	Confident	51 Å²	51	69.6 Å²	69.6	53%	0.526	39%	0.387	S	S	.	.	S	Bend	trans	122	92.4	159.1	0	0	0	0	0	116.4
181	H	47.3	Very low	78.2	Confident	162 Å²	162	70.8 Å²	70.8	75%	0.75	40%	0.395	S	S	*	.			trans	75.3	94.5	163.2	-60.4	-75.3	0	0	0	118.7	N183	H181-N183 PolarHBondContact O-N 2.9Å; H181-N183 PolarHBondContact O-ND2 2.84Å
182	A	53.4	Low	78.1	Confident	108 Å²	108	74.6 Å²	74.6	89%	0.893	41%	0.414	S	S	*	.			trans	32.7	12.4	132.6	0	0	0	0	0	123.2
183	N	62.3	Low	78.1	Confident	96 Å²	96	74.8 Å²	74.8	51%	0.513	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-88.3	155.2	178.7	-46.3	-48.8	0	0	0	111.3	E176 H181	E176-N183 VanDerWaalsContact OE1-CB 3.24Å; E176-N183 WeakPolarHBondContact OE1-CB 3.41Å; E176-N183 PolarHBondContact OE1-ND2 3.16Å; E176-N183 PolarHBondContact OE2-N 2.8Å; H181-N183 PolarHBondContact O-N 2.9Å; H181-N183 PolarHBondContact O-ND2 2.84Å
184	V	76.8	Confident	78.2	Confident	79 Å²	79	80.6 Å²	80.6	48%	0.479	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-81.3	139.7	179.6	179.8	0	0	0	0	108	E131 S186	E131-V184 HydrophobicContact CB-CG1 4.4Å; E131-V184 WeakPolarHBondContact O-CG1 3.42Å; V184-S186 PolarHBondContact O-N 3.16Å; V184-S186 VanDerWaalsContact O-N 3.17Å
185	V	85.3	Confident	78.5	Confident	2 Å²	2	76 Å²	76	1%	0.012	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-57	124.6	174.6	178.6	0	0	0	0	108.9	L109 V119 E131 C132	L109-V185 HydrophobicContact CD1-CG2 3.85Å; L109-V185 HydrophobicContact CD2-CG2 3.99Å; V119-V185 HydrophobicContact CG1-CG1 4.39Å; E131-V185 HydrophobicContact CB-CB 3.98Å; E131-V185 HydrophobicContact CB-CG2 4.31Å; E131-V185 HydrophobicContact CG-CG2 4.43Å; E131-V185 PolarHBondContact OE2-N 2.93Å; C132-V185 HydrophobicContact CB-CG1 4.34Å; C132-V185 WeakPolarHBondContact CB-O 3.47Å; C132-V185 PolarHBondContact SG-O 2.63Å
186	S	89.3	Confident	79.4	Confident	45 Å²	45	76.1 Å²	76.1	32%	0.315	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	161	177.5	101.7	0	0	0	0	109.7	L173 E174 V184	L173-S186 CarbonylContact C-O 3.56Å; L173-S186 WeakPolarHBondContact CA-O 3.25Å; E174-S186 PolarHBondContact N-O 2.96Å; E174-S186 PolarHBondContact OE2-OG 2.67Å; V184-S186 PolarHBondContact O-N 3.16Å; V184-S186 VanDerWaalsContact O-N 3.17Å
187	G	91.5	Very high	80.3	Confident	29 Å²	29	78.8 Å²	78.8	30%	0.299	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	160.1	169.4	0	0	0	0	0	113	A172	A172-G187 CarbonylContact O-C 3.5Å; A172-G187 WeakPolarHBondContact O-CA 3.43Å
188	R	93	Very high	81.9	Confident	154 Å²	154	77.2 Å²	77.2	58%	0.581	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141	156.5	-177.8	62.8	178.1	179.1	-105.6	-0.8	110.3	W171 A172 E174 E190	W171-R188 WeakPolarHBondContact CA-O 3.38Å; A172-R188 HydrophobicContact CB-CG 4.29Å; A172-R188 PolarHBondContact N-O 3.38Å; A172-R188 PolarHBondContact O-N 2.87Å; E174-R188 IonicContact OE1-NH1 2.87Å; E174-R188 PolarHBondContact OE1-NH1 3.47Å; R188-E190 PolarHBondContact O-N 2.82Å
189	V	94.7	Very high	83.7	Confident	47 Å²	47	76.5 Å²	76.5	29%	0.285	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	123.5	167.8	178.6	0	0	0	0	108.5	N136 T169 W171 Q192	N136-V189 HydrophobicContact CB-CG2 3.97Å; T169-V189 HydrophobicContact CG2-CB 4.45Å; T169-V189 HydrophobicContact CG2-CG1 3.85Å; T169-V189 HydrophobicContact CG2-CG2 3.93Å; W171-V189 HydrophobicContact CD2-CG2 4.41Å; W171-V189 HydrophobicContact CE3-CG2 3.75Å; W171-V189 HydrophobicContact CH2-CG2 3.69Å; W171-V189 HydrophobicContact CZ2-CG2 4.33Å; W171-V189 HydrophobicContact CZ3-CG2 3.35Å; V189-Q192 HydrophobicContact CG1-CB 4.44Å
190	E	94.6	Very high	85.8	Confident	105 Å²	105	68.7 Å²	68.7	49%	0.491	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-44.1	171.3	-176	168.1	-171.9	0	0	110.3	I170 A172 R188	I170-E190 PolarHBondContact O-N 2.99Å; A172-E190 HydrophobicContact CB-CB 4.2Å; R188-E190 PolarHBondContact O-N 2.82Å
191	S	94.6	Very high	88.3	Confident	25 Å²	25	68.7 Å²	68.7	18%	0.175	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	150.1	174.7	63.2	0	0	0	0	111.2	I170	I170-S191 WeakPolarHBondContact CB-OG 3.15Å; I170-S191 WeakPolarHBondContact CG1-OG 3.49Å; I170-S191 PolarHBondContact N-O 2.89Å; I170-S191 PolarHBondContact O-N 2.86Å
192	Q	94.8	Very high	90.7	Very high	91 Å²	91	61.2 Å²	61.2	43%	0.425	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	138	168.5	-177.6	-178.6	19.2	0	0	108.4	N136 T167 C168 T169 V189	N136-Q192 PolarHBondContact ND2-OE1 3.03Å; T167-Q192 HydrophobicContact CG2-CG 4.46Å; T167-Q192 PolarHBondContact OG1-NE2 2.76Å; C168-Q192 WeakPolarHBondContact O-CA 3.27Å; T169-Q192 HydrophobicContact CG2-CB 4.41Å; T169-Q192 WeakPolarHBondContact OG1-CG 3.41Å; V189-Q192 HydrophobicContact CG1-CB 4.44Å
193	L	95.8	Very high	92.9	Very high	20 Å²	20	56.1 Å²	56.1	11%	0.105	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	151.3	-179.5	64.5	118	0	0	0	111.1	T167 C168 A195 F215 F227 L232	T167-L193 CarbonylContact C-O 3.53Å; T167-L193 WeakPolarHBondContact CA-O 3.32Å; T167-L193 VanDerWaalsContact CB-O 3.23Å; T167-L193 WeakPolarHBondContact CB-O 3.5Å; C168-L193 HydrophobicContact CB-CD2 4.41Å; C168-L193 HydrophobicContact CB-CG 4.27Å; C168-L193 PolarHBondContact N-O 2.87Å; C168-L193 PolarHBondContact O-N 2.94Å; L193-A195 HydrophobicContact CD1-CB 3.8Å; L193-A195 PolarHBondContact O-N 2.8Å; L193-F215 HydrophobicContact CD2-CZ 3.93Å; L193-F227 HydrophobicContact CD1-CD1 3.61Å; L193-F227 HydrophobicContact CD1-CE1 3.33Å; L193-F227 HydrophobicContact CD1-CZ 4.06Å; L193-L232 HydrophobicContact CD2-CD1 4.38Å; L193-L232 HydrophobicContact CD2-CD2 3.86Å
194	I	95.8	Very high	94.6	Very high	130 Å²	130	52 Å²	52	67%	0.667	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	107	165.6	-62.1	171.9	0	0	0	106.4	T167 H196	T167-I194 HydrophobicContact CG2-CG1 4.36Å; I194-H196 VanDerWaalsContact CG2-O 3.23Å; I194-H196 WeakPolarHBondContact CG2-O 3.23Å
195	A	97.6	Very high	95.6	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.008	25%	0.246	C	C	.	.			trans	-85.8	-39.8	-173.1	0	0	0	0	0	111.6	T166 C168 L193 V200 R225 F227	T166-A195 PolarHBondContact O-N 3.48Å; C168-A195 HydrophobicContact CB-CB 4.08Å; C168-A195 VanDerWaalsContact SG-CB 3.55Å; L193-A195 HydrophobicContact CD1-CB 3.8Å; L193-A195 PolarHBondContact O-N 2.8Å; A195-V200 HydrophobicContact CB-CG2 4.12Å; A195-R225 WeakPolarHBondContact O-CD 3.43Å; A195-R225 PolarHBondContact O-NH1 2.8Å; A195-F227 HydrophobicContact CB-CE1 4.37Å; A195-F227 HydrophobicContact CB-CE2 4.37Å; A195-F227 HydrophobicContact CB-CZ 3.78Å
196	H	97.6	Very high	96.2	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.009	25%	0.245	C	C	.	.			trans	-129.1	168.2	-179	-67.8	-99.9	0	0	0	109.8	T166 I194 K198 V200 S217 D221 S223 R225	T166-H196 WeakPolarHBondContact CB-O 3.24Å; T166-H196 PolarHBondContact O-N 2.78Å; I194-H196 VanDerWaalsContact CG2-O 3.23Å; I194-H196 WeakPolarHBondContact CG2-O 3.23Å; H196-K198 VanDerWaalsContact C-N 3.33Å; H196-K198 WeakPolarHBondContact CB-O 3.25Å; H196-V200 HydrophobicContact CB-CG2 4.24Å; H196-S217 PolarHBondContact CD2-OG 2.94Å; H196-S217 PolarHBondContact NE2-OG 2.85Å; H196-D221 IonicContact CE1-OD1 3.22Å; H196-D221 IonicContact CE1-OD2 3.59Å; H196-D221 IonicContact CG-OD2 2.86Å; H196-D221 IonicContact ND1-OD1 3.44Å; H196-D221 PolarHBondContact ND1-OD1 2.87Å; H196-D221 IonicContact ND1-OD2 3.05Å; H196-D221 PolarHBondContact ND1-OD2 3.47Å; H196-S223 PolarHBondContact CE1-O 3.13Å; H196-S223 PolarHBondContact CE1-OG 3.36Å; H196-S223 PolarHBondContact ND1-OG 3.18Å; H196-R225 PolarHBondContact ND1-NE 3.1Å
197	D	95.4	Very high	96.4	Very high	117 Å²	117	52 Å²	52	63%	0.626	25%	0.251	S	S	*	.	S	Bend	trans	-90.6	-0.6	172.1	62	-3.2	0	0	0	112.9	D221	D197-D221 WeakPolarHBondContact OD1-CB 3.21Å
198	K	98	Very high	96.3	Very high	98 Å²	98	52 Å²	52	43%	0.426	25%	0.248	S	C	.	.	S	Bend	trans	-135.9	-176	171	-60.5	-175.8	-175	171.4	0	110.5	T166 H196 V200 A220 D221	T166-K198 WeakPolarHBondContact CA-O 3.37Å; T166-K198 WeakPolarHBondContact CB-O 3.36Å; T166-K198 WeakPolarHBondContact CG2-O 3.34Å; H196-K198 VanDerWaalsContact C-N 3.33Å; H196-K198 WeakPolarHBondContact CB-O 3.25Å; K198-V200 PolarHBondContact O-N 3.44Å; K198-A220 HydrophobicContact CB-CB 3.77Å; K198-A220 HydrophobicContact CD-CB 4.12Å; K198-A220 WeakPolarHBondContact CD-O 3.18Å; K198-D221 HydrophobicContact CB-CB 4.46Å; K198-D221 HydrophobicContact CD-CB 4.44Å; K198-D221 HydrophobicContact CG-CB 4.47Å
199	E	98.4	Very high	96	Very high	80 Å²	80	47.7 Å²	47.7	37%	0.374	25%	0.252	S	S	.	.			trans	-50.8	135.6	-178.8	-62.3	78.1	179.3	0	0	112	I164 Y201 G219 A220	I164-E199 HydrophobicContact CB-CG 4.01Å; I164-E199 HydrophobicContact CG2-CG 4.47Å; I164-E199 WeakPolarHBondContact O-CG 3.23Å; E199-Y201 HydrophobicContact CB-CE1 3.97Å; E199-G219 CarbonylContact O-C 3.42Å; E199-G219 WeakPolarHBondContact O-CA 3.46Å; E199-A220 HydrophobicContact CB-CB 4.16Å; E199-A220 PolarHBondContact O-N 2.92Å; E199-A220 WeakPolarHBondContact OE2-CB 3.47Å
200	V	98.7	Very high	95.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	127.2	172.8	-166.4	0	0	0	0	107.8	T147 S163 T166 A195 H196 K198 V218	T147-V200 VanDerWaalsContact CB-O 3.29Å; T147-V200 WeakPolarHBondContact CB-O 3.34Å; T147-V200 VanDerWaalsContact CG2-O 3.27Å; T147-V200 WeakPolarHBondContact CG2-O 3.3Å; T147-V200 PolarHBondContact OG1-O 2.9Å; S163-V200 PolarHBondContact O-N 3.13Å; S163-V200 VanDerWaalsContact O-N 3.14Å; T166-V200 VanDerWaalsContact C-CG2 3.48Å; T166-V200 WeakPolarHBondContact O-CG2 3.45Å; A195-V200 HydrophobicContact CB-CG2 4.12Å; H196-V200 HydrophobicContact CB-CG2 4.24Å; K198-V200 PolarHBondContact O-N 3.44Å; V200-V218 WeakPolarHBondContact CG1-O 3.47Å
201	Y	98.7	Very high	95.6	Very high	51 Å²	51	43.2 Å²	43.2	20%	0.2	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	-29.9	-175.6	-69.1	-46.8	0	0	0	114.5	T147 E199 V218 A220 P246 L247 L248 R249	T147-Y201 HydrophobicContact CG2-CD1 4.37Å; E199-Y201 HydrophobicContact CB-CE1 3.97Å; Y201-V218 PolarHBondContact N-O 3.05Å; Y201-A220 HydrophobicContact CE2-CB 3.59Å; Y201-P246 HydrophobicContact CE2-CB 4Å; Y201-L247 WeakPolarHBondContact CD2-O 3.23Å; Y201-L248 HydrophobicContact CD2-CD2 4.03Å; Y201-L248 HydrophobicContact CE2-CD2 4.29Å; Y201-L248 HydrophobicContact CG-CD2 4.43Å; Y201-R249 PolarHBondContact O-NH1 3.41Å
202	D	98.8	Very high	95.6	Very high	6 Å²	6	47.1 Å²	47.1	3%	0.032	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	156.3	177.1	-154.6	9.6	0	0	0	111.7	K95 S148 S217 V218 R249 L250	K95-D202 IonicContact NZ-OD1 3.61Å; K95-D202 PolarHBondContact NZ-OD1 3.03Å; S148-D202 VanDerWaalsContact CB-OD1 3.25Å; S148-D202 WeakPolarHBondContact CB-OD1 3.49Å; S148-D202 PolarHBondContact OG-OD1 2.73Å; D202-S217 WeakPolarHBondContact O-CA 3.39Å; D202-S217 WeakPolarHBondContact O-CB 3.07Å; D202-V218 HydrophobicContact CB-CG2 3.65Å; D202-V218 PolarHBondContact N-O 3.27Å; D202-V218 PolarHBondContact O-N 2.83Å; D202-R249 WeakPolarHBondContact OD2-CA 3.46Å; D202-R249 VanDerWaalsContact OD2-CD 3.23Å; D202-R249 WeakPolarHBondContact OD2-CD 3.48Å; D202-L250 PolarHBondContact OD2-N 2.94Å; D202-L250 VanDerWaalsContact OD2-N 3.12Å
203	I	98.8	Very high	95.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	139.7	176.3	-176.7	172.7	0	0	0	107.9	D150 C168 I170 F215 A216	D150-I203 WeakPolarHBondContact CB-O 3.36Å; C168-I203 HydrophobicContact CB-CD1 4.2Å; I170-I203 HydrophobicContact CD1-CD1 4.5Å; I203-F215 HydrophobicContact CD1-CD2 3.64Å; I203-F215 HydrophobicContact CD1-CE2 3.87Å; I203-F215 HydrophobicContact CD1-CG 4.31Å; I203-F215 HydrophobicContact CG1-CD2 3.75Å; I203-F215 HydrophobicContact CG1-CE2 4.36Å; I203-F215 HydrophobicContact CG1-CG 4.46Å; I203-A216 CarbonylContact C-O 3.53Å; I203-A216 VanDerWaalsContact CA-O 3.31Å; I203-A216 WeakPolarHBondContact CA-O 3.41Å
204	A	98.7	Very high	95.7	Very high	11 Å²	11	43.5 Å²	43.5	9%	0.091	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	138.3	166.4	0	0	0	0	0	112.9	D150 F215 A216 L250 W252	D150-A204 HydrophobicContact CB-CB 4.38Å; D150-A204 WeakPolarHBondContact OD2-CA 3.27Å; A204-F215 WeakPolarHBondContact O-CA 3.44Å; A204-A216 PolarHBondContact N-O 2.87Å; A204-A216 PolarHBondContact O-N 3.22Å; A204-L250 HydrophobicContact CB-CD1 3.4Å; A204-L250 VanDerWaalsContact CB-CD1 3.4Å; A204-L250 HydrophobicContact CB-CG 4.42Å; A204-W252 PolarHBondContact O-NE1 3.36Å
205	F	98.3	Very high	95.8	Very high	9 Å²	9	37.3 Å²	37.3	4%	0.039	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	132	171.1	-73.2	-78.4	0	0	0	110.2	D150 N152 I158 I170 F215 L229	D150-F205 HydrophobicContact CB-CD2 4.2Å; D150-F205 WeakPolarHBondContact O-CE2 3.01Å; D150-F205 PolarHBondContact OD2-N 3.43Å; N152-F205 HydrophobicContact CB-CD1 4.43Å; N152-F205 HydrophobicContact CB-CD2 3.84Å; N152-F205 HydrophobicContact CB-CE2 3.98Å; N152-F205 HydrophobicContact CB-CG 4.08Å; N152-F205 HydrophobicContact CB-CZ 4.37Å; N152-F205 WeakPolarHBondContact ND2-CD1 3.47Å; N152-F205 WeakPolarHBondContact ND2-CG 3.47Å; I158-F205 HydrophobicContact CG2-CE1 4.26Å; I158-F205 HydrophobicContact CG2-CE2 4.3Å; I158-F205 HydrophobicContact CG2-CZ 3.63Å; I170-F205 HydrophobicContact CD1-CZ 4.25Å; F205-F215 HydrophobicContact CD1-CB 3.82Å; F205-F215 HydrophobicContact CE1-CB 4.14Å; F205-F215 HydrophobicContact CE1-CD1 4.4Å; F205-F215 HydrophobicContact CG-CB 4.3Å; F205-L229 HydrophobicContact CE1-CD1 4.24Å
206	S	96.9	Very high	95.9	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.007	21%	0.206	C	C	.	.			trans	-83.7	152.9	171.2	-172.4	0	0	0	0	109.3	A208 G211 V214	S206-A208 VanDerWaalsContact OG-CB 3.28Å; S206-A208 WeakPolarHBondContact OG-CB 3.46Å; S206-A208 PolarHBondContact OG-N 2.77Å; S206-A208 VanDerWaalsContact OG-N 3.08Å; S206-G211 WeakPolarHBondContact O-CA 3.28Å; S206-V214 PolarHBondContact N-O 3.16Å
207	R	93.8	Very high	95.9	Very high	116 Å²	116	37.1 Å²	37.1	44%	0.438	21%	0.205	S	C	.	.	S	Bend	trans	-82.6	-2.5	165.3	-69.2	-178.4	177.5	-174.6	-8	112.8	E153 G211 K254 A257	E153-R207 IonicContact OE2-CZ 2.64Å; E153-R207 IonicContact OE2-NE 3.63Å; E153-R207 PolarHBondContact OE2-NE 2.87Å; E153-R207 IonicContact OE2-NH2 2.75Å; E153-R207 PolarHBondContact OE2-NH2 3.03Å; R207-G211 PolarHBondContact O-N 2.76Å; R207-K254 PolarHBondContact NH1-O 2.86Å; R207-A257 HydrophobicContact CB-CB 4.2Å
208	A	90.5	Very high	96.1	Very high	27 Å²	27	31.6 Å²	31.6	22%	0.223	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-60	147.1	176	0	0	0	0	0	111.3	S206 G210 G211 A257	S206-A208 VanDerWaalsContact OG-CB 3.28Å; S206-A208 WeakPolarHBondContact OG-CB 3.46Å; S206-A208 PolarHBondContact OG-N 2.77Å; S206-A208 VanDerWaalsContact OG-N 3.08Å; A208-G210 PolarHBondContact O-N 2.9Å; A208-G211 PolarHBondContact O-N 2.86Å; A208-A257 HydrophobicContact CB-CB 4.26Å
209	G	86	Confident	96.1	Very high	65 Å²	65	26.9 Å²	26.9	67%	0.67	16%	0.155	S	C	*	.	G	3₁₀ helix	trans	61.6	25.1	176.1	0	0	0	0	0	115.1
210	G	90.1	Very high	96.1	Very high	56 Å²	56	23.4 Å²	23.4	58%	0.577	14%	0.14	S	C	*	.	G	3₁₀ helix	trans	93.8	-4.7	-176.8	0	0	0	0	0	114	V154 A208 R212	V154-G210 WeakPolarHBondContact CG1-O 3.15Å; A208-G210 PolarHBondContact O-N 2.9Å; G210-R212 VanDerWaalsContact C-N 3.26Å; G210-R212 PolarHBondContact O-N 2.95Å
