A0A060Z2V9_ONCMY Loading...

Methyltransferase-like protein 21B

AlphaFold DB , UniProt , Accession A0A060Z2V9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110528242, Length 224 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	36.5	Very low	36.9	Very low	245 Å²	245	164 Å²	164	100%	1.207	86%	0.859	S	S	*	*				0	102.7	0	-58.2	-65.5	-128.8	0	0	106.4
2	A	35.5	Very low	36.8	Very low	86 Å²	86	162 Å²	162	71%	0.711	85%	0.849	S	S	*	*			cis	-151	129.4	7	0	0	0	0	0	105.7
3	E	34.4	Very low	37	Very low	193 Å²	193	158.6 Å²	158.6	90%	0.902	84%	0.843	S	S	*	*				85	110.2	106.2	-75.2	-174.1	176.2	0	0	113.9
4	Y	34.3	Very low	37.7	Very low	233 Å²	233	156.4 Å²	156.4	91%	0.914	84%	0.837	S	S	*	*			trans	-74.7	129.5	171.6	-75.7	-99.4	0	0	0	108.9
5	G	35	Very low	37.9	Very low	79 Å²	79	154.9 Å²	154.9	81%	0.814	83%	0.83	S	S	*	*			trans	-86.6	116.1	163.7	0	0	0	0	0	109.4
6	E	39.1	Very low	38.2	Very low	179 Å²	179	155.4 Å²	155.4	84%	0.836	83%	0.832	S	S	*	*			trans	-76	115.7	170.2	-69.3	176.9	157.3	0	0	108.9	E8	E6-E8 PolarHBondContact O-N 3.27Å
7	E	41.5	Very low	38.5	Very low	198 Å²	198	147.8 Å²	147.8	93%	0.925	80%	0.799	S	S	*	*			trans	-79.4	104.5	159.8	-80	-172.9	168.6	0	0	107.5	G9	E7-G9 VanDerWaalsContact C-N 3.33Å; E7-G9 PolarHBondContact O-N 3.09Å
8	E	38.5	Very low	38.9	Very low	167 Å²	167	149 Å²	149	78%	0.78	80%	0.804	S	S	*	*			trans	-63.8	95.2	168.1	-73.6	-158.9	156.5	0	0	109.5	E6 F10	E6-E8 PolarHBondContact O-N 3.27Å; E8-F10 PolarHBondContact O-N 3.5Å
9	G	38.7	Very low	39.4	Very low	69 Å²	69	150.2 Å²	150.2	71%	0.711	80%	0.801	S	S	*	*			trans	-63.2	100.3	163.4	0	0	0	0	0	109.2	E7 M11	E7-G9 VanDerWaalsContact C-N 3.33Å; E7-G9 PolarHBondContact O-N 3.09Å; G9-M11 VanDerWaalsContact C-N 3.25Å; G9-M11 PolarHBondContact O-N 3.38Å
10	F	34.4	Very low	40.4	Very low	178 Å²	178	145.7 Å²	145.7	78%	0.781	79%	0.786	S	S	*	*			trans	-62.5	89.4	166.8	-124.1	-98.4	0	0	0	108.2	E8 L12	E8-F10 PolarHBondContact O-N 3.5Å; F10-L12 VanDerWaalsContact C-N 3.33Å; F10-L12 PolarHBondContact O-N 2.67Å
11	M	38.2	Very low	41.8	Very low	177 Å²	177	144.9 Å²	144.9	87%	0.872	78%	0.781	S	S	*	*			trans	-66.2	98	163.2	-92.8	-170	-80.7	0	0	106.9	G9	G9-M11 VanDerWaalsContact C-N 3.25Å; G9-M11 PolarHBondContact O-N 3.38Å
12	L	35.7	Very low	43.9	Very low	140 Å²	140	137.9 Å²	137.9	73%	0.733	75%	0.753	S	S	*	*			trans	-56.5	129.3	159.7	-70.3	171.8	0	0	0	106.9	F10 V14	F10-L12 VanDerWaalsContact C-N 3.33Å; F10-L12 PolarHBondContact O-N 2.67Å; L12-V14 PolarHBondContact O-N 2.78Å
13	P	39.9	Very low	46.4	Very low	118 Å²	118	139.7 Å²	139.7	77%	0.766	74%	0.744	S	S	*	*			trans	-57.7	115.8	170.3	-15.4	27.7	0	0	0	107.2	D15	P13-D15 PolarHBondContact O-N 2.95Å
14	V	45.7	Very low	48.9	Very low	127 Å²	127	134 Å²	134	77%	0.77	73%	0.726	S	S	*	*			trans	-68.2	89.3	159	-87.4	0	0	0	0	105.6	L12 D16	L12-V14 PolarHBondContact O-N 2.78Å; V14-D16 PolarHBondContact O-N 3.49Å
15	D	41.2	Very low	51.7	Low	135 Å²	135	126.8 Å²	126.8	72%	0.722	70%	0.703	S	S	*	*			trans	-69.5	91	165.8	-164.6	18.1	0	0	0	106.6	P13 G17	P13-D15 PolarHBondContact O-N 2.95Å; D15-G17 PolarHBondContact O-N 2.9Å
16	D	43.3	Very low	54.5	Low	163 Å²	163	126.5 Å²	126.5	87%	0.872	68%	0.683	S	S	*	*			trans	-70	51.6	169	-82.4	-21.4	0	0	0	110.1	V14	V14-D16 PolarHBondContact O-N 3.49Å
17	G	42.4	Very low	57.2	Low	26 Å²	26	119.5 Å²	119.5	27%	0.268	65%	0.654	S	S	.	*			trans	-145.3	27.9	-169.5	0	0	0	0	0	112.7	D15 F19	D15-G17 PolarHBondContact O-N 2.9Å; G17-F19 PolarHBondContact O-N 3.2Å
18	L	45.8	Very low	59.9	Low	169 Å²	169	114 Å²	114	89%	0.885	63%	0.633	S	S	*	*			trans	-72.7	69.1	167.7	-136.8	89.3	0	0	0	109.2	A20	L18-A20 VanDerWaalsContact C-N 3.28Å; L18-A20 PolarHBondContact O-N 3.38Å
19	F	48.3	Very low	62.7	Low	172 Å²	172	108 Å²	108	75%	0.754	60%	0.604	S	S	*	*			trans	-58.6	102.8	153.6	-67.5	-85.6	0	0	0	105.1	G17 D21	G17-F19 PolarHBondContact O-N 3.2Å; F19-D21 PolarHBondContact O-N 2.87Å
20	A	59	Low	65.4	Low	60 Å²	60	111.6 Å²	111.6	50%	0.496	60%	0.6	S	S	.	*			trans	-65.4	88	161.7	0	0	0	0	0	105.4	L18 T22 A44	L18-A20 VanDerWaalsContact C-N 3.28Å; L18-A20 PolarHBondContact O-N 3.38Å; A20-T22 PolarHBondContact O-N 3.45Å; A20-A44 HydrophobicContact CB-CB 4.24Å
21	D	70.1	Confident	68.2	Low	129 Å²	129	103.3 Å²	103.3	69%	0.69	56%	0.564	S	S	*	*			trans	-49.8	113.3	-177.8	-77.8	-31	0	0	0	108	F19 F23	F19-D21 PolarHBondContact O-N 2.87Å; D21-F23 PolarHBondContact O-N 2.79Å
22	T	81.4	Confident	70.5	Confident	98 Å²	98	98 Å²	98	60%	0.601	54%	0.538	S	S	*	.			trans	-73.6	117.2	172	-64.5	0	0	0	0	106.5	A20 V41 F42	A20-T22 PolarHBondContact O-N 3.45Å; T22-V41 HydrophobicContact CG2-CG1 3.77Å; T22-F42 WeakPolarHBondContact CA-O 3.25Å
23	F	87.4	Confident	72.9	Confident	123 Å²	123	95.3 Å²	95.3	54%	0.539	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	152.9	176.6	71.7	-86.3	0	0	0	110	D21 F42	D21-F23 PolarHBondContact O-N 2.79Å; F23-F42 HydrophobicContact CD1-CB 3.98Å; F23-F42 HydrophobicContact CD2-CB 4.33Å; F23-F42 AromaticContact CD2-CD2 3.94Å; F23-F42 HydrophobicContact CD2-CD2 3.94Å; F23-F42 HydrophobicContact CE1-CB 3.52Å; F23-F42 HydrophobicContact CE1-CG 4.24Å; F23-F42 HydrophobicContact CE2-CB 3.91Å; F23-F42 AromaticContact CE2-CD2 3.34Å; F23-F42 HydrophobicContact CE2-CD2 3.34Å; F23-F42 HydrophobicContact CE2-CE2 4.12Å; F23-F42 AromaticContact CE2-CG 3.85Å; F23-F42 HydrophobicContact CE2-CG 3.85Å; F23-F42 HydrophobicContact CG-CB 4.36Å; F23-F42 HydrophobicContact CZ-CB 3.48Å; F23-F42 VanDerWaalsContact CZ-CB 3.48Å; F23-F42 AromaticContact CZ-CD2 3.68Å; F23-F42 HydrophobicContact CZ-CD2 3.68Å; F23-F42 AromaticContact CZ-CG 3.67Å; F23-F42 HydrophobicContact CZ-CG 3.67Å; F23-F42 PolarHBondContact N-O 2.74Å; F23-F42 VanDerWaalsContact N-O 3.15Å; F23-F42 PolarHBondContact O-N 3.43Å
24	S	87.6	Confident	75.2	Confident	74 Å²	74	92.2 Å²	92.2	52%	0.517	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	139.4	176.5	57.3	0	0	0	0	109.9	Q40	S24-Q40 CarbonylContact C-O 3.55Å; S24-Q40 VanDerWaalsContact CA-O 3.29Å; S24-Q40 WeakPolarHBondContact CA-O 3.49Å
25	D	92.3	Very high	77.5	Confident	81 Å²	81	91.5 Å²	91.5	43%	0.433	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126.7	168.5	-174.8	44.6	0	0	0	110.3	Q40 F42	D25-Q40 PolarHBondContact N-O 3.12Å; D25-Q40 WeakPolarHBondContact O-CB 3.41Å; D25-Q40 PolarHBondContact O-N 3.28Å; D25-F42 HydrophobicContact CB-CE2 4.04Å
26	D	94.2	Very high	80.2	Confident	74 Å²	74	85.1 Å²	85.1	40%	0.396	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	117.5	-178.9	-78.1	-4.1	0	0	0	109.4	K37 S39	D26-K37 WeakPolarHBondContact OD2-CE 3.04Å; D26-K37 IonicContact OD2-NZ 2.78Å; D26-K37 PolarHBondContact OD2-NZ 3.17Å; D26-S39 WeakPolarHBondContact OD1-CA 3.47Å; D26-S39 WeakPolarHBondContact OD1-CB 3.41Å; D26-S39 PolarHBondContact OD1-OG 2.73Å
27	S	96.6	Very high	82.7	Confident	31 Å²	31	82.2 Å²	82.2	22%	0.217	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	144.3	175.6	-77.6	0	0	0	0	111.2	I38 Q40	S27-I38 PolarHBondContact N-O 2.84Å; S27-I38 PolarHBondContact O-N 3Å; S27-Q40 PolarHBondContact OG-NE2 3.16Å
28	V	97.1	Very high	85.4	Confident	82 Å²	82	81 Å²	81	50%	0.497	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	122.9	176.6	-179.2	0	0	0	0	109.6	E35 L36 K37	V28-E35 HydrophobicContact CG1-CB 4.04Å; V28-E35 HydrophobicContact CG1-CG 4.39Å; V28-L36 WeakPolarHBondContact CA-O 3.3Å; V28-K37 HydrophobicContact CG2-CG 4.35Å
29	Y	97.1	Very high	87.8	Confident	43 Å²	43	74 Å²	74	17%	0.169	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	146.2	177.5	-57	-86.7	0	0	0	110.1	F31 E35 L36 I38 V52 L57 I84	Y29-F31 HydrophobicContact CG-CE2 4.49Å; Y29-E35 CarbonylContact O-C 3.54Å; Y29-E35 WeakPolarHBondContact O-CA 3.11Å; Y29-L36 PolarHBondContact N-O 3.14Å; Y29-L36 PolarHBondContact O-N 3.47Å; Y29-I38 HydrophobicContact CD2-CB 4.31Å; Y29-I38 HydrophobicContact CD2-CG1 3.94Å; Y29-I38 HydrophobicContact CE2-CB 4.05Å; Y29-I38 HydrophobicContact CE2-CG1 4.13Å; Y29-V52 HydrophobicContact CE1-CG1 4.49Å; Y29-V52 HydrophobicContact CE2-CB 4.44Å; Y29-V52 HydrophobicContact CE2-CG1 4.49Å; Y29-V52 HydrophobicContact CE2-CG2 3.89Å; Y29-V52 WeakPolarHBondContact OH-CB 3.33Å; Y29-L57 HydrophobicContact CD1-CD1 4.41Å; Y29-L57 HydrophobicContact CD1-CD2 3.47Å; Y29-L57 VanDerWaalsContact CD1-CD2 3.47Å; Y29-L57 HydrophobicContact CE1-CD1 3.96Å; Y29-L57 HydrophobicContact CE1-CD2 3.57Å; Y29-L57 HydrophobicContact CE1-CG 4.41Å; Y29-L57 HydrophobicContact CG-CD2 4.17Å; Y29-I84 HydrophobicContact CD1-CD1 4.33Å; Y29-I84 HydrophobicContact CD2-CD1 3.56Å; Y29-I84 HydrophobicContact CE2-CD1 4.01Å; Y29-I84 HydrophobicContact CG-CD1 3.73Å
30	K	96.1	Very high	90	Very high	143 Å²	143	66.5 Å²	66.5	62%	0.622	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	121	-180	-56.5	-164.6	178.8	-157.5	0	110	Q34 E35	K30-Q34 WeakPolarHBondContact CA-O 3.39Å; K30-E35 HydrophobicContact CD-CG 4.38Å; K30-E35 WeakPolarHBondContact CE-OE1 3.3Å; K30-E35 HydrophobicContact CG-CG 4.22Å; K30-E35 IonicContact NZ-OE1 3.71Å; K30-E35 PolarHBondContact NZ-OE1 3.2Å
31	F	93.4	Very high	91.5	Very high	5 Å²	5	65.7 Å²	65.7	2%	0.022	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	133.2	174.6	-58.5	-70.3	0	0	0	108.9	Y29 G33 Q34 L36 L57 C60 R61 I84 L88	Y29-F31 HydrophobicContact CG-CE2 4.49Å; F31-G33 PolarHBondContact O-N 3.02Å; F31-Q34 PolarHBondContact N-O 3.05Å; F31-Q34 WeakPolarHBondContact O-CA 3.32Å; F31-Q34 WeakPolarHBondContact O-CB 3.44Å; F31-Q34 PolarHBondContact O-N 2.84Å; F31-L36 HydrophobicContact CB-CD1 4.45Å; F31-L36 HydrophobicContact CD2-CD1 3.57Å; F31-L36 HydrophobicContact CE2-CD1 4.36Å; F31-L36 HydrophobicContact CG-CD1 4.49Å; F31-L57 HydrophobicContact CE2-CD2 4.43Å; F31-L57 HydrophobicContact CZ-CD2 3.87Å; F31-C60 HydrophobicContact CD1-CB 3.86Å; F31-C60 HydrophobicContact CD2-CB 4.13Å; F31-C60 HydrophobicContact CE1-CB 3.54Å; F31-C60 HydrophobicContact CE2-CB 3.82Å; F31-C60 HydrophobicContact CG-CB 4.15Å; F31-C60 HydrophobicContact CZ-CB 3.5Å; F31-R61 HydrophobicContact CD1-CG 4.34Å; F31-R61 HydrophobicContact CE1-CG 3.82Å; F31-I84 HydrophobicContact CE2-CD1 4.07Å; F31-I84 HydrophobicContact CE2-CG1 4.46Å; F31-L88 HydrophobicContact CB-CD1 3.85Å; F31-L88 HydrophobicContact CB-CD2 4.03Å; F31-L88 HydrophobicContact CD2-CD2 4.26Å; F31-L88 HydrophobicContact CG-CD2 4.1Å
32	I	85.4	Confident	92.4	Very high	65 Å²	65	62.6 Å²	62.6	33%	0.333	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	38.3	174.5	-50.6	168.4	0	0	0	111	Q34 E64 L88 L92	I32-Q34 PolarHBondContact O-N 3.31Å; I32-Q34 VanDerWaalsContact O-N 3.12Å; I32-E64 VanDerWaalsContact CA-OE1 3.25Å; I32-E64 WeakPolarHBondContact CA-OE1 3.5Å; I32-E64 HydrophobicContact CD1-CB 4.04Å; I32-E64 HydrophobicContact CD1-CG 4.47Å; I32-E64 HydrophobicContact CG1-CB 3.72Å; I32-E64 HydrophobicContact CG1-CG 3.66Å; I32-E64 PolarHBondContact N-OE1 2.86Å; I32-L88 HydrophobicContact CD1-CD1 4.32Å; I32-L92 HydrophobicContact CD1-CD1 3.65Å; I32-L92 HydrophobicContact CD1-CD2 3.37Å; I32-L92 HydrophobicContact CD1-CG 4.01Å; I32-L92 HydrophobicContact CG2-CD2 4.36Å
33	G	86.8	Confident	92.6	Very high	84 Å²	84	59.6 Å²	59.6	87%	0.866	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	7.5	-175.8	0	0	0	0	0	115.1	F31	F31-G33 PolarHBondContact O-N 3.02Å
34	Q	87.6	Confident	92	Very high	52 Å²	52	57.7 Å²	57.7	24%	0.243	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	141.9	176.1	-56.3	-172.6	45.1	0	0	110.5	K30 F31 I32 R91	K30-Q34 WeakPolarHBondContact CA-O 3.39Å; F31-Q34 PolarHBondContact N-O 3.05Å; F31-Q34 WeakPolarHBondContact O-CA 3.32Å; F31-Q34 WeakPolarHBondContact O-CB 3.44Å; F31-Q34 PolarHBondContact O-N 2.84Å; I32-Q34 PolarHBondContact O-N 3.31Å; I32-Q34 VanDerWaalsContact O-N 3.12Å; Q34-R91 VanDerWaalsContact OE1-NH1 3.15Å
35	E	95.2	Very high	91.6	Very high	112 Å²	112	60.7 Å²	60.7	52%	0.523	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	130.2	172.4	-59.7	-170.1	159.1	0	0	109.8	V28 Y29 K30	V28-E35 HydrophobicContact CG1-CB 4.04Å; V28-E35 HydrophobicContact CG1-CG 4.39Å; Y29-E35 CarbonylContact O-C 3.54Å; Y29-E35 WeakPolarHBondContact O-CA 3.11Å; K30-E35 HydrophobicContact CD-CG 4.38Å; K30-E35 WeakPolarHBondContact CE-OE1 3.3Å; K30-E35 HydrophobicContact CG-CG 4.22Å; K30-E35 IonicContact NZ-OE1 3.71Å; K30-E35 PolarHBondContact NZ-OE1 3.2Å
36	L	96.8	Very high	91.1	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	116.5	172.5	-72.8	132	0	0	0	108.5	V28 Y29 F31 I87 L88 N115	V28-L36 WeakPolarHBondContact CA-O 3.3Å; Y29-L36 PolarHBondContact N-O 3.14Å; Y29-L36 PolarHBondContact O-N 3.47Å; F31-L36 HydrophobicContact CB-CD1 4.45Å; F31-L36 HydrophobicContact CD2-CD1 3.57Å; F31-L36 HydrophobicContact CE2-CD1 4.36Å; F31-L36 HydrophobicContact CG-CD1 4.49Å; L36-I87 HydrophobicContact CD2-CB 4.01Å; L36-I87 HydrophobicContact CD2-CG2 3.27Å; L36-L88 HydrophobicContact CD1-CB 4.34Å; L36-L88 HydrophobicContact CD1-CD1 4.16Å; L36-N115 VanDerWaalsContact CA-OD1 3.27Å; L36-N115 WeakPolarHBondContact CA-OD1 3.43Å; L36-N115 HydrophobicContact CD2-CB 4.49Å
37	K	97.1	Very high	90.8	Very high	103 Å²	103	56.2 Å²	56.2	45%	0.448	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	113	176.5	-173.6	-177.6	179.2	-164.7	0	108.8	D26 V28 N115	D26-K37 WeakPolarHBondContact OD2-CE 3.04Å; D26-K37 IonicContact OD2-NZ 2.78Å; D26-K37 PolarHBondContact OD2-NZ 3.17Å; V28-K37 HydrophobicContact CG2-CG 4.35Å; K37-N115 PolarHBondContact N-OD1 3.02Å; K37-N115 PolarHBondContact O-ND2 3.11Å
38	I	98.1	Very high	90.5	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	120.7	-176.7	-57.5	-61.1	0	0	0	109.2	S27 Y29 Q40 V52 T82 I84 I87 N111	S27-I38 PolarHBondContact N-O 2.84Å; S27-I38 PolarHBondContact O-N 3Å; Y29-I38 HydrophobicContact CD2-CB 4.31Å; Y29-I38 HydrophobicContact CD2-CG1 3.94Å; Y29-I38 HydrophobicContact CE2-CB 4.05Å; Y29-I38 HydrophobicContact CE2-CG1 4.13Å; I38-Q40 HydrophobicContact CG2-CG 4.4Å; I38-V52 HydrophobicContact CB-CG2 4.29Å; I38-V52 HydrophobicContact CG2-CG2 3.62Å; I38-T82 HydrophobicContact CG2-CG2 3.87Å; I38-I84 HydrophobicContact CD1-CB 4.16Å; I38-I84 HydrophobicContact CD1-CG1 4.19Å; I38-I84 HydrophobicContact CG1-CB 4.27Å; I38-I84 HydrophobicContact CG1-CD1 4.06Å; I38-I84 HydrophobicContact CG1-CG1 4.05Å; I38-I87 HydrophobicContact CD1-CD1 4.11Å; I38-N111 HydrophobicContact CD1-CB 4.49Å
39	S	96.4	Very high	90	Very high	23 Å²	23	55.1 Å²	55.1	16%	0.161	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	130.8	171	-156.8	0	0	0	0	109.8	D26 N111	D26-S39 WeakPolarHBondContact OD1-CA 3.47Å; D26-S39 WeakPolarHBondContact OD1-CB 3.41Å; D26-S39 PolarHBondContact OD1-OG 2.73Å; S39-N111 PolarHBondContact N-OD1 3.32Å; S39-N111 PolarHBondContact O-ND2 3.46Å; S39-N111 PolarHBondContact O-OD1 2.91Å
40	Q	94.6	Very high	89.6	Confident	14 Å²	14	53.1 Å²	53.1	7%	0.065	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	106	-178.7	-60.2	171.1	103.4	0	0	108.3	S24 D25 S27 I38 F42 A50 V52 T82	S24-Q40 CarbonylContact C-O 3.55Å; S24-Q40 VanDerWaalsContact CA-O 3.29Å; S24-Q40 WeakPolarHBondContact CA-O 3.49Å; D25-Q40 PolarHBondContact N-O 3.12Å; D25-Q40 WeakPolarHBondContact O-CB 3.41Å; D25-Q40 PolarHBondContact O-N 3.28Å; S27-Q40 PolarHBondContact OG-NE2 3.16Å; I38-Q40 HydrophobicContact CG2-CG 4.4Å; Q40-F42 HydrophobicContact CB-CE2 3.77Å; Q40-F42 HydrophobicContact CB-CZ 3.99Å; Q40-F42 WeakPolarHBondContact O-CD2 3.44Å; Q40-F42 WeakPolarHBondContact O-CE2 3.28Å; Q40-F42 PolarHBondContact O-N 3.35Å; Q40-A50 WeakPolarHBondContact CB-O 3.5Å; Q40-V52 HydrophobicContact CG-CG2 4.35Å; Q40-T82 HydrophobicContact CG-CG2 4.33Å
41	V	90.8	Very high	89.5	Confident	42 Å²	42	47.7 Å²	47.7	26%	0.255	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	102.1	-172.6	-177.9	0	0	0	0	110.1	T22 S43 L46 A50 Q107	T22-V41 HydrophobicContact CG2-CG1 3.77Å; V41-S43 PolarHBondContact O-N 3.05Å; V41-L46 HydrophobicContact CB-CD2 4.08Å; V41-L46 WeakPolarHBondContact O-CD2 3.31Å; V41-A50 VanDerWaalsContact O-CB 3.23Å; V41-A50 WeakPolarHBondContact O-CB 3.34Å; V41-Q107 HydrophobicContact CG2-CG 4.5Å
42	F	88.1	Confident	89.7	Confident	64 Å²	64	48.2 Å²	48.2	28%	0.281	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	108.6	176.6	-60.3	-80.4	0	0	0	109.4	T22 F23 D25 Q40 A50 P51	T22-F42 WeakPolarHBondContact CA-O 3.25Å; F23-F42 HydrophobicContact CD1-CB 3.98Å; F23-F42 HydrophobicContact CD2-CB 4.33Å; F23-F42 AromaticContact CD2-CD2 3.94Å; F23-F42 HydrophobicContact CD2-CD2 3.94Å; F23-F42 HydrophobicContact CE1-CB 3.52Å; F23-F42 HydrophobicContact CE1-CG 4.24Å; F23-F42 HydrophobicContact CE2-CB 3.91Å; F23-F42 AromaticContact CE2-CD2 3.34Å; F23-F42 HydrophobicContact CE2-CD2 3.34Å; F23-F42 HydrophobicContact CE2-CE2 4.12Å; F23-F42 AromaticContact CE2-CG 3.85Å; F23-F42 HydrophobicContact CE2-CG 3.85Å; F23-F42 HydrophobicContact CG-CB 4.36Å; F23-F42 HydrophobicContact CZ-CB 3.48Å; F23-F42 VanDerWaalsContact CZ-CB 3.48Å; F23-F42 AromaticContact CZ-CD2 3.68Å; F23-F42 HydrophobicContact CZ-CD2 3.68Å; F23-F42 AromaticContact CZ-CG 3.67Å; F23-F42 HydrophobicContact CZ-CG 3.67Å; F23-F42 PolarHBondContact N-O 2.74Å; F23-F42 VanDerWaalsContact N-O 3.15Å; F23-F42 PolarHBondContact O-N 3.43Å; D25-F42 HydrophobicContact CB-CE2 4.04Å; Q40-F42 HydrophobicContact CB-CE2 3.77Å; Q40-F42 HydrophobicContact CB-CZ 3.99Å; Q40-F42 WeakPolarHBondContact O-CD2 3.44Å; Q40-F42 WeakPolarHBondContact O-CE2 3.28Å; Q40-F42 PolarHBondContact O-N 3.35Å; F42-A50 HydrophobicContact CD1-CB 4.02Å; F42-A50 HydrophobicContact CE1-CB 4.17Å; F42-P51 HydrophobicContact CE1-CB 4.32Å; F42-P51 HydrophobicContact CZ-CB 4.44Å
