A0A096N9X9_PAPAN Loading...

Methionine adenosyltransferase 2 subunit beta

Regulatory subunit of S-adenosylmethionine synthetase 2, an enzyme that catalyzes the formation of S-adenosylmethionine from methionine and ATP. Regulates MAT2A catalytic activity by changing its kinetic properties, increasing its affinity for L-methionine. Can bind NADP (in vitro).

AlphaFold DB (A0A0D9RCY8), UniProt , Accession A0A096N9X9, Species PAPAN (Papio anubis, Olive baboon), Gene MAT2B, Length 334 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	38.5	Very low	64.5	Low	222 Å²	222	108.3 Å²	108.3	100%	1.094	54%	0.539	S	S	*	.				0	128.7	0	-77.3	-176.6	-86.9	0	0	107.6
2	V	46	Very low	66.1	Low	78 Å²	78	113.4 Å²	113.4	47%	0.473	56%	0.556	S	S	.	*			trans	-76.9	124.2	175.6	-174	0	0	0	0	106.8	N25 I26	V2-N25 HydrophobicContact CG1-CB 3.78Å; V2-N25 WeakPolarHBondContact CG1-OD1 3.38Å; V2-I26 VanDerWaalsContact CG1-O 3.28Å; V2-I26 WeakPolarHBondContact CG1-O 3.5Å
3	G	51.8	Low	67.5	Low	38 Å²	38	110.2 Å²	110.2	39%	0.392	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	133.2	171.5	0	0	0	0	0	108.7	I26	G3-I26 WeakPolarHBondContact O-CG1 3.46Å; G3-I26 PolarHBondContact O-N 3.32Å
4	R	51.3	Low	68.3	Low	167 Å²	167	112.1 Å²	112.1	63%	0.63	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.8	123.5	172.1	-60	-170.5	-167.1	178.7	3.8	107.5	E23	R4-E23 WeakPolarHBondContact CD-OE2 3.35Å; R4-E23 IonicContact CZ-OE2 3.68Å; R4-E23 IonicContact NE-OE2 2.83Å; R4-E23 IonicContact NH1-OE2 2.87Å; R4-E23 PolarHBondContact NH1-OE2 3.06Å
5	E	60.5	Low	69.4	Low	110 Å²	110	110.8 Å²	110.8	51%	0.514	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.4	158.4	166.7	-97.7	170.6	-163.1	0	0	109.1	V24 I26	E5-V24 PolarHBondContact N-O 3.12Å; E5-V24 PolarHBondContact O-N 3.01Å; E5-I26 HydrophobicContact CB-CD1 3.64Å; E5-I26 HydrophobicContact CB-CG1 3.95Å; E5-I26 VanDerWaalsContact CD-CD1 3.41Å; E5-I26 HydrophobicContact CG-CD1 3.55Å; E5-I26 HydrophobicContact CG-CG1 4.41Å
6	K	65.2	Low	70.2	Confident	134 Å²	134	107.2 Å²	107.2	58%	0.583	58%	0.582	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.4	116	175	-63.8	-159.8	178.9	-172	0	108.6	E21	K6-E21 HydrophobicContact CB-CG 3.93Å; K6-E21 HydrophobicContact CD-CG 3.84Å; K6-E21 WeakPolarHBondContact CD-OE1 3.3Å; K6-E21 WeakPolarHBondContact CD-OE2 3.07Å; K6-E21 HydrophobicContact CG-CG 4.42Å; K6-E21 IonicContact NZ-OE1 2.73Å; K6-E21 PolarHBondContact NZ-OE1 3.28Å; K6-E21 IonicContact NZ-OE2 2.73Å; K6-E21 PolarHBondContact NZ-OE2 2.83Å
7	E	71.6	Confident	70.7	Confident	123 Å²	123	105.5 Å²	105.5	58%	0.575	58%	0.579	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.8	140.5	175	-163.4	173.7	172.6	0	0	109.6	E21 E22 V24	E7-E21 WeakPolarHBondContact O-CA 3.38Å; E7-E22 PolarHBondContact N-O 3.15Å; E7-E22 VanDerWaalsContact N-O 3.1Å; E7-E22 PolarHBondContact O-N 2.8Å; E7-V24 HydrophobicContact CB-CG2 3.55Å