211	G	91.5	Very high	96.1	Very high	1 Å²	1	24 Å²	24	1%	0.01	14%	0.143	C	C	.	.	S	Bend	trans	78.5	-4.9	167	0	0	0	0	0	117.5	N152 S206 R207 A208	N152-G211 PolarHBondContact ND2-O 2.76Å; N152-G211 PolarHBondContact OD1-O 2.82Å; S206-G211 WeakPolarHBondContact O-CA 3.28Å; R207-G211 PolarHBondContact O-N 2.76Å; A208-G211 PolarHBondContact O-N 2.86Å
212	R	94.5	Very high	96.1	Very high	108 Å²	108	21.5 Å²	21.5	41%	0.408	13%	0.134	S	C	.	.	S	Bend	trans	-81.8	-41.9	177.3	-174.8	173.9	171.1	-92.5	0.5	112.9	N152 D155 I158 G210	N152-R212 PolarHBondContact ND2-O 2.82Å; N152-R212 VanDerWaalsContact ND2-O 3.15Å; D155-R212 HydrophobicContact CB-CG 4.24Å; D155-R212 IonicContact OD2-NE 3.73Å; D155-R212 PolarHBondContact OD2-NE 2.85Å; I158-R212 HydrophobicContact CD1-CG 4.13Å; G210-R212 VanDerWaalsContact C-N 3.26Å; G210-R212 PolarHBondContact O-N 2.95Å
213	D	95.4	Very high	96	Very high	19 Å²	19	21.3 Å²	21.3	10%	0.102	13%	0.133	C	C	.	.	S	Bend	trans	-104.4	-9.9	-162.8	-53.1	-41.9	0	0	0	114	D228 L229 R230	D213-D228 CarbonylContact O-C 3.23Å; D213-D228 WeakPolarHBondContact O-CA 3.45Å; D213-L229 HydrophobicContact CB-CB 4.36Å; D213-L229 WeakPolarHBondContact O-CG 3.5Å; D213-L229 PolarHBondContact O-N 3.14Å; D213-R230 HydrophobicContact CB-CG 4.23Å; D213-R230 WeakPolarHBondContact OD2-CD 3.18Å; D213-R230 IonicContact OD2-CZ 3.06Å; D213-R230 IonicContact OD2-NE 2.94Å; D213-R230 PolarHBondContact OD2-NE 2.68Å; D213-R230 IonicContact OD2-NH1 2.72Å; D213-R230 PolarHBondContact OD2-NH1 3.49Å
214	V	96.7	Very high	96	Very high	15 Å²	15	21.4 Å²	21.4	9%	0.091	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.8	-171.5	-178.6	0	0	0	0	110.8	S206 M226 F227	S206-V214 PolarHBondContact N-O 3.16Å; V214-M226 HydrophobicContact CG1-CE 3.39Å; V214-F227 WeakPolarHBondContact CA-O 3.41Å
215	F	97.9	Very high	96	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	162.5	171.7	70.4	-87.9	0	0	0	111.2	C168 I170 L193 I203 A204 F205 M226 F227 L229 L232	C168-F215 HydrophobicContact CB-CE2 4.35Å; I170-F215 HydrophobicContact CD1-CD1 4.35Å; I170-F215 HydrophobicContact CD1-CE1 4.06Å; I170-F215 HydrophobicContact CD1-CZ 4.36Å; L193-F215 HydrophobicContact CD2-CZ 3.93Å; I203-F215 HydrophobicContact CD1-CD2 3.64Å; I203-F215 HydrophobicContact CD1-CE2 3.87Å; I203-F215 HydrophobicContact CD1-CG 4.31Å; I203-F215 HydrophobicContact CG1-CD2 3.75Å; I203-F215 HydrophobicContact CG1-CE2 4.36Å; I203-F215 HydrophobicContact CG1-CG 4.46Å; A204-F215 WeakPolarHBondContact O-CA 3.44Å; F205-F215 HydrophobicContact CD1-CB 3.82Å; F205-F215 HydrophobicContact CE1-CB 4.14Å; F205-F215 HydrophobicContact CE1-CD1 4.4Å; F205-F215 HydrophobicContact CG-CB 4.3Å; F215-M226 WeakPolarHBondContact O-CA 3.5Å; F215-F227 HydrophobicContact CD1-CB 3.96Å; F215-F227 HydrophobicContact CD2-CB 4.24Å; F215-F227 AromaticContact CD2-CD2 3.93Å; F215-F227 HydrophobicContact CD2-CD2 3.93Å; F215-F227 HydrophobicContact CD2-CG 4.4Å; F215-F227 HydrophobicContact CE1-CB 3.4Å; F215-F227 VanDerWaalsContact CE1-CB 3.4Å; F215-F227 HydrophobicContact CE1-CG 4.14Å; F215-F227 HydrophobicContact CE2-CB 3.74Å; F215-F227 AromaticContact CE2-CD2 3.35Å; F215-F227 HydrophobicContact CE2-CD2 3.35Å; F215-F227 HydrophobicContact CE2-CE2 4.11Å; F215-F227 AromaticContact CE2-CG 3.63Å; F215-F227 HydrophobicContact CE2-CG 3.63Å; F215-F227 HydrophobicContact CG-CB 4.35Å; F215-F227 HydrophobicContact CZ-CB 3.28Å; F215-F227 HydrophobicContact CZ-CD1 4.18Å; F215-F227 AromaticContact CZ-CD2 3.75Å; F215-F227 HydrophobicContact CZ-CD2 3.75Å; F215-F227 AromaticContact CZ-CG 3.47Å; F215-F227 HydrophobicContact CZ-CG 3.47Å; F215-F227 VanDerWaalsContact CZ-CG 3.47Å; F215-F227 PolarHBondContact N-O 2.54Å; F215-F227 VanDerWaalsContact N-O 3.12Å; F215-F227 PolarHBondContact O-N 3.44Å; F215-L229 HydrophobicContact CD1-CD2 3.97Å; F215-L229 HydrophobicContact CD1-CG 4.35Å; F215-L229 HydrophobicContact CE1-CD2 3.59Å; F215-L229 HydrophobicContact CE1-CG 4.37Å; F215-L232 HydrophobicContact CE1-CD2 4.42Å
216	A	98.4	Very high	95.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	155.6	169	0	0	0	0	0	111	I203 A204 V224 R225 M226 L250 W252 L260	I203-A216 CarbonylContact C-O 3.53Å; I203-A216 VanDerWaalsContact CA-O 3.31Å; I203-A216 WeakPolarHBondContact CA-O 3.41Å; A204-A216 PolarHBondContact N-O 2.87Å; A204-A216 PolarHBondContact O-N 3.22Å; A216-V224 HydrophobicContact CB-CG1 4.44Å; A216-R225 CarbonylContact C-O 3.58Å; A216-R225 WeakPolarHBondContact CA-O 3.33Å; A216-R225 WeakPolarHBondContact CB-O 3.46Å; A216-M226 HydrophobicContact CB-CG 4.18Å; A216-L250 HydrophobicContact CB-CD1 4.31Å; A216-L250 HydrophobicContact CB-CD2 4.28Å; A216-W252 HydrophobicContact CB-CH2 4.45Å; A216-W252 HydrophobicContact CB-CZ2 3.58Å; A216-L260 HydrophobicContact CB-CD1 4.48Å
217	S	98.7	Very high	95.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	156.5	170.3	61.7	0	0	0	0	111.6	H196 D202 V224 R225 F227	H196-S217 PolarHBondContact CD2-OG 2.94Å; H196-S217 PolarHBondContact NE2-OG 2.85Å; D202-S217 WeakPolarHBondContact O-CA 3.39Å; D202-S217 WeakPolarHBondContact O-CB 3.07Å; S217-V224 WeakPolarHBondContact O-CA 3.39Å; S217-R225 PolarHBondContact N-O 2.85Å; S217-R225 PolarHBondContact O-N 3.33Å; S217-F227 VanDerWaalsContact OG-CE2 3.25Å; S217-F227 WeakPolarHBondContact OG-CE2 3.27Å
218	V	98.8	Very high	96	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	152.3	171.1	-68.9	0	0	0	0	110.3	V200 Y201 D202 S223 V224 L247 L250	V200-V218 WeakPolarHBondContact CG1-O 3.47Å; Y201-V218 PolarHBondContact N-O 3.05Å; D202-V218 HydrophobicContact CB-CG2 3.65Å; D202-V218 PolarHBondContact N-O 3.27Å; D202-V218 PolarHBondContact O-N 2.83Å; V218-S223 WeakPolarHBondContact CA-O 3.4Å; V218-V224 HydrophobicContact CG1-CB 4.26Å; V218-V224 HydrophobicContact CG1-CG1 4.39Å; V218-V224 HydrophobicContact CG1-CG2 3.7Å; V218-L247 HydrophobicContact CB-CB 3.76Å; V218-L247 HydrophobicContact CG1-CB 4.01Å; V218-L247 HydrophobicContact CG1-CD1 4.25Å; V218-L247 HydrophobicContact CG2-CB 4.45Å; V218-L247 WeakPolarHBondContact CG2-O 3.28Å; V218-L250 HydrophobicContact CB-CD2 4.28Å; V218-L250 HydrophobicContact CG1-CB 4.05Å; V218-L250 HydrophobicContact CG1-CD2 3.77Å; V218-L250 HydrophobicContact CG2-CD2 4.04Å
219	G	98.5	Very high	96.3	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	-177.5	-176.8	0	0	0	0	0	115.2	E199 D221 G222 L247	E199-G219 CarbonylContact O-C 3.42Å; E199-G219 WeakPolarHBondContact O-CA 3.46Å; G219-D221 PolarHBondContact O-N 2.92Å; G219-G222 PolarHBondContact O-N 2.74Å; G219-G222 VanDerWaalsContact O-N 3.09Å; G219-L247 PolarHBondContact O-N 3.34Å
220	A	98.7	Very high	96.6	Very high	7 Å²	7	24.1 Å²	24.1	6%	0.058	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-8.7	178.4	0	0	0	0	0	114.1	K198 E199 Y201	K198-A220 HydrophobicContact CB-CB 3.77Å; K198-A220 HydrophobicContact CD-CB 4.12Å; K198-A220 WeakPolarHBondContact CD-O 3.18Å; E199-A220 HydrophobicContact CB-CB 4.16Å; E199-A220 PolarHBondContact O-N 2.92Å; E199-A220 WeakPolarHBondContact OE2-CB 3.47Å; Y201-A220 HydrophobicContact CE2-CB 3.59Å
221	D	98.1	Very high	96.8	Very high	11 Å²	11	27.1 Å²	27.1	6%	0.059	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-5.9	171.5	72.2	-5.5	0	0	0	113.1	H196 D197 K198 G219 S223 R225	H196-D221 IonicContact CE1-OD1 3.22Å; H196-D221 IonicContact CE1-OD2 3.59Å; H196-D221 IonicContact CG-OD2 2.86Å; H196-D221 IonicContact ND1-OD1 3.44Å; H196-D221 PolarHBondContact ND1-OD1 2.87Å; H196-D221 IonicContact ND1-OD2 3.05Å; H196-D221 PolarHBondContact ND1-OD2 3.47Å; D197-D221 WeakPolarHBondContact OD1-CB 3.21Å; K198-D221 HydrophobicContact CB-CB 4.46Å; K198-D221 HydrophobicContact CD-CB 4.44Å; K198-D221 HydrophobicContact CG-CB 4.47Å; G219-D221 PolarHBondContact O-N 2.92Å; D221-S223 WeakPolarHBondContact OD1-CB 3.06Å; D221-S223 PolarHBondContact OD1-N 2.89Å; D221-S223 PolarHBondContact OD1-OG 3.41Å; D221-S223 PolarHBondContact OD2-OG 2.81Å; D221-R225 IonicContact OD2-CZ 3.79Å; D221-R225 VanDerWaalsContact OD2-CZ 3.31Å; D221-R225 IonicContact OD2-NE 2.81Å; D221-R225 PolarHBondContact OD2-NE 2.91Å; D221-R225 IonicContact OD2-NH2 3.3Å; D221-R225 PolarHBondContact OD2-NH2 3.12Å
222	G	98.3	Very high	96.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	78.1	18.4	177.7	0	0	0	0	0	114.2	G219 E240 D241 S245 L247	G219-G222 PolarHBondContact O-N 2.74Å; G219-G222 VanDerWaalsContact O-N 3.09Å; G222-E240 WeakPolarHBondContact O-CA 3.32Å; G222-D241 PolarHBondContact O-N 2.66Å; G222-S245 WeakPolarHBondContact CA-O 3.38Å; G222-L247 WeakPolarHBondContact O-CD1 3.25Å
223	S	98.4	Very high	96.6	Very high	2 Å²	2	33 Å²	33	1%	0.014	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	149.3	-177.5	71.9	0	0	0	0	113.7	H196 V218 D221 R225 Y239	H196-S223 PolarHBondContact CE1-O 3.13Å; H196-S223 PolarHBondContact CE1-OG 3.36Å; H196-S223 PolarHBondContact ND1-OG 3.18Å; V218-S223 WeakPolarHBondContact CA-O 3.4Å; D221-S223 WeakPolarHBondContact OD1-CB 3.06Å; D221-S223 PolarHBondContact OD1-N 2.89Å; D221-S223 PolarHBondContact OD1-OG 3.41Å; D221-S223 PolarHBondContact OD2-OG 2.81Å; S223-R225 PolarHBondContact OG-NE 2.88Å; S223-Y239 CarbonylContact C-O 3.56Å; S223-Y239 WeakPolarHBondContact CA-O 3.37Å
224	V	98.5	Very high	96.3	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.012	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	118.8	161	-176.8	0	0	0	0	107.3	A216 S217 V218 V238 Y239 L247 L260 T262 L273	A216-V224 HydrophobicContact CB-CG1 4.44Å; S217-V224 WeakPolarHBondContact O-CA 3.39Å; V218-V224 HydrophobicContact CG1-CB 4.26Å; V218-V224 HydrophobicContact CG1-CG1 4.39Å; V218-V224 HydrophobicContact CG1-CG2 3.7Å; V224-V238 PolarHBondContact O-N 2.8Å; V224-Y239 HydrophobicContact CG2-CD1 4.12Å; V224-Y239 PolarHBondContact N-O 3.06Å; V224-Y239 PolarHBondContact O-N 3.05Å; V224-L247 HydrophobicContact CG2-CD1 3.64Å; V224-L260 HydrophobicContact CG1-CD2 4.07Å; V224-L260 HydrophobicContact CG2-CD2 4.45Å; V224-T262 HydrophobicContact CG2-CG2 4.08Å; V224-L273 HydrophobicContact CB-CD1 4.36Å; V224-L273 HydrophobicContact CG2-CD1 3.91Å
225	R	97.9	Very high	96.1	Very high	44 Å²	44	40.1 Å²	40.1	17%	0.166	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	138.1	-179.8	-63.4	-177.3	-174.7	-156.4	0.6	110.7	A195 H196 A216 S217 D221 S223 F227 N236 I237	A195-R225 WeakPolarHBondContact O-CD 3.43Å; A195-R225 PolarHBondContact O-NH1 2.8Å; H196-R225 PolarHBondContact ND1-NE 3.1Å; A216-R225 CarbonylContact C-O 3.58Å; A216-R225 WeakPolarHBondContact CA-O 3.33Å; A216-R225 WeakPolarHBondContact CB-O 3.46Å; S217-R225 PolarHBondContact N-O 2.85Å; S217-R225 PolarHBondContact O-N 3.33Å; D221-R225 IonicContact OD2-CZ 3.79Å; D221-R225 VanDerWaalsContact OD2-CZ 3.31Å; D221-R225 IonicContact OD2-NE 2.81Å; D221-R225 PolarHBondContact OD2-NE 2.91Å; D221-R225 IonicContact OD2-NH2 3.3Å; D221-R225 PolarHBondContact OD2-NH2 3.12Å; S223-R225 PolarHBondContact OG-NE 2.88Å; R225-F227 HydrophobicContact CB-CD2 4.5Å; R225-F227 HydrophobicContact CB-CE2 3.52Å; R225-F227 HydrophobicContact CB-CZ 3.79Å; R225-N236 CarbonylContact C-O 3.33Å; R225-N236 WeakPolarHBondContact CA-O 3.2Å; R225-I237 HydrophobicContact CG-CG1 4.22Å
226	M	97	Very high	95.9	Very high	27 Å²	27	45.5 Å²	45.5	13%	0.133	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	141.4	175.1	-76.5	-168	76.3	0	0	111.5	V214 F215 A216 S235 N236 V238 W252 L275	V214-M226 HydrophobicContact CG1-CE 3.39Å; F215-M226 WeakPolarHBondContact O-CA 3.5Å; A216-M226 HydrophobicContact CB-CG 4.18Å; M226-S235 VanDerWaalsContact O-CA 3.31Å; M226-S235 WeakPolarHBondContact O-CA 3.1Å; M226-N236 PolarHBondContact N-O 3.43Å; M226-N236 PolarHBondContact O-N 3.38Å; M226-V238 HydrophobicContact CB-CG2 4.07Å; M226-V238 HydrophobicContact CG-CG2 3.52Å; M226-V238 HydrophobicContact SD-CG2 3.62Å; M226-W252 HydrophobicContact CE-CH2 3.95Å; M226-W252 HydrophobicContact CE-CZ2 4.37Å; M226-W252 HydrophobicContact SD-CH2 4.17Å; M226-L275 HydrophobicContact CE-CD1 3.73Å; M226-L275 HydrophobicContact SD-CD1 3.72Å; M226-L275 HydrophobicContact SD-CD2 3.48Å; M226-L275 WeakPolarHBondContact SD-CD2 3.5Å; M226-L275 HydrophobicContact SD-CG 4.19Å
227	F	97.3	Very high	95.7	Very high	9 Å²	9	49.1 Å²	49.1	4%	0.039	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	146	-177.2	-57.9	-96.7	0	0	0	110.1	L193 A195 V214 F215 S217 R225	L193-F227 HydrophobicContact CD1-CD1 3.61Å; L193-F227 HydrophobicContact CD1-CE1 3.33Å; L193-F227 HydrophobicContact CD1-CZ 4.06Å; A195-F227 HydrophobicContact CB-CE1 4.37Å; A195-F227 HydrophobicContact CB-CE2 4.37Å; A195-F227 HydrophobicContact CB-CZ 3.78Å; V214-F227 WeakPolarHBondContact CA-O 3.41Å; F215-F227 HydrophobicContact CD1-CB 3.96Å; F215-F227 HydrophobicContact CD2-CB 4.24Å; F215-F227 AromaticContact CD2-CD2 3.93Å; F215-F227 HydrophobicContact CD2-CD2 3.93Å; F215-F227 HydrophobicContact CD2-CG 4.4Å; F215-F227 HydrophobicContact CE1-CB 3.4Å; F215-F227 VanDerWaalsContact CE1-CB 3.4Å; F215-F227 HydrophobicContact CE1-CG 4.14Å; F215-F227 HydrophobicContact CE2-CB 3.74Å; F215-F227 AromaticContact CE2-CD2 3.35Å; F215-F227 HydrophobicContact CE2-CD2 3.35Å; F215-F227 HydrophobicContact CE2-CE2 4.11Å; F215-F227 AromaticContact CE2-CG 3.63Å; F215-F227 HydrophobicContact CE2-CG 3.63Å; F215-F227 HydrophobicContact CG-CB 4.35Å; F215-F227 HydrophobicContact CZ-CB 3.28Å; F215-F227 HydrophobicContact CZ-CD1 4.18Å; F215-F227 AromaticContact CZ-CD2 3.75Å; F215-F227 HydrophobicContact CZ-CD2 3.75Å; F215-F227 AromaticContact CZ-CG 3.47Å; F215-F227 HydrophobicContact CZ-CG 3.47Å; F215-F227 VanDerWaalsContact CZ-CG 3.47Å; F215-F227 PolarHBondContact N-O 2.54Å; F215-F227 VanDerWaalsContact N-O 3.12Å; F215-F227 PolarHBondContact O-N 3.44Å; S217-F227 VanDerWaalsContact OG-CE2 3.25Å; S217-F227 WeakPolarHBondContact OG-CE2 3.27Å; R225-F227 HydrophobicContact CB-CD2 4.5Å; R225-F227 HydrophobicContact CB-CE2 3.52Å; R225-F227 HydrophobicContact CB-CZ 3.79Å
228	D	95.9	Very high	95.6	Very high	35 Å²	35	49.6 Å²	49.6	19%	0.187	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	118.9	170	-176.1	-29	0	0	0	107.9	D213 R230 H231 L232	D213-D228 CarbonylContact O-C 3.23Å; D213-D228 WeakPolarHBondContact O-CA 3.45Å; D228-R230 PolarHBondContact O-N 3Å; D228-R230 VanDerWaalsContact OD1-CB 3.25Å; D228-R230 WeakPolarHBondContact OD1-CB 3.34Å; D228-R230 WeakPolarHBondContact OD1-CG 3.44Å; D228-R230 IonicContact OD1-CZ 3.23Å; D228-R230 PolarHBondContact OD1-N 2.67Å; D228-R230 IonicContact OD1-NE 2.68Å; D228-R230 PolarHBondContact OD1-NE 3.26Å; D228-R230 IonicContact OD1-NH2 2.63Å; D228-R230 IonicContact OD2-CZ 2.87Å; D228-R230 IonicContact OD2-NE 3.63Å; D228-R230 PolarHBondContact OD2-NE 2.68Å; D228-R230 IonicContact OD2-NH2 3.06Å; D228-R230 PolarHBondContact OD2-NH2 3.24Å; D228-H231 CarbonylContact O-C 3.48Å; D228-H231 VanDerWaalsContact O-C 3.23Å; D228-H231 PolarHBondContact O-N 2.95Å; D228-H231 IonicContact OD2-ND1 3.35Å; D228-L232 PolarHBondContact O-N 3.07Å