43	S	85.2	Confident	90.3	Very high	36 Å²	36	49.6 Å²	49.6	25%	0.252	30%	0.3	S	S	.	.			trans	-137.8	160.2	174.3	66.3	0	0	0	0	109.6	V41 N45 L46	V41-S43 PolarHBondContact O-N 3.05Å; S43-N45 PolarHBondContact O-N 3.09Å; S43-L46 PolarHBondContact O-N 2.94Å; S43-L46 WeakPolarHBondContact OG-CB 3.33Å; S43-L46 PolarHBondContact OG-N 2.81Å
44	A	76.3	Confident	90.8	Very high	82 Å²	82	48.7 Å²	48.7	68%	0.678	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-26.7	179.8	0	0	0	0	0	113.5	A20	A20-A44 HydrophobicContact CB-CB 4.24Å
45	N	78.8	Confident	91.3	Very high	138 Å²	138	46.3 Å²	46.3	74%	0.738	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-23.9	-173.8	-63.1	-27.2	0	0	0	114	S43	S43-N45 PolarHBondContact O-N 3.09Å
46	L	82.3	Confident	91.4	Very high	14 Å²	14	41.4 Å²	41.4	7%	0.073	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-30.6	-174	-165.7	55.7	0	0	0	112.6	V41 S43 V48 A49 A50 L103 A104 Q107	V41-L46 HydrophobicContact CB-CD2 4.08Å; V41-L46 WeakPolarHBondContact O-CD2 3.31Å; S43-L46 PolarHBondContact O-N 2.94Å; S43-L46 WeakPolarHBondContact OG-CB 3.33Å; S43-L46 PolarHBondContact OG-N 2.81Å; L46-V48 PolarHBondContact O-N 3.17Å; L46-A49 HydrophobicContact CD1-CB 3.84Å; L46-A49 HydrophobicContact CG-CB 4.23Å; L46-A49 WeakPolarHBondContact O-CB 3.48Å; L46-A49 PolarHBondContact O-N 2.84Å; L46-A49 VanDerWaalsContact O-N 3.1Å; L46-A50 HydrophobicContact CB-CB 4.34Å; L46-A50 HydrophobicContact CD2-CB 3.89Å; L46-A50 HydrophobicContact CG-CB 3.96Å; L46-L103 HydrophobicContact CD1-CD1 3.56Å; L46-A104 HydrophobicContact CD1-CB 3.98Å; L46-Q107 HydrophobicContact CD2-CB 4.12Å; L46-Q107 HydrophobicContact CD2-CG 4.42Å
47	G	87.9	Confident	91.5	Very high	47 Å²	47	42.3 Å²	42.3	49%	0.485	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	49.9	-128	173.2	0	0	0	0	0	113.2	A49 A50	G47-A49 PolarHBondContact O-N 3.38Å; G47-A50 WeakPolarHBondContact O-CB 3.49Å; G47-A50 PolarHBondContact O-N 2.91Å
48	V	88.6	Confident	91.5	Very high	76 Å²	76	38.2 Å²	38.2	46%	0.461	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-67.9	-10.6	-176.7	-62.9	0	0	0	0	114.9	L46 A50 W53 Y154	L46-V48 PolarHBondContact O-N 3.17Å; V48-A50 VanDerWaalsContact C-N 3.34Å; V48-W53 HydrophobicContact CB-CZ2 4Å; V48-W53 HydrophobicContact CG1-CZ2 4.21Å; V48-W53 PolarHBondContact O-NE1 3.15Å; V48-Y154 HydrophobicContact CG2-CE2 4.15Å; V48-Y154 WeakPolarHBondContact CG2-OH 3.14Å
49	A	87.1	Confident	91.5	Very high	13 Å²	13	38.2 Å²	38.2	11%	0.107	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-83.1	-11.9	175.4	0	0	0	0	0	113.1	L46 G47 G81 L103 A104 Q107	L46-A49 HydrophobicContact CD1-CB 3.84Å; L46-A49 HydrophobicContact CG-CB 4.23Å; L46-A49 WeakPolarHBondContact O-CB 3.48Å; L46-A49 PolarHBondContact O-N 2.84Å; L46-A49 VanDerWaalsContact O-N 3.1Å; G47-A49 PolarHBondContact O-N 3.38Å; A49-G81 CarbonylContact O-C 3.59Å; A49-L103 HydrophobicContact CB-CD1 4.46Å; A49-A104 HydrophobicContact CB-CB 3.88Å; A49-Q107 PolarHBondContact O-NE2 2.83Å
50	A	89.1	Confident	91.5	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.008	22%	0.222	C	C	.	.	S	Bend	trans	-71	-49.6	-178.2	0	0	0	0	0	114.3	Q40 V41 F42 L46 G47 V48 T82	Q40-A50 WeakPolarHBondContact CB-O 3.5Å; V41-A50 VanDerWaalsContact O-CB 3.23Å; V41-A50 WeakPolarHBondContact O-CB 3.34Å; F42-A50 HydrophobicContact CD1-CB 4.02Å; F42-A50 HydrophobicContact CE1-CB 4.17Å; L46-A50 HydrophobicContact CB-CB 4.34Å; L46-A50 HydrophobicContact CD2-CB 3.89Å; L46-A50 HydrophobicContact CG-CB 3.96Å; G47-A50 WeakPolarHBondContact O-CB 3.49Å; G47-A50 PolarHBondContact O-N 2.91Å; V48-A50 VanDerWaalsContact C-N 3.34Å; A50-T82 WeakPolarHBondContact O-CG2 3.28Å
51	P	94.8	Very high	91.6	Very high	29 Å²	29	42 Å²	42	19%	0.188	24%	0.24	C	C	.	.	S	Bend	trans	-82.4	158.6	-173.8	33.4	-36.7	0	0	0	113.3	F42 W53	F42-P51 HydrophobicContact CE1-CB 4.32Å; F42-P51 HydrophobicContact CZ-CB 4.44Å; P51-W53 HydrophobicContact CG-CD2 4.43Å; P51-W53 HydrophobicContact CG-CH2 4.46Å; P51-W53 HydrophobicContact CG-CZ2 3.76Å
52	V	96.8	Very high	91.8	Very high	16 Å²	16	40.6 Å²	40.6	10%	0.097	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-78.5	116.3	161.9	-180	0	0	0	0	109.1	Y29 I38 Q40 L57 T82 I84	Y29-V52 HydrophobicContact CE1-CG1 4.49Å; Y29-V52 HydrophobicContact CE2-CB 4.44Å; Y29-V52 HydrophobicContact CE2-CG1 4.49Å; Y29-V52 HydrophobicContact CE2-CG2 3.89Å; Y29-V52 WeakPolarHBondContact OH-CB 3.33Å; I38-V52 HydrophobicContact CB-CG2 4.29Å; I38-V52 HydrophobicContact CG2-CG2 3.62Å; Q40-V52 HydrophobicContact CG-CG2 4.35Å; V52-L57 HydrophobicContact CG1-CD2 3.73Å; V52-L57 HydrophobicContact CG1-CG 3.97Å; V52-T82 HydrophobicContact CG2-CG2 3.87Å; V52-I84 HydrophobicContact CG1-CD1 4Å; V52-I84 HydrophobicContact CG1-CG2 4.13Å; V52-I84 HydrophobicContact CG2-CD1 4.49Å
53	W	97.4	Very high	92.1	Very high	94 Å²	94	37.8 Å²	37.8	36%	0.356	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-82.4	146.3	176.9	-64.4	99.2	0	0	0	112.4	V48 P51 A55 A56 L57 D151	V48-W53 HydrophobicContact CB-CZ2 4Å; V48-W53 HydrophobicContact CG1-CZ2 4.21Å; V48-W53 PolarHBondContact O-NE1 3.15Å; P51-W53 HydrophobicContact CG-CD2 4.43Å; P51-W53 HydrophobicContact CG-CH2 4.46Å; P51-W53 HydrophobicContact CG-CZ2 3.76Å; W53-A55 PolarHBondContact O-N 2.98Å; W53-A55 VanDerWaalsContact O-N 3.11Å; W53-A56 VanDerWaalsContact O-CB 3.31Å; W53-A56 WeakPolarHBondContact O-CB 3.48Å; W53-A56 PolarHBondContact O-N 3.26Å; W53-L57 PolarHBondContact O-N 3Å; W53-D151 HydrophobicContact CB-CB 3.86Å; W53-D151 HydrophobicContact CG-CB 4.14Å
54	D	97.3	Very high	92.3	Very high	66 Å²	66	39.4 Å²	39.4	35%	0.353	22%	0.221	S	C	.	.	H	α-helix	trans	-54.2	-35.9	-178.9	-67.8	-35.3	0	0	0	113	A56 L57 H58 I213	D54-A56 VanDerWaalsContact C-N 3.26Å; D54-A56 PolarHBondContact O-N 3.19Å; D54-L57 WeakPolarHBondContact O-CB 3.26Å; D54-L57 PolarHBondContact O-N 2.84Å; D54-L57 VanDerWaalsContact O-N 3.15Å; D54-H58 PolarHBondContact O-N 3.03Å; D54-H58 PolarHBondContact O-ND1 2.81Å; D54-I213 HydrophobicContact CB-CD1 3.5Å; D54-I213 VanDerWaalsContact CB-CD1 3.5Å
55	A	97.8	Very high	93	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.008	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-31.9	179.2	0	0	0	0	0	112.4	W53 H58 L59 D151 S179 I213	W53-A55 PolarHBondContact O-N 2.98Å; W53-A55 VanDerWaalsContact O-N 3.11Å; A55-H58 PolarHBondContact O-N 3.15Å; A55-L59 PolarHBondContact O-N 2.88Å; A55-D151 HydrophobicContact CB-CB 3.87Å; A55-S179 VanDerWaalsContact O-CB 3.27Å; A55-S179 WeakPolarHBondContact O-CB 3.4Å; A55-S179 PolarHBondContact O-OG 3.43Å; A55-I213 HydrophobicContact CB-CG2 4.34Å
56	A	98.4	Very high	93.5	Very high	9 Å²	9	39.2 Å²	39.2	7%	0.074	21%	0.205	C	C	.	.	H	α-helix	trans	-67.1	-42.6	174.3	0	0	0	0	0	111.1	W53 D54 H58 L59 C60 I84 V85 A150	W53-A56 VanDerWaalsContact O-CB 3.31Å; W53-A56 WeakPolarHBondContact O-CB 3.48Å; W53-A56 PolarHBondContact O-N 3.26Å; D54-A56 VanDerWaalsContact C-N 3.26Å; D54-A56 PolarHBondContact O-N 3.19Å; A56-H58 VanDerWaalsContact C-N 3.32Å; A56-H58 PolarHBondContact O-N 3.2Å; A56-L59 PolarHBondContact O-N 2.6Å; A56-C60 PolarHBondContact O-N 3.34Å; A56-C60 PolarHBondContact O-SG 3.39Å; A56-C60 VanDerWaalsContact O-SG 3.35Å; A56-I84 HydrophobicContact CB-CG2 3.73Å; A56-V85 HydrophobicContact CB-CG2 3.8Å; A56-A150 HydrophobicContact CB-CB 3.77Å
57	L	97.9	Very high	93.6	Very high	20 Å²	20	43.4 Å²	43.4	11%	0.105	24%	0.235	C	C	.	.	H	α-helix	trans	-62.5	-39.7	175.5	-57.2	178.9	0	0	0	111.9	Y29 F31 V52 W53 D54 C60 R61 I84	Y29-L57 HydrophobicContact CD1-CD1 4.41Å; Y29-L57 HydrophobicContact CD1-CD2 3.47Å; Y29-L57 VanDerWaalsContact CD1-CD2 3.47Å; Y29-L57 HydrophobicContact CE1-CD1 3.96Å; Y29-L57 HydrophobicContact CE1-CD2 3.57Å; Y29-L57 HydrophobicContact CE1-CG 4.41Å; Y29-L57 HydrophobicContact CG-CD2 4.17Å; F31-L57 HydrophobicContact CE2-CD2 4.43Å; F31-L57 HydrophobicContact CZ-CD2 3.87Å; V52-L57 HydrophobicContact CG1-CD2 3.73Å; V52-L57 HydrophobicContact CG1-CG 3.97Å; W53-L57 PolarHBondContact O-N 3Å; D54-L57 WeakPolarHBondContact O-CB 3.26Å; D54-L57 PolarHBondContact O-N 2.84Å; D54-L57 VanDerWaalsContact O-N 3.15Å; L57-C60 PolarHBondContact O-N 3.11Å; L57-R61 WeakPolarHBondContact O-CG 3.11Å; L57-R61 PolarHBondContact O-N 2.81Å; L57-I84 HydrophobicContact CD2-CD1 3.76Å
58	H	97.5	Very high	93.5	Very high	17 Å²	17	43.8 Å²	43.8	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-64.8	-39.8	175.7	-75.5	69.9	0	0	0	111.9	D54 A55 A56 R61 Y62 D208 I213 I215	D54-H58 PolarHBondContact O-N 3.03Å; D54-H58 PolarHBondContact O-ND1 2.81Å; A55-H58 PolarHBondContact O-N 3.15Å; A56-H58 VanDerWaalsContact C-N 3.32Å; A56-H58 PolarHBondContact O-N 3.2Å; H58-R61 PolarHBondContact O-N 2.93Å; H58-Y62 VanDerWaalsContact O-CB 3.31Å; H58-Y62 WeakPolarHBondContact O-CB 3.48Å; H58-Y62 PolarHBondContact O-N 3.24Å; H58-D208 IonicContact NE2-OD2 3.79Å; H58-D208 PolarHBondContact NE2-OD2 2.85Å; H58-I213 HydrophobicContact CB-CG2 3.8Å; H58-I213 VanDerWaalsContact CE1-CD1 3.42Å; H58-I213 WeakPolarHBondContact CE1-CD1 3.48Å; H58-I213 WeakPolarHBondContact ND1-CD1 3.4Å; H58-I215 HydrophobicContact CB-CD1 4.48Å
59	L	97.9	Very high	93.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.3	-41.2	177.3	-169.4	53.4	0	0	0	111.7	A55 A56 Y62 F63 V85 A150 I215	A55-L59 PolarHBondContact O-N 2.88Å; A56-L59 PolarHBondContact O-N 2.6Å; L59-Y62 HydrophobicContact CD1-CD1 4.48Å; L59-Y62 PolarHBondContact O-N 2.84Å; L59-F63 HydrophobicContact CD1-CD1 4.36Å; L59-F63 HydrophobicContact CD1-CE1 3.67Å; L59-F63 HydrophobicContact CD1-CE2 4.42Å; L59-F63 HydrophobicContact CD1-CZ 3.7Å; L59-F63 HydrophobicContact CD2-CZ 4.34Å; L59-F63 HydrophobicContact CG-CE1 4.25Å; L59-F63 HydrophobicContact CG-CE2 4.11Å; L59-F63 HydrophobicContact CG-CZ 3.83Å; L59-F63 WeakPolarHBondContact O-CG 3.25Å; L59-F63 PolarHBondContact O-N 3.16Å; L59-F63 VanDerWaalsContact O-N 3.08Å; L59-V85 HydrophobicContact CD2-CG1 3.85Å; L59-V85 HydrophobicContact CD2-CG2 4.48Å; L59-V85 HydrophobicContact CG-CG1 4.07Å; L59-A150 HydrophobicContact CD2-CB 4.36Å; L59-I215 HydrophobicContact CD1-CD1 4.4Å; L59-I215 HydrophobicContact CD1-CG2 3.98Å
60	C	97.5	Very high	93.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.5	-48.6	173.2	-70.9	0	0	0	0	112.3	F31 A56 L57 Y62 F63 E64 L88	F31-C60 HydrophobicContact CD1-CB 3.86Å; F31-C60 HydrophobicContact CD2-CB 4.13Å; F31-C60 HydrophobicContact CE1-CB 3.54Å; F31-C60 HydrophobicContact CE2-CB 3.82Å; F31-C60 HydrophobicContact CG-CB 4.15Å; F31-C60 HydrophobicContact CZ-CB 3.5Å; A56-C60 PolarHBondContact O-N 3.34Å; A56-C60 PolarHBondContact O-SG 3.39Å; A56-C60 VanDerWaalsContact O-SG 3.35Å; L57-C60 PolarHBondContact O-N 3.11Å; C60-Y62 VanDerWaalsContact C-N 3.34Å; C60-Y62 PolarHBondContact O-N 3.01Å; C60-F63 PolarHBondContact O-N 3.16Å; C60-E64 PolarHBondContact O-N 3.08Å; C60-E64 VanDerWaalsContact O-N 3.16Å; C60-L88 HydrophobicContact CB-CD2 3.48Å; C60-L88 VanDerWaalsContact CB-CD2 3.48Å
61	R	95.9	Very high	94.3	Very high	116 Å²	116	52.8 Å²	52.8	44%	0.438	26%	0.262	S	S	.	.	H	α-helix	trans	-62.7	-40.7	177.1	-69.6	177	-173.6	152.7	2.6	111.9	F31 L57 H58 F63 E64 E65	F31-R61 HydrophobicContact CD1-CG 4.34Å; F31-R61 HydrophobicContact CE1-CG 3.82Å; L57-R61 WeakPolarHBondContact O-CG 3.11Å; L57-R61 PolarHBondContact O-N 2.81Å; H58-R61 PolarHBondContact O-N 2.93Å; R61-F63 VanDerWaalsContact C-N 3.3Å; R61-F63 PolarHBondContact O-N 3.29Å; R61-E64 WeakPolarHBondContact O-CB 3.43Å; R61-E64 PolarHBondContact O-N 3.38Å; R61-E64 VanDerWaalsContact O-N 3.16Å; R61-E65 WeakPolarHBondContact O-CB 3.24Å; R61-E65 WeakPolarHBondContact O-CG 3.27Å; R61-E65 PolarHBondContact O-N 3.06Å
62	Y	95.6	Very high	94.3	Very high	14 Å²	14	54 Å²	54	6%	0.055	28%	0.279	C	S	.	.	H	α-helix	trans	-60.4	-40.5	177.5	176.3	-94.6	0	0	0	111.9	H58 L59 C60 N66 L68 Y177 E205 H206 I215	H58-Y62 VanDerWaalsContact O-CB 3.31Å; H58-Y62 WeakPolarHBondContact O-CB 3.48Å; H58-Y62 PolarHBondContact O-N 3.24Å; L59-Y62 HydrophobicContact CD1-CD1 4.48Å; L59-Y62 PolarHBondContact O-N 2.84Å; C60-Y62 VanDerWaalsContact C-N 3.34Å; C60-Y62 PolarHBondContact O-N 3.01Å; Y62-N66 WeakPolarHBondContact CD2-ND2 3.33Å; Y62-N66 WeakPolarHBondContact CE2-ND2 3.44Å; Y62-N66 WeakPolarHBondContact O-CB 3.49Å; Y62-N66 PolarHBondContact O-N 3.36Å; Y62-N66 PolarHBondContact O-ND2 3.22Å; Y62-L68 HydrophobicContact CD1-CD1 4.16Å; Y62-L68 HydrophobicContact CE1-CD1 3.69Å; Y62-Y177 HydrophobicContact CE1-CD1 4.12Å; Y62-Y177 AromaticContact CE1-CE1 3.63Å; Y62-Y177 HydrophobicContact CE1-CE1 3.63Å; Y62-E205 HydrophobicContact CE2-CB 4.07Å; Y62-H206 HydrophobicContact CD2-CB 3.96Å; Y62-H206 HydrophobicContact CE2-CB 4.14Å; Y62-I215 HydrophobicContact CD1-CD1 4.32Å; Y62-I215 HydrophobicContact CD1-CG2 4.39Å; Y62-I215 HydrophobicContact CD2-CD1 3.94Å; Y62-I215 HydrophobicContact CG-CD1 3.6Å
63	F	93.4	Very high	94.4	Very high	4 Å²	4	56.5 Å²	56.5	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-65	-39.1	174.9	-66.9	-14.3	0	0	0	113	L59 C60 R61 S67 L68 L70 V85 L148 Y177	L59-F63 HydrophobicContact CD1-CD1 4.36Å; L59-F63 HydrophobicContact CD1-CE1 3.67Å; L59-F63 HydrophobicContact CD1-CE2 4.42Å; L59-F63 HydrophobicContact CD1-CZ 3.7Å; L59-F63 HydrophobicContact CD2-CZ 4.34Å; L59-F63 HydrophobicContact CG-CE1 4.25Å; L59-F63 HydrophobicContact CG-CE2 4.11Å; L59-F63 HydrophobicContact CG-CZ 3.83Å; L59-F63 WeakPolarHBondContact O-CG 3.25Å; L59-F63 PolarHBondContact O-N 3.16Å; L59-F63 VanDerWaalsContact O-N 3.08Å; C60-F63 PolarHBondContact O-N 3.16Å; R61-F63 VanDerWaalsContact C-N 3.3Å; R61-F63 PolarHBondContact O-N 3.29Å; F63-S67 PolarHBondContact O-N 3.29Å; F63-L68 HydrophobicContact CD1-CD1 3.48Å; F63-L68 VanDerWaalsContact CD1-CD1 3.48Å; F63-L68 HydrophobicContact CE1-CD1 3.92Å; F63-L68 HydrophobicContact CG-CD1 4.48Å; F63-L68 PolarHBondContact O-N 3.44Å; F63-L70 HydrophobicContact CD2-CD1 4.12Å; F63-L70 HydrophobicContact CE2-CD1 4.47Å; F63-V85 HydrophobicContact CE2-CG1 3.91Å; F63-L148 HydrophobicContact CE2-CD1 3.95Å; F63-L148 HydrophobicContact CE2-CD2 4.32Å; F63-L148 HydrophobicContact CZ-CD1 4.21Å; F63-L148 HydrophobicContact CZ-CD2 3.72Å; F63-Y177 HydrophobicContact CE1-CG 4.35Å
64	E	90.6	Very high	94.4	Very high	70 Å²	70	55.1 Å²	55.1	33%	0.327	28%	0.284	S	S	.	.	H	α-helix	trans	-63.5	-55.7	174.2	171.5	169.1	-135.6	0	0	111.8	I32 C60 R61 N66 S67	I32-E64 VanDerWaalsContact CA-OE1 3.25Å; I32-E64 WeakPolarHBondContact CA-OE1 3.5Å; I32-E64 HydrophobicContact CD1-CB 4.04Å; I32-E64 HydrophobicContact CD1-CG 4.47Å; I32-E64 HydrophobicContact CG1-CB 3.72Å; I32-E64 HydrophobicContact CG1-CG 3.66Å; I32-E64 PolarHBondContact N-OE1 2.86Å; C60-E64 PolarHBondContact O-N 3.08Å; C60-E64 VanDerWaalsContact O-N 3.16Å; R61-E64 WeakPolarHBondContact O-CB 3.43Å; R61-E64 PolarHBondContact O-N 3.38Å; R61-E64 VanDerWaalsContact O-N 3.16Å; E64-N66 VanDerWaalsContact C-N 3.33Å; E64-N66 PolarHBondContact O-N 2.83Å; E64-S67 PolarHBondContact O-N 2.9Å; E64-S67 VanDerWaalsContact O-N 3.16Å
65	E	91.1	Very high	94.5	Very high	132 Å²	132	52 Å²	52	62%	0.617	27%	0.267	S	S	*	.	H	α-helix	trans	-64.3	-35.8	-174.7	-70.9	172.8	-177.8	0	0	112.8	R61 S67	R61-E65 WeakPolarHBondContact O-CB 3.24Å; R61-E65 WeakPolarHBondContact O-CG 3.27Å; R61-E65 PolarHBondContact O-N 3.06Å; E65-S67 VanDerWaalsContact C-N 3.33Å
66	N	89.7	Confident	94.5	Very high	85 Å²	85	51.9 Å²	51.9	46%	0.455	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	1.6	-179.5	-67.1	-89.9	0	0	0	113	Y62 E64 L68	Y62-N66 WeakPolarHBondContact CD2-ND2 3.33Å; Y62-N66 WeakPolarHBondContact CE2-ND2 3.44Å; Y62-N66 WeakPolarHBondContact O-CB 3.49Å; Y62-N66 PolarHBondContact O-N 3.36Å; Y62-N66 PolarHBondContact O-ND2 3.22Å; E64-N66 VanDerWaalsContact C-N 3.33Å; E64-N66 PolarHBondContact O-N 2.83Å; N66-L68 HydrophobicContact CB-CG 4.32Å; N66-L68 PolarHBondContact O-N 2.89Å; N66-L68 VanDerWaalsContact O-N 3.12Å
67	S	84.1	Confident	94.5	Very high	102 Å²	102	51.7 Å²	51.7	71%	0.713	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	41.6	-179.9	-61.9	0	0	0	0	112.5	F63 E64 E65 N69	F63-S67 PolarHBondContact O-N 3.29Å; E64-S67 PolarHBondContact O-N 2.9Å; E64-S67 VanDerWaalsContact O-N 3.16Å; E65-S67 VanDerWaalsContact C-N 3.33Å; S67-N69 PolarHBondContact O-N 3.17Å; S67-N69 VanDerWaalsContact O-N 3.14Å
68	L	84.6	Confident	94.6	Very high	54 Å²	54	50.7 Å²	50.7	28%	0.283	26%	0.259	S	S	.	.			trans	-62.8	119.2	-177.7	-87	163.2	0	0	0	109.2	Y62 F63 N66 L70	Y62-L68 HydrophobicContact CD1-CD1 4.16Å; Y62-L68 HydrophobicContact CE1-CD1 3.69Å; F63-L68 HydrophobicContact CD1-CD1 3.48Å; F63-L68 VanDerWaalsContact CD1-CD1 3.48Å; F63-L68 HydrophobicContact CE1-CD1 3.92Å; F63-L68 HydrophobicContact CG-CD1 4.48Å; F63-L68 PolarHBondContact O-N 3.44Å; N66-L68 HydrophobicContact CB-CG 4.32Å; N66-L68 PolarHBondContact O-N 2.89Å; N66-L68 VanDerWaalsContact O-N 3.12Å; L68-L70 HydrophobicContact CB-CD2 4.32Å; L68-L70 PolarHBondContact O-N 3.34Å