8	L	77.2	Confident	71.7	Confident	120 Å²	120	108.9 Å²	108.9	63%	0.628	58%	0.582	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90.2	108.4	174.2	-77.9	164.3	0	0	0	109	L19 V20 E21	L8-L19 HydrophobicContact CB-CD2 4.16Å; L8-L19 HydrophobicContact CD2-CD2 3.92Å; L8-L19 HydrophobicContact CG-CD2 4.48Å; L8-V20 WeakPolarHBondContact CA-O 3.45Å; L8-E21 HydrophobicContact CD2-CB 4.39Å
9	S	77	Confident	72.2	Confident	29 Å²	29	109.7 Å²	109.7	20%	0.203	59%	0.585	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.2	147	175.3	56.9	0	0	0	0	110.9	H11 L19 V20	S9-H11 PolarHBondContact OG-NE2 2.94Å; S9-L19 WeakPolarHBondContact O-CA 3.49Å; S9-V20 PolarHBondContact N-O 3.23Å; S9-V20 PolarHBondContact O-N 3.47Å; S9-V20 PolarHBondContact OG-O 3.31Å
10	I	85.8	Confident	72.9	Confident	93 Å²	93	106.4 Å²	106.4	48%	0.477	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.5	112.9	176.6	-59.5	-179.3	0	0	0	108.4	F12 C17 L19	I10-F12 HydrophobicContact CB-CE2 4.39Å; I10-F12 HydrophobicContact CG2-CD2 4.38Å; I10-F12 HydrophobicContact CG2-CE1 4.34Å; I10-F12 HydrophobicContact CG2-CE2 3.8Å; I10-F12 HydrophobicContact CG2-CZ 3.79Å; I10-C17 WeakPolarHBondContact CG2-SG 3.39Å; I10-L19 HydrophobicContact CG1-CD2 4.41Å; I10-L19 HydrophobicContact CG1-CG 4.41Å
11	H	85.1	Confident	73.1	Confident	77 Å²	77	106.7 Å²	106.7	36%	0.356	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.6	118.2	178.9	-73.5	-154.3	0	0	0	109.6	S9 R18 V20 E22	S9-H11 PolarHBondContact OG-NE2 2.94Å; H11-R18 PolarHBondContact N-O 2.74Å; H11-R18 PolarHBondContact O-N 3.12Å; H11-V20 HydrophobicContact CB-CG2 4.08Å; H11-E22 IonicContact CE1-OE1 3.06Å; H11-E22 PolarHBondContact CE1-OE1 3Å; H11-E22 IonicContact NE2-OE1 2.76Å; H11-E22 PolarHBondContact NE2-OE1 3.17Å
12	F	82.7	Confident	75.1	Confident	170 Å²	170	100.1 Å²	100.1	75%	0.746	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	123.7	172.7	-64.2	-84.8	0	0	0	109.6	I10	I10-F12 HydrophobicContact CB-CE2 4.39Å; I10-F12 HydrophobicContact CG2-CD2 4.38Å; I10-F12 HydrophobicContact CG2-CE1 4.34Å; I10-F12 HydrophobicContact CG2-CE2 3.8Å; I10-F12 HydrophobicContact CG2-CZ 3.79Å
13	V	84.4	Confident	76	Confident	72 Å²	72	102.4 Å²	102.4	44%	0.436	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	147.5	170.5	-103.4	0	0	0	0	107.9	G15 S16	V13-G15 PolarHBondContact O-N 3.29Å; V13-S16 VanDerWaalsContact CG2-OG 3.22Å; V13-S16 WeakPolarHBondContact CG2-OG 3.22Å; V13-S16 PolarHBondContact N-O 2.88Å; V13-S16 PolarHBondContact O-N 3.43Å
14	P	78.9	Confident	76.4	Confident	136 Å²	136	103.2 Å²	103.2	88%	0.883	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	117.7	178.9	-27.6	35.3	0	0	0	111.3
15	G	84.4	Confident	76.5	Confident	93 Å²	93	100.1 Å²	100.1	96%	0.959	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	2	-179.4	0	0	0	0	0	116.9	V13	V13-G15 PolarHBondContact O-N 3.29Å
16	S	82.5	Confident	76.2	Confident	53 Å²	53	97.7 Å²	97.7	37%	0.371	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	155.7	173.4	62	0	0	0	0	114.1	V13	V13-S16 VanDerWaalsContact CG2-OG 3.22Å; V13-S16 WeakPolarHBondContact CG2-OG 3.22Å; V13-S16 PolarHBondContact N-O 2.88Å; V13-S16 PolarHBondContact O-N 3.43Å