229	L	95.3	Very high	95.6	Very high	32 Å²	32	49.8 Å²	49.8	17%	0.168	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-22.8	-179.7	-68	-175.7	0	0	0	113.3	I170 F205 D213 F215 L232	I170-L229 HydrophobicContact CB-CD2 4.44Å; I170-L229 HydrophobicContact CD1-CD2 3.98Å; I170-L229 HydrophobicContact CG1-CD2 3.62Å; I170-L229 HydrophobicContact CG2-CD1 4.34Å; I170-L229 HydrophobicContact CG2-CD2 4.27Å; F205-L229 HydrophobicContact CE1-CD1 4.24Å; D213-L229 HydrophobicContact CB-CB 4.36Å; D213-L229 WeakPolarHBondContact O-CG 3.5Å; D213-L229 PolarHBondContact O-N 3.14Å; F215-L229 HydrophobicContact CD1-CD2 3.97Å; F215-L229 HydrophobicContact CD1-CG 4.35Å; F215-L229 HydrophobicContact CE1-CD2 3.59Å; F215-L229 HydrophobicContact CE1-CG 4.37Å; L229-L232 HydrophobicContact CD2-CD2 4.21Å
230	R	93.7	Very high	95.5	Very high	138 Å²	138	54.1 Å²	54.1	52%	0.521	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-18.1	177.7	-55.8	166.8	-65	-161	12.8	112.5	D213 D228	D213-R230 HydrophobicContact CB-CG 4.23Å; D213-R230 WeakPolarHBondContact OD2-CD 3.18Å; D213-R230 IonicContact OD2-CZ 3.06Å; D213-R230 IonicContact OD2-NE 2.94Å; D213-R230 PolarHBondContact OD2-NE 2.68Å; D213-R230 IonicContact OD2-NH1 2.72Å; D213-R230 PolarHBondContact OD2-NH1 3.49Å; D228-R230 PolarHBondContact O-N 3Å; D228-R230 VanDerWaalsContact OD1-CB 3.25Å; D228-R230 WeakPolarHBondContact OD1-CB 3.34Å; D228-R230 WeakPolarHBondContact OD1-CG 3.44Å; D228-R230 IonicContact OD1-CZ 3.23Å; D228-R230 PolarHBondContact OD1-N 2.67Å; D228-R230 IonicContact OD1-NE 2.68Å; D228-R230 PolarHBondContact OD1-NE 3.26Å; D228-R230 IonicContact OD1-NH2 2.63Å; D228-R230 IonicContact OD2-CZ 2.87Å; D228-R230 IonicContact OD2-NE 3.63Å; D228-R230 PolarHBondContact OD2-NE 2.68Å; D228-R230 IonicContact OD2-NH2 3.06Å; D228-R230 PolarHBondContact OD2-NH2 3.24Å
231	H	93.5	Very high	95.5	Very high	120 Å²	120	54.4 Å²	54.4	56%	0.556	26%	0.262	S	S	*	.			trans	-140.6	51.3	-173.4	-56.3	103.1	0	0	0	111.9	D228 E233 H234	D228-H231 CarbonylContact O-C 3.48Å; D228-H231 VanDerWaalsContact O-C 3.23Å; D228-H231 PolarHBondContact O-N 2.95Å; D228-H231 IonicContact OD2-ND1 3.35Å; H231-E233 PolarHBondContact O-N 3.27Å; H231-H234 PolarHBondContact O-N 2.71Å; H231-H234 VanDerWaalsContact O-N 3.09Å
232	L	92.3	Very high	95.3	Very high	53 Å²	53	58.6 Å²	58.6	28%	0.277	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-9.8	-176	-69.2	179.6	0	0	0	115.5	L193 F215 D228 L229 H234	L193-L232 HydrophobicContact CD2-CD1 4.38Å; L193-L232 HydrophobicContact CD2-CD2 3.86Å; F215-L232 HydrophobicContact CE1-CD2 4.42Å; D228-L232 PolarHBondContact O-N 3.07Å; L229-L232 HydrophobicContact CD2-CD2 4.21Å; L232-H234 PolarHBondContact O-N 3.39Å
233	E	89	Confident	95.2	Very high	180 Å²	180	64.5 Å²	64.5	84%	0.841	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-19	173	-61.2	179.2	-179.9	0	0	112.5	H231	H231-E233 PolarHBondContact O-N 3.27Å
234	H	88.8	Confident	95	Very high	134 Å²	134	69.3 Å²	69.3	62%	0.62	35%	0.346	S	S	*	.			trans	-126.7	139.5	-178.8	-57.8	86.4	0	0	0	110.8	H231 L232	H231-H234 PolarHBondContact O-N 2.71Å; H231-H234 VanDerWaalsContact O-N 3.09Å; L232-H234 PolarHBondContact O-N 3.39Å
235	S	92.8	Very high	95	Very high	48 Å²	48	71.2 Å²	71.2	34%	0.336	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	153	165.8	66.6	0	0	0	0	109.3	M226	M226-S235 VanDerWaalsContact O-CA 3.31Å; M226-S235 WeakPolarHBondContact O-CA 3.1Å
236	N	93.4	Very high	95.1	Very high	113 Å²	113	70.7 Å²	70.7	60%	0.604	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.1	176	-65	-58.9	0	0	0	109.2	R225 M226 V238	R225-N236 CarbonylContact C-O 3.33Å; R225-N236 WeakPolarHBondContact CA-O 3.2Å; M226-N236 PolarHBondContact N-O 3.43Å; M226-N236 PolarHBondContact O-N 3.38Å; N236-V238 PolarHBondContact O-N 2.84Å
237	I	95.7	Very high	95.1	Very high	76 Å²	76	69.4 Å²	69.4	39%	0.39	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	116.8	168.5	-59.6	173.8	0	0	0	107.2	R225 E240	R225-I237 HydrophobicContact CG-CG1 4.22Å; I237-E240 HydrophobicContact CG2-CB 4.3Å
238	V	96.4	Very high	95.2	Very high	10 Å²	10	70.6 Å²	70.6	6%	0.061	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	-26.3	-179.2	178.2	0	0	0	0	111.4	V224 M226 N236 L275 C279	V224-V238 PolarHBondContact O-N 2.8Å; M226-V238 HydrophobicContact CB-CG2 4.07Å; M226-V238 HydrophobicContact CG-CG2 3.52Å; M226-V238 HydrophobicContact SD-CG2 3.62Å; N236-V238 PolarHBondContact O-N 2.84Å; V238-L275 HydrophobicContact CG1-CD2 3.7Å; V238-L275 HydrophobicContact CG2-CD2 4.38Å; V238-C279 WeakPolarHBondContact O-CA 3.38Å; V238-C279 PolarHBondContact O-N 3.04Å
239	Y	98	Very high	95.3	Very high	5 Å²	5	73.2 Å²	73.2	2%	0.02	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	148.1	174.4	173.7	-101.3	0	0	0	109.2	S223 V224 D241 L247 I271 L273 P281	S223-Y239 CarbonylContact C-O 3.56Å; S223-Y239 WeakPolarHBondContact CA-O 3.37Å; V224-Y239 HydrophobicContact CG2-CD1 4.12Å; V224-Y239 PolarHBondContact N-O 3.06Å; V224-Y239 PolarHBondContact O-N 3.05Å; Y239-D241 HydrophobicContact CE1-CB 4.17Å; Y239-D241 PolarHBondContact OH-OD1 3.49Å; Y239-L247 HydrophobicContact CD1-CD1 3.86Å; Y239-L247 HydrophobicContact CE1-CD1 4.06Å; Y239-L247 HydrophobicContact CE1-CD2 4.4Å; Y239-I271 HydrophobicContact CE1-CD1 3.85Å; Y239-I271 HydrophobicContact CE2-CG2 4.35Å; Y239-I271 WeakPolarHBondContact OH-CD1 3.41Å; Y239-L273 VanDerWaalsContact CB-CD1 3.44Å; Y239-L273 HydrophobicContact CD2-CD2 3.78Å; Y239-L273 HydrophobicContact CG-CD1 4.02Å; Y239-L273 HydrophobicContact CG-CD2 3.86Å; Y239-P281 HydrophobicContact CD2-CG 3.91Å; Y239-P281 HydrophobicContact CE2-CG 3.48Å; Y239-P281 VanDerWaalsContact CE2-CG 3.48Å
240	E	97.6	Very high	95.5	Very high	90 Å²	90	72.1 Å²	72.1	42%	0.421	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	129	171.5	-172	171.8	-174.7	0	0	107.3	G222 I237 H244	G222-E240 WeakPolarHBondContact O-CA 3.32Å; I237-E240 HydrophobicContact CG2-CB 4.3Å; E240-H244 IonicContact OE1-CE1 2.93Å; E240-H244 PolarHBondContact OE1-CE1 2.87Å; E240-H244 IonicContact OE1-ND1 2.92Å; E240-H244 PolarHBondContact OE1-ND1 3.14Å
241	D	96.8	Very high	95.7	Very high	14 Å²	14	66.3 Å²	66.3	8%	0.075	34%	0.344	C	S	.	.			trans	-66	136.1	176.7	-174.4	71.8	0	0	0	110.6	G222 Y239 N243 H244 S245	G222-D241 PolarHBondContact O-N 2.66Å; Y239-D241 HydrophobicContact CE1-CB 4.17Å; Y239-D241 PolarHBondContact OH-OD1 3.49Å; D241-N243 PolarHBondContact O-N 2.83Å; D241-N243 VanDerWaalsContact O-N 3.15Å; D241-N243 WeakPolarHBondContact OD2-CA 3.38Å; D241-N243 WeakPolarHBondContact OD2-CB 3.33Å; D241-N243 PolarHBondContact OD2-N 2.85Å; D241-H244 WeakPolarHBondContact O-CA 3.49Å; D241-H244 PolarHBondContact O-N 2.95Å; D241-H244 PolarHBondContact OD2-N 3.17Å; D241-S245 PolarHBondContact OD2-N 2.81Å
242	S	94.8	Very high	95.9	Very high	98 Å²	98	61.1 Å²	61.1	69%	0.685	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-24.3	-175.9	52.4	0	0	0	0	113.9
243	N	95.3	Very high	96.1	Very high	125 Å²	125	58.7 Å²	58.7	67%	0.668	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	3.4	176	-59.5	-49	0	0	0	112.1	D241 S245	D241-N243 PolarHBondContact O-N 2.83Å; D241-N243 VanDerWaalsContact O-N 3.15Å; D241-N243 WeakPolarHBondContact OD2-CA 3.38Å; D241-N243 WeakPolarHBondContact OD2-CB 3.33Å; D241-N243 PolarHBondContact OD2-N 2.85Å; N243-S245 PolarHBondContact O-N 3.26Å
244	H	96	Very high	96.4	Very high	103 Å²	103	52.7 Å²	52.7	48%	0.477	28%	0.278	S	S	.	.			trans	51.6	33.7	-168.4	-51.4	-82	0	0	0	112.3	E240 D241	E240-H244 IonicContact OE1-CE1 2.93Å; E240-H244 PolarHBondContact OE1-CE1 2.87Å; E240-H244 IonicContact OE1-ND1 2.92Å; E240-H244 PolarHBondContact OE1-ND1 3.14Å; D241-H244 WeakPolarHBondContact O-CA 3.49Å; D241-H244 PolarHBondContact O-N 2.95Å; D241-H244 PolarHBondContact OD2-N 3.17Å
245	S	98	Very high	96.7	Very high	41 Å²	41	51.5 Å²	51.5	29%	0.287	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-65.9	133	174.7	-73.7	0	0	0	0	109.6	G222 D241 N243 L247	G222-S245 WeakPolarHBondContact CA-O 3.38Å; D241-S245 PolarHBondContact OD2-N 2.81Å; N243-S245 PolarHBondContact O-N 3.26Å; S245-L247 PolarHBondContact O-N 3.39Å
246	P	98.7	Very high	96.8	Very high	33 Å²	33	51.1 Å²	51.1	21%	0.214	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-49.2	132.5	178.9	-33.5	38.9	0	0	0	113.7	Y201 A264 M265	Y201-P246 HydrophobicContact CE2-CB 4Å; P246-A264 CarbonylContact O-C 3.58Å; P246-A264 WeakPolarHBondContact O-CA 3.41Å; P246-M265 HydrophobicContact CB-CB 3.98Å; P246-M265 HydrophobicContact CB-CE 4.2Å; P246-M265 HydrophobicContact CB-SD 4.46Å; P246-M265 HydrophobicContact CG-SD 4.38Å; P246-M265 PolarHBondContact O-N 3.4Å
247	L	98.7	Very high	96.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	126.3	174.7	-65.1	-175.5	0	0	0	110.1	Y201 V218 G219 G222 V224 Y239 S245 T262 A264	Y201-L247 WeakPolarHBondContact CD2-O 3.23Å; V218-L247 HydrophobicContact CB-CB 3.76Å; V218-L247 HydrophobicContact CG1-CB 4.01Å; V218-L247 HydrophobicContact CG1-CD1 4.25Å; V218-L247 HydrophobicContact CG2-CB 4.45Å; V218-L247 WeakPolarHBondContact CG2-O 3.28Å; G219-L247 PolarHBondContact O-N 3.34Å; G222-L247 WeakPolarHBondContact O-CD1 3.25Å; V224-L247 HydrophobicContact CG2-CD1 3.64Å; Y239-L247 HydrophobicContact CD1-CD1 3.86Å; Y239-L247 HydrophobicContact CE1-CD1 4.06Å; Y239-L247 HydrophobicContact CE1-CD2 4.4Å; S245-L247 PolarHBondContact O-N 3.39Å; L247-T262 HydrophobicContact CD1-CG2 4.4Å; L247-A264 HydrophobicContact CD2-CB 3.89Å
248	L	98.4	Very high	96.9	Very high	35 Å²	35	45.7 Å²	45.7	18%	0.183	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-39.7	-165.6	-68.2	-178	0	0	0	114.6	Y201 F263 M265	Y201-L248 HydrophobicContact CD2-CD2 4.03Å; Y201-L248 HydrophobicContact CE2-CD2 4.29Å; Y201-L248 HydrophobicContact CG-CD2 4.43Å; L248-F263 HydrophobicContact CB-CD2 4.21Å; L248-F263 HydrophobicContact CB-CE2 3.63Å; L248-F263 HydrophobicContact CB-CZ 4.18Å; L248-F263 HydrophobicContact CD1-CD2 4.39Å; L248-F263 HydrophobicContact CD1-CE2 3.82Å; L248-F263 HydrophobicContact CG-CE2 4.25Å; L248-F263 PolarHBondContact N-O 2.84Å; L248-F263 VanDerWaalsContact N-O 3.08Å; L248-M265 HydrophobicContact CD1-CB 3.98Å; L248-M265 HydrophobicContact CD1-CG 4.33Å; L248-M265 HydrophobicContact CD2-CB 4.15Å; L248-M265 HydrophobicContact CD2-CE 3.72Å; L248-M265 HydrophobicContact CG-CB 4.01Å
249	R	98.4	Very high	96.9	Very high	90 Å²	90	47.2 Å²	47.2	34%	0.34	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	150.2	-175.6	-65	-66.3	179.8	-100.5	4.4	111.1	Y201 D202 T262 F263	Y201-R249 PolarHBondContact O-NH1 3.41Å; D202-R249 WeakPolarHBondContact OD2-CA 3.46Å; D202-R249 VanDerWaalsContact OD2-CD 3.23Å; D202-R249 WeakPolarHBondContact OD2-CD 3.48Å; R249-T262 WeakPolarHBondContact O-CA 3.46Å; R249-T262 WeakPolarHBondContact O-CB 3.36Å; R249-T262 PolarHBondContact O-OG1 3.32Å; R249-F263 HydrophobicContact CB-CD1 4.5Å; R249-F263 HydrophobicContact CB-CE1 3.64Å; R249-F263 HydrophobicContact CB-CZ 3.82Å; R249-F263 HydrophobicContact CG-CE1 4.01Å; R249-F263 HydrophobicContact CG-CZ 3.7Å
250	L	98.3	Very high	96.9	Very high	9 Å²	9	47.1 Å²	47.1	5%	0.047	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	143.3	171.5	69.4	97.8	0	0	0	110.7	D202 A204 A216 V218 L260 A261	D202-L250 PolarHBondContact OD2-N 2.94Å; D202-L250 VanDerWaalsContact OD2-N 3.12Å; A204-L250 HydrophobicContact CB-CD1 3.4Å; A204-L250 VanDerWaalsContact CB-CD1 3.4Å; A204-L250 HydrophobicContact CB-CG 4.42Å; A216-L250 HydrophobicContact CB-CD1 4.31Å; A216-L250 HydrophobicContact CB-CD2 4.28Å; V218-L250 HydrophobicContact CB-CD2 4.28Å; V218-L250 HydrophobicContact CG1-CB 4.05Å; V218-L250 HydrophobicContact CG1-CD2 3.77Å; V218-L250 HydrophobicContact CG2-CD2 4.04Å; L250-L260 HydrophobicContact CB-CD1 4.17Å; L250-L260 HydrophobicContact CB-CD2 4.37Å; L250-L260 HydrophobicContact CB-CG 4.49Å; L250-L260 HydrophobicContact CD1-CD1 3.79Å; L250-A261 CarbonylContact C-O 3.54Å; L250-A261 WeakPolarHBondContact CA-O 3.47Å
251	A	98.4	Very high	96.9	Very high	16 Å²	16	42.8 Å²	42.8	13%	0.132	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	125.8	177.2	0	0	0	0	0	110.4	L260 A261 L295 W297	A251-L260 WeakPolarHBondContact O-CA 3.21Å; A251-A261 PolarHBondContact N-O 3.34Å; A251-A261 PolarHBondContact O-N 3.03Å; A251-L295 HydrophobicContact CB-CB 4.01Å; A251-W297 VanDerWaalsContact O-CD1 3.3Å; A251-W297 PolarHBondContact O-NE1 2.86Å
252	W	98	Very high	97	Very high	10 Å²	10	42.1 Å²	42.1	4%	0.038	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	138.8	173.5	-69.2	108.4	0	0	0	111.5	A204 A216 M226 K254 L260 L275	A204-W252 PolarHBondContact O-NE1 3.36Å; A216-W252 HydrophobicContact CB-CH2 4.45Å; A216-W252 HydrophobicContact CB-CZ2 3.58Å; M226-W252 HydrophobicContact CE-CH2 3.95Å; M226-W252 HydrophobicContact CE-CZ2 4.37Å; M226-W252 HydrophobicContact SD-CH2 4.17Å; W252-K254 PolarHBondContact O-N 2.73Å; W252-L260 HydrophobicContact CD2-CD1 3.6Å; W252-L260 VanDerWaalsContact CE2-CD1 3.5Å; W252-L260 HydrophobicContact CE3-CB 3.89Å; W252-L260 HydrophobicContact CE3-CD1 3.76Å; W252-L260 HydrophobicContact CE3-CG 4.42Å; W252-L260 HydrophobicContact CG-CD1 4.28Å; W252-L260 HydrophobicContact CH2-CB 4.47Å; W252-L260 HydrophobicContact CH2-CD1 3.73Å; W252-L260 HydrophobicContact CZ2-CD1 3.6Å; W252-L260 HydrophobicContact CZ3-CB 3.85Å; W252-L260 HydrophobicContact CZ3-CD1 3.81Å; W252-L260 HydrophobicContact CZ3-CG 4.49Å; W252-L275 HydrophobicContact CH2-CD1 3.69Å; W252-L275 HydrophobicContact CH2-CD2 3.93Å; W252-L275 HydrophobicContact CH2-CG 4.19Å; W252-L275 HydrophobicContact CZ3-CD1 3.61Å; W252-L275 HydrophobicContact CZ3-CD2 4.03Å; W252-L275 HydrophobicContact CZ3-CG 3.93Å
253	N	97.5	Very high	97.2	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.011	19%	0.191	C	C	.	.			trans	-68.9	123.9	165.6	-177.7	-38.9	0	0	0	109.6	Q255 D256 Y259 W297 S302	N253-Q255 VanDerWaalsContact C-N 3.34Å; N253-Q255 PolarHBondContact OD1-N 3.29Å; N253-D256 WeakPolarHBondContact CB-O 3.19Å; N253-D256 CarbonylContact O-C 3.46Å; N253-D256 PolarHBondContact OD1-N 2.94Å; N253-Y259 WeakPolarHBondContact CB-O 3.12Å; N253-Y259 PolarHBondContact N-O 3.18Å; N253-W297 HydrophobicContact CB-CD2 3.73Å; N253-W297 HydrophobicContact CB-CE3 3.91Å; N253-W297 HydrophobicContact CB-CG 4.13Å; N253-W297 HydrophobicContact CB-CH2 4.44Å; N253-W297 HydrophobicContact CB-CZ2 4.27Å; N253-W297 HydrophobicContact CB-CZ3 4.28Å; N253-W297 VanDerWaalsContact ND2-CE3 3.34Å; N253-W297 VanDerWaalsContact ND2-CZ3 3.27Å; N253-W297 WeakPolarHBondContact ND2-CZ3 3.32Å; N253-S302 PolarHBondContact ND2-O 3.08Å
254	K	93.9	Very high	97.3	Very high	55 Å²	55	31.9 Å²	31.9	24%	0.239	16%	0.162	C	C	.	.	S	Bend	trans	-79.9	-18	-172.4	-60.2	-66.1	178.1	169.3	0	113.2	E153 R207 W252	E153-K254 IonicContact OE1-NZ 3.33Å; E153-K254 PolarHBondContact OE1-NZ 3.16Å; E153-K254 IonicContact OE2-NZ 2.76Å; R207-K254 PolarHBondContact NH1-O 2.86Å; W252-K254 PolarHBondContact O-N 2.73Å
255	Q	95.4	Very high	97.4	Very high	108 Å²	108	30.3 Å²	30.3	51%	0.505	16%	0.155	S	C	.	.	S	Bend	trans	-97.6	-30.1	179.3	-65.6	-60.7	-45.7	0	0	112.6	N253 P299	N253-Q255 VanDerWaalsContact C-N 3.34Å; N253-Q255 PolarHBondContact OD1-N 3.29Å; Q255-P299 PolarHBondContact NE2-O 3.28Å