69	N	90.3	Very high	94.6	Very high	116 Å²	116	50.7 Å²	50.7	62%	0.62	26%	0.263	S	S	*	.			trans	-75.2	97.4	179.2	-177.1	14.7	0	0	0	110.1	S67 K71 K73	S67-N69 PolarHBondContact O-N 3.17Å; S67-N69 VanDerWaalsContact O-N 3.14Å; N69-K71 VanDerWaalsContact OD1-CB 3.25Å; N69-K71 WeakPolarHBondContact OD1-CB 3.43Å; N69-K71 PolarHBondContact OD1-N 3.04Å; N69-K71 VanDerWaalsContact OD1-N 3.17Å; N69-K73 WeakPolarHBondContact O-CD 3.5Å; N69-K73 WeakPolarHBondContact O-CE 3.41Å
70	L	94.9	Very high	94.7	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.016	27%	0.267	C	S	.	.			trans	-89.3	-5.4	177.1	-56.1	-173.4	0	0	0	113.3	F63 L68 G72 K73 I75 A89 L92 A94 L146	F63-L70 HydrophobicContact CD2-CD1 4.12Å; F63-L70 HydrophobicContact CE2-CD1 4.47Å; L68-L70 HydrophobicContact CB-CD2 4.32Å; L68-L70 PolarHBondContact O-N 3.34Å; L70-G72 PolarHBondContact O-N 3.03Å; L70-K73 HydrophobicContact CD2-CD 4.34Å; L70-K73 WeakPolarHBondContact O-CB 3.26Å; L70-K73 PolarHBondContact O-N 3.41Å; L70-I75 HydrophobicContact CB-CD1 4.46Å; L70-I75 HydrophobicContact CD1-CD1 4.36Å; L70-I75 HydrophobicContact CD2-CD1 4.21Å; L70-A89 HydrophobicContact CD1-CB 3.84Å; L70-L92 HydrophobicContact CB-CB 4.22Å; L70-L92 HydrophobicContact CD1-CB 4.38Å; L70-L92 HydrophobicContact CD1-CD1 3.93Å; L70-A94 HydrophobicContact CB-CB 4.27Å; L70-A94 WeakPolarHBondContact O-CA 3.5Å; L70-A94 WeakPolarHBondContact O-CB 3.32Å; L70-A94 PolarHBondContact O-N 3.1Å; L70-L146 HydrophobicContact CD2-CD1 3.61Å
71	K	96.4	Very high	94.7	Very high	161 Å²	161	51.5 Å²	51.5	70%	0.7	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	122.9	-175.4	-172.2	178	-178.7	177	0	111.1	N69 K73	N69-K71 VanDerWaalsContact OD1-CB 3.25Å; N69-K71 WeakPolarHBondContact OD1-CB 3.43Å; N69-K71 PolarHBondContact OD1-N 3.04Å; N69-K71 VanDerWaalsContact OD1-N 3.17Å; K71-K73 PolarHBondContact O-N 3.2Å
72	G	96.3	Very high	94.8	Very high	54 Å²	54	46.2 Å²	46.2	56%	0.557	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	3	179.2	0	0	0	0	0	114.9	L70 G93	L70-G72 PolarHBondContact O-N 3.03Å; G72-G93 PolarHBondContact N-O 2.82Å
73	K	97.5	Very high	94.9	Very high	68 Å²	68	45.5 Å²	45.5	30%	0.296	25%	0.248	S	C	.	.			trans	-75.5	141.2	175.4	-67.8	-167.2	173.1	-69.8	0	110.8	N69 L70 K71 I75 A94 D95 D145 L146	N69-K73 WeakPolarHBondContact O-CD 3.5Å; N69-K73 WeakPolarHBondContact O-CE 3.41Å; L70-K73 HydrophobicContact CD2-CD 4.34Å; L70-K73 WeakPolarHBondContact O-CB 3.26Å; L70-K73 PolarHBondContact O-N 3.41Å; K71-K73 PolarHBondContact O-N 3.2Å; K73-I75 HydrophobicContact CB-CD1 4.38Å; K73-I75 HydrophobicContact CB-CG1 4.14Å; K73-A94 WeakPolarHBondContact O-CA 3.48Å; K73-A94 WeakPolarHBondContact O-CB 3.49Å; K73-D95 PolarHBondContact O-N 2.92Å; K73-D145 VanDerWaalsContact CA-OD2 3.3Å; K73-D145 WeakPolarHBondContact CA-OD2 3.43Å; K73-D145 HydrophobicContact CB-CB 4.03Å; K73-D145 HydrophobicContact CD-CB 4.35Å; K73-D145 HydrophobicContact CG-CB 4.27Å; K73-L146 HydrophobicContact CD-CD1 3.86Å; K73-L146 HydrophobicContact CD-CG 4.24Å
74	R	98	Very high	95.2	Very high	65 Å²	65	45.4 Å²	45.4	25%	0.245	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	120.4	169.2	-67.3	-170	60.9	-153.9	-22.3	110.1	D95 P141 D143 W144 D145 L146	R74-D95 CarbonylContact C-O 3.57Å; R74-D95 WeakPolarHBondContact CA-O 3.2Å; R74-D95 HydrophobicContact CG-CB 4.27Å; R74-P141 VanDerWaalsContact NH2-CG 3.3Å; R74-D143 IonicContact CZ-OD1 2.73Å; R74-D143 IonicContact CZ-OD2 2.95Å; R74-D143 IonicContact NH1-OD1 2.84Å; R74-D143 PolarHBondContact NH1-OD1 2.69Å; R74-D143 IonicContact NH1-OD2 3.19Å; R74-D143 PolarHBondContact NH1-OD2 2.99Å; R74-D143 IonicContact NH2-OD1 3.25Å; R74-D143 PolarHBondContact NH2-OD1 2.97Å; R74-W144 HydrophobicContact CB-CE3 3.99Å; R74-W144 HydrophobicContact CB-CZ3 4.39Å; R74-D145 PolarHBondContact N-OD2 3.22Å; R74-D145 WeakPolarHBondContact O-CB 3.34Å; R74-D145 PolarHBondContact O-N 3.04Å; R74-L146 PolarHBondContact O-N 3.43Å
75	I	98.6	Very high	95.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	133.2	-171.9	-55.8	-170.9	0	0	0	109.5	L70 K73 A89 A94 D95 V96 T97 W144 L146 L148	L70-I75 HydrophobicContact CB-CD1 4.46Å; L70-I75 HydrophobicContact CD1-CD1 4.36Å; L70-I75 HydrophobicContact CD2-CD1 4.21Å; K73-I75 HydrophobicContact CB-CD1 4.38Å; K73-I75 HydrophobicContact CB-CG1 4.14Å; I75-A89 HydrophobicContact CD1-CB 4.08Å; I75-A94 HydrophobicContact CD1-CB 3.46Å; I75-A94 VanDerWaalsContact CD1-CB 3.46Å; I75-A94 HydrophobicContact CG1-CB 3.92Å; I75-D95 PolarHBondContact N-O 3Å; I75-V96 HydrophobicContact CB-CG2 4.34Å; I75-V96 CarbonylContact O-C 3.5Å; I75-V96 WeakPolarHBondContact O-CA 3.47Å; I75-T97 PolarHBondContact O-N 3.15Å; I75-W144 WeakPolarHBondContact O-CZ3 3.47Å; I75-L146 WeakPolarHBondContact CA-O 3.46Å; I75-L146 HydrophobicContact CD1-CB 4.46Å; I75-L146 HydrophobicContact CD1-CD1 3.86Å; I75-L146 HydrophobicContact CG1-CB 4.08Å; I75-L146 HydrophobicContact CG1-CD1 4.26Å; I75-L146 HydrophobicContact CG2-CB 4.38Å; I75-L148 HydrophobicContact CG2-CD1 3.52Å; I75-L148 HydrophobicContact CG2-CG 3.61Å
76	I	98.8	Very high	95.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128.6	166.1	-173.1	170.6	0	0	0	109.8	T97 T99 L131 F140 W144 L146 V147 L148 L169	I76-T97 CarbonylContact C-O 3.51Å; I76-T97 VanDerWaalsContact CA-O 3.29Å; I76-T97 WeakPolarHBondContact CA-O 3.5Å; I76-T97 HydrophobicContact CG1-CG2 4.43Å; I76-T99 HydrophobicContact CD1-CG2 4.04Å; I76-T99 HydrophobicContact CG1-CG2 4.02Å; I76-L131 HydrophobicContact CD1-CD1 4.07Å; I76-F140 HydrophobicContact CD1-CB 4.44Å; I76-F140 HydrophobicContact CD1-CD1 3.75Å; I76-F140 HydrophobicContact CD1-CE1 4.26Å; I76-F140 HydrophobicContact CD1-CG 4.15Å; I76-W144 HydrophobicContact CB-CD2 3.8Å; I76-W144 HydrophobicContact CB-CE3 3.89Å; I76-W144 HydrophobicContact CB-CG 4.43Å; I76-W144 HydrophobicContact CB-CH2 4.05Å; I76-W144 HydrophobicContact CB-CZ2 3.95Å; I76-W144 HydrophobicContact CB-CZ3 4.02Å; I76-W144 HydrophobicContact CD1-CZ2 3.88Å; I76-W144 HydrophobicContact CG1-CZ2 4.37Å; I76-W144 HydrophobicContact CG2-CB 4.42Å; I76-W144 HydrophobicContact CG2-CD2 3.63Å; I76-W144 HydrophobicContact CG2-CE3 4.14Å; I76-W144 HydrophobicContact CG2-CG 3.74Å; I76-W144 HydrophobicContact CG2-CZ2 4.42Å; I76-L146 PolarHBondContact N-O 3.36Å; I76-L146 VanDerWaalsContact N-O 3.11Å; I76-V147 HydrophobicContact CG2-CB 4.32Å; I76-V147 HydrophobicContact CG2-CG1 4.19Å; I76-V147 HydrophobicContact CG2-CG2 3.83Å; I76-V147 CarbonylContact O-C 3.56Å; I76-V147 WeakPolarHBondContact O-CA 3.46Å; I76-L148 PolarHBondContact O-N 2.99Å; I76-L169 HydrophobicContact CD1-CD1 4.16Å; I76-L169 HydrophobicContact CD1-CD2 4.01Å; I76-L169 HydrophobicContact CG2-CD1 4.11Å
77	E	98.9	Very high	96.3	Very high	4 Å²	4	31.8 Å²	31.8	2%	0.019	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128.2	174.6	-175.2	179.9	-166.5	0	0	109.9	A80 V85 G86 T97 L98 T99 L148	E77-A80 HydrophobicContact CB-CB 4.48Å; E77-A80 HydrophobicContact CG-CB 3.88Å; E77-V85 WeakPolarHBondContact OE1-CB 3.2Å; E77-G86 WeakPolarHBondContact OE2-CA 3.48Å; E77-G86 PolarHBondContact OE2-N 2.91Å; E77-T97 PolarHBondContact N-O 3.27Å; E77-L98 WeakPolarHBondContact OE2-CD2 3.17Å; E77-T99 WeakPolarHBondContact O-CA 3.23Å; E77-T99 WeakPolarHBondContact O-CB 3.44Å; E77-T99 PolarHBondContact O-N 3.4Å; E77-T99 PolarHBondContact O-OG1 2.99Å; E77-L148 WeakPolarHBondContact CA-O 3.32Å; E77-L148 HydrophobicContact CB-CB 4.29Å; E77-L148 HydrophobicContact CG-CB 4.22Å
78	L	98.9	Very high	97	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	134.3	176.5	-62.8	178.3	0	0	0	110.1	L131 V147 L148 I152 L162 T165 L166 L169	L78-L131 HydrophobicContact CD2-CD1 3.81Å; L78-L131 HydrophobicContact CD2-CD2 4.13Å; L78-V147 HydrophobicContact CD1-CG1 3.87Å; L78-V147 HydrophobicContact CG-CG1 4.1Å; L78-L148 PolarHBondContact N-O 3.43Å; L78-I152 HydrophobicContact CB-CD1 4.18Å; L78-I152 WeakPolarHBondContact O-CG2 3.33Å; L78-L162 HydrophobicContact CD1-CD1 3.95Å; L78-T165 HydrophobicContact CD1-CG2 3.98Å; L78-T165 HydrophobicContact CD2-CG2 4Å; L78-L166 HydrophobicContact CD1-CD2 3.74Å; L78-L166 HydrophobicContact CD1-CG 4.45Å; L78-L169 HydrophobicContact CD1-CD1 4.18Å; L78-L169 HydrophobicContact CD2-CD1 3.85Å; L78-L169 HydrophobicContact CG-CD1 4.34Å
79	G	98.4	Very high	97.6	Very high	17 Å²	17	24.3 Å²	24.3	18%	0.175	13%	0.134	C	C	.	.	S	Bend	trans	60	48.2	177.1	0	0	0	0	0	112	G81 T99 D100	G79-G81 VanDerWaalsContact C-N 3.27Å; G79-G81 PolarHBondContact O-N 3.35Å; G79-T99 PolarHBondContact N-O 2.93Å; G79-D100 VanDerWaalsContact CA-OD2 3.3Å; G79-D100 WeakPolarHBondContact CA-OD2 3.4Å
80	A	98.6	Very high	97.9	Very high	9 Å²	9	18.9 Å²	18.9	7%	0.074	11%	0.105	C	C	.	.			trans	-67.1	-24	-170.7	0	0	0	0	0	113.9	E77 T82 G83 L98 T99 D100 L108	E77-A80 HydrophobicContact CB-CB 4.48Å; E77-A80 HydrophobicContact CG-CB 3.88Å; A80-T82 PolarHBondContact O-N 2.83Å; A80-G83 PolarHBondContact O-N 2.88Å; A80-L98 HydrophobicContact CB-CB 4.27Å; A80-L98 HydrophobicContact CB-CD2 4.48Å; A80-T99 PolarHBondContact N-O 2.78Å; A80-D100 PolarHBondContact N-OD2 3.19Å; A80-L108 HydrophobicContact CB-CD1 3.89Å; A80-L108 HydrophobicContact CB-CD2 3.92Å
81	G	97.7	Very high	98	Very high	7 Å²	7	20.6 Å²	20.6	7%	0.072	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	-95	-177.9	0	0	0	0	0	112.5	A49 G79 D100 Q107	A49-G81 CarbonylContact O-C 3.59Å; G79-G81 VanDerWaalsContact C-N 3.27Å; G79-G81 PolarHBondContact O-N 3.35Å; G81-D100 WeakPolarHBondContact CA-OD2 3.47Å; G81-D100 PolarHBondContact N-OD2 2.88Å; G81-Q107 PolarHBondContact O-NE2 2.91Å
82	T	98.2	Very high	97.9	Very high	5 Å²	5	15 Å²	15	3%	0.031	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-22.3	175.4	59.5	0	0	0	0	113.8	I38 Q40 A50 V52 A80 N111	I38-T82 HydrophobicContact CG2-CG2 3.87Å; Q40-T82 HydrophobicContact CG-CG2 4.33Å; A50-T82 WeakPolarHBondContact O-CG2 3.28Å; V52-T82 HydrophobicContact CG2-CG2 3.87Å; A80-T82 PolarHBondContact O-N 2.83Å; T82-N111 VanDerWaalsContact O-CB 3.26Å; T82-N111 WeakPolarHBondContact O-CB 3.34Å; T82-N111 PolarHBondContact O-ND2 2.94Å
83	G	98.4	Very high	97.9	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.065	C	C	.	.			trans	87.9	7.1	-179.7	0	0	0	0	0	115.7	A80 V85 G86 I87	A80-G83 PolarHBondContact O-N 2.88Å; G83-V85 VanDerWaalsContact C-N 3.26Å; G83-V85 PolarHBondContact O-N 3.11Å; G83-V85 VanDerWaalsContact O-N 3.16Å; G83-G86 PolarHBondContact O-N 2.93Å; G83-I87 WeakPolarHBondContact O-CB 3.44Å; G83-I87 WeakPolarHBondContact O-CD1 3.26Å; G83-I87 WeakPolarHBondContact O-CG1 3.45Å; G83-I87 PolarHBondContact O-N 3.44Å
84	I	98.5	Very high	97.9	Very high	2 Å²	2	9.4 Å²	9.4	1%	0.01	5%	0.051	C	C	.	.	H	α-helix	trans	-55.6	-37.9	-170.7	-167.2	173.3	0	0	0	113.6	Y29 F31 I38 V52 A56 L57 L88	Y29-I84 HydrophobicContact CD1-CD1 4.33Å; Y29-I84 HydrophobicContact CD2-CD1 3.56Å; Y29-I84 HydrophobicContact CE2-CD1 4.01Å; Y29-I84 HydrophobicContact CG-CD1 3.73Å; F31-I84 HydrophobicContact CE2-CD1 4.07Å; F31-I84 HydrophobicContact CE2-CG1 4.46Å; I38-I84 HydrophobicContact CD1-CB 4.16Å; I38-I84 HydrophobicContact CD1-CG1 4.19Å; I38-I84 HydrophobicContact CG1-CB 4.27Å; I38-I84 HydrophobicContact CG1-CD1 4.06Å; I38-I84 HydrophobicContact CG1-CG1 4.05Å; V52-I84 HydrophobicContact CG1-CD1 4Å; V52-I84 HydrophobicContact CG1-CG2 4.13Å; V52-I84 HydrophobicContact CG2-CD1 4.49Å; A56-I84 HydrophobicContact CB-CG2 3.73Å; L57-I84 HydrophobicContact CD2-CD1 3.76Å; I84-L88 WeakPolarHBondContact O-CB 3.33Å; I84-L88 PolarHBondContact O-N 2.82Å; I84-L88 VanDerWaalsContact O-N 3.13Å
85	V	98.6	Very high	97.9	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-72.6	-50.2	-178.8	-172.8	0	0	0	0	110.6	A56 L59 F63 E77 G83 I87 L88 A89 L148 A150	A56-V85 HydrophobicContact CB-CG2 3.8Å; L59-V85 HydrophobicContact CD2-CG1 3.85Å; L59-V85 HydrophobicContact CD2-CG2 4.48Å; L59-V85 HydrophobicContact CG-CG1 4.07Å; F63-V85 HydrophobicContact CE2-CG1 3.91Å; E77-V85 WeakPolarHBondContact OE1-CB 3.2Å; G83-V85 VanDerWaalsContact C-N 3.26Å; G83-V85 PolarHBondContact O-N 3.11Å; G83-V85 VanDerWaalsContact O-N 3.16Å; V85-I87 VanDerWaalsContact C-N 3.35Å; V85-I87 PolarHBondContact O-N 3.15Å; V85-L88 PolarHBondContact O-N 2.87Å; V85-A89 PolarHBondContact O-N 2.85Å; V85-L148 HydrophobicContact CG1-CD1 3.96Å; V85-A150 HydrophobicContact CG2-CB 4.11Å
86	G	98.4	Very high	97.9	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-64.3	-36.6	178.3	0	0	0	0	0	113.2	E77 G83 A89 A90	E77-G86 WeakPolarHBondContact OE2-CA 3.48Å; E77-G86 PolarHBondContact OE2-N 2.91Å; G83-G86 PolarHBondContact O-N 2.93Å; G86-A89 PolarHBondContact O-N 3.45Å; G86-A90 WeakPolarHBondContact O-CB 3.38Å; G86-A90 PolarHBondContact O-N 3.3Å
87	I	98.5	Very high	97.9	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-63.7	-45.3	174.6	-65.1	165.1	0	0	0	110.1	L36 I38 G83 V85 A89 A90 R91 L98 N111 V112 N115 W121	L36-I87 HydrophobicContact CD2-CB 4.01Å; L36-I87 HydrophobicContact CD2-CG2 3.27Å; I38-I87 HydrophobicContact CD1-CD1 4.11Å; G83-I87 WeakPolarHBondContact O-CB 3.44Å; G83-I87 WeakPolarHBondContact O-CD1 3.26Å; G83-I87 WeakPolarHBondContact O-CG1 3.45Å; G83-I87 PolarHBondContact O-N 3.44Å; V85-I87 VanDerWaalsContact C-N 3.35Å; V85-I87 PolarHBondContact O-N 3.15Å; I87-A89 VanDerWaalsContact C-N 3.34Å; I87-A89 PolarHBondContact O-N 2.9Å; I87-A90 PolarHBondContact O-N 3.49Å; I87-R91 WeakPolarHBondContact O-CG 3.34Å; I87-R91 PolarHBondContact O-N 3.18Å; I87-L98 HydrophobicContact CG1-CD2 4.28Å; I87-N111 HydrophobicContact CD1-CB 3.92Å; I87-V112 HydrophobicContact CD1-CG2 4.14Å; I87-V112 HydrophobicContact CG1-CG2 3.84Å; I87-N115 HydrophobicContact CG2-CB 3.48Å; I87-N115 VanDerWaalsContact CG2-CB 3.48Å; I87-W121 HydrophobicContact CG2-CH2 4.26Å
88	L	97.6	Very high	97.9	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-60	-45.2	174.4	176.3	62.3	0	0	0	111.2	F31 I32 L36 C60 I84 V85 A90 R91 L92	F31-L88 HydrophobicContact CB-CD1 3.85Å; F31-L88 HydrophobicContact CB-CD2 4.03Å; F31-L88 HydrophobicContact CD2-CD2 4.26Å; F31-L88 HydrophobicContact CG-CD2 4.1Å; I32-L88 HydrophobicContact CD1-CD1 4.32Å; L36-L88 HydrophobicContact CD1-CB 4.34Å; L36-L88 HydrophobicContact CD1-CD1 4.16Å; C60-L88 HydrophobicContact CB-CD2 3.48Å; C60-L88 VanDerWaalsContact CB-CD2 3.48Å; I84-L88 WeakPolarHBondContact O-CB 3.33Å; I84-L88 PolarHBondContact O-N 2.82Å; I84-L88 VanDerWaalsContact O-N 3.13Å; V85-L88 PolarHBondContact O-N 2.87Å; L88-A90 VanDerWaalsContact C-N 3.3Å; L88-A90 PolarHBondContact O-N 2.91Å; L88-R91 WeakPolarHBondContact O-CB 3.29Å; L88-R91 PolarHBondContact O-N 2.86Å; L88-R91 VanDerWaalsContact O-N 3.15Å; L88-L92 HydrophobicContact CD1-CD1 4.22Å; L88-L92 HydrophobicContact CD1-CG 4.41Å; L88-L92 HydrophobicContact CG-CD1 4.08Å; L88-L92 WeakPolarHBondContact O-CG 3.35Å; L88-L92 PolarHBondContact O-N 2.92Å
89	A	97.8	Very high	97.9	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-59.3	-41.2	177.7	0	0	0	0	0	112.2	L70 I75 V85 G86 I87 L92 G93 A94 V96	L70-A89 HydrophobicContact CD1-CB 3.84Å; I75-A89 HydrophobicContact CD1-CB 4.08Å; V85-A89 PolarHBondContact O-N 2.85Å; G86-A89 PolarHBondContact O-N 3.45Å; I87-A89 VanDerWaalsContact C-N 3.34Å; I87-A89 PolarHBondContact O-N 2.9Å; A89-L92 CarbonylContact O-C 3.59Å; A89-L92 WeakPolarHBondContact O-CA 3.4Å; A89-L92 WeakPolarHBondContact O-CB 3.32Å; A89-L92 PolarHBondContact O-N 3.37Å; A89-L92 VanDerWaalsContact O-N 3.11Å; A89-G93 PolarHBondContact O-N 3.29Å; A89-A94 HydrophobicContact CB-CB 4.41Å; A89-A94 WeakPolarHBondContact O-CB 3.34Å; A89-A94 PolarHBondContact O-N 3.48Å; A89-A94 VanDerWaalsContact O-N 3.15Å; A89-V96 HydrophobicContact CB-CG2 4.1Å
90	A	97.7	Very high	97.9	Very high	1 Å²	1	8.9 Å²	8.9	1%	0.008	5%	0.049	C	C	.	.	H	α-helix	trans	-65.5	-40.5	175	0	0	0	0	0	112.4	G86 I87 L88 L92 G93 V96 W121 P126	G86-A90 WeakPolarHBondContact O-CB 3.38Å; G86-A90 PolarHBondContact O-N 3.3Å; I87-A90 PolarHBondContact O-N 3.49Å; L88-A90 VanDerWaalsContact C-N 3.3Å; L88-A90 PolarHBondContact O-N 2.91Å; A90-L92 PolarHBondContact O-N 3.21Å; A90-G93 WeakPolarHBondContact O-CA 3.33Å; A90-G93 PolarHBondContact O-N 2.84Å; A90-V96 HydrophobicContact CB-CB 4.3Å; A90-V96 HydrophobicContact CB-CG2 3.8Å; A90-W121 HydrophobicContact CB-CE3 3.89Å; A90-W121 HydrophobicContact CB-CZ3 3.69Å; A90-P126 HydrophobicContact CB-CB 4.5Å; A90-P126 HydrophobicContact CB-CG 3.44Å; A90-P126 VanDerWaalsContact CB-CG 3.44Å
91	R	95.4	Very high	97.9	Very high	39 Å²	39	12 Å²	12	15%	0.147	6%	0.064	C	C	.	.	H	α-helix	trans	-61.9	-22.4	171.9	-72.1	-62.4	-166.3	118.1	-6.4	113	Q34 I87 L88 G93 N115 W121	Q34-R91 VanDerWaalsContact OE1-NH1 3.15Å; I87-R91 WeakPolarHBondContact O-CG 3.34Å; I87-R91 PolarHBondContact O-N 3.18Å; L88-R91 WeakPolarHBondContact O-CB 3.29Å; L88-R91 PolarHBondContact O-N 2.86Å; L88-R91 VanDerWaalsContact O-N 3.15Å; R91-G93 VanDerWaalsContact C-N 3.32Å; R91-N115 PolarHBondContact NE-O 2.8Å; R91-N115 VanDerWaalsContact NH2-C 3.27Å; R91-N115 PolarHBondContact NH2-O 3.31Å; R91-W121 HydrophobicContact CG-CZ3 4.11Å