256	D	95.6	Very high	97.3	Very high	41 Å²	41	33.6 Å²	33.6	22%	0.219	17%	0.169	C	C	.	.			trans	-133.8	104.5	174	-174.2	-12.1	0	0	0	110.7	N253 N258 Y259	N253-D256 WeakPolarHBondContact CB-O 3.19Å; N253-D256 CarbonylContact O-C 3.46Å; N253-D256 PolarHBondContact OD1-N 2.94Å; D256-N258 PolarHBondContact O-N 3.26Å; D256-N258 WeakPolarHBondContact OD1-CB 3.46Å; D256-N258 PolarHBondContact OD1-N 2.83Å; D256-N258 PolarHBondContact OD1-ND2 2.88Å; D256-Y259 HydrophobicContact CB-CD2 4Å; D256-Y259 PolarHBondContact O-N 3.28Å; D256-Y259 VanDerWaalsContact O-N 3.11Å; D256-Y259 WeakPolarHBondContact OD2-CE2 3.33Å
257	A	94.9	Very high	97.3	Very high	23 Å²	23	33.2 Å²	33.2	19%	0.19	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-4.5	-176.4	0	0	0	0	0	114.6	R207 A208	R207-A257 HydrophobicContact CB-CB 4.2Å; A208-A257 HydrophobicContact CB-CB 4.26Å
258	N	95.1	Very high	97.2	Very high	51 Å²	51	35.3 Å²	35.3	27%	0.273	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-20.8	173.1	-60.3	-69.8	0	0	0	112.6	D256 D274 L275 R276	D256-N258 PolarHBondContact O-N 3.26Å; D256-N258 WeakPolarHBondContact OD1-CB 3.46Å; D256-N258 PolarHBondContact OD1-N 2.83Å; D256-N258 PolarHBondContact OD1-ND2 2.88Å; N258-D274 CarbonylContact O-C 3.57Å; N258-D274 WeakPolarHBondContact O-CA 3.45Å; N258-L275 WeakPolarHBondContact O-CG 3.3Å; N258-L275 PolarHBondContact O-N 3.3Å; N258-R276 HydrophobicContact CB-CG 4.46Å
259	Y	96.7	Very high	97.2	Very high	43 Å²	43	35.8 Å²	35.8	17%	0.169	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	135.5	-177.1	-67.3	-67	0	0	0	112.8	N253 D256 I272 L273 D274 R276 V282 M322	N253-Y259 WeakPolarHBondContact CB-O 3.12Å; N253-Y259 PolarHBondContact N-O 3.18Å; D256-Y259 HydrophobicContact CB-CD2 4Å; D256-Y259 PolarHBondContact O-N 3.28Å; D256-Y259 VanDerWaalsContact O-N 3.11Å; D256-Y259 WeakPolarHBondContact OD2-CE2 3.33Å; Y259-I272 HydrophobicContact CD1-CG2 4.32Å; Y259-L273 WeakPolarHBondContact CA-O 3.07Å; Y259-L273 WeakPolarHBondContact CD1-O 3.17Å; Y259-D274 HydrophobicContact CD1-CB 4.18Å; Y259-D274 HydrophobicContact CE1-CB 3.89Å; Y259-R276 PolarHBondContact OH-NH2 3.11Å; Y259-R276 VanDerWaalsContact OH-NH2 3.16Å; Y259-V282 HydrophobicContact CD1-CG2 4.36Å; Y259-V282 HydrophobicContact CE1-CG2 4.12Å; Y259-M322 HydrophobicContact CD1-CE 4.34Å; Y259-M322 HydrophobicContact CE1-CE 3.86Å
260	L	97.6	Very high	97.2	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	141.1	175.3	178.6	131.1	0	0	0	109.7	A216 V224 L250 A251 W252 L273	A216-L260 HydrophobicContact CB-CD1 4.48Å; V224-L260 HydrophobicContact CG1-CD2 4.07Å; V224-L260 HydrophobicContact CG2-CD2 4.45Å; L250-L260 HydrophobicContact CB-CD1 4.17Å; L250-L260 HydrophobicContact CB-CD2 4.37Å; L250-L260 HydrophobicContact CB-CG 4.49Å; L250-L260 HydrophobicContact CD1-CD1 3.79Å; A251-L260 WeakPolarHBondContact O-CA 3.21Å; W252-L260 HydrophobicContact CD2-CD1 3.6Å; W252-L260 VanDerWaalsContact CE2-CD1 3.5Å; W252-L260 HydrophobicContact CE3-CB 3.89Å; W252-L260 HydrophobicContact CE3-CD1 3.76Å; W252-L260 HydrophobicContact CE3-CG 4.42Å; W252-L260 HydrophobicContact CG-CD1 4.28Å; W252-L260 HydrophobicContact CH2-CB 4.47Å; W252-L260 HydrophobicContact CH2-CD1 3.73Å; W252-L260 HydrophobicContact CZ2-CD1 3.6Å; W252-L260 HydrophobicContact CZ3-CB 3.85Å; W252-L260 HydrophobicContact CZ3-CD1 3.81Å; W252-L260 HydrophobicContact CZ3-CG 4.49Å; L260-L273 HydrophobicContact CD2-CD1 3.78Å; L260-L273 HydrophobicContact CD2-CG 4.43Å; L260-L273 PolarHBondContact N-O 3.28Å; L260-L273 VanDerWaalsContact N-O 3.1Å; L260-L273 PolarHBondContact O-N 2.89Å
261	A	98.5	Very high	97.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	145	171.9	0	0	0	0	0	110.2	L250 A251 I270 I271 I272 L295 W297 L305	L250-A261 CarbonylContact C-O 3.54Å; L250-A261 WeakPolarHBondContact CA-O 3.47Å; A251-A261 PolarHBondContact N-O 3.34Å; A251-A261 PolarHBondContact O-N 3.03Å; A261-I270 HydrophobicContact CB-CG2 4.34Å; A261-I271 CarbonylContact C-O 3.55Å; A261-I271 VanDerWaalsContact CA-O 3.3Å; A261-I271 WeakPolarHBondContact CA-O 3.33Å; A261-I272 HydrophobicContact CB-CD1 3.73Å; A261-L295 HydrophobicContact CB-CD1 4.03Å; A261-L295 HydrophobicContact CB-CD2 4.3Å; A261-W297 HydrophobicContact CB-CZ2 3.89Å; A261-L305 HydrophobicContact CB-CD1 4.32Å; A261-L305 HydrophobicContact CB-CD2 4.07Å
262	T	98.7	Very high	97.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	165.9	173.3	-172.3	0	0	0	0	110.1	V224 L247 R249 I271 L273	V224-T262 HydrophobicContact CG2-CG2 4.08Å; L247-T262 HydrophobicContact CD1-CG2 4.4Å; R249-T262 WeakPolarHBondContact O-CA 3.46Å; R249-T262 WeakPolarHBondContact O-CB 3.36Å; R249-T262 PolarHBondContact O-OG1 3.32Å; T262-I271 HydrophobicContact CG2-CB 3.91Å; T262-I271 HydrophobicContact CG2-CD1 4.41Å; T262-I271 HydrophobicContact CG2-CG2 4.19Å; T262-I271 PolarHBondContact N-O 2.8Å; T262-I271 PolarHBondContact O-N 2.91Å; T262-L273 HydrophobicContact CG2-CD1 4.43Å
263	F	98.3	Very high	97	Very high	2 Å²	2	30 Å²	30	1%	0.009	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	155.3	168.4	60.2	-93.2	0	0	0	110.6	L248 R249 V292 L295	L248-F263 HydrophobicContact CB-CD2 4.21Å; L248-F263 HydrophobicContact CB-CE2 3.63Å; L248-F263 HydrophobicContact CB-CZ 4.18Å; L248-F263 HydrophobicContact CD1-CD2 4.39Å; L248-F263 HydrophobicContact CD1-CE2 3.82Å; L248-F263 HydrophobicContact CG-CE2 4.25Å; L248-F263 PolarHBondContact N-O 2.84Å; L248-F263 VanDerWaalsContact N-O 3.08Å; R249-F263 HydrophobicContact CB-CD1 4.5Å; R249-F263 HydrophobicContact CB-CE1 3.64Å; R249-F263 HydrophobicContact CB-CZ 3.82Å; R249-F263 HydrophobicContact CG-CE1 4.01Å; R249-F263 HydrophobicContact CG-CZ 3.7Å; F263-V292 HydrophobicContact CB-CB 4.46Å; F263-V292 HydrophobicContact CB-CG1 4.5Å; F263-V292 HydrophobicContact CD1-CB 4.43Å; F263-V292 HydrophobicContact CD1-CG1 3.77Å; F263-V292 HydrophobicContact CD2-CB 4.23Å; F263-V292 HydrophobicContact CD2-CG1 4.39Å; F263-V292 WeakPolarHBondContact CD2-O 3.44Å; F263-V292 HydrophobicContact CE1-CG1 4.04Å; F263-V292 WeakPolarHBondContact CE2-O 3.49Å; F263-V292 HydrophobicContact CG-CB 4.14Å; F263-V292 HydrophobicContact CG-CG1 3.98Å; F263-V292 HydrophobicContact CZ-CG1 4.47Å; F263-L295 HydrophobicContact CD1-CD1 3.44Å; F263-L295 VanDerWaalsContact CD1-CD1 3.44Å; F263-L295 HydrophobicContact CD1-CD2 4.29Å; F263-L295 HydrophobicContact CD1-CG 3.62Å; F263-L295 HydrophobicContact CE1-CD1 3.77Å; F263-L295 HydrophobicContact CE1-CG 3.71Å
264	A	98.4	Very high	96.9	Very high	6 Å²	6	30.5 Å²	30.5	5%	0.05	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	158.3	176	0	0	0	0	0	111.8	P246 L247 S267	P246-A264 CarbonylContact O-C 3.58Å; P246-A264 WeakPolarHBondContact O-CA 3.41Å; L247-A264 HydrophobicContact CD2-CB 3.89Å; A264-S267 WeakPolarHBondContact O-CB 3.31Å; A264-S267 PolarHBondContact O-N 2.77Å
265	M	97.7	Very high	96.9	Very high	70 Å²	70	29.7 Å²	29.7	35%	0.345	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	139.9	169.9	-177.1	179.9	-74.3	0	0	110.2	P246 L248 S267	P246-M265 HydrophobicContact CB-CB 3.98Å; P246-M265 HydrophobicContact CB-CE 4.2Å; P246-M265 HydrophobicContact CB-SD 4.46Å; P246-M265 HydrophobicContact CG-SD 4.38Å; P246-M265 PolarHBondContact O-N 3.4Å; L248-M265 HydrophobicContact CD1-CB 3.98Å; L248-M265 HydrophobicContact CD1-CG 4.33Å; L248-M265 HydrophobicContact CD2-CB 4.15Å; L248-M265 HydrophobicContact CD2-CE 3.72Å; L248-M265 HydrophobicContact CG-CB 4.01Å; M265-S267 PolarHBondContact O-N 3.12Å; M265-S267 VanDerWaalsContact O-N 3.14Å
266	D	97.1	Very high	96.8	Very high	109 Å²	109	31.1 Å²	31.1	58%	0.583	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	31.3	-179.2	-53.6	-22.1	0	0	0	113.7	F291	D266-F291 VanDerWaalsContact C-CE1 3.44Å; D266-F291 VanDerWaalsContact CA-CD1 3.5Å; D266-F291 HydrophobicContact CB-CD1 4.2Å; D266-F291 HydrophobicContact CB-CD2 4.28Å; D266-F291 HydrophobicContact CB-CE1 3.85Å; D266-F291 HydrophobicContact CB-CE2 3.92Å; D266-F291 HydrophobicContact CB-CG 4.41Å; D266-F291 HydrophobicContact CB-CZ 3.69Å; D266-F291 VanDerWaalsContact O-CD1 3.24Å; D266-F291 WeakPolarHBondContact O-CD1 3.33Å; D266-F291 WeakPolarHBondContact O-CE1 3.48Å
267	S	97.6	Very high	96.7	Very high	26 Å²	26	32.8 Å²	32.8	18%	0.182	17%	0.169	C	C	.	.			trans	-110.3	141.9	-179.6	-174	0	0	0	0	112.2	A264 M265 E269 F291 V292	A264-S267 WeakPolarHBondContact O-CB 3.31Å; A264-S267 PolarHBondContact O-N 2.77Å; M265-S267 PolarHBondContact O-N 3.12Å; M265-S267 VanDerWaalsContact O-N 3.14Å; S267-E269 PolarHBondContact OG-N 2.79Å; S267-E269 PolarHBondContact OG-O 2.9Å; S267-F291 WeakPolarHBondContact O-CA 3.39Å; S267-V292 PolarHBondContact O-N 2.55Å
268	V	97.7	Very high	96.5	Very high	44 Å²	44	35.1 Å²	35.1	27%	0.267	18%	0.182	S	C	.	.	S	Bend	trans	-89.7	-9.2	169.2	-52.5	0	0	0	0	112.5	A290	V268-A290 WeakPolarHBondContact CG1-O 3.39Å
269	E	97.1	Very high	96.3	Very high	44 Å²	44	36.9 Å²	36.9	21%	0.206	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	132.4	-171.6	-172.2	-178	80.2	0	0	111.6	S267 R284 L285	S267-E269 PolarHBondContact OG-N 2.79Å; S267-E269 PolarHBondContact OG-O 2.9Å; E269-R284 HydrophobicContact CG-CB 4Å; E269-R284 HydrophobicContact CG-CG 4.42Å; E269-R284 WeakPolarHBondContact OE1-CD 3.18Å; E269-R284 IonicContact OE1-CZ 2.85Å; E269-R284 IonicContact OE1-NE 2.66Å; E269-R284 IonicContact OE1-NH1 3.86Å; E269-R284 PolarHBondContact OE1-NH1 2.91Å; E269-R284 WeakPolarHBondContact OE2-CD 3.43Å; E269-L285 WeakPolarHBondContact CA-O 3.21Å
270	I	98	Very high	96.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	133.4	170.7	-55.2	92	0	0	0	109.2	A261 I272 R284 L285 V292 L295 L305 T307 W317	A261-I270 HydrophobicContact CB-CG2 4.34Å; I270-I272 HydrophobicContact CG2-CD1 4.09Å; I270-R284 CarbonylContact O-C 3.55Å; I270-R284 VanDerWaalsContact O-CA 3.3Å; I270-R284 WeakPolarHBondContact O-CA 3.21Å; I270-L285 HydrophobicContact CB-CB 4.14Å; I270-L285 HydrophobicContact CB-CD1 4.38Å; I270-L285 HydrophobicContact CB-CG 4.5Å; I270-L285 HydrophobicContact CD1-CB 4.25Å; I270-L285 HydrophobicContact CG2-CD1 4.42Å; I270-L285 PolarHBondContact N-O 3.49Å; I270-L285 PolarHBondContact O-N 2.98Å; I270-V292 HydrophobicContact CD1-CG2 3.84Å; I270-V292 HydrophobicContact CG1-CG1 4.15Å; I270-V292 HydrophobicContact CG1-CG2 4.15Å; I270-L295 HydrophobicContact CG1-CD2 4.12Å; I270-L295 HydrophobicContact CG2-CD2 3.6Å; I270-L305 HydrophobicContact CG2-CD2 4.14Å; I270-T307 HydrophobicContact CD1-CG2 3.81Å; I270-T307 HydrophobicContact CG1-CG2 3.76Å; I270-W317 HydrophobicContact CD1-CZ2 4.32Å
271	I	97.5	Very high	96.1	Very high	2 Å²	2	40 Å²	40	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	124.8	-178.3	-62.1	159.3	0	0	0	108.4	Y239 A261 T262 L273 P281	Y239-I271 HydrophobicContact CE1-CD1 3.85Å; Y239-I271 HydrophobicContact CE2-CG2 4.35Å; Y239-I271 WeakPolarHBondContact OH-CD1 3.41Å; A261-I271 CarbonylContact C-O 3.55Å; A261-I271 VanDerWaalsContact CA-O 3.3Å; A261-I271 WeakPolarHBondContact CA-O 3.33Å; T262-I271 HydrophobicContact CG2-CB 3.91Å; T262-I271 HydrophobicContact CG2-CD1 4.41Å; T262-I271 HydrophobicContact CG2-CG2 4.19Å; T262-I271 PolarHBondContact N-O 2.8Å; T262-I271 PolarHBondContact O-N 2.91Å; I271-L273 HydrophobicContact CG2-CD2 3.6Å; I271-L273 HydrophobicContact CG2-CG 4.16Å; I271-P281 HydrophobicContact CG2-CB 3.83Å; I271-P281 HydrophobicContact CG2-CG 3.7Å
272	I	97.4	Very high	95.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.1	172.8	-48.8	-58.1	0	0	0	108.9	Y259 A261 I270 P281 V282 A283 L285 W297 L305 M322	Y259-I272 HydrophobicContact CD1-CG2 4.32Å; A261-I272 HydrophobicContact CB-CD1 3.73Å; I270-I272 HydrophobicContact CG2-CD1 4.09Å; I272-P281 CarbonylContact O-C 3.56Å; I272-P281 WeakPolarHBondContact O-CA 3.25Å; I272-V282 HydrophobicContact CB-CG2 4.19Å; I272-V282 HydrophobicContact CG2-CG2 3.83Å; I272-V282 WeakPolarHBondContact O-CG2 3.25Å; I272-V282 PolarHBondContact O-N 3.18Å; I272-A283 HydrophobicContact CB-CB 4.09Å; I272-A283 HydrophobicContact CG1-CB 4.13Å; I272-A283 PolarHBondContact N-O 3.2Å; I272-A283 PolarHBondContact O-N 2.77Å; I272-L285 HydrophobicContact CD1-CD1 4.08Å; I272-L285 HydrophobicContact CG1-CD1 4.25Å; I272-L285 HydrophobicContact CG1-CG 4.3Å; I272-W297 HydrophobicContact CD1-CH2 4.34Å; I272-W297 HydrophobicContact CD1-CZ2 4.18Å; I272-W297 HydrophobicContact CG2-CH2 4.27Å; I272-W297 HydrophobicContact CG2-CZ2 4.42Å; I272-L305 HydrophobicContact CD1-CD2 3.73Å; I272-M322 HydrophobicContact CG2-CE 4.44Å; I272-M322 HydrophobicContact CG2-SD 4.15Å
273	L	97	Very high	95.8	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.016	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	148.2	-179.4	-55.8	-178.9	0	0	0	110.4	V224 Y239 Y259 L260 T262 I271 P281	V224-L273 HydrophobicContact CB-CD1 4.36Å; V224-L273 HydrophobicContact CG2-CD1 3.91Å; Y239-L273 VanDerWaalsContact CB-CD1 3.44Å; Y239-L273 HydrophobicContact CD2-CD2 3.78Å; Y239-L273 HydrophobicContact CG-CD1 4.02Å; Y239-L273 HydrophobicContact CG-CD2 3.86Å; Y259-L273 WeakPolarHBondContact CA-O 3.07Å; Y259-L273 WeakPolarHBondContact CD1-O 3.17Å; L260-L273 HydrophobicContact CD2-CD1 3.78Å; L260-L273 HydrophobicContact CD2-CG 4.43Å; L260-L273 PolarHBondContact N-O 3.28Å; L260-L273 VanDerWaalsContact N-O 3.1Å; L260-L273 PolarHBondContact O-N 2.89Å; T262-L273 HydrophobicContact CG2-CD1 4.43Å; I271-L273 HydrophobicContact CG2-CD2 3.6Å; I271-L273 HydrophobicContact CG2-CG 4.16Å; L273-P281 HydrophobicContact CD2-CB 4.23Å; L273-P281 HydrophobicContact CD2-CG 4.04Å
274	D	95.3	Very high	95.7	Very high	11 Å²	11	47.4 Å²	47.4	6%	0.059	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	118.7	169.3	-174.6	-25.5	0	0	0	108.6	N258 Y259 R276 V277 V282	N258-D274 CarbonylContact O-C 3.57Å; N258-D274 WeakPolarHBondContact O-CA 3.45Å; Y259-D274 HydrophobicContact CD1-CB 4.18Å; Y259-D274 HydrophobicContact CE1-CB 3.89Å; D274-R276 PolarHBondContact O-N 3.02Å; D274-R276 VanDerWaalsContact OD1-CB 3.27Å; D274-R276 WeakPolarHBondContact OD1-CB 3.45Å; D274-R276 WeakPolarHBondContact OD1-CG 3.17Å; D274-R276 IonicContact OD1-CZ 2.88Å; D274-R276 PolarHBondContact OD1-N 2.9Å; D274-R276 IonicContact OD1-NE 3.34Å; D274-R276 PolarHBondContact OD1-NE 2.82Å; D274-R276 IonicContact OD1-NH2 3.56Å; D274-R276 IonicContact OD2-CZ 3.17Å; D274-R276 IonicContact OD2-NE 2.71Å; D274-R276 PolarHBondContact OD2-NE 3.47Å; D274-R276 IonicContact OD2-NH2 2.67Å; D274-R276 PolarHBondContact OD2-NH2 2.9Å; D274-V277 CarbonylContact O-C 3.56Å; D274-V277 VanDerWaalsContact O-C 3.3Å; D274-V277 PolarHBondContact O-N 3.03Å; D274-V282 HydrophobicContact CB-CB 4.46Å; D274-V282 HydrophobicContact CB-CG1 3.49Å; D274-V282 VanDerWaalsContact CB-CG1 3.49Å; D274-V282 HydrophobicContact CB-CG2 4.16Å
275	L	93.9	Very high	95.6	Very high	39 Å²	39	47.1 Å²	47.1	20%	0.204	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-19.6	-177.9	-63.3	-168.5	0	0	0	113.8	M226 V238 W252 N258 V277	M226-L275 HydrophobicContact CE-CD1 3.73Å; M226-L275 HydrophobicContact SD-CD1 3.72Å; M226-L275 HydrophobicContact SD-CD2 3.48Å; M226-L275 WeakPolarHBondContact SD-CD2 3.5Å; M226-L275 HydrophobicContact SD-CG 4.19Å; V238-L275 HydrophobicContact CG1-CD2 3.7Å; V238-L275 HydrophobicContact CG2-CD2 4.38Å; W252-L275 HydrophobicContact CH2-CD1 3.69Å; W252-L275 HydrophobicContact CH2-CD2 3.93Å; W252-L275 HydrophobicContact CH2-CG 4.19Å; W252-L275 HydrophobicContact CZ3-CD1 3.61Å; W252-L275 HydrophobicContact CZ3-CD2 4.03Å; W252-L275 HydrophobicContact CZ3-CG 3.93Å; N258-L275 WeakPolarHBondContact O-CG 3.3Å; N258-L275 PolarHBondContact O-N 3.3Å; L275-V277 VanDerWaalsContact C-N 3.27Å
276	R	93.4	Very high	95.5	Very high	138 Å²	138	48.1 Å²	48.1	52%	0.521	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-16.8	177.5	-57.1	169.1	-66.4	-164.9	0.2	112	N258 Y259 D274	N258-R276 HydrophobicContact CB-CG 4.46Å; Y259-R276 PolarHBondContact OH-NH2 3.11Å; Y259-R276 VanDerWaalsContact OH-NH2 3.16Å; D274-R276 PolarHBondContact O-N 3.02Å; D274-R276 VanDerWaalsContact OD1-CB 3.27Å; D274-R276 WeakPolarHBondContact OD1-CB 3.45Å; D274-R276 WeakPolarHBondContact OD1-CG 3.17Å; D274-R276 IonicContact OD1-CZ 2.88Å; D274-R276 PolarHBondContact OD1-N 2.9Å; D274-R276 IonicContact OD1-NE 3.34Å; D274-R276 PolarHBondContact OD1-NE 2.82Å; D274-R276 IonicContact OD1-NH2 3.56Å; D274-R276 IonicContact OD2-CZ 3.17Å; D274-R276 IonicContact OD2-NE 2.71Å; D274-R276 PolarHBondContact OD2-NE 3.47Å; D274-R276 IonicContact OD2-NH2 2.67Å; D274-R276 PolarHBondContact OD2-NH2 2.9Å
277	V	93.2	Very high	95.4	Very high	76 Å²	76	45.2 Å²	45.2	46%	0.461	25%	0.246	S	C	.	.	S	Bend	trans	-129.8	71.3	179.8	-168.1	0	0	0	0	108.8	D274 L275	D274-V277 CarbonylContact O-C 3.56Å; D274-V277 VanDerWaalsContact O-C 3.3Å; D274-V277 PolarHBondContact O-N 3.03Å; L275-V277 VanDerWaalsContact C-N 3.27Å
278	P	90.4	Very high	95.5	Very high	71 Å²	71	44.3 Å²	44.3	46%	0.461	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	160.1	-177.2	28	-35.7	0	0	0	112	T280	P278-T280 PolarHBondContact O-N 2.92Å
279	C	91.8	Very high	95.5	Very high	88 Å²	88	52.9 Å²	52.9	60%	0.595	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	-8.1	179.7	-50.4	0	0	0	0	115.8	V238	V238-C279 WeakPolarHBondContact O-CA 3.38Å; V238-C279 PolarHBondContact O-N 3.04Å
280	T	93.8	Very high	95.5	Very high	84 Å²	84	52 Å²	52	52%	0.515	27%	0.267	S	S	.	.	S	Bend	trans	-124.4	118.5	-178	-51.6	0	0	0	0	111	P278 V282	P278-T280 PolarHBondContact O-N 2.92Å; T280-V282 PolarHBondContact O-N 3.4Å
281	P	95.3	Very high	95.5	Very high	28 Å²	28	55.6 Å²	55.6	18%	0.182	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	136	170.5	-27.1	37.8	0	0	0	112.4	Y239 I271 I272 L273	Y239-P281 HydrophobicContact CD2-CG 3.91Å; Y239-P281 HydrophobicContact CE2-CG 3.48Å; Y239-P281 VanDerWaalsContact CE2-CG 3.48Å; I271-P281 HydrophobicContact CG2-CB 3.83Å; I271-P281 HydrophobicContact CG2-CG 3.7Å; I272-P281 CarbonylContact O-C 3.56Å; I272-P281 WeakPolarHBondContact O-CA 3.25Å; L273-P281 HydrophobicContact CD2-CB 4.23Å; L273-P281 HydrophobicContact CD2-CG 4.04Å
282	V	95.3	Very high	95.6	Very high	37 Å²	37	55.6 Å²	55.6	22%	0.224	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-21.6	175.8	-68.3	0	0	0	0	112.7	Y259 I272 D274 T280 M322	Y259-V282 HydrophobicContact CD1-CG2 4.36Å; Y259-V282 HydrophobicContact CE1-CG2 4.12Å; I272-V282 HydrophobicContact CB-CG2 4.19Å; I272-V282 HydrophobicContact CG2-CG2 3.83Å; I272-V282 WeakPolarHBondContact O-CG2 3.25Å; I272-V282 PolarHBondContact O-N 3.18Å; D274-V282 HydrophobicContact CB-CB 4.46Å; D274-V282 HydrophobicContact CB-CG1 3.49Å; D274-V282 VanDerWaalsContact CB-CG1 3.49Å; D274-V282 HydrophobicContact CB-CG2 4.16Å; T280-V282 PolarHBondContact O-N 3.4Å; V282-M322 HydrophobicContact CG2-CE 4.44Å; V282-M322 HydrophobicContact CG2-SD 4.12Å
283	A	95.4	Very high	95.6	Very high	16 Å²	16	57.5 Å²	57.5	13%	0.132	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	156.6	169.2	0	0	0	0	0	111.2	I272 M322 I326	I272-A283 HydrophobicContact CB-CB 4.09Å; I272-A283 HydrophobicContact CG1-CB 4.13Å; I272-A283 PolarHBondContact N-O 3.2Å; I272-A283 PolarHBondContact O-N 2.77Å; A283-M322 HydrophobicContact CB-CG 4Å; A283-M322 HydrophobicContact CB-SD 3.45Å; A283-M322 WeakPolarHBondContact CB-SD 3.25Å; A283-I326 HydrophobicContact CB-CD1 4.45Å
284	R	95.5	Very high	95.6	Very high	104 Å²	104	57.6 Å²	57.6	39%	0.392	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	125.2	168.9	-69.8	176.1	-176.5	-86.3	3	107.3	E269 I270	E269-R284 HydrophobicContact CG-CB 4Å; E269-R284 HydrophobicContact CG-CG 4.42Å; E269-R284 WeakPolarHBondContact OE1-CD 3.18Å; E269-R284 IonicContact OE1-CZ 2.85Å; E269-R284 IonicContact OE1-NE 2.66Å; E269-R284 IonicContact OE1-NH1 3.86Å; E269-R284 PolarHBondContact OE1-NH1 2.91Å; E269-R284 WeakPolarHBondContact OE2-CD 3.43Å; I270-R284 CarbonylContact O-C 3.55Å; I270-R284 VanDerWaalsContact O-CA 3.3Å; I270-R284 WeakPolarHBondContact O-CA 3.21Å
285	L	97.3	Very high	95.7	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122	-179.5	-47.3	174.7	0	0	0	108.1	E269 I270 I272 L305 W317 I319 I326	E269-L285 WeakPolarHBondContact CA-O 3.21Å; I270-L285 HydrophobicContact CB-CB 4.14Å; I270-L285 HydrophobicContact CB-CD1 4.38Å; I270-L285 HydrophobicContact CB-CG 4.5Å; I270-L285 HydrophobicContact CD1-CB 4.25Å; I270-L285 HydrophobicContact CG2-CD1 4.42Å; I270-L285 PolarHBondContact N-O 3.49Å; I270-L285 PolarHBondContact O-N 2.98Å; I272-L285 HydrophobicContact CD1-CD1 4.08Å; I272-L285 HydrophobicContact CG1-CD1 4.25Å; I272-L285 HydrophobicContact CG1-CG 4.3Å; L285-L305 HydrophobicContact CD1-CD2 3.95Å; L285-W317 HydrophobicContact CB-CD2 4.12Å; L285-W317 HydrophobicContact CB-CE3 4Å; L285-W317 HydrophobicContact CB-CH2 3.78Å; L285-W317 HydrophobicContact CB-CZ2 3.98Å; L285-W317 HydrophobicContact CB-CZ3 3.84Å; L285-W317 HydrophobicContact CD1-CB 4.02Å; L285-W317 HydrophobicContact CD1-CD2 3.77Å; L285-W317 HydrophobicContact CD1-CE3 4.19Å; L285-W317 HydrophobicContact CD1-CG 3.7Å; L285-W317 HydrophobicContact CD2-CD2 4.47Å; L285-W317 HydrophobicContact CD2-CE3 4.05Å; L285-W317 HydrophobicContact CD2-CZ3 4.4Å; L285-W317 HydrophobicContact CG-CD2 4.35Å; L285-W317 HydrophobicContact CG-CE3 4.31Å; L285-I319 HydrophobicContact CD2-CG2 4.45Å; L285-I326 HydrophobicContact CD2-CB 3.85Å; L285-I326 HydrophobicContact CD2-CD1 3.62Å; L285-I326 HydrophobicContact CD2-CG1 4.39Å; L285-I326 HydrophobicContact CD2-CG2 4.04Å
286	N	95.1	Very high	95.9	Very high	91 Å²	91	56.3 Å²	56.3	49%	0.487	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	90.8	-170.8	-166.2	-23.9	0	0	0	110.1
287	N	96.5	Very high	96.1	Very high	48 Å²	48	50.2 Å²	50.2	26%	0.257	27%	0.266	S	S	.	.			trans	-139.9	-28.7	178.4	-164.1	-79.4	0	0	0	111.7	L315 W317 E327 D328	N287-L315 HydrophobicContact CB-CD1 4.26Å; N287-W317 HydrophobicContact CB-CH2 3.34Å; N287-W317 HydrophobicContact CB-CZ2 4.1Å; N287-W317 HydrophobicContact CB-CZ3 4.1Å; N287-E327 PolarHBondContact ND2-O 3.2Å; N287-D328 PolarHBondContact ND2-OD1 3.09Å
288	H	97.7	Very high	96.4	Very high	6 Å²	6	46.6 Å²	46.6	3%	0.028	24%	0.244	C	C	.	.			trans	-54.6	146.9	172.4	-80	-60	0	0	0	112.3	V292 T307 S309 D311 Q313	H288-V292 HydrophobicContact CB-CG2 4.42Å; H288-T307 WeakPolarHBondContact NE2-CB 3.11Å; H288-T307 PolarHBondContact NE2-OG1 3.23Å; H288-S309 WeakPolarHBondContact CE1-CB 3.25Å; H288-S309 WeakPolarHBondContact ND1-CB 3.31Å; H288-D311 WeakPolarHBondContact CA-OD2 3.46Å; H288-D311 WeakPolarHBondContact CB-OD2 3.47Å; H288-D311 IonicContact CE1-OD1 3.49Å; H288-D311 IonicContact CG-OD2 3.43Å; H288-D311 IonicContact ND1-OD1 2.87Å; H288-D311 PolarHBondContact ND1-OD1 3.36Å; H288-D311 IonicContact ND1-OD2 3.64Å; H288-D311 PolarHBondContact ND1-OD2 3.36Å; H288-Q313 PolarHBondContact CE1-O 3.33Å
289	R	97.8	Very high	96.6	Very high	224 Å²	224	44.3 Å²	44.3	85%	0.845	23%	0.229	S	C	*	.	S	Bend	trans	-106.4	-1.7	-176.1	-60.7	-173.1	179.3	-148	-0.9	113.8	D311	R289-D311 HydrophobicContact CB-CB 4.15Å; R289-D311 PolarHBondContact N-OD2 2.74Å
290	A	98.2	Very high	96.8	Very high	26 Å²	26	44.6 Å²	44.6	22%	0.215	22%	0.221	C	C	.	.	S	Bend	trans	-148.3	-175.8	172.7	0	0	0	0	0	109.1	V268 S309 E310 D311	V268-A290 WeakPolarHBondContact CG1-O 3.39Å; A290-S309 VanDerWaalsContact C-OG 3.29Å; A290-S309 PolarHBondContact O-OG 3.21Å; A290-E310 HydrophobicContact CB-CB 3.8Å; A290-D311 HydrophobicContact CB-CB 3.96Å
291	F	98.2	Very high	96.9	Very high	76 Å²	76	41.3 Å²	41.3	33%	0.333	20%	0.202	S	C	.	.			trans	-66.5	142.7	-168.5	-52.2	-36.2	0	0	0	112.6	D266 S267 S309 E310	D266-F291 VanDerWaalsContact C-CE1 3.44Å; D266-F291 VanDerWaalsContact CA-CD1 3.5Å; D266-F291 HydrophobicContact CB-CD1 4.2Å; D266-F291 HydrophobicContact CB-CD2 4.28Å; D266-F291 HydrophobicContact CB-CE1 3.85Å; D266-F291 HydrophobicContact CB-CE2 3.92Å; D266-F291 HydrophobicContact CB-CG 4.41Å; D266-F291 HydrophobicContact CB-CZ 3.69Å; D266-F291 VanDerWaalsContact O-CD1 3.24Å; D266-F291 WeakPolarHBondContact O-CD1 3.33Å; D266-F291 WeakPolarHBondContact O-CE1 3.48Å; S267-F291 WeakPolarHBondContact O-CA 3.39Å; F291-S309 CarbonylContact O-C 3.54Å; F291-S309 WeakPolarHBondContact O-CA 3.19Å; F291-S309 VanDerWaalsContact O-CB 3.25Å; F291-S309 WeakPolarHBondContact O-CB 3.29Å; F291-S309 PolarHBondContact O-OG 2.61Å; F291-E310 HydrophobicContact CB-CG 4.41Å; F291-E310 VanDerWaalsContact CD2-OE2 3.31Å; F291-E310 WeakPolarHBondContact CD2-OE2 3.38Å; F291-E310 PolarHBondContact O-N 3.05Å
292	V	98.5	Very high	97	Very high	2 Å²	2	43 Å²	43	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	133.3	176.8	-179.5	0	0	0	0	108.8	F263 S267 I270 H288	F263-V292 HydrophobicContact CB-CB 4.46Å; F263-V292 HydrophobicContact CB-CG1 4.5Å; F263-V292 HydrophobicContact CD1-CB 4.43Å; F263-V292 HydrophobicContact CD1-CG1 3.77Å; F263-V292 HydrophobicContact CD2-CB 4.23Å; F263-V292 HydrophobicContact CD2-CG1 4.39Å; F263-V292 WeakPolarHBondContact CD2-O 3.44Å; F263-V292 HydrophobicContact CE1-CG1 4.04Å; F263-V292 WeakPolarHBondContact CE2-O 3.49Å; F263-V292 HydrophobicContact CG-CB 4.14Å; F263-V292 HydrophobicContact CG-CG1 3.98Å; F263-V292 HydrophobicContact CZ-CG1 4.47Å; S267-V292 PolarHBondContact O-N 2.55Å; I270-V292 HydrophobicContact CD1-CG2 3.84Å; I270-V292 HydrophobicContact CG1-CG1 4.15Å; I270-V292 HydrophobicContact CG1-CG2 4.15Å; H288-V292 HydrophobicContact CB-CG2 4.42Å
293	N	97.7	Very high	97	Very high	39 Å²	39	42.2 Å²	42.2	21%	0.209	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	-20.9	-179.3	-73.7	-28.7	0	0	0	113.2	A308 E310 I339	N293-A308 PolarHBondContact N-O 2.82Å; N293-E310 WeakPolarHBondContact ND2-CG 3.29Å; N293-I339 WeakPolarHBondContact CB-O 3.37Å; N293-I339 PolarHBondContact ND2-O 3.04Å
294	G	97.5	Very high	97.2	Very high	5 Å²	5	43.5 Å²	43.5	5%	0.052	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	145.4	-171.5	0	0	0	0	0	114.5	T307 A308	G294-T307 VanDerWaalsContact O-CA 3.3Å; G294-T307 WeakPolarHBondContact O-CA 3.4Å; G294-A308 PolarHBondContact N-O 2.93Å; G294-A308 VanDerWaalsContact N-O 3.17Å; G294-A308 PolarHBondContact O-N 3.38Å
295	L	97.7	Very high	97.3	Very high	16 Å²	16	38.5 Å²	38.5	8%	0.084	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	132.2	175.4	-68.9	171.3	0	0	0	109.6	A251 A261 F263 I270 L305 T307	A251-L295 HydrophobicContact CB-CB 4.01Å; A261-L295 HydrophobicContact CB-CD1 4.03Å; A261-L295 HydrophobicContact CB-CD2 4.3Å; F263-L295 HydrophobicContact CD1-CD1 3.44Å; F263-L295 VanDerWaalsContact CD1-CD1 3.44Å; F263-L295 HydrophobicContact CD1-CD2 4.29Å; F263-L295 HydrophobicContact CD1-CG 3.62Å; F263-L295 HydrophobicContact CE1-CD1 3.77Å; F263-L295 HydrophobicContact CE1-CG 3.71Å; I270-L295 HydrophobicContact CG1-CD2 4.12Å; I270-L295 HydrophobicContact CG2-CD2 3.6Å; L295-L305 HydrophobicContact CD2-CD1 4.37Å; L295-L305 HydrophobicContact CD2-CD2 4.24Å; L295-T307 HydrophobicContact CD2-CG2 3.85Å
296	A	98.1	Very high	97.3	Very high	7 Å²	7	38.6 Å²	38.6	6%	0.058	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	123.6	163.7	0	0	0	0	0	111.8	C306 W344	A296-C306 PolarHBondContact N-O 2.81Å; A296-C306 PolarHBondContact O-N 2.74Å; A296-C306 PolarHBondContact O-SG 3.45Å; A296-W344 HydrophobicContact CB-CB 4.28Å
297	W	98.2	Very high	97.5	Very high	11 Å²	11	34.2 Å²	34.2	4%	0.042	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	143.6	172.4	-71.9	93.1	0	0	0	110.8	A251 N253 A261 I272 L305 I319	A251-W297 VanDerWaalsContact O-CD1 3.3Å; A251-W297 PolarHBondContact O-NE1 2.86Å; N253-W297 HydrophobicContact CB-CD2 3.73Å; N253-W297 HydrophobicContact CB-CE3 3.91Å; N253-W297 HydrophobicContact CB-CG 4.13Å; N253-W297 HydrophobicContact CB-CH2 4.44Å; N253-W297 HydrophobicContact CB-CZ2 4.27Å; N253-W297 HydrophobicContact CB-CZ3 4.28Å; N253-W297 VanDerWaalsContact ND2-CE3 3.34Å; N253-W297 VanDerWaalsContact ND2-CZ3 3.27Å; N253-W297 WeakPolarHBondContact ND2-CZ3 3.32Å; A261-W297 HydrophobicContact CB-CZ2 3.89Å; I272-W297 HydrophobicContact CD1-CH2 4.34Å; I272-W297 HydrophobicContact CD1-CZ2 4.18Å; I272-W297 HydrophobicContact CG2-CH2 4.27Å; I272-W297 HydrophobicContact CG2-CZ2 4.42Å; W297-L305 HydrophobicContact CD2-CB 4.39Å; W297-L305 HydrophobicContact CD2-CD1 3.85Å; W297-L305 HydrophobicContact CE3-CB 4.07Å; W297-L305 HydrophobicContact CE3-CD1 4.39Å; W297-L305 HydrophobicContact CG-CD1 3.92Å; W297-L305 HydrophobicContact CZ3-CB 4.17Å; W297-I319 HydrophobicContact CH2-CD1 3.57Å; W297-I319 HydrophobicContact CH2-CG1 4.48Å; W297-I319 HydrophobicContact CZ3-CD1 3.58Å; W297-I319 HydrophobicContact CZ3-CG1 4.19Å
298	A	97.9	Very high	97.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.16	C	C	.	.			trans	-63.4	128.4	172.5	0	0	0	0	0	110	H300 S301 H304 W344	A298-H300 PolarHBondContact O-N 2.91Å; A298-S301 PolarHBondContact O-N 2.84Å; A298-S301 VanDerWaalsContact O-O 3.09Å; A298-H304 HydrophobicContact CB-CB 3.6Å; A298-H304 WeakPolarHBondContact CB-O 3.31Å; A298-H304 PolarHBondContact N-O 3.09Å; A298-W344 HydrophobicContact CB-CD2 4.07Å; A298-W344 HydrophobicContact CB-CE3 3.81Å; A298-W344 HydrophobicContact CB-CH2 3.68Å; A298-W344 HydrophobicContact CB-CZ2 3.92Å; A298-W344 HydrophobicContact CB-CZ3 3.62Å
299	P	96.1	Very high	97.6	Very high	23 Å²	23	31.7 Å²	31.7	15%	0.149	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-14.9	-177.2	27.9	-34	0	0	0	112.5	Q255 W344 S345 P349	Q255-P299 PolarHBondContact NE2-O 3.28Å; P299-W344 VanDerWaalsContact CD-CG 3.43Å; P299-W344 HydrophobicContact CG-CG 4.33Å; P299-S345 WeakPolarHBondContact CG-O 3.38Å; P299-P349 HydrophobicContact CG-CB 4.23Å
300	H	95.4	Very high	97.6	Very high	93 Å²	93	24 Å²	24	43%	0.431	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-2.3	-175.7	64.3	-88.7	0	0	0	113.6	A298 W344 P349	A298-H300 PolarHBondContact O-N 2.91Å; H300-W344 AromaticContact CE1-CE2 3.96Å; H300-W344 AromaticContact CE1-CZ2 3.6Å; H300-P349 HydrophobicContact CB-CB 4Å; H300-P349 PolarHBondContact CE1-O 2.94Å; H300-P349 VanDerWaalsContact CE1-O 3.31Å; H300-P349 VanDerWaalsContact ND1-CB 3.26Å; H300-P349 WeakPolarHBondContact ND1-CB 3.39Å