92	L	94.7	Very high	97.8	Very high	44 Å²	44	15.9 Å²	15.9	23%	0.23	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	5	173.1	-64.3	168	0	0	0	113.5	I32 L70 L88 A89 A90	I32-L92 HydrophobicContact CD1-CD1 3.65Å; I32-L92 HydrophobicContact CD1-CD2 3.37Å; I32-L92 HydrophobicContact CD1-CG 4.01Å; I32-L92 HydrophobicContact CG2-CD2 4.36Å; L70-L92 HydrophobicContact CB-CB 4.22Å; L70-L92 HydrophobicContact CD1-CB 4.38Å; L70-L92 HydrophobicContact CD1-CD1 3.93Å; L88-L92 HydrophobicContact CD1-CD1 4.22Å; L88-L92 HydrophobicContact CD1-CG 4.41Å; L88-L92 HydrophobicContact CG-CD1 4.08Å; L88-L92 WeakPolarHBondContact O-CG 3.35Å; L88-L92 PolarHBondContact O-N 2.92Å; A89-L92 CarbonylContact O-C 3.59Å; A89-L92 WeakPolarHBondContact O-CA 3.4Å; A89-L92 WeakPolarHBondContact O-CB 3.32Å; A89-L92 PolarHBondContact O-N 3.37Å; A89-L92 VanDerWaalsContact O-N 3.11Å; A90-L92 PolarHBondContact O-N 3.21Å
93	G	96	Very high	97.7	Very high	5 Å²	5	19.9 Å²	19.9	5%	0.052	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.8	18.2	172.9	0	0	0	0	0	115	G72 A89 A90 R91 S123	G72-G93 PolarHBondContact N-O 2.82Å; A89-G93 PolarHBondContact O-N 3.29Å; A90-G93 WeakPolarHBondContact O-CA 3.33Å; A90-G93 PolarHBondContact O-N 2.84Å; R91-G93 VanDerWaalsContact C-N 3.32Å; G93-S123 WeakPolarHBondContact O-CB 3.35Å
94	A	97.8	Very high	97.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.109	C	C	.	.			trans	-72.7	155.1	167.1	0	0	0	0	0	112	L70 K73 I75 A89 V96	L70-A94 HydrophobicContact CB-CB 4.27Å; L70-A94 WeakPolarHBondContact O-CA 3.5Å; L70-A94 WeakPolarHBondContact O-CB 3.32Å; L70-A94 PolarHBondContact O-N 3.1Å; K73-A94 WeakPolarHBondContact O-CA 3.48Å; K73-A94 WeakPolarHBondContact O-CB 3.49Å; I75-A94 HydrophobicContact CD1-CB 3.46Å; I75-A94 VanDerWaalsContact CD1-CB 3.46Å; I75-A94 HydrophobicContact CG1-CB 3.92Å; A89-A94 HydrophobicContact CB-CB 4.41Å; A89-A94 WeakPolarHBondContact O-CB 3.34Å; A89-A94 PolarHBondContact O-N 3.48Å; A89-A94 VanDerWaalsContact O-N 3.15Å; A94-V96 HydrophobicContact CB-CG2 3.61Å
95	D	98.2	Very high	97.6	Very high	45 Å²	45	20.6 Å²	20.6	24%	0.241	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	109.6	160.9	174.9	1.7	0	0	0	107.6	K73 R74 I75 V124	K73-D95 PolarHBondContact O-N 2.92Å; R74-D95 CarbonylContact C-O 3.57Å; R74-D95 WeakPolarHBondContact CA-O 3.2Å; R74-D95 HydrophobicContact CG-CB 4.27Å; I75-D95 PolarHBondContact N-O 3Å; D95-V124 HydrophobicContact CB-CG2 3.7Å; D95-V124 WeakPolarHBondContact OD1-CG2 3.46Å
96	V	98.6	Very high	97.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.8	-167.1	-172.7	0	0	0	0	111.7	I75 A89 A90 A94 L98 P126 S127	I75-V96 HydrophobicContact CB-CG2 4.34Å; I75-V96 CarbonylContact O-C 3.5Å; I75-V96 WeakPolarHBondContact O-CA 3.47Å; A89-V96 HydrophobicContact CB-CG2 4.1Å; A90-V96 HydrophobicContact CB-CB 4.3Å; A90-V96 HydrophobicContact CB-CG2 3.8Å; A94-V96 HydrophobicContact CB-CG2 3.61Å; V96-L98 HydrophobicContact CB-CD1 4.4Å; V96-L98 HydrophobicContact CG1-CD1 3.7Å; V96-L98 HydrophobicContact CG1-CG 3.93Å; V96-P126 HydrophobicContact CB-CB 4.43Å; V96-P126 WeakPolarHBondContact O-CA 3.13Å; V96-S127 PolarHBondContact O-N 3.47Å
97	T	98.8	Very high	97.4	Very high	13 Å²	13	25 Å²	25	8%	0.08	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	112.8	162.9	-61.2	0	0	0	0	109.2	I75 I76 E77 T99 S127 L129 F140 W144	I75-T97 PolarHBondContact O-N 3.15Å; I76-T97 CarbonylContact C-O 3.51Å; I76-T97 VanDerWaalsContact CA-O 3.29Å; I76-T97 WeakPolarHBondContact CA-O 3.5Å; I76-T97 HydrophobicContact CG1-CG2 4.43Å; E77-T97 PolarHBondContact N-O 3.27Å; T97-T99 HydrophobicContact CG2-CG2 3.88Å; T97-S127 CarbonylContact C-O 3.57Å; T97-S127 WeakPolarHBondContact CA-O 3.27Å; T97-L129 HydrophobicContact CG2-CD1 4.12Å; T97-F140 HydrophobicContact CG2-CD1 4.46Å; T97-F140 HydrophobicContact CG2-CE1 4.07Å; T97-W144 HydrophobicContact CG2-CH2 4.49Å; T97-W144 WeakPolarHBondContact OG1-CH2 3.43Å
98	L	98.9	Very high	97.4	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	132.3	175	-58.3	92.3	0	0	0	109.4	E77 A80 I87 V96 L108 V112 P126 S127 V128 L129	E77-L98 WeakPolarHBondContact OE2-CD2 3.17Å; A80-L98 HydrophobicContact CB-CB 4.27Å; A80-L98 HydrophobicContact CB-CD2 4.48Å; I87-L98 HydrophobicContact CG1-CD2 4.28Å; V96-L98 HydrophobicContact CB-CD1 4.4Å; V96-L98 HydrophobicContact CG1-CD1 3.7Å; V96-L98 HydrophobicContact CG1-CG 3.93Å; L98-L108 HydrophobicContact CB-CD1 4.14Å; L98-L108 HydrophobicContact CB-CD2 3.9Å; L98-L108 HydrophobicContact CB-CG 4.2Å; L98-L108 HydrophobicContact CD2-CD1 3.76Å; L98-V112 HydrophobicContact CD1-CG2 4.02Å; L98-V112 HydrophobicContact CD2-CG2 4.25Å; L98-P126 HydrophobicContact CD1-CB 3.54Å; L98-S127 PolarHBondContact N-O 3.13Å; L98-V128 WeakPolarHBondContact O-CA 3.37Å; L98-L129 PolarHBondContact O-N 3.29Å; L98-L129 VanDerWaalsContact O-N 3.07Å
99	T	98.9	Very high	97.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	145.8	-177.6	74.1	0	0	0	0	113.1	I76 E77 G79 A80 T97 L129 L131 F140	I76-T99 HydrophobicContact CD1-CG2 4.04Å; I76-T99 HydrophobicContact CG1-CG2 4.02Å; E77-T99 WeakPolarHBondContact O-CA 3.23Å; E77-T99 WeakPolarHBondContact O-CB 3.44Å; E77-T99 PolarHBondContact O-N 3.4Å; E77-T99 PolarHBondContact O-OG1 2.99Å; G79-T99 PolarHBondContact N-O 2.93Å; A80-T99 PolarHBondContact N-O 2.78Å; T97-T99 HydrophobicContact CG2-CG2 3.88Å; T99-L129 VanDerWaalsContact CA-O 3.25Å; T99-L129 WeakPolarHBondContact CA-O 3.34Å; T99-L129 WeakPolarHBondContact CB-O 3.46Å; T99-L131 HydrophobicContact CG2-CB 4.05Å; T99-L131 HydrophobicContact CG2-CD1 4.07Å; T99-F140 HydrophobicContact CG2-CE1 3.87Å; T99-F140 HydrophobicContact CG2-CZ 4.07Å
100	D	98.7	Very high	97.5	Very high	16 Å²	16	32.6 Å²	32.6	9%	0.086	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	-179.3	173.3	-149.1	-64	0	0	0	109.3	G79 A80 G81 A104 L108 P130 L131	G79-D100 VanDerWaalsContact CA-OD2 3.3Å; G79-D100 WeakPolarHBondContact CA-OD2 3.4Å; A80-D100 PolarHBondContact N-OD2 3.19Å; G81-D100 WeakPolarHBondContact CA-OD2 3.47Å; G81-D100 PolarHBondContact N-OD2 2.88Å; D100-A104 HydrophobicContact CB-CB 3.81Å; D100-L108 HydrophobicContact CB-CD2 4.35Å; D100-P130 CarbonylContact O-C 3.53Å; D100-P130 VanDerWaalsContact O-CA 3.28Å; D100-P130 WeakPolarHBondContact O-CA 3.35Å; D100-L131 PolarHBondContact O-N 3.25Å
101	L	97.9	Very high	97.5	Very high	76 Å²	76	32.6 Å²	32.6	40%	0.398	18%	0.184	S	C	.	.			trans	-60.7	152.2	169.3	-67	174.8	0	0	0	111	L103 A104 V105	L101-L103 HydrophobicContact CB-CD2 4.46Å; L101-L103 HydrophobicContact CB-CG 4.16Å; L101-L103 PolarHBondContact O-N 2.98Å; L101-A104 PolarHBondContact O-N 3.42Å; L101-V105 PolarHBondContact O-N 3.33Å
102	P	97.2	Very high	97.6	Very high	87 Å²	87	31.1 Å²	31.1	57%	0.565	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-31.8	-178.4	-30	35.2	0	0	0	115	A104 P106 P130	P102-A104 VanDerWaalsContact C-N 3.3Å; P102-A104 PolarHBondContact O-N 3.48Å; P102-P106 WeakPolarHBondContact O-CD 3.3Å; P102-P130 HydrophobicContact CG-CB 4.05Å
103	L	95.7	Very high	97.8	Very high	89 Å²	89	33.2 Å²	33.2	47%	0.466	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-28.5	179	64.9	87.3	0	0	0	113.8	L46 A49 L101	L46-L103 HydrophobicContact CD1-CD1 3.56Å; A49-L103 HydrophobicContact CB-CD1 4.46Å; L101-L103 HydrophobicContact CB-CD2 4.46Å; L101-L103 HydrophobicContact CB-CG 4.16Å; L101-L103 PolarHBondContact O-N 2.98Å
104	A	96.6	Very high	97.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-18.4	-177	0	0	0	0	0	112.9	L46 A49 D100 L101 P102 P106 Q107 L108	L46-A104 HydrophobicContact CD1-CB 3.98Å; A49-A104 HydrophobicContact CB-CB 3.88Å; D100-A104 HydrophobicContact CB-CB 3.81Å; L101-A104 PolarHBondContact O-N 3.42Å; P102-A104 VanDerWaalsContact C-N 3.3Å; P102-A104 PolarHBondContact O-N 3.48Å; A104-P106 VanDerWaalsContact C-CD 3.49Å; A104-Q107 PolarHBondContact O-N 3.2Å; A104-Q107 VanDerWaalsContact O-N 3.17Å; A104-L108 WeakPolarHBondContact O-CB 3.39Å; A104-L108 PolarHBondContact O-N 2.88Å
105	V	97.7	Very high	97.8	Very high	17 Å²	17	36.3 Å²	36.3	10%	0.103	22%	0.222	C	C	.	.	H	α-helix	trans	-51.8	-43.2	-179.8	169.4	0	0	0	0	113.4	L101 Q107 L108 Q109 V128 P130	L101-V105 PolarHBondContact O-N 3.33Å; V105-Q107 PolarHBondContact O-N 2.86Å; V105-L108 PolarHBondContact O-N 3.4Å; V105-Q109 HydrophobicContact CG1-CG 4.14Å; V105-Q109 WeakPolarHBondContact O-CB 3.15Å; V105-Q109 VanDerWaalsContact O-CG 3.29Å; V105-Q109 WeakPolarHBondContact O-CG 3.4Å; V105-Q109 PolarHBondContact O-N 3.12Å; V105-V128 HydrophobicContact CG1-CG1 4.11Å; V105-P130 HydrophobicContact CG2-CB 4.24Å
106	P	97	Very high	97.8	Very high	82 Å²	82	39.4 Å²	39.4	53%	0.532	24%	0.236	S	C	.	.	H	α-helix	trans	-61.9	-43.3	178.6	-25.3	35.9	0	0	0	113.9	P102 A104 S110	P102-P106 WeakPolarHBondContact O-CD 3.3Å; A104-P106 VanDerWaalsContact C-CD 3.49Å; P106-S110 WeakPolarHBondContact O-CB 3.41Å; P106-S110 PolarHBondContact O-N 3.45Å
107	Q	96.6	Very high	97.5	Very high	10 Å²	10	40.1 Å²	40.1	5%	0.047	24%	0.241	C	C	.	.	H	α-helix	trans	-63.9	-46	175.8	178.8	-177.7	-95.6	0	0	110.3	V41 L46 A49 G81 A104 V105 Q109 S110 N111	V41-Q107 HydrophobicContact CG2-CG 4.5Å; L46-Q107 HydrophobicContact CD2-CB 4.12Å; L46-Q107 HydrophobicContact CD2-CG 4.42Å; A49-Q107 PolarHBondContact O-NE2 2.83Å; G81-Q107 PolarHBondContact O-NE2 2.91Å; A104-Q107 PolarHBondContact O-N 3.2Å; A104-Q107 VanDerWaalsContact O-N 3.17Å; V105-Q107 PolarHBondContact O-N 2.86Å; Q107-Q109 PolarHBondContact O-N 3.13Å; Q107-S110 WeakPolarHBondContact O-CB 3.36Å; Q107-S110 PolarHBondContact O-N 3.47Å; Q107-N111 PolarHBondContact O-N 2.77Å
108	L	97.8	Very high	97.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-59.4	-45.7	-179.6	-173	56	0	0	0	111.7	A80 L98 D100 A104 V105 N111 V112 V128	A80-L108 HydrophobicContact CB-CD1 3.89Å; A80-L108 HydrophobicContact CB-CD2 3.92Å; L98-L108 HydrophobicContact CB-CD1 4.14Å; L98-L108 HydrophobicContact CB-CD2 3.9Å; L98-L108 HydrophobicContact CB-CG 4.2Å; L98-L108 HydrophobicContact CD2-CD1 3.76Å; D100-L108 HydrophobicContact CB-CD2 4.35Å; A104-L108 WeakPolarHBondContact O-CB 3.39Å; A104-L108 PolarHBondContact O-N 2.88Å; V105-L108 PolarHBondContact O-N 3.4Å; L108-N111 PolarHBondContact O-N 3.01Å; L108-V112 VanDerWaalsContact O-CG2 3.32Å; L108-V112 WeakPolarHBondContact O-CG2 3.31Å; L108-V112 PolarHBondContact O-N 2.71Å; L108-V128 HydrophobicContact CB-CG1 4.01Å; L108-V128 HydrophobicContact CD2-CG1 3.57Å; L108-V128 HydrophobicContact CG-CG1 3.63Å; L108-V128 HydrophobicContact CG-CG2 4.27Å
109	Q	98.4	Very high	97	Very high	91 Å²	91	51.4 Å²	51.4	43%	0.425	32%	0.32	S	S	.	.	H	α-helix	trans	-62.1	-42.2	174.9	-75.5	172.7	-11	0	0	112.6	V105 Q107 V112 S113 V128	V105-Q109 HydrophobicContact CG1-CG 4.14Å; V105-Q109 WeakPolarHBondContact O-CB 3.15Å; V105-Q109 VanDerWaalsContact O-CG 3.29Å; V105-Q109 WeakPolarHBondContact O-CG 3.4Å; V105-Q109 PolarHBondContact O-N 3.12Å; Q107-Q109 PolarHBondContact O-N 3.13Å; Q109-V112 PolarHBondContact O-N 2.98Å; Q109-S113 WeakPolarHBondContact O-CB 3.31Å; Q109-S113 PolarHBondContact O-N 3.23Å; Q109-S113 PolarHBondContact O-OG 3.03Å; Q109-V128 HydrophobicContact CG-CB 3.69Å; Q109-V128 HydrophobicContact CG-CG1 3.73Å; Q109-V128 HydrophobicContact CG-CG2 4.06Å
110	S	97.9	Very high	96.9	Very high	69 Å²	69	52.2 Å²	52.2	48%	0.483	33%	0.329	S	S	.	.	H	α-helix	trans	-60.7	-48.1	176.8	-173.8	0	0	0	0	111	P106 Q107 S113 A114	P106-S110 WeakPolarHBondContact O-CB 3.41Å; P106-S110 PolarHBondContact O-N 3.45Å; Q107-S110 WeakPolarHBondContact O-CB 3.36Å; Q107-S110 PolarHBondContact O-N 3.47Å; S110-S113 PolarHBondContact O-N 3.45Å; S110-A114 WeakPolarHBondContact O-CB 3.46Å; S110-A114 PolarHBondContact O-N 2.89Å
111	N	98.6	Very high	96.7	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-65.7	-41.4	179.1	-76.1	-28.1	0	0	0	112.6	I38 S39 T82 I87 Q107 L108 S113 A114 N115	I38-N111 HydrophobicContact CD1-CB 4.49Å; S39-N111 PolarHBondContact N-OD1 3.32Å; S39-N111 PolarHBondContact O-ND2 3.46Å; S39-N111 PolarHBondContact O-OD1 2.91Å; T82-N111 VanDerWaalsContact O-CB 3.26Å; T82-N111 WeakPolarHBondContact O-CB 3.34Å; T82-N111 PolarHBondContact O-ND2 2.94Å; I87-N111 HydrophobicContact CD1-CB 3.92Å; Q107-N111 PolarHBondContact O-N 2.77Å; L108-N111 PolarHBondContact O-N 3.01Å; N111-S113 VanDerWaalsContact C-N 3.32Å; N111-S113 PolarHBondContact O-N 2.67Å; N111-A114 PolarHBondContact O-N 3.34Å; N111-N115 WeakPolarHBondContact O-CB 3.34Å; N111-N115 PolarHBondContact O-N 2.89Å; N111-N115 VanDerWaalsContact O-N 3.14Å; N111-N115 PolarHBondContact O-ND2 3.07Å
112	V	98.5	Very high	96.6	Very high	9 Å²	9	53.5 Å²	53.5	6%	0.055	34%	0.338	C	S	.	.	H	α-helix	trans	-58.6	-46.6	173.9	168.6	0	0	0	0	110.5	I87 L98 L108 Q109 N115 M116 W121 P126 V128	I87-V112 HydrophobicContact CD1-CG2 4.14Å; I87-V112 HydrophobicContact CG1-CG2 3.84Å; L98-V112 HydrophobicContact CD1-CG2 4.02Å; L98-V112 HydrophobicContact CD2-CG2 4.25Å; L108-V112 VanDerWaalsContact O-CG2 3.32Å; L108-V112 WeakPolarHBondContact O-CG2 3.31Å; L108-V112 PolarHBondContact O-N 2.71Å; Q109-V112 PolarHBondContact O-N 2.98Å; V112-N115 CarbonylContact O-C 3.57Å; V112-N115 PolarHBondContact O-N 3.47Å; V112-M116 PolarHBondContact O-N 2.86Å; V112-W121 HydrophobicContact CG1-CZ2 4.07Å; V112-W121 WeakPolarHBondContact O-CZ2 3.25Å; V112-P126 HydrophobicContact CG1-CB 4.01Å; V112-P126 HydrophobicContact CG1-CG 4.19Å; V112-V128 HydrophobicContact CB-CG2 4.34Å; V112-V128 HydrophobicContact CG2-CG2 3.81Å
113	S	97.8	Very high	96.5	Very high	88 Å²	88	51.8 Å²	51.8	62%	0.615	33%	0.328	S	S	*	.	H	α-helix	trans	-64.5	-44.1	-179.1	-57	0	0	0	0	112.2	Q109 S110 N111 N115 M116	Q109-S113 WeakPolarHBondContact O-CB 3.31Å; Q109-S113 PolarHBondContact O-N 3.23Å; Q109-S113 PolarHBondContact O-OG 3.03Å; S110-S113 PolarHBondContact O-N 3.45Å; N111-S113 VanDerWaalsContact C-N 3.32Å; N111-S113 PolarHBondContact O-N 2.67Å; S113-N115 PolarHBondContact O-N 2.81Å; S113-M116 PolarHBondContact O-N 2.82Å
114	A	97.1	Very high	96.4	Very high	66 Å²	66	51 Å²	51	55%	0.545	33%	0.327	S	S	.	.	H	α-helix	trans	-64.7	-23.3	178.8	0	0	0	0	0	113.1	S110 N111	S110-A114 WeakPolarHBondContact O-CB 3.46Å; S110-A114 PolarHBondContact O-N 2.89Å; N111-A114 PolarHBondContact O-N 3.34Å
115	N	97.6	Very high	96.4	Very high	4 Å²	4	54 Å²	54	2%	0.021	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	25	-180	-69.7	-78.7	0	0	0	113.1	L36 K37 I87 R91 N111 V112 S113 W121	L36-N115 VanDerWaalsContact CA-OD1 3.27Å; L36-N115 WeakPolarHBondContact CA-OD1 3.43Å; L36-N115 HydrophobicContact CD2-CB 4.49Å; K37-N115 PolarHBondContact N-OD1 3.02Å; K37-N115 PolarHBondContact O-ND2 3.11Å; I87-N115 HydrophobicContact CG2-CB 3.48Å; I87-N115 VanDerWaalsContact CG2-CB 3.48Å; R91-N115 PolarHBondContact NE-O 2.8Å; R91-N115 VanDerWaalsContact NH2-C 3.27Å; R91-N115 PolarHBondContact NH2-O 3.31Å; N111-N115 WeakPolarHBondContact O-CB 3.34Å; N111-N115 PolarHBondContact O-N 2.89Å; N111-N115 VanDerWaalsContact O-N 3.14Å; N111-N115 PolarHBondContact O-ND2 3.07Å; V112-N115 CarbonylContact O-C 3.57Å; V112-N115 PolarHBondContact O-N 3.47Å; S113-N115 PolarHBondContact O-N 2.81Å; N115-W121 VanDerWaalsContact O-CH2 3.27Å; N115-W121 WeakPolarHBondContact O-CH2 3.43Å
116	M	96.5	Very high	96.5	Very high	109 Å²	109	53.8 Å²	53.8	54%	0.537	35%	0.351	S	S	.	.			trans	-71.1	128	168	-176	174.2	176	0	0	110.9	V112 S113 W121	V112-M116 PolarHBondContact O-N 2.86Å; S113-M116 PolarHBondContact O-N 2.82Å; M116-W121 HydrophobicContact CB-CZ2 4.22Å
117	P	94.1	Very high	96.5	Very high	15 Å²	15	52.5 Å²	52.5	10%	0.097	34%	0.344	C	S	.	.			trans	-62.3	150	172.2	-13.7	23.2	0	0	0	111.5	S119 G120	P117-S119 PolarHBondContact O-N 2.86Å; P117-G120 WeakPolarHBondContact CB-O 3.28Å; P117-G120 WeakPolarHBondContact CG-O 3.37Å; P117-G120 WeakPolarHBondContact O-CA 3.47Å; P117-G120 PolarHBondContact O-N 3.46Å
118	S	93.1	Very high	96.6	Very high	140 Å²	140	53 Å²	53	98%	0.979	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.3	173.3	55	0	0	0	0	113.4	G120	S118-G120 VanDerWaalsContact C-N 3.26Å; S118-G120 PolarHBondContact O-N 3.28Å
119	S	93.9	Very high	96.7	Very high	110 Å²	110	56.8 Å²	56.8	77%	0.769	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	0	173.7	57.9	0	0	0	0	114.2	P117	P117-S119 PolarHBondContact O-N 2.86Å
120	G	95.4	Very high	96.7	Very high	18 Å²	18	55.2 Å²	55.2	19%	0.186	37%	0.365	C	S	.	.			trans	79.4	170.5	-166	0	0	0	0	0	112.9	P117 S118	P117-G120 WeakPolarHBondContact CB-O 3.28Å; P117-G120 WeakPolarHBondContact CG-O 3.37Å; P117-G120 WeakPolarHBondContact O-CA 3.47Å; P117-G120 PolarHBondContact O-N 3.46Å; S118-G120 VanDerWaalsContact C-N 3.26Å; S118-G120 PolarHBondContact O-N 3.28Å
121	W	96.1	Very high	96.7	Very high	36 Å²	36	52 Å²	52	14%	0.136	34%	0.343	C	S	.	.			trans	-62.9	139.3	178	-66.5	104.2	0	0	0	111	I87 A90 R91 V112 N115 M116 S123 A125 P126	I87-W121 HydrophobicContact CG2-CH2 4.26Å; A90-W121 HydrophobicContact CB-CE3 3.89Å; A90-W121 HydrophobicContact CB-CZ3 3.69Å; R91-W121 HydrophobicContact CG-CZ3 4.11Å; V112-W121 HydrophobicContact CG1-CZ2 4.07Å; V112-W121 WeakPolarHBondContact O-CZ2 3.25Å; N115-W121 VanDerWaalsContact O-CH2 3.27Å; N115-W121 WeakPolarHBondContact O-CH2 3.43Å; M116-W121 HydrophobicContact CB-CZ2 4.22Å; W121-S123 PolarHBondContact O-N 3.16Å; W121-A125 VanDerWaalsContact CD1-CA 3.46Å; W121-A125 HydrophobicContact CG-CB 4.37Å; W121-P126 VanDerWaalsContact CD2-CD 3.46Å; W121-P126 HydrophobicContact CD2-CG 4.13Å; W121-P126 HydrophobicContact CE3-CG 4.13Å; W121-P126 HydrophobicContact CH2-CG 3.95Å; W121-P126 HydrophobicContact CZ2-CG 3.94Å; W121-P126 HydrophobicContact CZ3-CG 4.04Å
122	P	94.8	Very high	96.7	Very high	83 Å²	83	53.9 Å²	53.9	54%	0.539	36%	0.356	S	S	.	.	S	Bend	trans	-66.2	-17.5	179.9	-20.4	31.8	0	0	0	114.5
123	S	94.4	Very high	96.7	Very high	50 Å²	50	55.2 Å²	55.2	35%	0.35	36%	0.36	S	S	.	.	S	Bend	trans	-128.2	-139.2	174.7	-172.5	0	0	0	0	108.2	G93 W121	G93-S123 WeakPolarHBondContact O-CB 3.35Å; W121-S123 PolarHBondContact O-N 3.16Å
124	V	94.9	Very high	96.7	Very high	73 Å²	73	51.8 Å²	51.8	44%	0.442	34%	0.338	S	S	.	.	S	Bend	trans	-74.7	154.6	169.2	-62.4	0	0	0	0	111.6	D95	D95-V124 HydrophobicContact CB-CG2 3.7Å; D95-V124 WeakPolarHBondContact OD1-CG2 3.46Å
125	A	97.1	Very high	96.7	Very high	62 Å²	62	54.7 Å²	54.7	51%	0.512	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-64.4	136.4	173	0	0	0	0	0	110.3	W121 S127	W121-A125 VanDerWaalsContact CD1-CA 3.46Å; W121-A125 HydrophobicContact CG-CB 4.37Å; A125-S127 PolarHBondContact O-N 3.26Å
126	P	98.4	Very high	96.8	Very high	14 Å²	14	57.3 Å²	57.3	9%	0.091	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-60.9	136.3	-179.7	-24.1	34.6	0	0	0	112	A90 V96 L98 V112 W121	A90-P126 HydrophobicContact CB-CB 4.5Å; A90-P126 HydrophobicContact CB-CG 3.44Å; A90-P126 VanDerWaalsContact CB-CG 3.44Å; V96-P126 HydrophobicContact CB-CB 4.43Å; V96-P126 WeakPolarHBondContact O-CA 3.13Å; L98-P126 HydrophobicContact CD1-CB 3.54Å; V112-P126 HydrophobicContact CG1-CB 4.01Å; V112-P126 HydrophobicContact CG1-CG 4.19Å; W121-P126 VanDerWaalsContact CD2-CD 3.46Å; W121-P126 HydrophobicContact CD2-CG 4.13Å; W121-P126 HydrophobicContact CE3-CG 4.13Å; W121-P126 HydrophobicContact CH2-CG 3.95Å; W121-P126 HydrophobicContact CZ2-CG 3.94Å; W121-P126 HydrophobicContact CZ3-CG 4.04Å
127	S	98.4	Very high	96.8	Very high	55 Å²	55	52.4 Å²	52.4	39%	0.385	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	139.5	173	-65.7	0	0	0	0	110	V96 T97 L98 A125	V96-S127 PolarHBondContact O-N 3.47Å; T97-S127 CarbonylContact C-O 3.57Å; T97-S127 WeakPolarHBondContact CA-O 3.27Å; L98-S127 PolarHBondContact N-O 3.13Å; A125-S127 PolarHBondContact O-N 3.26Å
128	V	98.8	Very high	96.9	Very high	21 Å²	21	57.7 Å²	57.7	13%	0.127	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	117.2	173.9	-175.8	0	0	0	0	109	L98 V105 L108 Q109 V112	L98-V128 WeakPolarHBondContact O-CA 3.37Å; V105-V128 HydrophobicContact CG1-CG1 4.11Å; L108-V128 HydrophobicContact CB-CG1 4.01Å; L108-V128 HydrophobicContact CD2-CG1 3.57Å; L108-V128 HydrophobicContact CG-CG1 3.63Å; L108-V128 HydrophobicContact CG-CG2 4.27Å; Q109-V128 HydrophobicContact CG-CB 3.69Å; Q109-V128 HydrophobicContact CG-CG1 3.73Å; Q109-V128 HydrophobicContact CG-CG2 4.06Å; V112-V128 HydrophobicContact CB-CG2 4.34Å; V112-V128 HydrophobicContact CG2-CG2 3.81Å
129	L	98.5	Very high	97.1	Very high	78 Å²	78	57.5 Å²	57.5	41%	0.408	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	144.3	-174	-65.9	173.8	0	0	0	111.2	T97 L98 T99 F140	T97-L129 HydrophobicContact CG2-CD1 4.12Å; L98-L129 PolarHBondContact O-N 3.29Å; L98-L129 VanDerWaalsContact O-N 3.07Å; T99-L129 VanDerWaalsContact CA-O 3.25Å; T99-L129 WeakPolarHBondContact CA-O 3.34Å; T99-L129 WeakPolarHBondContact CB-O 3.46Å; L129-F140 HydrophobicContact CB-CE1 4.02Å; L129-F140 HydrophobicContact CB-CZ 4.02Å; L129-F140 HydrophobicContact CD1-CE1 3.83Å; L129-F140 HydrophobicContact CD1-CZ 4.44Å
130	P	98.4	Very high	97.2	Very high	59 Å²	59	52.8 Å²	52.8	38%	0.383	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	140	172.8	29.9	-33.9	0	0	0	110.7	D100 P102 V105	D100-P130 CarbonylContact O-C 3.53Å; D100-P130 VanDerWaalsContact O-CA 3.28Å; D100-P130 WeakPolarHBondContact O-CA 3.35Å; P102-P130 HydrophobicContact CG-CB 4.05Å; V105-P130 HydrophobicContact CG2-CB 4.24Å
131	L	98.6	Very high	97.2	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	31%	0.314	C	S	.	.			trans	-148.2	110.2	171.7	-167.1	167.5	0	0	0	109.6	I76 L78 T99 D100 D136 F140 T165	I76-L131 HydrophobicContact CD1-CD1 4.07Å; L78-L131 HydrophobicContact CD2-CD1 3.81Å; L78-L131 HydrophobicContact CD2-CD2 4.13Å; T99-L131 HydrophobicContact CG2-CB 4.05Å; T99-L131 HydrophobicContact CG2-CD1 4.07Å; D100-L131 PolarHBondContact O-N 3.25Å; L131-D136 HydrophobicContact CG-CB 4.29Å; L131-F140 HydrophobicContact CB-CE2 3.88Å; L131-F140 HydrophobicContact CB-CZ 3.95Å; L131-F140 HydrophobicContact CD1-CD1 4.5Å; L131-F140 HydrophobicContact CD1-CD2 3.65Å; L131-F140 HydrophobicContact CD1-CE1 4.34Å; L131-F140 HydrophobicContact CD1-CE2 3.47Å; L131-F140 VanDerWaalsContact CD1-CE2 3.47Å; L131-F140 HydrophobicContact CD1-CG 4.18Å; L131-F140 HydrophobicContact CD1-CZ 3.84Å; L131-F140 HydrophobicContact CG-CD2 4.13Å; L131-F140 HydrophobicContact CG-CE2 3.6Å; L131-F140 HydrophobicContact CG-CZ 4.11Å; L131-T165 HydrophobicContact CD2-CG2 4.11Å
132	S	98.4	Very high	97	Very high	40 Å²	40	56.9 Å²	56.9	28%	0.28	33%	0.327	S	S	.	.			trans	-89	122.6	166.1	-172.5	0	0	0	0	110.3	Q135 D136	S132-Q135 PolarHBondContact O-N 3.31Å; S132-Q135 VanDerWaalsContact O-N 3.17Å; S132-D136 VanDerWaalsContact CB-OD2 3.27Å; S132-D136 WeakPolarHBondContact CB-OD2 3.25Å; S132-D136 PolarHBondContact N-OD2 3Å; S132-D136 PolarHBondContact O-N 3.26Å
133	W	98.5	Very high	97	Very high	36 Å²	36	56.4 Å²	56.4	14%	0.136	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	140.8	-176.7	-55.3	-29.1	0	0	0	111.9	Q135 I152 L161 L162 T165	W133-Q135 PolarHBondContact O-N 3.35Å; W133-I152 HydrophobicContact CH2-CB 3.67Å; W133-I152 HydrophobicContact CH2-CD1 4.47Å; W133-I152 HydrophobicContact CH2-CG2 4.25Å; W133-I152 HydrophobicContact CZ2-CB 3.96Å; W133-I152 HydrophobicContact CZ2-CD1 4.18Å; W133-I152 HydrophobicContact CZ2-CG2 4.16Å; W133-L161 HydrophobicContact CB-CB 4.1Å; W133-L162 HydrophobicContact CD2-CB 4.34Å; W133-L162 HydrophobicContact CD2-CD1 3.99Å; W133-L162 HydrophobicContact CE3-CB 3.96Å; W133-L162 HydrophobicContact CE3-CD1 4.24Å; W133-L162 HydrophobicContact CG-CD1 4.4Å; W133-L162 HydrophobicContact CZ2-CD1 4.4Å; W133-L162 HydrophobicContact CZ3-CB 4.5Å; W133-T165 WeakPolarHBondContact CA-OG1 3.37Å
134	G	98.1	Very high	97.1	Very high	16 Å²	16	54.4 Å²	54.4	17%	0.165	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	-8.1	-178.1	0	0	0	0	0	114.1	Q137 L161 T165	G134-Q137 PolarHBondContact O-NE2 3.5Å; G134-Q137 VanDerWaalsContact O-NE2 3.13Å; G134-L161 PolarHBondContact N-O 3.14Å; G134-T165 PolarHBondContact N-OG1 3Å
135	Q	97.6	Very high	97.3	Very high	128 Å²	128	54.3 Å²	54.3	60%	0.598	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-57.5	179.2	-57	-59.5	-48.7	0	0	111.9	S132 W133	S132-Q135 PolarHBondContact O-N 3.31Å; S132-Q135 VanDerWaalsContact O-N 3.17Å; W133-Q135 PolarHBondContact O-N 3.35Å
136	D	97.9	Very high	97.3	Very high	58 Å²	58	52 Å²	52	31%	0.31	28%	0.281	S	S	.	.	S	Bend	trans	-94.4	-10.1	-164.4	-62	-37.5	0	0	0	113.4	L131 S132 H138 I139 F140	L131-D136 HydrophobicContact CG-CB 4.29Å; S132-D136 VanDerWaalsContact CB-OD2 3.27Å; S132-D136 WeakPolarHBondContact CB-OD2 3.25Å; S132-D136 PolarHBondContact N-OD2 3Å; S132-D136 PolarHBondContact O-N 3.26Å; D136-H138 PolarHBondContact O-N 3.12Å; D136-I139 WeakPolarHBondContact O-CG1 3.42Å; D136-I139 PolarHBondContact O-N 2.64Å; D136-I139 VanDerWaalsContact O-N 3.1Å; D136-F140 WeakPolarHBondContact O-CD2 3.43Å
137	Q	97.1	Very high	97.3	Very high	7 Å²	7	51.3 Å²	51.3	3%	0.033	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-52	-29.3	-173.9	62.4	-78.3	-13.1	0	0	114.1	G134 I139 F140 T165 H168	G134-Q137 PolarHBondContact O-NE2 3.5Å; G134-Q137 VanDerWaalsContact O-NE2 3.13Å; Q137-I139 VanDerWaalsContact C-N 3.31Å; Q137-I139 PolarHBondContact O-N 2.83Å; Q137-F140 PolarHBondContact O-N 2.97Å; Q137-F140 VanDerWaalsContact O-N 3.17Å; Q137-T165 HydrophobicContact CB-CG2 3.99Å; Q137-T165 PolarHBondContact OE1-OG1 3Å; Q137-H168 HydrophobicContact CB-CB 4.27Å; Q137-H168 HydrophobicContact CG-CB 3.89Å; Q137-H168 PolarHBondContact O-CD2 3.41Å; Q137-H168 PolarHBondContact O-NE2 3.49Å
138	H	96.7	Very high	97.4	Very high	125 Å²	125	48.7 Å²	48.7	58%	0.579	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-71.2	-18.2	-175.2	-59.6	-51.7	0	0	0	115	D136 F140 H168	D136-H138 PolarHBondContact O-N 3.12Å; H138-F140 VanDerWaalsContact C-N 3.29Å; H138-H168 AromaticContact ND1-CE1 3.69Å; H138-H168 AromaticContact ND1-ND1 3.44Å; H138-H168 PolarHBondContact ND1-ND1 3Å
139	I	96.8	Very high	97.3	Very high	136 Å²	136	47.7 Å²	47.7	70%	0.697	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-80.8	-15.3	174	74	172.9	0	0	0	112.2	D136 Q137	D136-I139 WeakPolarHBondContact O-CG1 3.42Å; D136-I139 PolarHBondContact O-N 2.64Å; D136-I139 VanDerWaalsContact O-N 3.1Å; Q137-I139 VanDerWaalsContact C-N 3.31Å; Q137-I139 PolarHBondContact O-N 2.83Å
140	F	97	Very high	97.3	Very high	11 Å²	11	44.5 Å²	44.5	5%	0.048	24%	0.237	C	C	.	.	S	Bend	trans	-89.4	143.9	179.1	-64.7	-93.6	0	0	0	110.2	I76 T97 T99 L129 L131 D136 Q137 H138 H168 L169	I76-F140 HydrophobicContact CD1-CB 4.44Å; I76-F140 HydrophobicContact CD1-CD1 3.75Å; I76-F140 HydrophobicContact CD1-CE1 4.26Å; I76-F140 HydrophobicContact CD1-CG 4.15Å; T97-F140 HydrophobicContact CG2-CD1 4.46Å; T97-F140 HydrophobicContact CG2-CE1 4.07Å; T99-F140 HydrophobicContact CG2-CE1 3.87Å; T99-F140 HydrophobicContact CG2-CZ 4.07Å; L129-F140 HydrophobicContact CB-CE1 4.02Å; L129-F140 HydrophobicContact CB-CZ 4.02Å; L129-F140 HydrophobicContact CD1-CE1 3.83Å; L129-F140 HydrophobicContact CD1-CZ 4.44Å; L131-F140 HydrophobicContact CB-CE2 3.88Å; L131-F140 HydrophobicContact CB-CZ 3.95Å; L131-F140 HydrophobicContact CD1-CD1 4.5Å; L131-F140 HydrophobicContact CD1-CD2 3.65Å; L131-F140 HydrophobicContact CD1-CE1 4.34Å; L131-F140 HydrophobicContact CD1-CE2 3.47Å; L131-F140 VanDerWaalsContact CD1-CE2 3.47Å; L131-F140 HydrophobicContact CD1-CG 4.18Å; L131-F140 HydrophobicContact CD1-CZ 3.84Å; L131-F140 HydrophobicContact CG-CD2 4.13Å; L131-F140 HydrophobicContact CG-CE2 3.6Å; L131-F140 HydrophobicContact CG-CZ 4.11Å; D136-F140 WeakPolarHBondContact O-CD2 3.43Å; Q137-F140 PolarHBondContact O-N 2.97Å; Q137-F140 VanDerWaalsContact O-N 3.17Å; H138-F140 VanDerWaalsContact C-N 3.29Å; F140-H168 PolarHBondContact O-NE2 2.81Å; F140-L169 HydrophobicContact CB-CD2 3.98Å
141	P	94.8	Very high	97.3	Very high	56 Å²	56	42.3 Å²	42.3	36%	0.364	22%	0.222	S	C	.	.			trans	-66.4	171.2	177.1	33.5	-39.1	0	0	0	110.9	R74 D143 W144	R74-P141 VanDerWaalsContact NH2-CG 3.3Å; P141-D143 VanDerWaalsContact CB-OD1 3.31Å; P141-D143 WeakPolarHBondContact CB-OD1 3.32Å; P141-W144 HydrophobicContact CG-CH2 4.33Å; P141-W144 HydrophobicContact CG-CZ2 3.66Å; P141-W144 PolarHBondContact O-NE1 2.69Å
142	M	92.1	Very high	97.3	Very high	85 Å²	85	42.4 Å²	42.4	42%	0.419	22%	0.223	S	C	.	.	S	Bend	trans	-112.5	-0.1	-172.6	-63.7	174.5	-70.6	0	0	113.2	W144 K171 D172	M142-W144 VanDerWaalsContact C-N 3.34Å; M142-W144 PolarHBondContact O-N 2.9Å; M142-K171 HydrophobicContact CB-CB 4.29Å; M142-K171 HydrophobicContact CG-CD 4.22Å; M142-K171 HydrophobicContact SD-CB 4.3Å; M142-K171 HydrophobicContact SD-CD 3.33Å; M142-K171 WeakPolarHBondContact SD-CD 3.42Å; M142-K171 HydrophobicContact SD-CG 4.45Å; M142-D172 VanDerWaalsContact O-CB 3.3Å; M142-D172 WeakPolarHBondContact O-CB 3.23Å
143	D	93.9	Very high	97.2	Very high	73 Å²	73	40.5 Å²	40.5	39%	0.39	21%	0.209	S	C	.	.			trans	-98.1	49.3	-173.5	58.7	-10.4	0	0	0	111.5	R74 P141	R74-D143 IonicContact CZ-OD1 2.73Å; R74-D143 IonicContact CZ-OD2 2.95Å; R74-D143 IonicContact NH1-OD1 2.84Å; R74-D143 PolarHBondContact NH1-OD1 2.69Å; R74-D143 IonicContact NH1-OD2 3.19Å; R74-D143 PolarHBondContact NH1-OD2 2.99Å; R74-D143 IonicContact NH2-OD1 3.25Å; R74-D143 PolarHBondContact NH2-OD1 2.97Å; P141-D143 VanDerWaalsContact CB-OD1 3.31Å; P141-D143 WeakPolarHBondContact CB-OD1 3.32Å
144	W	97.7	Very high	97.1	Very high	8 Å²	8	42.2 Å²	42.2	3%	0.03	22%	0.216	C	C	.	.			trans	-86.4	141.4	174	-57.8	104.8	0	0	0	110.5	R74 I75 I76 T97 P141 M142 A174	R74-W144 HydrophobicContact CB-CE3 3.99Å; R74-W144 HydrophobicContact CB-CZ3 4.39Å; I75-W144 WeakPolarHBondContact O-CZ3 3.47Å; I76-W144 HydrophobicContact CB-CD2 3.8Å; I76-W144 HydrophobicContact CB-CE3 3.89Å; I76-W144 HydrophobicContact CB-CG 4.43Å; I76-W144 HydrophobicContact CB-CH2 4.05Å; I76-W144 HydrophobicContact CB-CZ2 3.95Å; I76-W144 HydrophobicContact CB-CZ3 4.02Å; I76-W144 HydrophobicContact CD1-CZ2 3.88Å; I76-W144 HydrophobicContact CG1-CZ2 4.37Å; I76-W144 HydrophobicContact CG2-CB 4.42Å; I76-W144 HydrophobicContact CG2-CD2 3.63Å; I76-W144 HydrophobicContact CG2-CE3 4.14Å; I76-W144 HydrophobicContact CG2-CG 3.74Å; I76-W144 HydrophobicContact CG2-CZ2 4.42Å; T97-W144 HydrophobicContact CG2-CH2 4.49Å; T97-W144 WeakPolarHBondContact OG1-CH2 3.43Å; P141-W144 HydrophobicContact CG-CH2 4.33Å; P141-W144 HydrophobicContact CG-CZ2 3.66Å; P141-W144 PolarHBondContact O-NE1 2.69Å; M142-W144 VanDerWaalsContact C-N 3.34Å; M142-W144 PolarHBondContact O-N 2.9Å; W144-A174 HydrophobicContact CB-CB 4.16Å; W144-A174 WeakPolarHBondContact O-CA 3.37Å; W144-A174 WeakPolarHBondContact O-CB 3.43Å
145	D	97.6	Very high	97	Very high	70 Å²	70	45 Å²	45	37%	0.374	23%	0.227	S	C	.	.	S	Bend	trans	-79.6	-41.4	167.9	-68.4	-71.7	0	0	0	110.6	K73 R74 A174 V175	K73-D145 VanDerWaalsContact CA-OD2 3.3Å; K73-D145 WeakPolarHBondContact CA-OD2 3.43Å; K73-D145 HydrophobicContact CB-CB 4.03Å; K73-D145 HydrophobicContact CD-CB 4.35Å; K73-D145 HydrophobicContact CG-CB 4.27Å; R74-D145 PolarHBondContact N-OD2 3.22Å; R74-D145 WeakPolarHBondContact O-CB 3.34Å; R74-D145 PolarHBondContact O-N 3.04Å; D145-A174 WeakPolarHBondContact O-CA 3.27Å; D145-V175 PolarHBondContact O-N 2.95Å
146	L	98.4	Very high	96.9	Very high	13 Å²	13	41.8 Å²	41.8	7%	0.068	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	143.4	-177.6	-57.7	173.8	0	0	0	112.3	L70 K73 R74 I75 I76 L148 V175 Y177	L70-L146 HydrophobicContact CD2-CD1 3.61Å; K73-L146 HydrophobicContact CD-CD1 3.86Å; K73-L146 HydrophobicContact CD-CG 4.24Å; R74-L146 PolarHBondContact O-N 3.43Å; I75-L146 WeakPolarHBondContact CA-O 3.46Å; I75-L146 HydrophobicContact CD1-CB 4.46Å; I75-L146 HydrophobicContact CD1-CD1 3.86Å; I75-L146 HydrophobicContact CG1-CB 4.08Å; I75-L146 HydrophobicContact CG1-CD1 4.26Å; I75-L146 HydrophobicContact CG2-CB 4.38Å; I76-L146 PolarHBondContact N-O 3.36Å; I76-L146 VanDerWaalsContact N-O 3.11Å; L146-L148 HydrophobicContact CB-CD2 4.33Å; L146-V175 VanDerWaalsContact CA-O 3.27Å; L146-V175 WeakPolarHBondContact CA-O 3.41Å; L146-V175 HydrophobicContact CD2-CB 3.87Å; L146-Y177 HydrophobicContact CD2-CD2 4.19Å; L146-Y177 HydrophobicContact CD2-CE2 4.07Å
147	V	98.7	Very high	96.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	126.1	165.8	-176.8	0	0	0	0	108.2	I76 L78 L166 L169 A174 V175 V176 Y177	I76-V147 HydrophobicContact CG2-CB 4.32Å; I76-V147 HydrophobicContact CG2-CG1 4.19Å; I76-V147 HydrophobicContact CG2-CG2 3.83Å; I76-V147 CarbonylContact O-C 3.56Å; I76-V147 WeakPolarHBondContact O-CA 3.46Å; L78-V147 HydrophobicContact CD1-CG1 3.87Å; L78-V147 HydrophobicContact CG-CG1 4.1Å; V147-L166 HydrophobicContact CG1-CD2 3.74Å; V147-L169 HydrophobicContact CG1-CD1 4.35Å; V147-L169 HydrophobicContact CG2-CB 3.89Å; V147-A174 HydrophobicContact CG2-CB 4.2Å; V147-V175 PolarHBondContact N-O 3.39Å; V147-V176 HydrophobicContact CB-CG1 4.29Å; V147-V176 HydrophobicContact CB-CG2 4.28Å; V147-V176 HydrophobicContact CG1-CG1 4.45Å; V147-V176 CarbonylContact O-C 3.48Å; V147-V176 VanDerWaalsContact O-CA 3.24Å; V147-V176 WeakPolarHBondContact O-CA 3.28Å; V147-Y177 PolarHBondContact O-N 3.43Å
148	L	98.9	Very high	96.9	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	148.4	-177.1	-54.1	-175	0	0	0	111.1	F63 I75 I76 E77 L78 V85 L146 Y177	F63-L148 HydrophobicContact CE2-CD1 3.95Å; F63-L148 HydrophobicContact CE2-CD2 4.32Å; F63-L148 HydrophobicContact CZ-CD1 4.21Å; F63-L148 HydrophobicContact CZ-CD2 3.72Å; I75-L148 HydrophobicContact CG2-CD1 3.52Å; I75-L148 HydrophobicContact CG2-CG 3.61Å; I76-L148 PolarHBondContact O-N 2.99Å; E77-L148 WeakPolarHBondContact CA-O 3.32Å; E77-L148 HydrophobicContact CB-CB 4.29Å; E77-L148 HydrophobicContact CG-CB 4.22Å; L78-L148 PolarHBondContact N-O 3.43Å; V85-L148 HydrophobicContact CG1-CD1 3.96Å; L146-L148 HydrophobicContact CB-CD2 4.33Å; L148-Y177 WeakPolarHBondContact CA-O 3.35Å
149	G	98.6	Very high	96.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	135.6	169.3	0	0	0	0	0	111.6	Y177 L178 S179	G149-Y177 PolarHBondContact N-O 3.34Å; G149-L178 VanDerWaalsContact O-CA 3.31Å; G149-L178 WeakPolarHBondContact O-CA 3.29Å; G149-S179 PolarHBondContact O-N 3.26Å
150	A	98.6	Very high	97	Very high	11 Å²	11	38.8 Å²	38.8	9%	0.091	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	122.9	-179.7	0	0	0	0	0	111.4	A56 L59 V85 I152 S179	A56-A150 HydrophobicContact CB-CB 3.77Å; L59-A150 HydrophobicContact CD2-CB 4.36Å; V85-A150 HydrophobicContact CG2-CB 4.11Å; A150-I152 PolarHBondContact O-N 3.15Å; A150-S179 WeakPolarHBondContact CA-O 3.41Å