301	S	96.7	Very high	97.6	Very high	16 Å²	16	24.3 Å²	24.3	11%	0.112	13%	0.13	C	C	.	.			trans	-135.9	134.2	-176.6	172.6	0	0	0	0	110.8	A298 C303 H304	A298-S301 PolarHBondContact O-N 2.84Å; A298-S301 VanDerWaalsContact O-O 3.09Å; S301-C303 PolarHBondContact O-N 2.99Å; S301-C303 PolarHBondContact OG-N 3.43Å; S301-C303 VanDerWaalsContact OG-N 3.09Å; S301-C303 PolarHBondContact OG-SG 3.27Å; S301-H304 PolarHBondContact OG-N 2.86Å; S301-H304 PolarHBondContact OG-ND1 3.33Å
302	S	96	Very high	97.7	Very high	62 Å²	62	22.2 Å²	22.2	43%	0.434	12%	0.124	S	C	.	.	S	Bend	trans	-79.4	-6.1	173	62.5	0	0	0	0	113	N253	N253-S302 PolarHBondContact ND2-O 3.08Å
303	C	96.4	Very high	97.7	Very high	21 Å²	21	24 Å²	24	14%	0.142	13%	0.133	C	C	.	.	S	Bend	trans	-121.2	-1.5	-176.7	65.4	0	0	0	0	114.8	S301 D318 I319 Q320	S301-C303 PolarHBondContact O-N 2.99Å; S301-C303 PolarHBondContact OG-N 3.43Å; S301-C303 VanDerWaalsContact OG-N 3.09Å; S301-C303 PolarHBondContact OG-SG 3.27Å; C303-D318 WeakPolarHBondContact CB-OD1 3.41Å; C303-D318 WeakPolarHBondContact O-CA 3.26Å; C303-D318 PolarHBondContact SG-OD1 3.49Å; C303-D318 VanDerWaalsContact SG-OD1 3.37Å; C303-I319 VanDerWaalsContact CA-CG1 3.49Å; C303-I319 HydrophobicContact CB-CG1 3.98Å; C303-I319 WeakPolarHBondContact O-CG1 3.49Å; C303-I319 PolarHBondContact O-N 2.9Å; C303-Q320 HydrophobicContact CB-CB 3.95Å
304	H	97.8	Very high	97.7	Very high	43 Å²	43	22.6 Å²	22.6	20%	0.199	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	131.4	178.8	-60.6	153.5	0	0	0	112.2	A298 S301 W317 W344	A298-H304 HydrophobicContact CB-CB 3.6Å; A298-H304 WeakPolarHBondContact CB-O 3.31Å; A298-H304 PolarHBondContact N-O 3.09Å; S301-H304 PolarHBondContact OG-N 2.86Å; S301-H304 PolarHBondContact OG-ND1 3.33Å; H304-W317 WeakPolarHBondContact CA-O 3.26Å; H304-W344 HydrophobicContact CB-CH2 4.4Å
305	L	98	Very high	97.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	136.9	175	173.5	70.4	0	0	0	108	A261 I270 I272 L285 L295 W297 T307 I316 W317	A261-L305 HydrophobicContact CB-CD1 4.32Å; A261-L305 HydrophobicContact CB-CD2 4.07Å; I270-L305 HydrophobicContact CG2-CD2 4.14Å; I272-L305 HydrophobicContact CD1-CD2 3.73Å; L285-L305 HydrophobicContact CD1-CD2 3.95Å; L295-L305 HydrophobicContact CD2-CD1 4.37Å; L295-L305 HydrophobicContact CD2-CD2 4.24Å; W297-L305 HydrophobicContact CD2-CB 4.39Å; W297-L305 HydrophobicContact CD2-CD1 3.85Å; W297-L305 HydrophobicContact CE3-CB 4.07Å; W297-L305 HydrophobicContact CE3-CD1 4.39Å; W297-L305 HydrophobicContact CG-CD1 3.92Å; W297-L305 HydrophobicContact CZ3-CB 4.17Å; L305-T307 HydrophobicContact CD2-CG2 4.18Å; L305-T307 HydrophobicContact CG-CG2 4.29Å; L305-I316 WeakPolarHBondContact O-CA 3.35Å; L305-W317 PolarHBondContact N-O 2.98Å; L305-W317 PolarHBondContact O-N 3.28Å
306	C	98.1	Very high	97.7	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.007	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	142.9	166	69.4	0	0	0	0	111.7	A296 L315 I316 I342 W344 I352	A296-C306 PolarHBondContact N-O 2.81Å; A296-C306 PolarHBondContact O-N 2.74Å; A296-C306 PolarHBondContact O-SG 3.45Å; C306-L315 CarbonylContact C-O 3.59Å; C306-L315 WeakPolarHBondContact CA-O 3.36Å; C306-I316 HydrophobicContact CB-CG1 4.17Å; C306-I342 HydrophobicContact CB-CD1 3.8Å; C306-I342 VanDerWaalsContact SG-CD1 3.51Å; C306-W344 HydrophobicContact CB-CE3 4.01Å; C306-W344 HydrophobicContact CB-CZ3 3.92Å; C306-I352 HydrophobicContact CB-CD1 3.94Å
307	T	98.6	Very high	97.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	151.5	179.3	61.9	0	0	0	0	109.5	I270 H288 G294 L295 L305 A314 L315 W317	I270-T307 HydrophobicContact CD1-CG2 3.81Å; I270-T307 HydrophobicContact CG1-CG2 3.76Å; H288-T307 WeakPolarHBondContact NE2-CB 3.11Å; H288-T307 PolarHBondContact NE2-OG1 3.23Å; G294-T307 VanDerWaalsContact O-CA 3.3Å; G294-T307 WeakPolarHBondContact O-CA 3.4Å; L295-T307 HydrophobicContact CD2-CG2 3.85Å; L305-T307 HydrophobicContact CD2-CG2 4.18Å; L305-T307 HydrophobicContact CG-CG2 4.29Å; T307-A314 CarbonylContact O-C 3.58Å; T307-A314 VanDerWaalsContact O-CA 3.23Å; T307-A314 WeakPolarHBondContact O-CA 3.35Å; T307-L315 PolarHBondContact N-O 3.12Å; T307-L315 PolarHBondContact O-N 3.36Å; T307-W317 PolarHBondContact OG1-NE1 3.04Å
308	A	98.5	Very high	97.7	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	144.4	176.5	0	0	0	0	0	110.6	N293 G294 Q313 I339 I342	N293-A308 PolarHBondContact N-O 2.82Å; G294-A308 PolarHBondContact N-O 2.93Å; G294-A308 VanDerWaalsContact N-O 3.17Å; G294-A308 PolarHBondContact O-N 3.38Å; A308-Q313 WeakPolarHBondContact CA-O 3.5Å; A308-I339 HydrophobicContact CB-CB 3.91Å; A308-I339 HydrophobicContact CB-CG2 3.48Å; A308-I339 VanDerWaalsContact CB-CG2 3.48Å; A308-I342 HydrophobicContact CB-CB 3.77Å; A308-I342 HydrophobicContact CB-CD1 4.25Å; A308-I342 HydrophobicContact CB-CG2 3.83Å
309	S	98.7	Very high	97.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	163.1	-172.4	171.6	0	0	0	0	113.2	H288 A290 F291 D311 C312 Q313 I339	H288-S309 WeakPolarHBondContact CE1-CB 3.25Å; H288-S309 WeakPolarHBondContact ND1-CB 3.31Å; A290-S309 VanDerWaalsContact C-OG 3.29Å; A290-S309 PolarHBondContact O-OG 3.21Å; F291-S309 CarbonylContact O-C 3.54Å; F291-S309 WeakPolarHBondContact O-CA 3.19Å; F291-S309 VanDerWaalsContact O-CB 3.25Å; F291-S309 WeakPolarHBondContact O-CB 3.29Å; F291-S309 PolarHBondContact O-OG 2.61Å; S309-D311 VanDerWaalsContact CB-OD1 3.25Å; S309-D311 WeakPolarHBondContact CB-OD1 3.45Å; S309-D311 PolarHBondContact O-N 2.94Å; S309-D311 PolarHBondContact OG-N 3.27Å; S309-D311 PolarHBondContact OG-OD1 3.08Å; S309-C312 PolarHBondContact O-N 3.32Å; S309-Q313 PolarHBondContact N-O 3.48Å; S309-I339 PolarHBondContact O-N 2.75Å; S309-I339 VanDerWaalsContact O-N 3.13Å
310	E	98.4	Very high	97.4	Very high	64 Å²	64	29.6 Å²	29.6	30%	0.299	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-12.8	167.7	-61.1	-175.3	169	0	0	113.4	A290 F291 N293 C312 E338	A290-E310 HydrophobicContact CB-CB 3.8Å; F291-E310 HydrophobicContact CB-CG 4.41Å; F291-E310 VanDerWaalsContact CD2-OE2 3.31Å; F291-E310 WeakPolarHBondContact CD2-OE2 3.38Å; F291-E310 PolarHBondContact O-N 3.05Å; N293-E310 WeakPolarHBondContact ND2-CG 3.29Å; E310-C312 PolarHBondContact O-N 2.89Å; E310-E338 HydrophobicContact CB-CG 4.36Å; E310-E338 WeakPolarHBondContact O-CG 3.44Å
311	D	98.3	Very high	97.1	Very high	31 Å²	31	27.9 Å²	27.9	17%	0.166	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	10.6	172.6	66.7	10.6	0	0	0	113.2	H288 R289 A290 S309 Q313	H288-D311 WeakPolarHBondContact CA-OD2 3.46Å; H288-D311 WeakPolarHBondContact CB-OD2 3.47Å; H288-D311 IonicContact CE1-OD1 3.49Å; H288-D311 IonicContact CG-OD2 3.43Å; H288-D311 IonicContact ND1-OD1 2.87Å; H288-D311 PolarHBondContact ND1-OD1 3.36Å; H288-D311 IonicContact ND1-OD2 3.64Å; H288-D311 PolarHBondContact ND1-OD2 3.36Å; R289-D311 HydrophobicContact CB-CB 4.15Å; R289-D311 PolarHBondContact N-OD2 2.74Å; A290-D311 HydrophobicContact CB-CB 3.96Å; S309-D311 VanDerWaalsContact CB-OD1 3.25Å; S309-D311 WeakPolarHBondContact CB-OD1 3.45Å; S309-D311 PolarHBondContact O-N 2.94Å; S309-D311 PolarHBondContact OG-N 3.27Å; S309-D311 PolarHBondContact OG-OD1 3.08Å; D311-Q313 PolarHBondContact O-N 3.48Å; D311-Q313 WeakPolarHBondContact OD1-CA 3.5Å; D311-Q313 WeakPolarHBondContact OD1-CB 3.39Å; D311-Q313 WeakPolarHBondContact OD1-CG 3.32Å; D311-Q313 PolarHBondContact OD1-N 2.94Å
312	C	98.5	Very high	96.7	Very high	32 Å²	32	28.8 Å²	28.8	22%	0.216	16%	0.158	C	C	.	.	S	Bend	trans	65	12	-175.6	-50.3	0	0	0	0	113.4	S309 E310 T334 A335 G337	S309-C312 PolarHBondContact O-N 3.32Å; E310-C312 PolarHBondContact O-N 2.89Å; C312-T334 HydrophobicContact CB-CG2 4.43Å; C312-T334 CarbonylContact O-C 3.53Å; C312-T334 WeakPolarHBondContact O-CA 3.36Å; C312-A335 PolarHBondContact O-N 3.21Å; C312-G337 WeakPolarHBondContact CA-O 3.48Å; C312-G337 WeakPolarHBondContact CB-O 3.39Å
313	Q	98.3	Very high	96.1	Very high	41 Å²	41	31.6 Å²	31.6	19%	0.192	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	140.9	-179.1	-54.5	-156.9	-55.6	0	0	113.3	H288 A308 S309 D311 L315 Y333 T334 I339	H288-Q313 PolarHBondContact CE1-O 3.33Å; A308-Q313 WeakPolarHBondContact CA-O 3.5Å; S309-Q313 PolarHBondContact N-O 3.48Å; D311-Q313 PolarHBondContact O-N 3.48Å; D311-Q313 WeakPolarHBondContact OD1-CA 3.5Å; D311-Q313 WeakPolarHBondContact OD1-CB 3.39Å; D311-Q313 WeakPolarHBondContact OD1-CG 3.32Å; D311-Q313 PolarHBondContact OD1-N 2.94Å; Q313-L315 HydrophobicContact CB-CD2 4.09Å; Q313-L315 HydrophobicContact CB-CG 4.38Å; Q313-Y333 CarbonylContact C-O 3.3Å; Q313-Y333 VanDerWaalsContact CA-O 3.24Å; Q313-Y333 WeakPolarHBondContact CA-O 3.31Å; Q313-T334 PolarHBondContact NE2-OG1 3.38Å; Q313-I339 VanDerWaalsContact C-CD1 3.48Å
314	A	98.5	Very high	95.7	Very high	8 Å²	8	40.1 Å²	40.1	7%	0.066	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	122.8	158	0	0	0	0	0	108.4	T307 A332 Y333 I339 I342 I354	T307-A314 CarbonylContact O-C 3.58Å; T307-A314 VanDerWaalsContact O-CA 3.23Å; T307-A314 WeakPolarHBondContact O-CA 3.35Å; A314-A332 WeakPolarHBondContact O-CA 3.3Å; A314-Y333 PolarHBondContact N-O 2.75Å; A314-Y333 PolarHBondContact O-N 3.38Å; A314-I339 HydrophobicContact CB-CD1 3.89Å; A314-I342 HydrophobicContact CB-CD1 3.96Å; A314-I354 HydrophobicContact CB-CG2 4.24Å
315	L	98.3	Very high	95.2	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	144.2	-178.5	-56.9	-179.7	0	0	0	110.1	N287 C306 T307 Q313 W317 P329 L331 A332	N287-L315 HydrophobicContact CB-CD1 4.26Å; C306-L315 CarbonylContact C-O 3.59Å; C306-L315 WeakPolarHBondContact CA-O 3.36Å; T307-L315 PolarHBondContact N-O 3.12Å; T307-L315 PolarHBondContact O-N 3.36Å; Q313-L315 HydrophobicContact CB-CD2 4.09Å; Q313-L315 HydrophobicContact CB-CG 4.38Å; L315-W317 HydrophobicContact CB-CZ2 4.4Å; L315-W317 HydrophobicContact CD1-CH2 4.42Å; L315-W317 HydrophobicContact CD1-CZ2 3.73Å; L315-P329 HydrophobicContact CB-CB 3.93Å; L315-P329 HydrophobicContact CB-CG 4.37Å; L315-P329 HydrophobicContact CD1-CB 4.44Å; L315-P329 HydrophobicContact CD1-CG 4.13Å; L315-P329 HydrophobicContact CD2-CB 4.37Å; L315-P329 HydrophobicContact CD2-CG 3.96Å; L315-P329 HydrophobicContact CG-CB 4.47Å; L315-P329 HydrophobicContact CG-CG 4.38Å; L315-L331 WeakPolarHBondContact CA-O 3.15Å; L315-A332 HydrophobicContact CD2-CB 3.49Å; L315-A332 VanDerWaalsContact CD2-CB 3.49Å
316	I	98.1	Very high	94.9	Very high	13 Å²	13	42.9 Å²	42.9	7%	0.067	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	128	169.2	-58.2	176.6	0	0	0	108.2	L305 C306 P329 I330 L331 W344 I352 V365	L305-I316 WeakPolarHBondContact O-CA 3.35Å; C306-I316 HydrophobicContact CB-CG1 4.17Å; I316-P329 CarbonylContact O-C 3.39Å; I316-P329 WeakPolarHBondContact O-CA 2.94Å; I316-P329 VanDerWaalsContact O-CB 3.27Å; I316-P329 WeakPolarHBondContact O-CB 3.24Å; I316-I330 HydrophobicContact CB-CG1 4.21Å; I316-I330 HydrophobicContact CG2-CD1 3.96Å; I316-I330 HydrophobicContact CG2-CG1 3.91Å; I316-I330 VanDerWaalsContact O-CG1 3.28Å; I316-I330 WeakPolarHBondContact O-CG1 3.23Å; I316-I330 PolarHBondContact O-N 3.04Å; I316-L331 HydrophobicContact CB-CB 4.12Å; I316-L331 HydrophobicContact CD1-CB 4.22Å; I316-L331 HydrophobicContact CD1-CD1 3.94Å; I316-L331 HydrophobicContact CG1-CB 4.38Å; I316-L331 PolarHBondContact N-O 2.85Å; I316-L331 PolarHBondContact O-N 2.81Å; I316-W344 HydrophobicContact CD1-CH2 4.21Å; I316-W344 HydrophobicContact CG2-CH2 4.33Å; I316-I352 HydrophobicContact CD1-CD1 3.96Å; I316-I352 HydrophobicContact CG1-CD1 4.37Å; I316-V365 HydrophobicContact CD1-CB 4.06Å; I316-V365 HydrophobicContact CD1-CG1 3.72Å
317	W	97.9	Very high	94.4	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	143.7	-177.9	-55.3	88.1	0	0	0	109.9	I270 L285 N287 H304 L305 T307 L315 I326 P329	I270-W317 HydrophobicContact CD1-CZ2 4.32Å; L285-W317 HydrophobicContact CB-CD2 4.12Å; L285-W317 HydrophobicContact CB-CE3 4Å; L285-W317 HydrophobicContact CB-CH2 3.78Å; L285-W317 HydrophobicContact CB-CZ2 3.98Å; L285-W317 HydrophobicContact CB-CZ3 3.84Å; L285-W317 HydrophobicContact CD1-CB 4.02Å; L285-W317 HydrophobicContact CD1-CD2 3.77Å; L285-W317 HydrophobicContact CD1-CE3 4.19Å; L285-W317 HydrophobicContact CD1-CG 3.7Å; L285-W317 HydrophobicContact CD2-CD2 4.47Å; L285-W317 HydrophobicContact CD2-CE3 4.05Å; L285-W317 HydrophobicContact CD2-CZ3 4.4Å; L285-W317 HydrophobicContact CG-CD2 4.35Å; L285-W317 HydrophobicContact CG-CE3 4.31Å; N287-W317 HydrophobicContact CB-CH2 3.34Å; N287-W317 HydrophobicContact CB-CZ2 4.1Å; N287-W317 HydrophobicContact CB-CZ3 4.1Å; H304-W317 WeakPolarHBondContact CA-O 3.26Å; L305-W317 PolarHBondContact N-O 2.98Å; L305-W317 PolarHBondContact O-N 3.28Å; T307-W317 PolarHBondContact OG1-NE1 3.04Å; L315-W317 HydrophobicContact CB-CZ2 4.4Å; L315-W317 HydrophobicContact CD1-CH2 4.42Å; L315-W317 HydrophobicContact CD1-CZ2 3.73Å; W317-I326 HydrophobicContact CE3-CG2 3.98Å; W317-I326 HydrophobicContact CZ3-CG2 4.46Å; W317-P329 HydrophobicContact CD2-CB 4.23Å; W317-P329 HydrophobicContact CE3-CB 4.2Å; W317-P329 HydrophobicContact CZ3-CB 4.5Å
318	D	96.7	Very high	94.2	Very high	41 Å²	41	55.2 Å²	55.2	22%	0.219	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	114.3	165.5	-175.8	1.7	0	0	0	109.4	C303 Q320 I330	C303-D318 WeakPolarHBondContact CB-OD1 3.41Å; C303-D318 WeakPolarHBondContact O-CA 3.26Å; C303-D318 PolarHBondContact SG-OD1 3.49Å; C303-D318 VanDerWaalsContact SG-OD1 3.37Å; D318-Q320 WeakPolarHBondContact OD1-CB 3.46Å; D318-Q320 PolarHBondContact OD1-N 3.14Å; D318-I330 HydrophobicContact CB-CD1 4.28Å; D318-I330 HydrophobicContact CB-CG2 3.72Å
319	I	95.2	Very high	94.1	Very high	5 Å²	5	56.5 Å²	56.5	3%	0.026	30%	0.3	C	S	.	.			trans	-97	10	180	61.6	146.3	0	0	0	112.8	L285 W297 C303 S321 M322 I326	L285-I319 HydrophobicContact CD2-CG2 4.45Å; W297-I319 HydrophobicContact CH2-CD1 3.57Å; W297-I319 HydrophobicContact CH2-CG1 4.48Å; W297-I319 HydrophobicContact CZ3-CD1 3.58Å; W297-I319 HydrophobicContact CZ3-CG1 4.19Å; C303-I319 VanDerWaalsContact CA-CG1 3.49Å; C303-I319 HydrophobicContact CB-CG1 3.98Å; C303-I319 WeakPolarHBondContact O-CG1 3.49Å; C303-I319 PolarHBondContact O-N 2.9Å; I319-S321 PolarHBondContact O-N 3.3Å; I319-S321 VanDerWaalsContact O-N 3.16Å; I319-M322 HydrophobicContact CB-CE 3.86Å; I319-M322 HydrophobicContact CB-CG 4.02Å; I319-M322 HydrophobicContact CB-SD 3.85Å; I319-M322 HydrophobicContact CD1-CE 3.28Å; I319-M322 HydrophobicContact CD1-SD 4.2Å; I319-M322 HydrophobicContact CG1-CE 4.05Å; I319-M322 HydrophobicContact CG2-SD 4.28Å; I319-M322 WeakPolarHBondContact O-CB 3.39Å; I319-M322 VanDerWaalsContact O-CG 3.27Å; I319-M322 WeakPolarHBondContact O-CG 3.31Å; I319-M322 PolarHBondContact O-N 2.98Å; I319-M322 VanDerWaalsContact O-N 3.09Å; I319-I326 HydrophobicContact CB-CD1 3.82Å; I319-I326 HydrophobicContact CG2-CD1 3.53Å
320	Q	93.5	Very high	94	Very high	150 Å²	150	60.5 Å²	60.5	70%	0.701	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-30.8	-178.3	-174.3	177	21.5	0	0	112.5	C303 D318 M322	C303-Q320 HydrophobicContact CB-CB 3.95Å; D318-Q320 WeakPolarHBondContact OD1-CB 3.46Å; D318-Q320 PolarHBondContact OD1-N 3.14Å; Q320-M322 VanDerWaalsContact C-N 3.27Å; Q320-M322 PolarHBondContact O-N 3.24Å