151	D	97	Very high	97.1	Very high	12 Å²	12	41.4 Å²	41.4	6%	0.064	22%	0.222	C	C	.	.	S	Bend	trans	53	30	-173.1	-129.8	32.7	0	0	0	115.2	W53 A55 Y154 S179 K181 R183	W53-D151 HydrophobicContact CB-CB 3.86Å; W53-D151 HydrophobicContact CG-CB 4.14Å; A55-D151 HydrophobicContact CB-CB 3.87Å; D151-Y154 WeakPolarHBondContact O-CD1 3.44Å; D151-S179 PolarHBondContact N-O 2.78Å; D151-K181 PolarHBondContact OD1-N 2.89Å; D151-K181 VanDerWaalsContact OD1-N 3.1Å; D151-R183 IonicContact OD1-NH1 2.72Å; D151-R183 PolarHBondContact OD1-NH1 2.94Å; D151-R183 IonicContact OD2-CZ 3.46Å; D151-R183 IonicContact OD2-NH1 3.35Å; D151-R183 PolarHBondContact OD2-NH1 3.35Å; D151-R183 IonicContact OD2-NH2 2.94Å; D151-R183 PolarHBondContact OD2-NH2 3.49Å
152	I	98.2	Very high	97.2	Very high	5 Å²	5	38.7 Å²	38.7	3%	0.026	21%	0.205	C	C	.	.			trans	-87	-6.6	-179.7	64.1	166.6	0	0	0	114.3	L78 W133 A150 L162 L178	L78-I152 HydrophobicContact CB-CD1 4.18Å; L78-I152 WeakPolarHBondContact O-CG2 3.33Å; W133-I152 HydrophobicContact CH2-CB 3.67Å; W133-I152 HydrophobicContact CH2-CD1 4.47Å; W133-I152 HydrophobicContact CH2-CG2 4.25Å; W133-I152 HydrophobicContact CZ2-CB 3.96Å; W133-I152 HydrophobicContact CZ2-CD1 4.18Å; W133-I152 HydrophobicContact CZ2-CG2 4.16Å; A150-I152 PolarHBondContact O-N 3.15Å; I152-L162 HydrophobicContact CD1-CD1 3.85Å; I152-L162 HydrophobicContact CD1-CD2 4.03Å; I152-L162 HydrophobicContact CG1-CD2 4.31Å; I152-L178 HydrophobicContact CD1-CD2 3.9Å; I152-L178 HydrophobicContact CG1-CD2 4.3Å
153	V	98.1	Very high	97.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.188	C	C	.	.			trans	-99.8	85.9	179.9	-177.8	0	0	0	0	108.1	Y159 L162 T188 F191 Y192	V153-Y159 HydrophobicContact CB-CE1 4.36Å; V153-Y159 HydrophobicContact CG1-CD1 4.47Å; V153-Y159 HydrophobicContact CG1-CE1 3.56Å; V153-Y159 WeakPolarHBondContact CG1-OH 3.2Å; V153-L162 HydrophobicContact CG2-CD2 4.19Å; V153-T188 HydrophobicContact CG1-CG2 4.18Å; V153-T188 WeakPolarHBondContact O-CG2 3.46Å; V153-F191 HydrophobicContact CB-CD1 4.36Å; V153-F191 HydrophobicContact CG1-CB 3.58Å; V153-F191 HydrophobicContact CG1-CD1 3.64Å; V153-F191 HydrophobicContact CG1-CD2 4.33Å; V153-F191 HydrophobicContact CG1-CE1 4.42Å; V153-F191 HydrophobicContact CG1-CG 3.58Å; V153-F191 HydrophobicContact CG2-CD1 3.69Å; V153-F191 HydrophobicContact CG2-CE1 3.68Å; V153-F191 HydrophobicContact CG2-CG 4.32Å; V153-F191 HydrophobicContact CG2-CZ 4.3Å; V153-Y192 HydrophobicContact CB-CE2 4.44Å; V153-Y192 HydrophobicContact CG1-CE2 4.31Å; V153-Y192 HydrophobicContact CG2-CE2 4.38Å
154	Y	96.2	Very high	97.7	Very high	71 Å²	71	35.7 Å²	35.7	28%	0.278	19%	0.191	S	C	.	.			trans	-147	-17.2	-179	70.2	-80.3	0	0	0	115.1	V48 D151 H186	V48-Y154 HydrophobicContact CG2-CE2 4.15Å; V48-Y154 WeakPolarHBondContact CG2-OH 3.14Å; D151-Y154 WeakPolarHBondContact O-CD1 3.44Å; Y154-H186 WeakPolarHBondContact O-CB 3.3Å
155	L	95.6	Very high	97.8	Very high	74 Å²	74	35.3 Å²	35.3	39%	0.387	19%	0.189	S	C	.	.			trans	-112.1	107.8	173.8	-64.4	173.1	0	0	0	109.4	E157 T158 Y159	L155-E157 PolarHBondContact O-N 2.81Å; L155-E157 VanDerWaalsContact O-N 3.16Å; L155-T158 HydrophobicContact CB-CG2 3.89Å; L155-T158 HydrophobicContact CD1-CG2 4.31Å; L155-T158 PolarHBondContact O-N 3Å; L155-T158 PolarHBondContact O-OG1 3.14Å; L155-Y159 VanDerWaalsContact O-CD1 3.29Å; L155-Y159 WeakPolarHBondContact O-CD1 3.43Å; L155-Y159 WeakPolarHBondContact O-CE1 3.31Å
156	S	95.1	Very high	97.8	Very high	61 Å²	61	32 Å²	32	43%	0.427	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-60.7	-29.3	-174	69	0	0	0	0	113.7	T158 Y159	S156-T158 PolarHBondContact O-N 2.85Å; S156-Y159 WeakPolarHBondContact O-CB 3.37Å; S156-Y159 PolarHBondContact O-N 3.25Å
157	E	96.8	Very high	97.8	Very high	141 Å²	141	32.2 Å²	32.2	66%	0.659	17%	0.173	S	C	*	.	G	3₁₀ helix	trans	-66	-25.1	178.4	-59.1	79.3	-176.9	0	0	112.1	L155	L155-E157 PolarHBondContact O-N 2.81Å; L155-E157 VanDerWaalsContact O-N 3.16Å
158	T	97.5	Very high	97.7	Very high	31 Å²	31	32.9 Å²	32.9	19%	0.19	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-91.9	-7.3	-179.7	72.3	0	0	0	0	112.8	L155 S156 L161 L162	L155-T158 HydrophobicContact CB-CG2 3.89Å; L155-T158 HydrophobicContact CD1-CG2 4.31Å; L155-T158 PolarHBondContact O-N 3Å; L155-T158 PolarHBondContact O-OG1 3.14Å; S156-T158 PolarHBondContact O-N 2.85Å; T158-L161 WeakPolarHBondContact O-CB 3.43Å; T158-L161 PolarHBondContact O-N 3.41Å; T158-L162 PolarHBondContact O-N 3.13Å
159	Y	98.1	Very high	97.6	Very high	15 Å²	15	32.8 Å²	32.8	6%	0.059	18%	0.176	C	C	.	.	H	α-helix	trans	-57.9	-43.6	-177.3	-66.8	-7.9	0	0	0	114.1	V153 L155 S156 L161 L162 L163 H186 F191	V153-Y159 HydrophobicContact CB-CE1 4.36Å; V153-Y159 HydrophobicContact CG1-CD1 4.47Å; V153-Y159 HydrophobicContact CG1-CE1 3.56Å; V153-Y159 WeakPolarHBondContact CG1-OH 3.2Å; L155-Y159 VanDerWaalsContact O-CD1 3.29Å; L155-Y159 WeakPolarHBondContact O-CD1 3.43Å; L155-Y159 WeakPolarHBondContact O-CE1 3.31Å; S156-Y159 WeakPolarHBondContact O-CB 3.37Å; S156-Y159 PolarHBondContact O-N 3.25Å; Y159-L161 VanDerWaalsContact C-N 3.32Å; Y159-L161 PolarHBondContact O-N 2.67Å; Y159-L162 PolarHBondContact O-N 3.46Å; Y159-L163 WeakPolarHBondContact O-CB 3.37Å; Y159-L163 PolarHBondContact O-N 2.92Å; Y159-H186 PolarHBondContact OH-O 2.75Å; Y159-F191 AromaticContact CD1-CD2 3.84Å; Y159-F191 HydrophobicContact CD1-CD2 3.84Å; Y159-F191 HydrophobicContact CD1-CE2 4.29Å; Y159-F191 HydrophobicContact CD2-CB 4.07Å; Y159-F191 AromaticContact CD2-CD2 3.8Å; Y159-F191 HydrophobicContact CD2-CD2 3.8Å; Y159-F191 HydrophobicContact CD2-CG 4.39Å; Y159-F191 HydrophobicContact CE1-CD2 4.3Å; Y159-F191 HydrophobicContact CE2-CB 3.8Å; Y159-F191 HydrophobicContact CE2-CD2 4.28Å; Y159-F191 HydrophobicContact CE2-CG 4.45Å; Y159-F191 AromaticContact CG-CD2 3.55Å; Y159-F191 HydrophobicContact CG-CD2 3.55Å; Y159-F191 HydrophobicContact CG-CE2 4.18Å; Y159-F191 HydrophobicContact CG-CG 4.44Å
160	P	98.2	Very high	97.5	Very high	76 Å²	76	32.8 Å²	32.8	49%	0.494	18%	0.176	S	C	.	.	H	α-helix	trans	-61.8	-40.2	174.5	-23.1	35.5	0	0	0	112.4	L163 D164	P160-L163 PolarHBondContact O-N 3.19Å; P160-D164 PolarHBondContact O-N 2.8Å
161	L	98.5	Very high	97.1	Very high	66 Å²	66	37.6 Å²	37.6	35%	0.346	20%	0.195	S	C	.	.	H	α-helix	trans	-67.2	-42.5	-179.8	-55.7	177.9	0	0	0	111.8	W133 G134 T158 Y159 T165	W133-L161 HydrophobicContact CB-CB 4.1Å; G134-L161 PolarHBondContact N-O 3.14Å; T158-L161 WeakPolarHBondContact O-CB 3.43Å; T158-L161 PolarHBondContact O-N 3.41Å; Y159-L161 VanDerWaalsContact C-N 3.32Å; Y159-L161 PolarHBondContact O-N 2.67Å; L161-T165 WeakPolarHBondContact O-CB 3.48Å; L161-T165 PolarHBondContact O-N 3.24Å; L161-T165 PolarHBondContact O-OG1 2.86Å
162	L	98.6	Very high	96.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63	-44.8	173.4	177.8	59	0	0	0	110.6	L78 W133 I152 V153 T158 Y159 D164 T165 L166 F191	L78-L162 HydrophobicContact CD1-CD1 3.95Å; W133-L162 HydrophobicContact CD2-CB 4.34Å; W133-L162 HydrophobicContact CD2-CD1 3.99Å; W133-L162 HydrophobicContact CE3-CB 3.96Å; W133-L162 HydrophobicContact CE3-CD1 4.24Å; W133-L162 HydrophobicContact CG-CD1 4.4Å; W133-L162 HydrophobicContact CZ2-CD1 4.4Å; W133-L162 HydrophobicContact CZ3-CB 4.5Å; I152-L162 HydrophobicContact CD1-CD1 3.85Å; I152-L162 HydrophobicContact CD1-CD2 4.03Å; I152-L162 HydrophobicContact CG1-CD2 4.31Å; V153-L162 HydrophobicContact CG2-CD2 4.19Å; T158-L162 PolarHBondContact O-N 3.13Å; Y159-L162 PolarHBondContact O-N 3.46Å; L162-D164 PolarHBondContact O-N 2.87Å; L162-T165 WeakPolarHBondContact O-CB 3.27Å; L162-T165 PolarHBondContact O-N 2.9Å; L162-L166 HydrophobicContact CD1-CD1 4.35Å; L162-L166 HydrophobicContact CD1-CG 4.18Å; L162-L166 HydrophobicContact CG-CD1 4.18Å; L162-L166 HydrophobicContact CG-CG 4.44Å; L162-L166 WeakPolarHBondContact O-CG 3.27Å; L162-L166 PolarHBondContact O-N 3.45Å; L162-F191 HydrophobicContact CD2-CE2 4.23Å; L162-F191 HydrophobicContact CD2-CZ 3.85Å; L162-F191 HydrophobicContact CG-CZ 4.38Å
163	L	98.3	Very high	96.2	Very high	13 Å²	13	52.5 Å²	52.5	7%	0.068	26%	0.258	C	S	.	.	H	α-helix	trans	-60.4	-45.5	178.6	-173.7	66.8	0	0	0	111.6	Y159 P160 T165 L166 V167 T195 L196 R199 F200	Y159-L163 WeakPolarHBondContact O-CB 3.37Å; Y159-L163 PolarHBondContact O-N 2.92Å; P160-L163 PolarHBondContact O-N 3.19Å; L163-T165 VanDerWaalsContact C-N 3.3Å; L163-T165 PolarHBondContact O-N 3.01Å; L163-L166 PolarHBondContact O-N 3.17Å; L163-V167 WeakPolarHBondContact O-CB 3.4Å; L163-V167 VanDerWaalsContact O-CG2 3.26Å; L163-V167 WeakPolarHBondContact O-CG2 3.36Å; L163-V167 PolarHBondContact O-N 3.32Å; L163-T195 HydrophobicContact CD2-CG2 4.05Å; L163-L196 HydrophobicContact CD1-CD1 4.05Å; L163-R199 HydrophobicContact CD1-CB 4.22Å; L163-R199 HydrophobicContact CD1-CG 4.24Å; L163-R199 HydrophobicContact CD2-CG 3.98Å; L163-R199 HydrophobicContact CG-CG 4.21Å; L163-F200 HydrophobicContact CD1-CD2 4.06Å; L163-F200 HydrophobicContact CD1-CE2 3.9Å
164	D	97.7	Very high	96.1	Very high	82 Å²	82	52.5 Å²	52.5	44%	0.439	26%	0.258	S	S	.	.	H	α-helix	trans	-62.9	-38.7	177	-77.8	-18.6	0	0	0	112	P160 L162 V167 H168	P160-D164 PolarHBondContact O-N 2.8Å; L162-D164 PolarHBondContact O-N 2.87Å; D164-V167 PolarHBondContact O-N 3.06Å; D164-H168 PolarHBondContact O-N 3.01Å
165	T	98.6	Very high	96.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-50.8	174.9	-58.4	0	0	0	0	111.3	L78 L131 W133 G134 Q137 L161 L162 L163 V167 H168 L169	L78-T165 HydrophobicContact CD1-CG2 3.98Å; L78-T165 HydrophobicContact CD2-CG2 4Å; L131-T165 HydrophobicContact CD2-CG2 4.11Å; W133-T165 WeakPolarHBondContact CA-OG1 3.37Å; G134-T165 PolarHBondContact N-OG1 3Å; Q137-T165 HydrophobicContact CB-CG2 3.99Å; Q137-T165 PolarHBondContact OE1-OG1 3Å; L161-T165 WeakPolarHBondContact O-CB 3.48Å; L161-T165 PolarHBondContact O-N 3.24Å; L161-T165 PolarHBondContact O-OG1 2.86Å; L162-T165 WeakPolarHBondContact O-CB 3.27Å; L162-T165 PolarHBondContact O-N 2.9Å; L163-T165 VanDerWaalsContact C-N 3.3Å; L163-T165 PolarHBondContact O-N 3.01Å; T165-V167 VanDerWaalsContact C-N 3.32Å; T165-V167 PolarHBondContact O-N 3.32Å; T165-H168 PolarHBondContact O-N 3.48Å; T165-L169 HydrophobicContact CG2-CD1 3.76Å; T165-L169 HydrophobicContact CG2-CG 4.42Å; T165-L169 WeakPolarHBondContact O-CG 3.3Å; T165-L169 PolarHBondContact O-N 3.16Å
166	L	98.4	Very high	96.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.4	-44.2	176.7	-69.3	174.4	0	0	0	111.2	L78 V147 L162 L163 H168 L169 C170 V176 L178 L196 F200	L78-L166 HydrophobicContact CD1-CD2 3.74Å; L78-L166 HydrophobicContact CD1-CG 4.45Å; V147-L166 HydrophobicContact CG1-CD2 3.74Å; L162-L166 HydrophobicContact CD1-CD1 4.35Å; L162-L166 HydrophobicContact CD1-CG 4.18Å; L162-L166 HydrophobicContact CG-CD1 4.18Å; L162-L166 HydrophobicContact CG-CG 4.44Å; L162-L166 WeakPolarHBondContact O-CG 3.27Å; L162-L166 PolarHBondContact O-N 3.45Å; L163-L166 PolarHBondContact O-N 3.17Å; L166-H168 VanDerWaalsContact C-N 3.32Å; L166-H168 PolarHBondContact O-N 3.05Å; L166-L169 PolarHBondContact O-N 2.74Å; L166-C170 VanDerWaalsContact O-CB 3.26Å; L166-C170 WeakPolarHBondContact O-CB 3.42Å; L166-C170 PolarHBondContact O-N 3.03Å; L166-C170 PolarHBondContact O-SG 3.33Å; L166-V176 HydrophobicContact CD2-CG1 3.73Å; L166-V176 HydrophobicContact CD2-CG2 4.11Å; L166-L178 HydrophobicContact CD1-CD1 4.39Å; L166-L196 HydrophobicContact CD1-CD1 3.87Å; L166-F200 HydrophobicContact CB-CE2 4.08Å; L166-F200 HydrophobicContact CB-CZ 3.73Å
167	V	97.2	Very high	96.5	Very high	18 Å²	18	46 Å²	46	11%	0.109	22%	0.223	C	C	.	.	H	α-helix	trans	-59.3	-43.2	177.9	165.9	0	0	0	0	111.3	L163 D164 T165 K171 R199 F200 L220	L163-V167 WeakPolarHBondContact O-CB 3.4Å; L163-V167 VanDerWaalsContact O-CG2 3.26Å; L163-V167 WeakPolarHBondContact O-CG2 3.36Å; L163-V167 PolarHBondContact O-N 3.32Å; D164-V167 PolarHBondContact O-N 3.06Å; T165-V167 VanDerWaalsContact C-N 3.32Å; T165-V167 PolarHBondContact O-N 3.32Å; V167-K171 WeakPolarHBondContact O-CG 3.35Å; V167-R199 HydrophobicContact CG2-CB 3.93Å; V167-R199 HydrophobicContact CG2-CG 4.11Å; V167-F200 HydrophobicContact CG2-CE2 3.79Å; V167-F200 HydrophobicContact CG2-CZ 4.13Å; V167-L220 HydrophobicContact CB-CD1 4.42Å; V167-L220 HydrophobicContact CG1-CD1 4.39Å; V167-L220 HydrophobicContact CG2-CD1 3.94Å
168	H	97.1	Very high	96.6	Very high	13 Å²	13	39.4 Å²	39.4	6%	0.06	19%	0.192	C	C	.	.	H	α-helix	trans	-65.2	-49.1	177.9	176.1	83.7	0	0	0	111.8	Q137 H138 F140 D164 T165 L166 C170 K171	Q137-H168 HydrophobicContact CB-CB 4.27Å; Q137-H168 HydrophobicContact CG-CB 3.89Å; Q137-H168 PolarHBondContact O-CD2 3.41Å; Q137-H168 PolarHBondContact O-NE2 3.49Å; H138-H168 AromaticContact ND1-CE1 3.69Å; H138-H168 AromaticContact ND1-ND1 3.44Å; H138-H168 PolarHBondContact ND1-ND1 3Å; F140-H168 PolarHBondContact O-NE2 2.81Å; D164-H168 PolarHBondContact O-N 3.01Å; T165-H168 PolarHBondContact O-N 3.48Å; L166-H168 VanDerWaalsContact C-N 3.32Å; L166-H168 PolarHBondContact O-N 3.05Å; H168-C170 VanDerWaalsContact C-N 3.27Å; H168-C170 PolarHBondContact O-N 3.2Å; H168-K171 PolarHBondContact ND1-NZ 2.81Å; H168-K171 WeakPolarHBondContact O-CD 3.37Å; H168-K171 WeakPolarHBondContact O-CG 3.01Å; H168-K171 PolarHBondContact O-N 2.85Å
169	L	97.8	Very high	96.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-68.6	-24.7	-176.5	-63.4	172.5	0	0	0	112.9	I76 L78 F140 V147 T165 L166	I76-L169 HydrophobicContact CD1-CD1 4.16Å; I76-L169 HydrophobicContact CD1-CD2 4.01Å; I76-L169 HydrophobicContact CG2-CD1 4.11Å; L78-L169 HydrophobicContact CD1-CD1 4.18Å; L78-L169 HydrophobicContact CD2-CD1 3.85Å; L78-L169 HydrophobicContact CG-CD1 4.34Å; F140-L169 HydrophobicContact CB-CD2 3.98Å; V147-L169 HydrophobicContact CG1-CD1 4.35Å; V147-L169 HydrophobicContact CG2-CB 3.89Å; T165-L169 HydrophobicContact CG2-CD1 3.76Å; T165-L169 HydrophobicContact CG2-CG 4.42Å; T165-L169 WeakPolarHBondContact O-CG 3.3Å; T165-L169 PolarHBondContact O-N 3.16Å; L166-L169 PolarHBondContact O-N 2.74Å
170	C	96.5	Very high	96.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	12.9	-178.5	-57.5	0	0	0	0	114.7	L166 H168 D172 R173 A174 V176 F200 L220	L166-C170 VanDerWaalsContact O-CB 3.26Å; L166-C170 WeakPolarHBondContact O-CB 3.42Å; L166-C170 PolarHBondContact O-N 3.03Å; L166-C170 PolarHBondContact O-SG 3.33Å; H168-C170 VanDerWaalsContact C-N 3.27Å; H168-C170 PolarHBondContact O-N 3.2Å; C170-D172 VanDerWaalsContact C-N 3.27Å; C170-D172 PolarHBondContact O-N 2.98Å; C170-R173 PolarHBondContact O-N 3.01Å; C170-A174 HydrophobicContact CB-CB 4.18Å; C170-V176 WeakPolarHBondContact SG-CG2 3.45Å; C170-F200 HydrophobicContact CB-CE1 3.99Å; C170-F200 HydrophobicContact CB-CZ 4.39Å; C170-L220 HydrophobicContact CB-CB 4.09Å
171	K	89.7	Confident	96.6	Very high	112 Å²	112	36.5 Å²	36.5	49%	0.487	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-33.9	-177.2	-84.2	168.1	-179.4	164.4	0	113.6	M142 V167 H168 R173	M142-K171 HydrophobicContact CB-CB 4.29Å; M142-K171 HydrophobicContact CG-CD 4.22Å; M142-K171 HydrophobicContact SD-CB 4.3Å; M142-K171 HydrophobicContact SD-CD 3.33Å; M142-K171 WeakPolarHBondContact SD-CD 3.42Å; M142-K171 HydrophobicContact SD-CG 4.45Å; V167-K171 WeakPolarHBondContact O-CG 3.35Å; H168-K171 PolarHBondContact ND1-NZ 2.81Å; H168-K171 WeakPolarHBondContact O-CD 3.37Å; H168-K171 WeakPolarHBondContact O-CG 3.01Å; H168-K171 PolarHBondContact O-N 2.85Å; K171-R173 VanDerWaalsContact C-N 3.34Å; K171-R173 PolarHBondContact O-N 3.25Å
172	D	87.3	Confident	96.6	Very high	107 Å²	107	34.5 Å²	34.5	57%	0.572	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.7	37.6	178.2	-156.1	22.9	0	0	0	113.2	M142 C170	M142-D172 VanDerWaalsContact O-CB 3.3Å; M142-D172 WeakPolarHBondContact O-CB 3.23Å; C170-D172 VanDerWaalsContact C-N 3.27Å; C170-D172 PolarHBondContact O-N 2.98Å
173	R	88.5	Confident	96.5	Very high	223 Å²	223	36.7 Å²	36.7	84%	0.842	17%	0.167	S	C	*	.			trans	71.2	25.6	173.5	-48.4	176.8	173.9	-174.7	-2	115.9	C170 K171	C170-R173 PolarHBondContact O-N 3.01Å; K171-R173 VanDerWaalsContact C-N 3.34Å; K171-R173 PolarHBondContact O-N 3.25Å
174	A	96.5	Very high	96.4	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-55	146.2	170	0	0	0	0	0	111.5	W144 D145 V147 C170	W144-A174 HydrophobicContact CB-CB 4.16Å; W144-A174 WeakPolarHBondContact O-CA 3.37Å; W144-A174 WeakPolarHBondContact O-CB 3.43Å; D145-A174 WeakPolarHBondContact O-CA 3.27Å; V147-A174 HydrophobicContact CG2-CB 4.2Å; C170-A174 HydrophobicContact CB-CB 4.18Å
175	V	97.6	Very high	96.3	Very high	42 Å²	42	46 Å²	46	26%	0.255	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	126.9	169.8	-174.9	0	0	0	0	108.8	D145 L146 V147 Y177 T219	D145-V175 PolarHBondContact O-N 2.95Å; L146-V175 VanDerWaalsContact CA-O 3.27Å; L146-V175 WeakPolarHBondContact CA-O 3.41Å; L146-V175 HydrophobicContact CD2-CB 3.87Å; V147-V175 PolarHBondContact N-O 3.39Å; V175-Y177 HydrophobicContact CG1-CD2 4.31Å; V175-Y177 HydrophobicContact CG1-CE2 3.92Å; V175-T219 HydrophobicContact CB-CG2 4.48Å; V175-T219 HydrophobicContact CG1-CG2 4.3Å; V175-T219 HydrophobicContact CG2-CG2 3.98Å
176	V	98.4	Very high	96.1	Very high	0 Å²	0	49 Å²	49	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	135.6	174.1	-166.8	0	0	0	0	109.1	V147 L166 C170 L178 F200 S217 A218	V147-V176 HydrophobicContact CB-CG1 4.29Å; V147-V176 HydrophobicContact CB-CG2 4.28Å; V147-V176 HydrophobicContact CG1-CG1 4.45Å; V147-V176 CarbonylContact O-C 3.48Å; V147-V176 VanDerWaalsContact O-CA 3.24Å; V147-V176 WeakPolarHBondContact O-CA 3.28Å; L166-V176 HydrophobicContact CD2-CG1 3.73Å; L166-V176 HydrophobicContact CD2-CG2 4.11Å; C170-V176 WeakPolarHBondContact SG-CG2 3.45Å; V176-L178 HydrophobicContact CG1-CD1 4.33Å; V176-L178 HydrophobicContact CG1-CD2 3.95Å; V176-L178 HydrophobicContact CG1-CG 3.76Å; V176-F200 HydrophobicContact CG2-CD1 4.45Å; V176-F200 HydrophobicContact CG2-CE1 3.97Å; V176-S217 CarbonylContact O-C 3.56Å; V176-S217 WeakPolarHBondContact O-CA 3.47Å; V176-A218 HydrophobicContact CB-CB 4.16Å; V176-A218 PolarHBondContact N-O 2.79Å; V176-A218 PolarHBondContact O-N 2.95Å
177	Y	98.8	Very high	96	Very high	26 Å²	26	50.4 Å²	50.4	10%	0.102	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	120.5	162.5	-79.5	-89.1	0	0	0	109.8	Y62 F63 L146 V147 L148 G149 V175 E205 I215 Y216	Y62-Y177 HydrophobicContact CE1-CD1 4.12Å; Y62-Y177 AromaticContact CE1-CE1 3.63Å; Y62-Y177 HydrophobicContact CE1-CE1 3.63Å; F63-Y177 HydrophobicContact CE1-CG 4.35Å; L146-Y177 HydrophobicContact CD2-CD2 4.19Å; L146-Y177 HydrophobicContact CD2-CE2 4.07Å; V147-Y177 PolarHBondContact O-N 3.43Å; L148-Y177 WeakPolarHBondContact CA-O 3.35Å; G149-Y177 PolarHBondContact N-O 3.34Å; V175-Y177 HydrophobicContact CG1-CD2 4.31Å; V175-Y177 HydrophobicContact CG1-CE2 3.92Å; Y177-E205 HydrophobicContact CE1-CG 4.19Å; Y177-I215 HydrophobicContact CD1-CG2 4.19Å; Y177-Y216 WeakPolarHBondContact CA-O 3.2Å
178	L	98.8	Very high	96	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.016	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.4	176.1	-63.1	177.7	0	0	0	110.1	G149 I152 L166 V176 F191 Y192 L196 I215 Y216	G149-L178 VanDerWaalsContact O-CA 3.31Å; G149-L178 WeakPolarHBondContact O-CA 3.29Å; I152-L178 HydrophobicContact CD1-CD2 3.9Å; I152-L178 HydrophobicContact CG1-CD2 4.3Å; L166-L178 HydrophobicContact CD1-CD1 4.39Å; V176-L178 HydrophobicContact CG1-CD1 4.33Å; V176-L178 HydrophobicContact CG1-CD2 3.95Å; V176-L178 HydrophobicContact CG1-CG 3.76Å; L178-F191 HydrophobicContact CD1-CE1 3.91Å; L178-Y192 HydrophobicContact CB-CE1 3.92Å; L178-Y192 WeakPolarHBondContact CB-OH 3.42Å; L178-Y192 HydrophobicContact CD1-CE1 3.91Å; L178-L196 HydrophobicContact CD1-CD2 4.06Å; L178-I215 CarbonylContact O-C 3.52Å; L178-I215 WeakPolarHBondContact O-CA 3.4Å; L178-Y216 PolarHBondContact N-O 3.04Å; L178-Y216 PolarHBondContact O-N 3.44Å
179	S	98.7	Very high	96	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133.9	171.1	-175.5	0	0	0	0	109.3	A55 G149 A150 D151 N214	A55-S179 VanDerWaalsContact O-CB 3.27Å; A55-S179 WeakPolarHBondContact O-CB 3.4Å; A55-S179 PolarHBondContact O-OG 3.43Å; G149-S179 PolarHBondContact O-N 3.26Å; A150-S179 WeakPolarHBondContact CA-O 3.41Å; D151-S179 PolarHBondContact N-O 2.78Å; S179-N214 WeakPolarHBondContact CA-O 2.94Å
180	S	98.4	Very high	96	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	145	179.7	-65.1	0	0	0	0	112.4	Y192 I213 N214	S180-Y192 WeakPolarHBondContact CB-OH 3.12Å; S180-Y192 PolarHBondContact OG-OH 2.79Å; S180-I213 WeakPolarHBondContact O-CA 3.34Å; S180-N214 PolarHBondContact N-O 3.5Å; S180-N214 PolarHBondContact O-N 2.92Å
181	K	98.2	Very high	96.1	Very high	61 Å²	61	52 Å²	52	27%	0.265	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	126.1	162.6	-168.6	164.6	-169.1	162.7	0	109.1	D151 R183 N212 I213	D151-K181 PolarHBondContact OD1-N 2.89Å; D151-K181 VanDerWaalsContact OD1-N 3.1Å; K181-R183 HydrophobicContact CG-CG 4.36Å; K181-R183 PolarHBondContact O-N 3.18Å; K181-R183 VanDerWaalsContact O-N 3.16Å; K181-N212 WeakPolarHBondContact CA-O 3.29Å; K181-I213 HydrophobicContact CB-CG1 4Å; K181-I213 HydrophobicContact CG-CG1 4.17Å
182	M	97.8	Very high	96.5	Very high	25 Å²	25	47.1 Å²	47.1	12%	0.123	23%	0.231	C	C	.	.			trans	-77.6	104.7	-176.8	-55	-56.3	-56	0	0	109.5	T188 P189 Y192 N212 N214 Y216	M182-T188 WeakPolarHBondContact CA-OG1 3.38Å; M182-P189 HydrophobicContact CE-CB 4.18Å; M182-P189 HydrophobicContact CE-CG 4Å; M182-Y192 HydrophobicContact CE-CD2 4.08Å; M182-Y192 HydrophobicContact SD-CD2 4.32Å; M182-Y192 HydrophobicContact SD-CE2 4.45Å; M182-N212 PolarHBondContact N-O 3.32Å; M182-N212 PolarHBondContact O-ND2 3.38Å; M182-N214 HydrophobicContact CG-CB 4.21Å; M182-N214 HydrophobicContact SD-CB 3.86Å; M182-Y216 HydrophobicContact SD-CE2 4.13Å
183	R	96.6	Very high	97	Very high	46 Å²	46	44.3 Å²	44.3	17%	0.174	23%	0.227	C	C	.	.			trans	-120.2	121.9	179.6	-63.8	176.2	-175.6	114.8	-10.3	109.6	D151 K181 E185 H186 T188	D151-R183 IonicContact OD1-NH1 2.72Å; D151-R183 PolarHBondContact OD1-NH1 2.94Å; D151-R183 IonicContact OD2-CZ 3.46Å; D151-R183 IonicContact OD2-NH1 3.35Å; D151-R183 PolarHBondContact OD2-NH1 3.35Å; D151-R183 IonicContact OD2-NH2 2.94Å; D151-R183 PolarHBondContact OD2-NH2 3.49Å; K181-R183 HydrophobicContact CG-CG 4.36Å; K181-R183 PolarHBondContact O-N 3.18Å; K181-R183 VanDerWaalsContact O-N 3.16Å; R183-E185 HydrophobicContact CB-CG 4.44Å; R183-H186 HydrophobicContact CB-CB 4.37Å; R183-H186 VanDerWaalsContact CD-CD2 3.43Å; R183-H186 WeakPolarHBondContact CD-CD2 3.42Å; R183-T188 HydrophobicContact CB-CG2 4.32Å; R183-T188 PolarHBondContact N-OG1 2.78Å; R183-T188 PolarHBondContact O-N 2.84Å; R183-T188 PolarHBondContact O-OG1 2.59Å
184	E	95.9	Very high	97.5	Very high	145 Å²	145	39 Å²	39	68%	0.678	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-38.4	-178.7	-71.2	-69.4	176.3	0	0	111	H186 G187	E184-H186 PolarHBondContact O-N 3.26Å; E184-H186 VanDerWaalsContact O-N 3.12Å; E184-G187 PolarHBondContact O-N 2.76Å
185	E	95.5	Very high	97.5	Very high	144 Å²	144	40.4 Å²	40.4	67%	0.673	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.9	179.7	64.7	-87.8	-153.8	0	0	113.9	R183	R183-E185 HydrophobicContact CB-CG 4.44Å
186	H	94.3	Very high	97.6	Very high	65 Å²	65	38.4 Å²	38.4	30%	0.301	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	0	174.5	-61.3	-21.9	0	0	0	112.2	Y154 Y159 R183 E184 T188	Y154-H186 WeakPolarHBondContact O-CB 3.3Å; Y159-H186 PolarHBondContact OH-O 2.75Å; R183-H186 HydrophobicContact CB-CB 4.37Å; R183-H186 VanDerWaalsContact CD-CD2 3.43Å; R183-H186 WeakPolarHBondContact CD-CD2 3.42Å; E184-H186 PolarHBondContact O-N 3.26Å; E184-H186 VanDerWaalsContact O-N 3.12Å; H186-T188 HydrophobicContact CB-CG2 3.96Å; H186-T188 PolarHBondContact O-N 2.78Å
187	G	96.7	Very high	97.5	Very high	28 Å²	28	39.8 Å²	39.8	29%	0.289	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	23.3	-176.3	0	0	0	0	0	113.5	E184 P189 G190 F191	E184-G187 PolarHBondContact O-N 2.76Å; G187-P189 VanDerWaalsContact C-CD 3.47Å; G187-G190 PolarHBondContact O-N 3.16Å; G187-G190 VanDerWaalsContact O-N 3.12Å; G187-F191 PolarHBondContact O-N 3.1Å
188	T	96.9	Very high	97.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.1	-39.2	-179.4	64.1	0	0	0	0	112.9	V153 M182 R183 H186 G190 F191 Y192	V153-T188 HydrophobicContact CG1-CG2 4.18Å; V153-T188 WeakPolarHBondContact O-CG2 3.46Å; M182-T188 WeakPolarHBondContact CA-OG1 3.38Å; R183-T188 HydrophobicContact CB-CG2 4.32Å; R183-T188 PolarHBondContact N-OG1 2.78Å; R183-T188 PolarHBondContact O-N 2.84Å; R183-T188 PolarHBondContact O-OG1 2.59Å; H186-T188 HydrophobicContact CB-CG2 3.96Å; H186-T188 PolarHBondContact O-N 2.78Å; T188-G190 VanDerWaalsContact C-N 3.31Å; T188-G190 PolarHBondContact O-N 2.85Å; T188-F191 PolarHBondContact O-N 3.46Å; T188-Y192 WeakPolarHBondContact O-CD2 3.26Å; T188-Y192 PolarHBondContact O-N 2.94Å
189	P	97.8	Very high	97.4	Very high	40 Å²	40	49.4 Å²	49.4	26%	0.26	26%	0.262	S	S	.	.	H	α-helix	trans	-64.9	-37.3	176.4	-20.9	37	0	0	0	111.8	M182 G187 Y192 G193	M182-P189 HydrophobicContact CE-CB 4.18Å; M182-P189 HydrophobicContact CE-CG 4Å; G187-P189 VanDerWaalsContact C-CD 3.47Å; P189-Y192 PolarHBondContact O-N 3.35Å; P189-G193 PolarHBondContact O-N 2.89Å
190	G	97.8	Very high	97.4	Very high	26 Å²	26	49.4 Å²	49.4	27%	0.268	26%	0.262	S	S	.	.	H	α-helix	trans	-65.6	-35.3	175.9	0	0	0	0	0	113	G187 T188 Y192 D194 T195	G187-G190 PolarHBondContact O-N 3.16Å; G187-G190 VanDerWaalsContact O-N 3.12Å; T188-G190 VanDerWaalsContact C-N 3.31Å; T188-G190 PolarHBondContact O-N 2.85Å; G190-Y192 PolarHBondContact O-N 3.11Å; G190-D194 WeakPolarHBondContact O-CA 3.31Å; G190-D194 VanDerWaalsContact O-CB 3.31Å; G190-D194 WeakPolarHBondContact O-CB 3.44Å; G190-D194 PolarHBondContact O-N 2.83Å; G190-T195 PolarHBondContact O-N 3.41Å; G190-T195 VanDerWaalsContact O-N 3.11Å
191	F	98.6	Very high	97.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.287	C	S	.	.	I	π-helix	trans	-60.5	-48.4	173.4	-179.1	-97.2	0	0	0	111.9	V153 Y159 L162 L178 G187 T188 T195 L196	V153-F191 HydrophobicContact CB-CD1 4.36Å; V153-F191 HydrophobicContact CG1-CB 3.58Å; V153-F191 HydrophobicContact CG1-CD1 3.64Å; V153-F191 HydrophobicContact CG1-CD2 4.33Å; V153-F191 HydrophobicContact CG1-CE1 4.42Å; V153-F191 HydrophobicContact CG1-CG 3.58Å; V153-F191 HydrophobicContact CG2-CD1 3.69Å; V153-F191 HydrophobicContact CG2-CE1 3.68Å; V153-F191 HydrophobicContact CG2-CG 4.32Å; V153-F191 HydrophobicContact CG2-CZ 4.3Å; Y159-F191 AromaticContact CD1-CD2 3.84Å; Y159-F191 HydrophobicContact CD1-CD2 3.84Å; Y159-F191 HydrophobicContact CD1-CE2 4.29Å; Y159-F191 HydrophobicContact CD2-CB 4.07Å; Y159-F191 AromaticContact CD2-CD2 3.8Å; Y159-F191 HydrophobicContact CD2-CD2 3.8Å; Y159-F191 HydrophobicContact CD2-CG 4.39Å; Y159-F191 HydrophobicContact CE1-CD2 4.3Å; Y159-F191 HydrophobicContact CE2-CB 3.8Å; Y159-F191 HydrophobicContact CE2-CD2 4.28Å; Y159-F191 HydrophobicContact CE2-CG 4.45Å; Y159-F191 AromaticContact CG-CD2 3.55Å; Y159-F191 HydrophobicContact CG-CD2 3.55Å; Y159-F191 HydrophobicContact CG-CE2 4.18Å; Y159-F191 HydrophobicContact CG-CG 4.44Å; L162-F191 HydrophobicContact CD2-CE2 4.23Å; L162-F191 HydrophobicContact CD2-CZ 3.85Å; L162-F191 HydrophobicContact CG-CZ 4.38Å; L178-F191 HydrophobicContact CD1-CE1 3.91Å; G187-F191 PolarHBondContact O-N 3.1Å; T188-F191 PolarHBondContact O-N 3.46Å; F191-T195 HydrophobicContact CD2-CG2 4Å; F191-T195 HydrophobicContact CE2-CG2 4.13Å; F191-T195 PolarHBondContact O-N 3.5Å; F191-L196 HydrophobicContact CD1-CB 4.4Å; F191-L196 HydrophobicContact CE1-CB 4.04Å; F191-L196 HydrophobicContact CE1-CD1 4.4Å; F191-L196 HydrophobicContact CE1-CD2 4.18Å; F191-L196 HydrophobicContact CE1-CG 4.44Å; F191-L196 HydrophobicContact CZ-CB 4.27Å; F191-L196 HydrophobicContact CZ-CD1 4.24Å; F191-L196 WeakPolarHBondContact O-CB 3.48Å; F191-L196 PolarHBondContact O-N 2.92Å
192	Y	98.4	Very high	97.4	Very high	8 Å²	8	53.8 Å²	53.8	3%	0.031	29%	0.286	C	S	.	.	I	π-helix	trans	-77.5	-29.6	-178.5	-68.9	-69.9	0	0	0	113.8	V153 L178 S180 M182 T188 P189 G190 L196 P197 Y216	V153-Y192 HydrophobicContact CB-CE2 4.44Å; V153-Y192 HydrophobicContact CG1-CE2 4.31Å; V153-Y192 HydrophobicContact CG2-CE2 4.38Å; L178-Y192 HydrophobicContact CB-CE1 3.92Å; L178-Y192 WeakPolarHBondContact CB-OH 3.42Å; L178-Y192 HydrophobicContact CD1-CE1 3.91Å; S180-Y192 WeakPolarHBondContact CB-OH 3.12Å; S180-Y192 PolarHBondContact OG-OH 2.79Å; M182-Y192 HydrophobicContact CE-CD2 4.08Å; M182-Y192 HydrophobicContact SD-CD2 4.32Å; M182-Y192 HydrophobicContact SD-CE2 4.45Å; T188-Y192 WeakPolarHBondContact O-CD2 3.26Å; T188-Y192 PolarHBondContact O-N 2.94Å; P189-Y192 PolarHBondContact O-N 3.35Å; G190-Y192 PolarHBondContact O-N 3.11Å; Y192-L196 HydrophobicContact CD1-CD2 4.11Å; Y192-L196 HydrophobicContact CE1-CD2 4.37Å; Y192-P197 VanDerWaalsContact O-CD 3.3Å; Y192-P197 WeakPolarHBondContact O-CD 3.46Å; Y192-P197 WeakPolarHBondContact O-CG 3.46Å; Y192-Y216 HydrophobicContact CD1-CD1 4.11Å; Y192-Y216 AromaticContact CD1-CD2 3.34Å; Y192-Y216 HydrophobicContact CD1-CD2 3.34Å; Y192-Y216 HydrophobicContact CD1-CE1 4.36Å; Y192-Y216 AromaticContact CD1-CE2 3.62Å; Y192-Y216 HydrophobicContact CD1-CE2 3.62Å; Y192-Y216 AromaticContact CD1-CG 3.6Å; Y192-Y216 HydrophobicContact CD1-CG 3.6Å; Y192-Y216 HydrophobicContact CD2-CD2 4.12Å; Y192-Y216 AromaticContact CD2-CE2 3.62Å; Y192-Y216 HydrophobicContact CD2-CE2 3.62Å; Y192-Y216 AromaticContact CE1-CD2 3.33Å; Y192-Y216 HydrophobicContact CE1-CD2 3.33Å; Y192-Y216 AromaticContact CE1-CE2 3.88Å; Y192-Y216 HydrophobicContact CE1-CE2 3.88Å; Y192-Y216 AromaticContact CE1-CG 3.83Å; Y192-Y216 HydrophobicContact CE1-CG 3.83Å; Y192-Y216 HydrophobicContact CE2-CD2 4.13Å; Y192-Y216 AromaticContact CE2-CE2 3.89Å; Y192-Y216 HydrophobicContact CE2-CE2 3.89Å; Y192-Y216 HydrophobicContact CG-CD1 4.5Å; Y192-Y216 AromaticContact CG-CD2 3.76Å; Y192-Y216 HydrophobicContact CG-CD2 3.76Å; Y192-Y216 HydrophobicContact CG-CE1 4.29Å; Y192-Y216 AromaticContact CG-CE2 3.48Å; Y192-Y216 HydrophobicContact CG-CE2 3.48Å; Y192-Y216 VanDerWaalsContact CG-CE2 3.48Å; Y192-Y216 HydrophobicContact CG-CG 4.25Å; Y192-Y216 AromaticContact CG-CZ 3.78Å; Y192-Y216 AromaticContact CZ-CD2 3.74Å
193	G	97.6	Very high	97.4	Very high	48 Å²	48	58.1 Å²	58.1	50%	0.495	30%	0.304	S	S	.	.	I	π-helix	trans	-86.1	-34.3	-178.8	0	0	0	0	0	114.1	P189 P197	P189-G193 PolarHBondContact O-N 2.89Å; G193-P197 WeakPolarHBondContact O-CG 3.36Å
194	D	97.4	Very high	97.5	Very high	112 Å²	112	59.6 Å²	59.6	60%	0.599	32%	0.316	S	S	*	.	I	π-helix	trans	-122.3	-53.5	-170.4	-53.9	-50.8	0	0	0	112.4	G190 Q198	G190-D194 WeakPolarHBondContact O-CA 3.31Å; G190-D194 VanDerWaalsContact O-CB 3.31Å; G190-D194 WeakPolarHBondContact O-CB 3.44Å; G190-D194 PolarHBondContact O-N 2.83Å; D194-Q198 WeakPolarHBondContact O-CG 3.17Å; D194-Q198 PolarHBondContact O-NE2 2.97Å
195	T	98	Very high	97.6	Very high	30 Å²	30	55.1 Å²	55.1	18%	0.184	29%	0.294	C	S	.	.	I	π-helix	trans	-71	-58	-171.7	-56.2	0	0	0	0	113	L163 G190 F191 Q198	L163-T195 HydrophobicContact CD2-CG2 4.05Å; G190-T195 PolarHBondContact O-N 3.41Å; G190-T195 VanDerWaalsContact O-N 3.11Å; F191-T195 HydrophobicContact CD2-CG2 4Å; F191-T195 HydrophobicContact CE2-CG2 4.13Å; F191-T195 PolarHBondContact O-N 3.5Å; T195-Q198 WeakPolarHBondContact O-CB 3.42Å; T195-Q198 PolarHBondContact O-N 3.17Å
196	L	98.4	Very high	97.7	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-61.9	-41.6	-177.9	-173	68	0	0	0	111.9	L163 L166 L178 F191 Y192 Q198 R199 F200 V202 A218	L163-L196 HydrophobicContact CD1-CD1 4.05Å; L166-L196 HydrophobicContact CD1-CD1 3.87Å; L178-L196 HydrophobicContact CD1-CD2 4.06Å; F191-L196 HydrophobicContact CD1-CB 4.4Å; F191-L196 HydrophobicContact CE1-CB 4.04Å; F191-L196 HydrophobicContact CE1-CD1 4.4Å; F191-L196 HydrophobicContact CE1-CD2 4.18Å; F191-L196 HydrophobicContact CE1-CG 4.44Å; F191-L196 HydrophobicContact CZ-CB 4.27Å; F191-L196 HydrophobicContact CZ-CD1 4.24Å; F191-L196 WeakPolarHBondContact O-CB 3.48Å; F191-L196 PolarHBondContact O-N 2.92Å; Y192-L196 HydrophobicContact CD1-CD2 4.11Å; Y192-L196 HydrophobicContact CE1-CD2 4.37Å; L196-Q198 PolarHBondContact O-N 3.19Å; L196-Q198 VanDerWaalsContact O-N 3.15Å; L196-R199 PolarHBondContact O-N 3.1Å; L196-F200 HydrophobicContact CD1-CB 4.38Å; L196-F200 HydrophobicContact CD1-CD2 3.6Å; L196-F200 HydrophobicContact CD1-CE2 4.11Å; L196-F200 HydrophobicContact CD1-CG 4.04Å; L196-F200 HydrophobicContact CG-CB 4.3Å; L196-F200 HydrophobicContact CG-CD2 4.34Å; L196-F200 HydrophobicContact CG-CG 4.49Å; L196-F200 PolarHBondContact O-N 2.9Å; L196-V202 HydrophobicContact CB-CG2 4.14Å; L196-V202 HydrophobicContact CD2-CG1 4.16Å; L196-V202 HydrophobicContact CD2-CG2 3.73Å; L196-V202 HydrophobicContact CG-CG2 3.65Å; L196-A218 HydrophobicContact CD2-CB 4.07Å
197	P	98	Very high	97.8	Very high	28 Å²	28	55.5 Å²	55.5	18%	0.182	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-62.5	-16.6	175.8	-27.7	39.3	0	0	0	115.7	Y192 G193 R199 F200 V202 R221	Y192-P197 VanDerWaalsContact O-CD 3.3Å; Y192-P197 WeakPolarHBondContact O-CD 3.46Å; Y192-P197 WeakPolarHBondContact O-CG 3.46Å; G193-P197 WeakPolarHBondContact O-CG 3.36Å; P197-R199 PolarHBondContact O-N 3.2Å; P197-F200 WeakPolarHBondContact CA-O 3.45Å; P197-V202 HydrophobicContact CB-CG2 4.43Å; P197-V202 HydrophobicContact CG-CB 4.35Å; P197-V202 HydrophobicContact CG-CG2 3.85Å; P197-R221 PolarHBondContact O-NE 2.99Å; P197-R221 VanDerWaalsContact O-NE 3.15Å; P197-R221 PolarHBondContact O-NH2 2.83Å
198	Q	96.9	Very high	97.9	Very high	127 Å²	127	55.7 Å²	55.7	59%	0.593	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-58.9	-33.9	174	-72	167.4	31.2	0	0	111.9	D194 T195 L196	D194-Q198 WeakPolarHBondContact O-CG 3.17Å; D194-Q198 PolarHBondContact O-NE2 2.97Å; T195-Q198 WeakPolarHBondContact O-CB 3.42Å; T195-Q198 PolarHBondContact O-N 3.17Å; L196-Q198 PolarHBondContact O-N 3.19Å; L196-Q198 VanDerWaalsContact O-N 3.15Å
199	R	97.4	Very high	97.8	Very high	104 Å²	104	60.4 Å²	60.4	39%	0.392	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-19.2	-174.5	-56.2	-59.5	-60.1	-76.2	-3.1	113.7	L163 V167 L196 P197 L220 R221	L163-R199 HydrophobicContact CD1-CB 4.22Å; L163-R199 HydrophobicContact CD1-CG 4.24Å; L163-R199 HydrophobicContact CD2-CG 3.98Å; L163-R199 HydrophobicContact CG-CG 4.21Å; V167-R199 HydrophobicContact CG2-CB 3.93Å; V167-R199 HydrophobicContact CG2-CG 4.11Å; L196-R199 PolarHBondContact O-N 3.1Å; P197-R199 PolarHBondContact O-N 3.2Å; R199-L220 HydrophobicContact CB-CD1 4.49Å; R199-R221 VanDerWaalsContact O-CB 3.32Å; R199-R221 WeakPolarHBondContact O-CB 3.42Å; R199-R221 VanDerWaalsContact O-CG 3.28Å; R199-R221 WeakPolarHBondContact O-CG 3.5Å; R199-R221 PolarHBondContact O-N 2.98Å