321	S	89	Confident	94	Very high	58 Å²	58	61.6 Å²	61.6	41%	0.406	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-0.7	-179.4	58	0	0	0	0	114.6	I319 R324	I319-S321 PolarHBondContact O-N 3.3Å; I319-S321 VanDerWaalsContact O-N 3.16Å; S321-R324 WeakPolarHBondContact O-CA 3.5Å; S321-R324 WeakPolarHBondContact O-CB 3.41Å; S321-R324 WeakPolarHBondContact O-CG 3.31Å; S321-R324 PolarHBondContact O-N 3.39Å
322	M	88.1	Confident	93.9	Very high	35 Å²	35	63.2 Å²	63.2	17%	0.172	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	141.5	177.1	-74	-170.7	-45.4	0	0	111.6	Y259 I272 V282 A283 I319 Q320 I326	Y259-M322 HydrophobicContact CD1-CE 4.34Å; Y259-M322 HydrophobicContact CE1-CE 3.86Å; I272-M322 HydrophobicContact CG2-CE 4.44Å; I272-M322 HydrophobicContact CG2-SD 4.15Å; V282-M322 HydrophobicContact CG2-CE 4.44Å; V282-M322 HydrophobicContact CG2-SD 4.12Å; A283-M322 HydrophobicContact CB-CG 4Å; A283-M322 HydrophobicContact CB-SD 3.45Å; A283-M322 WeakPolarHBondContact CB-SD 3.25Å; I319-M322 HydrophobicContact CB-CE 3.86Å; I319-M322 HydrophobicContact CB-CG 4.02Å; I319-M322 HydrophobicContact CB-SD 3.85Å; I319-M322 HydrophobicContact CD1-CE 3.28Å; I319-M322 HydrophobicContact CD1-SD 4.2Å; I319-M322 HydrophobicContact CG1-CE 4.05Å; I319-M322 HydrophobicContact CG2-SD 4.28Å; I319-M322 WeakPolarHBondContact O-CB 3.39Å; I319-M322 VanDerWaalsContact O-CG 3.27Å; I319-M322 WeakPolarHBondContact O-CG 3.31Å; I319-M322 PolarHBondContact O-N 2.98Å; I319-M322 VanDerWaalsContact O-N 3.09Å; Q320-M322 VanDerWaalsContact C-N 3.27Å; Q320-M322 PolarHBondContact O-N 3.24Å; M322-I326 HydrophobicContact CG-CD1 3.87Å
323	P	83.2	Confident	93.9	Very high	121 Å²	121	64.4 Å²	64.4	79%	0.786	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.9	13.8	9.1	36.4	-37.4	0	0	0	114.4
324	R	87.7	Confident	93.9	Very high	199 Å²	199	66.8 Å²	66.8	75%	0.751	36%	0.364	S	S	*	.	S	Bend	trans	-64	143.8	172.4	-57.1	-179.4	179.3	-173.7	0.3	109.1	S321 I326	S321-R324 WeakPolarHBondContact O-CA 3.5Å; S321-R324 WeakPolarHBondContact O-CB 3.41Å; S321-R324 WeakPolarHBondContact O-CG 3.31Å; S321-R324 PolarHBondContact O-N 3.39Å; R324-I326 PolarHBondContact O-N 2.82Å
325	A	87.2	Confident	93.9	Very high	83 Å²	83	66.8 Å²	66.8	69%	0.686	36%	0.364	S	S	*	.			trans	-55.8	139.2	176.7	0	0	0	0	0	110.7
326	I	91.3	Very high	93.8	Very high	19 Å²	19	70.5 Å²	70.5	10%	0.097	39%	0.394	C	S	.	.			trans	-105.9	104.8	175.6	-60.5	153.5	0	0	0	105.3	A283 L285 W317 I319 M322 R324	A283-I326 HydrophobicContact CB-CD1 4.45Å; L285-I326 HydrophobicContact CD2-CB 3.85Å; L285-I326 HydrophobicContact CD2-CD1 3.62Å; L285-I326 HydrophobicContact CD2-CG1 4.39Å; L285-I326 HydrophobicContact CD2-CG2 4.04Å; W317-I326 HydrophobicContact CE3-CG2 3.98Å; W317-I326 HydrophobicContact CZ3-CG2 4.46Å; I319-I326 HydrophobicContact CB-CD1 3.82Å; I319-I326 HydrophobicContact CG2-CD1 3.53Å; M322-I326 HydrophobicContact CG-CD1 3.87Å; R324-I326 PolarHBondContact O-N 2.82Å
327	E	88.7	Confident	93.8	Very high	149 Å²	149	70.3 Å²	70.3	70%	0.696	40%	0.396	S	S	*	.			trans	-85.6	-38.7	-172	-63	-177.6	173.7	0	0	111.6	N287	N287-E327 PolarHBondContact ND2-O 3.2Å
328	D	94.4	Very high	93.8	Very high	110 Å²	110	75.2 Å²	75.2	59%	0.588	42%	0.419	S	S	*	.	S	Bend	trans	-128.6	144.6	-174.1	-68.2	-57	0	0	0	112.3	N287	N287-D328 PolarHBondContact ND2-OD1 3.09Å
329	P	96.9	Very high	93.9	Very high	27 Å²	27	73.3 Å²	73.3	18%	0.175	41%	0.408	C	S	.	.			trans	-67.7	152.6	166	32.4	-36.6	0	0	0	110.6	L315 I316 W317	L315-P329 HydrophobicContact CB-CB 3.93Å; L315-P329 HydrophobicContact CB-CG 4.37Å; L315-P329 HydrophobicContact CD1-CB 4.44Å; L315-P329 HydrophobicContact CD1-CG 4.13Å; L315-P329 HydrophobicContact CD2-CB 4.37Å; L315-P329 HydrophobicContact CD2-CG 3.96Å; L315-P329 HydrophobicContact CG-CB 4.47Å; L315-P329 HydrophobicContact CG-CG 4.38Å; I316-P329 CarbonylContact O-C 3.39Å; I316-P329 WeakPolarHBondContact O-CA 2.94Å; I316-P329 VanDerWaalsContact O-CB 3.27Å; I316-P329 WeakPolarHBondContact O-CB 3.24Å; W317-P329 HydrophobicContact CD2-CB 4.23Å; W317-P329 HydrophobicContact CE3-CB 4.2Å; W317-P329 HydrophobicContact CZ3-CB 4.5Å
330	I	96.9	Very high	94	Very high	85 Å²	85	76.3 Å²	76.3	44%	0.436	43%	0.425	S	S	.	.	S	Bend	trans	-81	-25.2	177.5	58.7	162.8	0	0	0	112.7	I316 D318	I316-I330 HydrophobicContact CB-CG1 4.21Å; I316-I330 HydrophobicContact CG2-CD1 3.96Å; I316-I330 HydrophobicContact CG2-CG1 3.91Å; I316-I330 VanDerWaalsContact O-CG1 3.28Å; I316-I330 WeakPolarHBondContact O-CG1 3.23Å; I316-I330 PolarHBondContact O-N 3.04Å; D318-I330 HydrophobicContact CB-CD1 4.28Å; D318-I330 HydrophobicContact CB-CG2 3.72Å
331	L	97	Very high	94.1	Very high	87 Å²	87	70.6 Å²	70.6	46%	0.455	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	147.7	176.4	-66	169.5	0	0	0	110	L315 I316	L315-L331 WeakPolarHBondContact CA-O 3.15Å; I316-L331 HydrophobicContact CB-CB 4.12Å; I316-L331 HydrophobicContact CD1-CB 4.22Å; I316-L331 HydrophobicContact CD1-CD1 3.94Å; I316-L331 HydrophobicContact CG1-CB 4.38Å; I316-L331 PolarHBondContact N-O 2.85Å; I316-L331 PolarHBondContact O-N 2.81Å
332	A	97.2	Very high	94.6	Very high	65 Å²	65	68 Å²	68	54%	0.537	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	136.5	176.3	0	0	0	0	0	110	A314 L315	A314-A332 WeakPolarHBondContact O-CA 3.3Å; L315-A332 HydrophobicContact CD2-CB 3.49Å; L315-A332 VanDerWaalsContact CD2-CB 3.49Å
333	Y	97.9	Very high	95	Very high	57 Å²	57	68.5 Å²	68.5	22%	0.224	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.7	171.8	176.2	-99.2	0	0	0	109.5	I32 Q313 A314 A335 I354 E361 L363	I32-Y333 HydrophobicContact CD1-CD2 4.49Å; I32-Y333 HydrophobicContact CD1-CE2 3.63Å; Q313-Y333 CarbonylContact C-O 3.3Å; Q313-Y333 VanDerWaalsContact CA-O 3.24Å; Q313-Y333 WeakPolarHBondContact CA-O 3.31Å; A314-Y333 PolarHBondContact N-O 2.75Å; A314-Y333 PolarHBondContact O-N 3.38Å; Y333-A335 HydrophobicContact CE1-CB 4.11Å; Y333-I354 HydrophobicContact CD1-CD1 3.9Å; Y333-I354 HydrophobicContact CE1-CD1 3.6Å; Y333-E361 VanDerWaalsContact CE1-OE2 3.32Å; Y333-E361 WeakPolarHBondContact CE1-OE2 3.48Å; Y333-E361 PolarHBondContact OH-OE1 3.48Å; Y333-E361 PolarHBondContact OH-OE2 3.48Å; Y333-L363 HydrophobicContact CD1-CD1 3.5Å; Y333-L363 VanDerWaalsContact CD1-CD1 3.5Å; Y333-L363 HydrophobicContact CD1-CD2 4.33Å; Y333-L363 HydrophobicContact CD2-CD1 4.33Å; Y333-L363 HydrophobicContact CD2-CD2 4.42Å; Y333-L363 HydrophobicContact CE1-CD1 3.85Å; Y333-L363 HydrophobicContact CE1-CD2 3.91Å; Y333-L363 HydrophobicContact CE2-CD2 4.03Å; Y333-L363 HydrophobicContact CG-CD1 3.74Å
334	T	98	Very high	95.7	Very high	91 Å²	91	63.6 Å²	63.6	56%	0.558	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	113	176.9	-57.5	0	0	0	0	109.8	C312 Q313	C312-T334 HydrophobicContact CB-CG2 4.43Å; C312-T334 CarbonylContact O-C 3.53Å; C312-T334 WeakPolarHBondContact O-CA 3.36Å; Q313-T334 PolarHBondContact NE2-OG1 3.38Å
335	A	98	Very high	96.2	Very high	8 Å²	8	54.1 Å²	54.1	7%	0.066	31%	0.311	C	S	.	.			trans	-76.1	170.2	174.1	0	0	0	0	0	111.9	C312 Y333 G337 I339 I354 Y356	C312-A335 PolarHBondContact O-N 3.21Å; Y333-A335 HydrophobicContact CE1-CB 4.11Å; A335-G337 PolarHBondContact O-N 3.39Å; A335-I339 HydrophobicContact CB-CD1 3.81Å; A335-I339 HydrophobicContact CB-CG1 3.78Å; A335-I354 HydrophobicContact CB-CD1 4.02Å; A335-Y356 HydrophobicContact CB-CD1 3.72Å; A335-Y356 HydrophobicContact CB-CE1 3.76Å; A335-Y356 HydrophobicContact CB-CG 4.32Å
336	A	97.6	Very high	96.5	Very high	77 Å²	77	53.1 Å²	53.1	64%	0.636	30%	0.299	S	S	*	.	S	Bend	trans	-82.7	4.6	177.4	0	0	0	0	0	113.9	Y356	A336-Y356 HydrophobicContact CB-CE2 3.85Å
337	G	97.8	Very high	96.7	Very high	9 Å²	9	54.5 Å²	54.5	9%	0.093	31%	0.309	C	S	.	.	S	Bend	trans	-168.1	175.8	178.6	0	0	0	0	0	111.7	C312 A335 I339	C312-G337 WeakPolarHBondContact CA-O 3.48Å; C312-G337 WeakPolarHBondContact CB-O 3.39Å; A335-G337 PolarHBondContact O-N 3.39Å; G337-I339 PolarHBondContact O-N 2.65Å
338	E	98.2	Very high	97	Very high	104 Å²	104	48.3 Å²	48.3	49%	0.486	28%	0.28	S	S	.	.			trans	-58.7	124.2	-179.9	-60.1	175.3	173	0	0	110.3	E310 N340 Y356	E310-E338 HydrophobicContact CB-CG 4.36Å; E310-E338 WeakPolarHBondContact O-CG 3.44Å; E338-N340 PolarHBondContact O-N 3.14Å; E338-Y356 WeakPolarHBondContact O-CA 3.49Å; E338-Y356 WeakPolarHBondContact O-CB 3.32Å
339	I	98.4	Very high	97.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.265	C	S	.	.			trans	-84.9	118	-175.9	-52.6	-178.5	0	0	0	108.7	N293 A308 S309 Q313 A314 A335 G337 Q341 I354	N293-I339 WeakPolarHBondContact CB-O 3.37Å; N293-I339 PolarHBondContact ND2-O 3.04Å; A308-I339 HydrophobicContact CB-CB 3.91Å; A308-I339 HydrophobicContact CB-CG2 3.48Å; A308-I339 VanDerWaalsContact CB-CG2 3.48Å; S309-I339 PolarHBondContact O-N 2.75Å; S309-I339 VanDerWaalsContact O-N 3.13Å; Q313-I339 VanDerWaalsContact C-CD1 3.48Å; A314-I339 HydrophobicContact CB-CD1 3.89Å; A335-I339 HydrophobicContact CB-CD1 3.81Å; A335-I339 HydrophobicContact CB-CG1 3.78Å; G337-I339 PolarHBondContact O-N 2.65Å; I339-Q341 WeakPolarHBondContact CG2-O 3.36Å; I339-I354 HydrophobicContact CD1-CD1 3.96Å; I339-I354 HydrophobicContact CD1-CG2 4.48Å; I339-I354 HydrophobicContact CG2-CB 3.92Å; I339-I354 HydrophobicContact CG2-CG2 4.11Å
340	N	96.2	Very high	97	Very high	69 Å²	69	47.7 Å²	47.7	37%	0.369	28%	0.277	S	S	.	.			trans	-90	-30.9	-175.7	-64.8	-41.2	0	0	0	112.7	E338 C355	E338-N340 PolarHBondContact O-N 3.14Å; N340-C355 PolarHBondContact N-O 3.27Å
341	Q	96.9	Very high	97	Very high	30 Å²	30	44.2 Å²	44.2	14%	0.14	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	149.6	-179.8	-156.2	-172.3	1.6	0	0	110.6	S43 M44 I339 I354 C355	S43-Q341 VanDerWaalsContact CA-OE1 3.29Å; M44-Q341 HydrophobicContact CE-CB 3.92Å; M44-Q341 HydrophobicContact CE-CG 4.31Å; M44-Q341 WeakPolarHBondContact CE-O 3.25Å; M44-Q341 PolarHBondContact O-NE2 2.68Å; M44-Q341 VanDerWaalsContact O-NE2 3.16Å; M44-Q341 PolarHBondContact O-OE1 3.27Å; I339-Q341 WeakPolarHBondContact CG2-O 3.36Å; Q341-I354 WeakPolarHBondContact O-CA 3.23Å; Q341-C355 WeakPolarHBondContact CB-SG 3.5Å; Q341-C355 PolarHBondContact O-N 3.49Å; Q341-C355 VanDerWaalsContact O-N 3.1Å
342	I	98.2	Very high	97.1	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	141.3	173.6	-169	163.2	0	0	0	109.5	C306 A308 A314 I352 A353 I354	C306-I342 HydrophobicContact CB-CD1 3.8Å; C306-I342 VanDerWaalsContact SG-CD1 3.51Å; A308-I342 HydrophobicContact CB-CB 3.77Å; A308-I342 HydrophobicContact CB-CD1 4.25Å; A308-I342 HydrophobicContact CB-CG2 3.83Å; A314-I342 HydrophobicContact CB-CD1 3.96Å; I342-I352 HydrophobicContact CD1-CG2 3.83Å; I342-I352 HydrophobicContact CG1-CG2 3.52Å; I342-A353 CarbonylContact C-O 3.56Å; I342-A353 WeakPolarHBondContact CA-O 3.07Å; I342-I354 HydrophobicContact CB-CG2 4.21Å; I342-I354 HydrophobicContact CD1-CG2 3.92Å; I342-I354 HydrophobicContact CG1-CG2 3.77Å
343	Q	98.1	Very high	97.1	Very high	46 Å²	46	37.2 Å²	37.2	22%	0.215	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	128.2	177.7	-73.2	-64.6	-31.6	0	0	110.5	W46 I352 A353	W46-Q343 PolarHBondContact NE1-O 3.42Å; W46-Q343 VanDerWaalsContact NE1-O 3.14Å; Q343-I352 CarbonylContact O-C 3.51Å; Q343-I352 WeakPolarHBondContact O-CA 3.15Å; Q343-A353 PolarHBondContact N-O 3.34Å; Q343-A353 PolarHBondContact O-N 3Å
344	W	97.8	Very high	97.2	Very high	19 Å²	19	34.5 Å²	34.5	7%	0.072	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	130.1	172.7	-149.6	-46.8	0	0	0	110	A296 A298 P299 H300 H304 C306 I316 S346 P349 I352 V365	A296-W344 HydrophobicContact CB-CB 4.28Å; A298-W344 HydrophobicContact CB-CD2 4.07Å; A298-W344 HydrophobicContact CB-CE3 3.81Å; A298-W344 HydrophobicContact CB-CH2 3.68Å; A298-W344 HydrophobicContact CB-CZ2 3.92Å; A298-W344 HydrophobicContact CB-CZ3 3.62Å; P299-W344 VanDerWaalsContact CD-CG 3.43Å; P299-W344 HydrophobicContact CG-CG 4.33Å; H300-W344 AromaticContact CE1-CE2 3.96Å; H300-W344 AromaticContact CE1-CZ2 3.6Å; H304-W344 HydrophobicContact CB-CH2 4.4Å; C306-W344 HydrophobicContact CB-CE3 4.01Å; C306-W344 HydrophobicContact CB-CZ3 3.92Å; I316-W344 HydrophobicContact CD1-CH2 4.21Å; I316-W344 HydrophobicContact CG2-CH2 4.33Å; W344-S346 PolarHBondContact O-N 2.94Å; W344-P349 PolarHBondContact NE1-O 2.96Å; W344-I352 HydrophobicContact CD2-CD1 3.92Å; W344-I352 HydrophobicContact CD2-CG1 3.78Å; W344-I352 HydrophobicContact CE3-CD1 3.82Å; W344-I352 HydrophobicContact CE3-CG1 4.19Å; W344-I352 HydrophobicContact CG-CG1 3.99Å; W344-I352 HydrophobicContact CH2-CD1 4.09Å; W344-I352 HydrophobicContact CZ2-CD1 4.18Å; W344-I352 HydrophobicContact CZ2-CG1 4.4Å; W344-I352 HydrophobicContact CZ3-CD1 3.9Å; W344-V365 HydrophobicContact CH2-CG2 4.49Å; W344-V365 HydrophobicContact CZ2-CG2 3.69Å
345	S	97.5	Very high	97.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.175	C	C	.	.			trans	-70.6	121.8	178.2	-177.9	0	0	0	0	111.4	P299 T347 Q348 P349 W351	P299-S345 WeakPolarHBondContact CG-O 3.38Å; S345-T347 PolarHBondContact OG-OG1 3.21Å; S345-Q348 WeakPolarHBondContact CB-O 3.09Å; S345-Q348 CarbonylContact O-C 3.58Å; S345-Q348 PolarHBondContact OG-N 2.94Å; S345-Q348 VanDerWaalsContact OG-N 3.12Å; S345-P349 WeakPolarHBondContact O-CA 3.32Å; S345-W351 WeakPolarHBondContact CB-O 3.43Å; S345-W351 PolarHBondContact N-O 3.06Å
346	S	94.4	Very high	97.2	Very high	62 Å²	62	30 Å²	30	43%	0.434	17%	0.173	S	C	.	.	S	Bend	trans	-72.7	-29	176.2	57.8	0	0	0	0	113.5	V48 W344	V48-S346 WeakPolarHBondContact CG1-OG 3.46Å; W344-S346 PolarHBondContact O-N 2.94Å
347	T	94.5	Very high	97.1	Very high	48 Å²	48	30.2 Å²	30.2	29%	0.294	16%	0.164	S	C	.	.	S	Bend	trans	-89.3	-21.6	178.5	49.5	0	0	0	0	113.2	V48 S345	V48-T347 HydrophobicContact CB-CG2 4.34Å; V48-T347 WeakPolarHBondContact O-CG2 3.38Å; S345-T347 PolarHBondContact OG-OG1 3.21Å
348	Q	95.4	Very high	97.1	Very high	18 Å²	18	32.9 Å²	32.9	8%	0.084	18%	0.176	C	C	.	.	S	Bend	trans	-132.6	76.4	-179.3	-57.2	-177.4	93.3	0	0	109.1	R53 F54 S345 D350 W351	R53-Q348 VanDerWaalsContact CG-OE1 3.25Å; F54-Q348 VanDerWaalsContact N-NE2 3.17Å; S345-Q348 WeakPolarHBondContact CB-O 3.09Å; S345-Q348 CarbonylContact O-C 3.58Å; S345-Q348 PolarHBondContact OG-N 2.94Å; S345-Q348 VanDerWaalsContact OG-N 3.12Å; Q348-D350 PolarHBondContact O-N 2.7Å; Q348-W351 HydrophobicContact CB-CB 4.46Å; Q348-W351 HydrophobicContact CB-CG 4.46Å; Q348-W351 WeakPolarHBondContact O-CB 3.27Å; Q348-W351 PolarHBondContact O-N 2.76Å
349	P	95.4	Very high	97.1	Very high	43 Å²	43	28.2 Å²	28.2	28%	0.279	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-10	-167.3	-20.8	33.1	0	0	0	115.3	P299 H300 W344 S345 W351	P299-P349 HydrophobicContact CG-CB 4.23Å; H300-P349 HydrophobicContact CB-CB 4Å; H300-P349 PolarHBondContact CE1-O 2.94Å; H300-P349 VanDerWaalsContact CE1-O 3.31Å; H300-P349 VanDerWaalsContact ND1-CB 3.26Å; H300-P349 WeakPolarHBondContact ND1-CB 3.39Å; W344-P349 PolarHBondContact NE1-O 2.96Å; S345-P349 WeakPolarHBondContact O-CA 3.32Å; P349-W351 PolarHBondContact O-N 2.99Å