200	F	98.3	Very high	97.7	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	154.7	-174.9	-66.6	-100.3	0	0	0	112.7	L163 L166 V167 C170 V176 L196 P197 V202 A218 T219 L220 R221	L163-F200 HydrophobicContact CD1-CD2 4.06Å; L163-F200 HydrophobicContact CD1-CE2 3.9Å; L166-F200 HydrophobicContact CB-CE2 4.08Å; L166-F200 HydrophobicContact CB-CZ 3.73Å; V167-F200 HydrophobicContact CG2-CE2 3.79Å; V167-F200 HydrophobicContact CG2-CZ 4.13Å; C170-F200 HydrophobicContact CB-CE1 3.99Å; C170-F200 HydrophobicContact CB-CZ 4.39Å; V176-F200 HydrophobicContact CG2-CD1 4.45Å; V176-F200 HydrophobicContact CG2-CE1 3.97Å; L196-F200 HydrophobicContact CD1-CB 4.38Å; L196-F200 HydrophobicContact CD1-CD2 3.6Å; L196-F200 HydrophobicContact CD1-CE2 4.11Å; L196-F200 HydrophobicContact CD1-CG 4.04Å; L196-F200 HydrophobicContact CG-CB 4.3Å; L196-F200 HydrophobicContact CG-CD2 4.34Å; L196-F200 HydrophobicContact CG-CG 4.49Å; L196-F200 PolarHBondContact O-N 2.9Å; P197-F200 WeakPolarHBondContact CA-O 3.45Å; F200-V202 HydrophobicContact CB-CG2 4.07Å; F200-A218 HydrophobicContact CB-CB 3.95Å; F200-A218 HydrophobicContact CD1-CB 3.99Å; F200-A218 HydrophobicContact CG-CB 4.2Å; F200-T219 CarbonylContact C-O 3.5Å; F200-T219 VanDerWaalsContact CA-O 3.25Å; F200-T219 WeakPolarHBondContact CA-O 3.45Å; F200-T219 WeakPolarHBondContact CB-O 3.29Å; F200-T219 VanDerWaalsContact CD1-C 3.41Å; F200-L220 HydrophobicContact CD1-CB 4.26Å; F200-L220 HydrophobicContact CD1-CD1 4.44Å; F200-L220 HydrophobicContact CE1-CB 3.92Å; F200-L220 HydrophobicContact CE1-CD1 3.95Å; F200-L220 HydrophobicContact CE2-CD1 4.06Å; F200-L220 HydrophobicContact CZ-CD1 3.73Å; F200-R221 PolarHBondContact O-NE 3Å; F200-R221 PolarHBondContact O-NH2 3.02Å
201	H	97.9	Very high	97.6	Very high	111 Å²	111	66.7 Å²	66.7	51%	0.514	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	113.4	156.2	-66.8	-24.6	0	0	0	107.3	A218 T219 R221	H201-A218 VanDerWaalsContact O-CA 3.26Å; H201-A218 WeakPolarHBondContact O-CA 3.37Å; H201-T219 PolarHBondContact N-O 2.84Å; H201-T219 PolarHBondContact O-N 2.82Å; H201-R221 PolarHBondContact ND1-NE 3.42Å
202	V	98.4	Very high	97.5	Very high	43 Å²	43	69.6 Å²	69.6	26%	0.261	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	133.5	-174.3	-175.4	0	0	0	0	109.2	L196 P197 F200 Y216 S217 A218	L196-V202 HydrophobicContact CB-CG2 4.14Å; L196-V202 HydrophobicContact CD2-CG1 4.16Å; L196-V202 HydrophobicContact CD2-CG2 3.73Å; L196-V202 HydrophobicContact CG-CG2 3.65Å; P197-V202 HydrophobicContact CB-CG2 4.43Å; P197-V202 HydrophobicContact CG-CB 4.35Å; P197-V202 HydrophobicContact CG-CG2 3.85Å; F200-V202 HydrophobicContact CB-CG2 4.07Å; V202-Y216 HydrophobicContact CG1-CD1 3.89Å; V202-Y216 HydrophobicContact CG1-CG 4.42Å; V202-S217 WeakPolarHBondContact CA-O 3.49Å; V202-A218 HydrophobicContact CG2-CB 4.3Å
203	K	98.4	Very high	97.6	Very high	115 Å²	115	69.2 Å²	69.2	50%	0.5	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	131.3	177	175.3	176	169	-125.9	0	109.4	E205 Y216 S217	K203-E205 VanDerWaalsContact CD-OE1 3.28Å; K203-E205 WeakPolarHBondContact CD-OE1 3.47Å; K203-E205 WeakPolarHBondContact CE-OE1 3.43Å; K203-E205 IonicContact NZ-OE1 2.67Å; K203-E205 PolarHBondContact NZ-OE1 2.86Å; K203-E205 IonicContact NZ-OE2 2.67Å; K203-E205 PolarHBondContact NZ-OE2 3.12Å; K203-E205 PolarHBondContact O-N 2.88Å; K203-Y216 CarbonylContact O-C 3.58Å; K203-Y216 VanDerWaalsContact O-CA 3.23Å; K203-Y216 WeakPolarHBondContact O-CA 3.39Å; K203-S217 PolarHBondContact N-O 3.3Å; K203-S217 PolarHBondContact O-N 2.94Å
204	L	98.4	Very high	97.6	Very high	78 Å²	78	67.3 Å²	67.3	41%	0.408	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	114	168.9	179.6	66.4	0	0	0	108.3	H206 R207 N214 Y216	L204-H206 VanDerWaalsContact CD1-O 3.28Å; L204-H206 WeakPolarHBondContact CD1-O 3.43Å; L204-R207 HydrophobicContact CD2-CB 4.32Å; L204-N214 HydrophobicContact CD1-CB 3.73Å; L204-Y216 HydrophobicContact CB-CD1 4.11Å; L204-Y216 HydrophobicContact CB-CE1 3.99Å; L204-Y216 HydrophobicContact CD1-CD1 4Å; L204-Y216 HydrophobicContact CD1-CE1 3.62Å; L204-Y216 HydrophobicContact CD1-CE2 4.29Å; L204-Y216 HydrophobicContact CD1-CG 4.48Å; L204-Y216 HydrophobicContact CG-CE1 4.37Å
205	E	97.8	Very high	97.7	Very high	50 Å²	50	62 Å²	62	23%	0.234	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-36.8	-179.5	-66.3	-63.3	165.6	0	0	112.1	Y62 Y177 K203 I215 S217	Y62-E205 HydrophobicContact CE2-CB 4.07Å; Y177-E205 HydrophobicContact CE1-CG 4.19Å; K203-E205 VanDerWaalsContact CD-OE1 3.28Å; K203-E205 WeakPolarHBondContact CD-OE1 3.47Å; K203-E205 WeakPolarHBondContact CE-OE1 3.43Å; K203-E205 IonicContact NZ-OE1 2.67Å; K203-E205 PolarHBondContact NZ-OE1 2.86Å; K203-E205 IonicContact NZ-OE2 2.67Å; K203-E205 PolarHBondContact NZ-OE2 3.12Å; K203-E205 PolarHBondContact O-N 2.88Å; E205-I215 PolarHBondContact N-O 2.83Å; E205-S217 WeakPolarHBondContact OE1-CB 3.23Å; E205-S217 PolarHBondContact OE1-OG 2.8Å
206	H	97.8	Very high	97.7	Very high	66 Å²	66	61.9 Å²	61.9	31%	0.306	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	147	-179.8	-177.8	84.6	0	0	0	111	Y62 L204 N214 I215	Y62-H206 HydrophobicContact CD2-CB 3.96Å; Y62-H206 HydrophobicContact CE2-CB 4.14Å; L204-H206 VanDerWaalsContact CD1-O 3.28Å; L204-H206 WeakPolarHBondContact CD1-O 3.43Å; H206-N214 WeakPolarHBondContact O-CA 3.42Å; H206-I215 HydrophobicContact CB-CB 4.1Å; H206-I215 HydrophobicContact CB-CD1 4.2Å; H206-I215 HydrophobicContact CB-CG1 4.33Å; H206-I215 PolarHBondContact N-O 2.93Å; H206-I215 PolarHBondContact O-N 2.79Å
207	R	97.3	Very high	97.7	Very high	151 Å²	151	62.5 Å²	62.5	57%	0.57	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.8	118.7	173.5	171.9	166.3	-168.7	-177.1	4.4	109.4	L204 P209 N214	L204-R207 HydrophobicContact CD2-CB 4.32Å; R207-P209 WeakPolarHBondContact O-CD 3.19Å; R207-N214 VanDerWaalsContact CG-OD1 3.3Å; R207-N214 WeakPolarHBondContact CG-OD1 3.43Å
208	D	97.4	Very high	97.7	Very high	32 Å²	32	61.3 Å²	61.3	17%	0.171	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	105.4	164.9	-175.5	-18.3	0	0	0	108.7	H58 T210 Q211 N212 I213	H58-D208 IonicContact NE2-OD2 3.79Å; H58-D208 PolarHBondContact NE2-OD2 2.85Å; D208-T210 VanDerWaalsContact C-N 3.25Å; D208-T210 PolarHBondContact O-N 3.39Å; D208-T210 WeakPolarHBondContact OD1-CA 3.39Å; D208-T210 VanDerWaalsContact OD1-CB 3.23Å; D208-T210 WeakPolarHBondContact OD1-CB 3.47Å; D208-T210 PolarHBondContact OD1-N 3.31Å; D208-T210 PolarHBondContact OD1-OG1 2.9Å; D208-Q211 HydrophobicContact CB-CB 4.49Å; D208-Q211 PolarHBondContact OD1-N 2.72Å; D208-Q211 VanDerWaalsContact OD1-N 3.13Å; D208-Q211 WeakPolarHBondContact OD2-CG 3.21Å; D208-N212 WeakPolarHBondContact O-CA 3.43Å; D208-N212 PolarHBondContact O-N 2.7Å; D208-I213 PolarHBondContact N-O 3.3Å; D208-I213 PolarHBondContact O-N 3.31Å; D208-I213 VanDerWaalsContact O-N 3.14Å
209	P	95.5	Very high	97.8	Very high	99 Å²	99	58 Å²	58	64%	0.643	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-20.3	178.5	30.8	-35.5	0	0	0	113.3	R207	R207-P209 WeakPolarHBondContact O-CD 3.19Å
210	T	96.2	Very high	97.7	Very high	118 Å²	118	55.1 Å²	55.1	72%	0.724	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-48.2	-177.7	-48.1	0	0	0	0	110.5	D208 N212	D208-T210 VanDerWaalsContact C-N 3.25Å; D208-T210 PolarHBondContact O-N 3.39Å; D208-T210 WeakPolarHBondContact OD1-CA 3.39Å; D208-T210 VanDerWaalsContact OD1-CB 3.23Å; D208-T210 WeakPolarHBondContact OD1-CB 3.47Å; D208-T210 PolarHBondContact OD1-N 3.31Å; D208-T210 PolarHBondContact OD1-OG1 2.9Å; T210-N212 VanDerWaalsContact C-N 3.33Å
211	Q	95.3	Very high	97.5	Very high	80 Å²	80	60.2 Å²	60.2	37%	0.374	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-10.1	177	-61.4	-59.4	-54.9	0	0	112.7	D208 I213	D208-Q211 HydrophobicContact CB-CB 4.49Å; D208-Q211 PolarHBondContact OD1-N 2.72Å; D208-Q211 VanDerWaalsContact OD1-N 3.13Å; D208-Q211 WeakPolarHBondContact OD2-CG 3.21Å; Q211-I213 VanDerWaalsContact C-N 3.31Å; Q211-I213 HydrophobicContact CB-CD1 3.89Å; Q211-I213 HydrophobicContact CB-CG1 4.2Å
212	N	97.6	Very high	96.8	Very high	61 Å²	61	58 Å²	58	33%	0.326	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	46.1	-173.9	-162.8	30.4	0	0	0	112	K181 M182 D208 T210	K181-N212 WeakPolarHBondContact CA-O 3.29Å; M182-N212 PolarHBondContact N-O 3.32Å; M182-N212 PolarHBondContact O-ND2 3.38Å; D208-N212 WeakPolarHBondContact O-CA 3.43Å; D208-N212 PolarHBondContact O-N 2.7Å; T210-N212 VanDerWaalsContact C-N 3.33Å
213	I	98.5	Very high	95	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.7	-179.3	-70	166.8	0	0	0	109.1	D54 A55 H58 S180 K181 D208 Q211	D54-I213 HydrophobicContact CB-CD1 3.5Å; D54-I213 VanDerWaalsContact CB-CD1 3.5Å; A55-I213 HydrophobicContact CB-CG2 4.34Å; H58-I213 HydrophobicContact CB-CG2 3.8Å; H58-I213 VanDerWaalsContact CE1-CD1 3.42Å; H58-I213 WeakPolarHBondContact CE1-CD1 3.48Å; H58-I213 WeakPolarHBondContact ND1-CD1 3.4Å; S180-I213 WeakPolarHBondContact O-CA 3.34Å; K181-I213 HydrophobicContact CB-CG1 4Å; K181-I213 HydrophobicContact CG-CG1 4.17Å; D208-I213 PolarHBondContact N-O 3.3Å; D208-I213 PolarHBondContact O-N 3.31Å; D208-I213 VanDerWaalsContact O-N 3.14Å; Q211-I213 VanDerWaalsContact C-N 3.31Å; Q211-I213 HydrophobicContact CB-CD1 3.89Å; Q211-I213 HydrophobicContact CB-CG1 4.2Å
214	N	98.6	Very high	92.5	Very high	8 Å²	8	73 Å²	73	4%	0.043	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	147.4	178	-70.1	3.1	0	0	0	110.2	S179 S180 M182 L204 H206 R207 Y216	S179-N214 WeakPolarHBondContact CA-O 2.94Å; S180-N214 PolarHBondContact N-O 3.5Å; S180-N214 PolarHBondContact O-N 2.92Å; M182-N214 HydrophobicContact CG-CB 4.21Å; M182-N214 HydrophobicContact SD-CB 3.86Å; L204-N214 HydrophobicContact CD1-CB 3.73Å; H206-N214 WeakPolarHBondContact O-CA 3.42Å; R207-N214 VanDerWaalsContact CG-OD1 3.3Å; R207-N214 WeakPolarHBondContact CG-OD1 3.43Å; N214-Y216 HydrophobicContact CB-CD2 4.13Å; N214-Y216 HydrophobicContact CB-CE2 3.41Å; N214-Y216 VanDerWaalsContact CB-CE2 3.41Å; N214-Y216 PolarHBondContact ND2-OH 3.15Å
215	I	98.7	Very high	92.2	Very high	1 Å²	1	72.8 Å²	72.8	1%	0.005	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.4	170.1	-55.5	175.4	0	0	0	107.8	H58 L59 Y62 Y177 L178 E205 H206	H58-I215 HydrophobicContact CB-CD1 4.48Å; L59-I215 HydrophobicContact CD1-CD1 4.4Å; L59-I215 HydrophobicContact CD1-CG2 3.98Å; Y62-I215 HydrophobicContact CD1-CD1 4.32Å; Y62-I215 HydrophobicContact CD1-CG2 4.39Å; Y62-I215 HydrophobicContact CD2-CD1 3.94Å; Y62-I215 HydrophobicContact CG-CD1 3.6Å; Y177-I215 HydrophobicContact CD1-CG2 4.19Å; L178-I215 CarbonylContact O-C 3.52Å; L178-I215 WeakPolarHBondContact O-CA 3.4Å; E205-I215 PolarHBondContact N-O 2.83Å; H206-I215 HydrophobicContact CB-CB 4.1Å; H206-I215 HydrophobicContact CB-CD1 4.2Å; H206-I215 HydrophobicContact CB-CG1 4.33Å; H206-I215 PolarHBondContact N-O 2.93Å; H206-I215 PolarHBondContact O-N 2.79Å
216	Y	98.8	Very high	91.9	Very high	28 Å²	28	73.9 Å²	73.9	11%	0.11	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	139.4	177.1	-61.5	-92.7	0	0	0	110	Y177 L178 M182 Y192 V202 K203 L204 N214	Y177-Y216 WeakPolarHBondContact CA-O 3.2Å; L178-Y216 PolarHBondContact N-O 3.04Å; L178-Y216 PolarHBondContact O-N 3.44Å; M182-Y216 HydrophobicContact SD-CE2 4.13Å; Y192-Y216 HydrophobicContact CD1-CD1 4.11Å; Y192-Y216 AromaticContact CD1-CD2 3.34Å; Y192-Y216 HydrophobicContact CD1-CD2 3.34Å; Y192-Y216 HydrophobicContact CD1-CE1 4.36Å; Y192-Y216 AromaticContact CD1-CE2 3.62Å; Y192-Y216 HydrophobicContact CD1-CE2 3.62Å; Y192-Y216 AromaticContact CD1-CG 3.6Å; Y192-Y216 HydrophobicContact CD1-CG 3.6Å; Y192-Y216 HydrophobicContact CD2-CD2 4.12Å; Y192-Y216 AromaticContact CD2-CE2 3.62Å; Y192-Y216 HydrophobicContact CD2-CE2 3.62Å; Y192-Y216 AromaticContact CE1-CD2 3.33Å; Y192-Y216 HydrophobicContact CE1-CD2 3.33Å; Y192-Y216 AromaticContact CE1-CE2 3.88Å; Y192-Y216 HydrophobicContact CE1-CE2 3.88Å; Y192-Y216 AromaticContact CE1-CG 3.83Å; Y192-Y216 HydrophobicContact CE1-CG 3.83Å; Y192-Y216 HydrophobicContact CE2-CD2 4.13Å; Y192-Y216 AromaticContact CE2-CE2 3.89Å; Y192-Y216 HydrophobicContact CE2-CE2 3.89Å; Y192-Y216 HydrophobicContact CG-CD1 4.5Å; Y192-Y216 AromaticContact CG-CD2 3.76Å; Y192-Y216 HydrophobicContact CG-CD2 3.76Å; Y192-Y216 HydrophobicContact CG-CE1 4.29Å; Y192-Y216 AromaticContact CG-CE2 3.48Å; Y192-Y216 HydrophobicContact CG-CE2 3.48Å; Y192-Y216 VanDerWaalsContact CG-CE2 3.48Å; Y192-Y216 HydrophobicContact CG-CG 4.25Å; Y192-Y216 AromaticContact CG-CZ 3.78Å; Y192-Y216 AromaticContact CZ-CD2 3.74Å; V202-Y216 HydrophobicContact CG1-CD1 3.89Å; V202-Y216 HydrophobicContact CG1-CG 4.42Å; K203-Y216 CarbonylContact O-C 3.58Å; K203-Y216 VanDerWaalsContact O-CA 3.23Å; K203-Y216 WeakPolarHBondContact O-CA 3.39Å; L204-Y216 HydrophobicContact CB-CD1 4.11Å; L204-Y216 HydrophobicContact CB-CE1 3.99Å; L204-Y216 HydrophobicContact CD1-CD1 4Å; L204-Y216 HydrophobicContact CD1-CE1 3.62Å; L204-Y216 HydrophobicContact CD1-CE2 4.29Å; L204-Y216 HydrophobicContact CD1-CG 4.48Å; L204-Y216 HydrophobicContact CG-CE1 4.37Å; N214-Y216 HydrophobicContact CB-CD2 4.13Å; N214-Y216 HydrophobicContact CB-CE2 3.41Å; N214-Y216 VanDerWaalsContact CB-CE2 3.41Å; N214-Y216 PolarHBondContact ND2-OH 3.15Å
217	S	98.4	Very high	91.5	Very high	13 Å²	13	74.4 Å²	74.4	9%	0.091	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	147.6	160.5	70.6	0	0	0	0	109.8	V176 V202 K203 E205	V176-S217 CarbonylContact O-C 3.56Å; V176-S217 WeakPolarHBondContact O-CA 3.47Å; V202-S217 WeakPolarHBondContact CA-O 3.49Å; K203-S217 PolarHBondContact N-O 3.3Å; K203-S217 PolarHBondContact O-N 2.94Å; E205-S217 WeakPolarHBondContact OE1-CB 3.23Å; E205-S217 PolarHBondContact OE1-OG 2.8Å
218	A	98.3	Very high	91.2	Very high	2 Å²	2	69.9 Å²	69.9	2%	0.017	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	139.8	176.1	0	0	0	0	0	112.2	V176 L196 F200 H201 V202	V176-A218 HydrophobicContact CB-CB 4.16Å; V176-A218 PolarHBondContact N-O 2.79Å; V176-A218 PolarHBondContact O-N 2.95Å; L196-A218 HydrophobicContact CD2-CB 4.07Å; F200-A218 HydrophobicContact CB-CB 3.95Å; F200-A218 HydrophobicContact CD1-CB 3.99Å; F200-A218 HydrophobicContact CG-CB 4.2Å; H201-A218 VanDerWaalsContact O-CA 3.26Å; H201-A218 WeakPolarHBondContact O-CA 3.37Å; V202-A218 HydrophobicContact CG2-CB 4.3Å
219	T	98	Very high	90.8	Very high	59 Å²	59	72.3 Å²	72.3	36%	0.362	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	137.2	175	50.3	0	0	0	0	110.3	V175 F200 H201 R221	V175-T219 HydrophobicContact CB-CG2 4.48Å; V175-T219 HydrophobicContact CG1-CG2 4.3Å; V175-T219 HydrophobicContact CG2-CG2 3.98Å; F200-T219 CarbonylContact C-O 3.5Å; F200-T219 VanDerWaalsContact CA-O 3.25Å; F200-T219 WeakPolarHBondContact CA-O 3.45Å; F200-T219 WeakPolarHBondContact CB-O 3.29Å; F200-T219 VanDerWaalsContact CD1-C 3.41Å; H201-T219 PolarHBondContact N-O 2.84Å; H201-T219 PolarHBondContact O-N 2.82Å; T219-R221 PolarHBondContact O-N 2.92Å
220	L	97	Very high	90.5	Very high	43 Å²	43	70.5 Å²	70.5	23%	0.225	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	131.4	-176.7	-173.5	66.6	0	0	0	109.9	V167 C170 R199 F200 G222	V167-L220 HydrophobicContact CB-CD1 4.42Å; V167-L220 HydrophobicContact CG1-CD1 4.39Å; V167-L220 HydrophobicContact CG2-CD1 3.94Å; C170-L220 HydrophobicContact CB-CB 4.09Å; R199-L220 HydrophobicContact CB-CD1 4.49Å; F200-L220 HydrophobicContact CD1-CB 4.26Å; F200-L220 HydrophobicContact CD1-CD1 4.44Å; F200-L220 HydrophobicContact CE1-CB 3.92Å; F200-L220 HydrophobicContact CE1-CD1 3.95Å; F200-L220 HydrophobicContact CE2-CD1 4.06Å; F200-L220 HydrophobicContact CZ-CD1 3.73Å; L220-G222 PolarHBondContact O-N 2.9Å
221	R	94.3	Very high	90.1	Very high	106 Å²	106	67.1 Å²	67.1	40%	0.4	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-63.9	136.4	175	-66.9	179.9	-179.4	-154.1	-2.1	109.3	P197 R199 F200 H201 T219	P197-R221 PolarHBondContact O-NE 2.99Å; P197-R221 VanDerWaalsContact O-NE 3.15Å; P197-R221 PolarHBondContact O-NH2 2.83Å; R199-R221 VanDerWaalsContact O-CB 3.32Å; R199-R221 WeakPolarHBondContact O-CB 3.42Å; R199-R221 VanDerWaalsContact O-CG 3.28Å; R199-R221 WeakPolarHBondContact O-CG 3.5Å; R199-R221 PolarHBondContact O-N 2.98Å; F200-R221 PolarHBondContact O-NE 3Å; F200-R221 PolarHBondContact O-NH2 3.02Å; H201-R221 PolarHBondContact ND1-NE 3.42Å; T219-R221 PolarHBondContact O-N 2.92Å
222	G	81.4	Confident	89.7	Confident	65 Å²	65	66.1 Å²	66.1	67%	0.67	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-56.2	150.8	170.4	0	0	0	0	0	110.8	L220 Q224	L220-G222 PolarHBondContact O-N 2.9Å; G222-Q224 PolarHBondContact O-N 3.39Å; G222-Q224 VanDerWaalsContact O-N 3.09Å
223	K	62.1	Low	89	Confident	214 Å²	214	66.5 Å²	66.5	93%	0.93	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-57	118.8	170.6	-69.5	-175.3	179.3	-178.9	0	107.8
224	Q	44.3	Very low	88.2	Confident	259 Å²	259	72.5 Å²	72.5	100%	1.21	37%	0.369	S	S	*	.			trans	-64.9	0	163.4	-73.6	-175.4	-9.8	0	0	109.7	G222	G222-Q224 PolarHBondContact O-N 3.39Å; G222-Q224 VanDerWaalsContact O-N 3.09Å

Retrieved 224 of 224 residues in 103.1 ms (Link to these results)

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