350	D	95.6	Very high	97.1	Very high	81 Å²	81	28.2 Å²	28.2	43%	0.433	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	2.5	171.6	-58.3	-8.2	0	0	0	112.6	Q348 R364 V365	Q348-D350 PolarHBondContact O-N 2.7Å; D350-R364 HydrophobicContact CB-CG 4.36Å; D350-R364 CarbonylContact O-C 3.55Å; D350-R364 VanDerWaalsContact O-CA 3.25Å; D350-R364 WeakPolarHBondContact O-CA 3.46Å; D350-R364 WeakPolarHBondContact O-CG 3.45Å; D350-R364 IonicContact OD2-NH2 3.29Å; D350-V365 WeakPolarHBondContact O-CG2 3.21Å; D350-V365 PolarHBondContact O-N 2.92Å
351	W	97.3	Very high	97.2	Very high	12 Å²	12	25 Å²	25	5%	0.045	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	132.5	-172	-66.3	84.4	0	0	0	113.3	Y33 W46 F54 S345 Q348 P349 I362 L363 R364	Y33-W351 AromaticContact CD2-CH2 3.81Å; Y33-W351 HydrophobicContact CD2-CH2 3.81Å; Y33-W351 AromaticContact CD2-CZ3 3.89Å; Y33-W351 HydrophobicContact CD2-CZ3 3.89Å; Y33-W351 AromaticContact CE2-CH2 3.63Å; Y33-W351 HydrophobicContact CE2-CH2 3.63Å; Y33-W351 HydrophobicContact CE2-CZ3 4.2Å; W46-W351 HydrophobicContact CH2-CB 4.34Å; W46-W351 HydrophobicContact CZ2-CB 4.26Å; F54-W351 AromaticContact CE1-CD1 3.87Å; F54-W351 AromaticContact CE1-CD2 3.69Å; F54-W351 HydrophobicContact CE1-CD2 3.69Å; F54-W351 AromaticContact CE1-CE2 3.67Å; F54-W351 HydrophobicContact CE1-CE3 4.32Å; F54-W351 AromaticContact CE1-CG 3.82Å; F54-W351 HydrophobicContact CE1-CG 3.82Å; F54-W351 HydrophobicContact CE1-CZ2 4.29Å; F54-W351 AromaticContact CE1-NE1 3.76Å; F54-W351 HydrophobicContact CZ-CD2 4.14Å; F54-W351 AromaticContact CZ-CE2 3.63Å; F54-W351 AromaticContact CZ-CZ2 3.9Å; F54-W351 HydrophobicContact CZ-CZ2 3.9Å; F54-W351 AromaticContact CZ-NE1 3.73Å; S345-W351 WeakPolarHBondContact CB-O 3.43Å; S345-W351 PolarHBondContact N-O 3.06Å; Q348-W351 HydrophobicContact CB-CB 4.46Å; Q348-W351 HydrophobicContact CB-CG 4.46Å; Q348-W351 WeakPolarHBondContact O-CB 3.27Å; Q348-W351 PolarHBondContact O-N 2.76Å; P349-W351 PolarHBondContact O-N 2.99Å; W351-I362 HydrophobicContact CE3-CB 4.1Å; W351-I362 HydrophobicContact CE3-CD1 3.94Å; W351-I362 HydrophobicContact CE3-CG1 3.98Å; W351-I362 HydrophobicContact CZ3-CD1 4.06Å; W351-I362 HydrophobicContact CZ3-CG1 3.98Å; W351-L363 WeakPolarHBondContact CA-O 3.42Å; W351-R364 HydrophobicContact CD2-CB 4.37Å; W351-R364 HydrophobicContact CE3-CB 4.2Å; W351-R364 HydrophobicContact CH2-CB 3.78Å; W351-R364 HydrophobicContact CH2-CG 4.37Å; W351-R364 HydrophobicContact CZ2-CB 3.98Å; W351-R364 HydrophobicContact CZ2-CG 4.06Å; W351-R364 HydrophobicContact CZ3-CB 3.9Å
352	I	98.2	Very high	97.3	Very high	5 Å²	5	23.6 Å²	23.6	3%	0.026	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	142	170.9	-62.2	-176.9	0	0	0	108.3	C306 I316 I342 Q343 W344 I354 I362 L363 V365	C306-I352 HydrophobicContact CB-CD1 3.94Å; I316-I352 HydrophobicContact CD1-CD1 3.96Å; I316-I352 HydrophobicContact CG1-CD1 4.37Å; I342-I352 HydrophobicContact CD1-CG2 3.83Å; I342-I352 HydrophobicContact CG1-CG2 3.52Å; Q343-I352 CarbonylContact O-C 3.51Å; Q343-I352 WeakPolarHBondContact O-CA 3.15Å; W344-I352 HydrophobicContact CD2-CD1 3.92Å; W344-I352 HydrophobicContact CD2-CG1 3.78Å; W344-I352 HydrophobicContact CE3-CD1 3.82Å; W344-I352 HydrophobicContact CE3-CG1 4.19Å; W344-I352 HydrophobicContact CG-CG1 3.99Å; W344-I352 HydrophobicContact CH2-CD1 4.09Å; W344-I352 HydrophobicContact CZ2-CD1 4.18Å; W344-I352 HydrophobicContact CZ2-CG1 4.4Å; W344-I352 HydrophobicContact CZ3-CD1 3.9Å; I352-I354 HydrophobicContact CG2-CG2 4.33Å; I352-I362 CarbonylContact O-C 3.2Å; I352-I362 VanDerWaalsContact O-CA 3.26Å; I352-I362 WeakPolarHBondContact O-CA 3.5Å; I352-L363 PolarHBondContact N-O 2.94Å; I352-L363 PolarHBondContact O-N 3.25Å; I352-V365 HydrophobicContact CD1-CG1 3.68Å; I352-V365 HydrophobicContact CD1-CG2 4.41Å; I352-V365 HydrophobicContact CG1-CG1 3.96Å; I352-V365 HydrophobicContact CG1-CG2 4.3Å
353	A	98.5	Very high	97.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	141.2	166	0	0	0	0	0	109.8	M44 W46 L56 I342 Q343 L360 E361 I362	M44-A353 HydrophobicContact CE-CB 4.16Å; M44-A353 WeakPolarHBondContact CE-O 3.2Å; M44-A353 HydrophobicContact SD-CB 3.68Å; W46-A353 HydrophobicContact CZ2-CB 3.66Å; W46-A353 VanDerWaalsContact NE1-CB 3.31Å; L56-A353 HydrophobicContact CD2-CB 3.86Å; I342-A353 CarbonylContact C-O 3.56Å; I342-A353 WeakPolarHBondContact CA-O 3.07Å; Q343-A353 PolarHBondContact N-O 3.34Å; Q343-A353 PolarHBondContact O-N 3Å; A353-L360 HydrophobicContact CB-CD1 4.25Å; A353-E361 CarbonylContact C-O 3.47Å; A353-E361 VanDerWaalsContact CA-O 3.28Å; A353-E361 WeakPolarHBondContact CA-O 3.43Å; A353-I362 HydrophobicContact CB-CG2 4.1Å
354	I	98.5	Very high	97.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	150.3	169.5	57.4	164.9	0	0	0	109.9	A314 Y333 A335 I339 Q341 I342 I352 Y356 L360 E361 L363	A314-I354 HydrophobicContact CB-CG2 4.24Å; Y333-I354 HydrophobicContact CD1-CD1 3.9Å; Y333-I354 HydrophobicContact CE1-CD1 3.6Å; A335-I354 HydrophobicContact CB-CD1 4.02Å; I339-I354 HydrophobicContact CD1-CD1 3.96Å; I339-I354 HydrophobicContact CD1-CG2 4.48Å; I339-I354 HydrophobicContact CG2-CB 3.92Å; I339-I354 HydrophobicContact CG2-CG2 4.11Å; Q341-I354 WeakPolarHBondContact O-CA 3.23Å; I342-I354 HydrophobicContact CB-CG2 4.21Å; I342-I354 HydrophobicContact CD1-CG2 3.92Å; I342-I354 HydrophobicContact CG1-CG2 3.77Å; I352-I354 HydrophobicContact CG2-CG2 4.33Å; I354-Y356 HydrophobicContact CD1-CD1 4.31Å; I354-Y356 HydrophobicContact CD1-CE1 4.29Å; I354-L360 WeakPolarHBondContact O-CA 3.46Å; I354-E361 HydrophobicContact CD1-CB 4.29Å; I354-E361 HydrophobicContact CG1-CB 3.85Å; I354-E361 PolarHBondContact N-O 2.72Å; I354-E361 PolarHBondContact O-N 3.33Å; I354-L363 HydrophobicContact CD1-CD1 3.96Å; I354-L363 HydrophobicContact CG1-CD1 4.17Å; I354-L363 HydrophobicContact CG1-CG 4.47Å; I354-L363 HydrophobicContact CG2-CD1 4.47Å
355	C	97.9	Very high	96.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	142	169.6	68.5	0	0	0	0	111.7	I41 M44 N340 Q341 S359	I41-C355 HydrophobicContact CB-CB 4.26Å; I41-C355 HydrophobicContact CG2-CB 3.9Å; M44-C355 HydrophobicContact CE-CB 4.11Å; M44-C355 HydrophobicContact CG-CB 4.49Å; M44-C355 HydrophobicContact SD-CB 4.37Å; N340-C355 PolarHBondContact N-O 3.27Å; Q341-C355 WeakPolarHBondContact CB-SG 3.5Å; Q341-C355 PolarHBondContact O-N 3.49Å; Q341-C355 VanDerWaalsContact O-N 3.1Å; C355-S359 VanDerWaalsContact CA-O 3.32Å; C355-S359 WeakPolarHBondContact CA-O 3.47Å
356	Y	97.9	Very high	96.8	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.016	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	141.3	175.6	59.3	-91.4	0	0	0	108.3	R34 A335 A336 E338 I354 N358 S359 E361	R34-Y356 PolarHBondContact NE-OH 2.92Å; R34-Y356 PolarHBondContact NH2-OH 3.07Å; R34-Y356 VanDerWaalsContact NH2-OH 3.14Å; A335-Y356 HydrophobicContact CB-CD1 3.72Å; A335-Y356 HydrophobicContact CB-CE1 3.76Å; A335-Y356 HydrophobicContact CB-CG 4.32Å; A336-Y356 HydrophobicContact CB-CE2 3.85Å; E338-Y356 WeakPolarHBondContact O-CA 3.49Å; E338-Y356 WeakPolarHBondContact O-CB 3.32Å; I354-Y356 HydrophobicContact CD1-CD1 4.31Å; I354-Y356 HydrophobicContact CD1-CE1 4.29Å; Y356-N358 PolarHBondContact O-N 2.87Å; Y356-N358 VanDerWaalsContact O-N 3.16Å; Y356-S359 PolarHBondContact N-O 3.03Å; Y356-S359 WeakPolarHBondContact O-CA 3.42Å; Y356-S359 PolarHBondContact O-N 3.41Å; Y356-S359 VanDerWaalsContact O-O 3.13Å; Y356-E361 HydrophobicContact CE1-CG 3.85Å; Y356-E361 PolarHBondContact OH-OE1 2.9Å
357	N	97	Very high	97	Very high	83 Å²	83	30.5 Å²	30.5	44%	0.444	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	-122.7	-174.7	-61.6	-34.5	0	0	0	111.5	C40 I41	C40-N357 CarbonylContact C-O 3.55Å; C40-N357 VanDerWaalsContact CA-O 3.28Å; C40-N357 WeakPolarHBondContact CA-O 3.18Å; I41-N357 PolarHBondContact N-O 3.28Å
358	N	97.8	Very high	97.1	Very high	64 Å²	64	29.6 Å²	29.6	34%	0.342	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	11.1	174.7	72.6	-30.5	0	0	0	113.6	N36 A37 W39 Y356	N36-N358 CarbonylContact C-O 3.55Å; A37-N358 WeakPolarHBondContact CB-O 3.29Å; A37-N358 PolarHBondContact N-O 2.94Å; A37-N358 WeakPolarHBondContact O-CB 3.37Å; A37-N358 PolarHBondContact O-ND2 3.07Å; A37-N358 VanDerWaalsContact O-ND2 3.09Å; W39-N358 WeakPolarHBondContact O-CA 3.37Å; W39-N358 WeakPolarHBondContact O-CB 3.39Å; Y356-N358 PolarHBondContact O-N 2.87Å; Y356-N358 VanDerWaalsContact O-N 3.16Å
359	S	98.4	Very high	97.2	Very high	7 Å²	7	30.2 Å²	30.2	5%	0.049	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	135.7	-175.6	-64.1	0	0	0	0	111.2	Y35 N36 C355 Y356	Y35-S359 WeakPolarHBondContact O-CA 3.45Å; N36-S359 PolarHBondContact OD1-OG 2.81Å; C355-S359 VanDerWaalsContact CA-O 3.32Å; C355-S359 WeakPolarHBondContact CA-O 3.47Å; Y356-S359 PolarHBondContact N-O 3.03Å; Y356-S359 WeakPolarHBondContact O-CA 3.42Å; Y356-S359 PolarHBondContact O-N 3.41Å; Y356-S359 VanDerWaalsContact O-O 3.13Å
360	L	98.5	Very high	97.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	131.6	160.5	173.2	83.8	0	0	0	107.5	R34 Y35 I41 M44 L56 V58 I72 F81 A353 I354	R34-L360 CarbonylContact C-O 3.58Å; R34-L360 WeakPolarHBondContact CA-O 3.47Å; Y35-L360 HydrophobicContact CD1-CB 4.42Å; Y35-L360 PolarHBondContact N-O 2.94Å; Y35-L360 PolarHBondContact O-N 3.45Å; I41-L360 HydrophobicContact CD1-CB 3.85Å; M44-L360 HydrophobicContact CB-CD1 4.42Å; M44-L360 HydrophobicContact CE-CD1 4.46Å; M44-L360 HydrophobicContact CG-CD1 4.37Å; M44-L360 HydrophobicContact SD-CD1 3.23Å; M44-L360 WeakPolarHBondContact SD-CD1 3.49Å; L56-L360 HydrophobicContact CD1-CD2 4.17Å; L56-L360 HydrophobicContact CD2-CD1 4.37Å; L56-L360 HydrophobicContact CD2-CD2 4.18Å; V58-L360 HydrophobicContact CG1-CD1 4.49Å; V58-L360 HydrophobicContact CG1-CD2 4.19Å; I72-L360 HydrophobicContact CD1-CD2 3.56Å; F81-L360 HydrophobicContact CZ-CD2 4.43Å; A353-L360 HydrophobicContact CB-CD1 4.25Å; I354-L360 WeakPolarHBondContact O-CA 3.46Å
361	E	98.1	Very high	97.4	Very high	2 Å²	2	26 Å²	26	1%	0.009	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	140.8	168.2	-60.8	-169.9	135.6	0	0	110.5	Y33 R34 Y333 A353 I354 Y356 L363	Y33-E361 CarbonylContact O-C 3.53Å; Y33-E361 WeakPolarHBondContact O-CA 3.14Å; R34-E361 HydrophobicContact CB-CG 4.16Å; R34-E361 HydrophobicContact CG-CG 3.97Å; R34-E361 IonicContact CZ-OE1 2.65Å; R34-E361 IonicContact NE-OE1 3.31Å; R34-E361 PolarHBondContact NE-OE1 2.99Å; R34-E361 IonicContact NH2-OE1 3.93Å; R34-E361 PolarHBondContact NH2-OE1 2.87Å; Y333-E361 VanDerWaalsContact CE1-OE2 3.32Å; Y333-E361 WeakPolarHBondContact CE1-OE2 3.48Å; Y333-E361 PolarHBondContact OH-OE1 3.48Å; Y333-E361 PolarHBondContact OH-OE2 3.48Å; A353-E361 CarbonylContact C-O 3.47Å; A353-E361 VanDerWaalsContact CA-O 3.28Å; A353-E361 WeakPolarHBondContact CA-O 3.43Å; I354-E361 HydrophobicContact CD1-CB 4.29Å; I354-E361 HydrophobicContact CG1-CB 3.85Å; I354-E361 PolarHBondContact N-O 2.72Å; I354-E361 PolarHBondContact O-N 3.33Å; Y356-E361 HydrophobicContact CE1-CG 3.85Å; Y356-E361 PolarHBondContact OH-OE1 2.9Å; E361-L363 HydrophobicContact CB-CD2 4.09Å
362	I	97.9	Very high	97.4	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.5	164.3	67.6	167.8	0	0	0	108.4	I32 Y33 W46 F54 L56 L74 F81 W351 I352 A353	I32-I362 WeakPolarHBondContact CA-O 3.13Å; Y33-I362 HydrophobicContact CD2-CD1 4.28Å; Y33-I362 HydrophobicContact CD2-CG1 4.25Å; Y33-I362 HydrophobicContact CG-CG1 4.48Å; Y33-I362 PolarHBondContact N-O 3.24Å; Y33-I362 PolarHBondContact O-N 3.15Å; W46-I362 HydrophobicContact CH2-CB 3.83Å; W46-I362 HydrophobicContact CH2-CD1 4.03Å; W46-I362 HydrophobicContact CH2-CG2 3.36Å; W46-I362 HydrophobicContact CZ2-CB 4.06Å; W46-I362 HydrophobicContact CZ2-CG2 3.56Å; W46-I362 HydrophobicContact CZ3-CG2 4.31Å; F54-I362 HydrophobicContact CD1-CD1 3.87Å; F54-I362 HydrophobicContact CE1-CD1 4.09Å; L56-I362 HydrophobicContact CD1-CG2 4.25Å; L74-I362 HydrophobicContact CD2-CD1 3.99Å; F81-I362 HydrophobicContact CE2-CG1 4.28Å; F81-I362 HydrophobicContact CZ-CD1 3.84Å; F81-I362 HydrophobicContact CZ-CG1 3.89Å; F81-I362 HydrophobicContact CZ-CG2 3.95Å; W351-I362 HydrophobicContact CE3-CB 4.1Å; W351-I362 HydrophobicContact CE3-CD1 3.94Å; W351-I362 HydrophobicContact CE3-CG1 3.98Å; W351-I362 HydrophobicContact CZ3-CD1 4.06Å; W351-I362 HydrophobicContact CZ3-CG1 3.98Å; I352-I362 CarbonylContact O-C 3.2Å; I352-I362 VanDerWaalsContact O-CA 3.26Å; I352-I362 WeakPolarHBondContact O-CA 3.5Å; A353-I362 HydrophobicContact CB-CG2 4.1Å
363	L	97.2	Very high	97.4	Very high	12 Å²	12	28.7 Å²	28.7	6%	0.063	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.5	-172.6	-49.5	176.7	0	0	0	108.1	I32 Y333 W351 I352 I354 E361	I32-L363 HydrophobicContact CB-CD2 4.35Å; I32-L363 HydrophobicContact CD1-CD2 4.26Å; I32-L363 HydrophobicContact CG1-CD2 3.85Å; I32-L363 HydrophobicContact CG2-CD2 3.82Å; Y333-L363 HydrophobicContact CD1-CD1 3.5Å; Y333-L363 VanDerWaalsContact CD1-CD1 3.5Å; Y333-L363 HydrophobicContact CD1-CD2 4.33Å; Y333-L363 HydrophobicContact CD2-CD1 4.33Å; Y333-L363 HydrophobicContact CD2-CD2 4.42Å; Y333-L363 HydrophobicContact CE1-CD1 3.85Å; Y333-L363 HydrophobicContact CE1-CD2 3.91Å; Y333-L363 HydrophobicContact CE2-CD2 4.03Å; Y333-L363 HydrophobicContact CG-CD1 3.74Å; W351-L363 WeakPolarHBondContact CA-O 3.42Å; I352-L363 PolarHBondContact N-O 2.94Å; I352-L363 PolarHBondContact O-N 3.25Å; I354-L363 HydrophobicContact CD1-CD1 3.96Å; I354-L363 HydrophobicContact CG1-CD1 4.17Å; I354-L363 HydrophobicContact CG1-CG 4.47Å; I354-L363 HydrophobicContact CG2-CD1 4.47Å; E361-L363 HydrophobicContact CB-CD2 4.09Å
364	R	95.9	Very high	97.3	Very high	120 Å²	120	31.1 Å²	31.1	45%	0.453	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	134.1	168.7	-164.3	179.3	-176.8	-172.7	-0.7	109.6	E31 D350 W351	E31-R364 HydrophobicContact CB-CB 4.26Å; E31-R364 WeakPolarHBondContact O-CB 3.5Å; E31-R364 PolarHBondContact O-N 2.93Å; D350-R364 HydrophobicContact CB-CG 4.36Å; D350-R364 CarbonylContact O-C 3.55Å; D350-R364 VanDerWaalsContact O-CA 3.25Å; D350-R364 WeakPolarHBondContact O-CA 3.46Å; D350-R364 WeakPolarHBondContact O-CG 3.45Å; D350-R364 IonicContact OD2-NH2 3.29Å; W351-R364 HydrophobicContact CD2-CB 4.37Å; W351-R364 HydrophobicContact CE3-CB 4.2Å; W351-R364 HydrophobicContact CH2-CB 3.78Å; W351-R364 HydrophobicContact CH2-CG 4.37Å; W351-R364 HydrophobicContact CZ2-CB 3.98Å; W351-R364 HydrophobicContact CZ2-CG 4.06Å; W351-R364 HydrophobicContact CZ3-CB 3.9Å
365	V	92.3	Very high	97.2	Very high	81 Å²	81	33.9 Å²	33.9	49%	0.491	17%	0.17	S	C	.	.			trans	-116.9	0	-178.8	-63	0	0	0	0	113.2	I316 W344 D350 I352	I316-V365 HydrophobicContact CD1-CB 4.06Å; I316-V365 HydrophobicContact CD1-CG1 3.72Å; W344-V365 HydrophobicContact CH2-CG2 4.49Å; W344-V365 HydrophobicContact CZ2-CG2 3.69Å; D350-V365 WeakPolarHBondContact O-CG2 3.21Å; D350-V365 PolarHBondContact O-N 2.92Å; I352-V365 HydrophobicContact CD1-CG1 3.68Å; I352-V365 HydrophobicContact CD1-CG2 4.41Å; I352-V365 HydrophobicContact CG1-CG1 3.96Å; I352-V365 HydrophobicContact CG1-CG2 4.3Å

Retrieved 365 of 365 residues in 75.4 ms (Link to these results)

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