17	C	78.2	Confident	75.7	Confident	78 Å²	78	94 Å²	94	53%	0.527	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	132.7	173.1	179.3	0	0	0	0	107.9	I10	I10-C17 WeakPolarHBondContact CG2-SG 3.39Å
18	R	88.5	Confident	75.6	Confident	168 Å²	168	90.8 Å²	90.8	63%	0.634	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.3	132.6	178.9	-60.9	-176.5	-174.4	-179.3	0.8	109.8	H11 V20	H11-R18 PolarHBondContact N-O 2.74Å; H11-R18 PolarHBondContact O-N 3.12Å; R18-V20 HydrophobicContact CB-CG2 4.49Å
19	L	82.1	Confident	76	Confident	123 Å²	123	88.1 Å²	88.1	64%	0.644	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	125.4	163	-92.5	134.5	0	0	0	108.1	L8 S9 I10	L8-L19 HydrophobicContact CB-CD2 4.16Å; L8-L19 HydrophobicContact CD2-CD2 3.92Å; L8-L19 HydrophobicContact CG-CD2 4.48Å; S9-L19 WeakPolarHBondContact O-CA 3.49Å; I10-L19 HydrophobicContact CG1-CD2 4.41Å; I10-L19 HydrophobicContact CG1-CG 4.41Å
20	V	86.1	Confident	77	Confident	43 Å²	43	89.9 Å²	89.9	26%	0.261	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	134	177	-168.7	0	0	0	0	107.5	L8 S9 H11 R18 E22	L8-V20 WeakPolarHBondContact CA-O 3.45Å; S9-V20 PolarHBondContact N-O 3.23Å; S9-V20 PolarHBondContact O-N 3.47Å; S9-V20 PolarHBondContact OG-O 3.31Å; H11-V20 HydrophobicContact CB-CG2 4.08Å; R18-V20 HydrophobicContact CB-CG2 4.49Å; V20-E22 HydrophobicContact CB-CG 4.36Å; V20-E22 HydrophobicContact CG1-CG 3.75Å
21	E	77.9	Confident	77.6	Confident	114 Å²	114	85.4 Å²	85.4	53%	0.533	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	108.5	171.2	-165.8	-177.1	-144.9	0	0	106.6	K6 E7 L8	K6-E21 HydrophobicContact CB-CG 3.93Å; K6-E21 HydrophobicContact CD-CG 3.84Å; K6-E21 WeakPolarHBondContact CD-OE1 3.3Å; K6-E21 WeakPolarHBondContact CD-OE2 3.07Å; K6-E21 HydrophobicContact CG-CG 4.42Å; K6-E21 IonicContact NZ-OE1 2.73Å; K6-E21 PolarHBondContact NZ-OE1 3.28Å; K6-E21 IonicContact NZ-OE2 2.73Å; K6-E21 PolarHBondContact NZ-OE2 2.83Å; E7-E21 WeakPolarHBondContact O-CA 3.38Å; L8-E21 HydrophobicContact CD2-CB 4.39Å
22	E	80	Confident	78.2	Confident	83 Å²	83	81.8 Å²	81.8	39%	0.388	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	139.3	-177.6	-65	-168.6	158.6	0	0	110.7	E7 H11 V20 V24	E7-E22 PolarHBondContact N-O 3.15Å; E7-E22 VanDerWaalsContact N-O 3.1Å; E7-E22 PolarHBondContact O-N 2.8Å; H11-E22 IonicContact CE1-OE1 3.06Å; H11-E22 PolarHBondContact CE1-OE1 3Å; H11-E22 IonicContact NE2-OE1 2.76Å; H11-E22 PolarHBondContact NE2-OE1 3.17Å; V20-E22 HydrophobicContact CB-CG 4.36Å; V20-E22 HydrophobicContact CG1-CG 3.75Å; E22-V24 HydrophobicContact CB-CG2 4.42Å; E22-V24 PolarHBondContact O-N 3.49Å
23	E	64.7	Low	79	Confident	126 Å²	126	73.7 Å²	73.7	59%	0.589	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	104.6	166.5	-78	-167.2	177.7	0	0	108.5	R4	R4-E23 WeakPolarHBondContact CD-OE2 3.35Å; R4-E23 IonicContact CZ-OE2 3.68Å; R4-E23 IonicContact NE-OE2 2.83Å; R4-E23 IonicContact NH1-OE2 2.87Å; R4-E23 PolarHBondContact NH1-OE2 3.06Å
24	V	59.9	Low	79.7	Confident	55 Å²	55	70.3 Å²	70.3	33%	0.333	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	130	178.1	-156.3	0	0	0	0	108.6	E5 E7 E22 I26	E5-V24 PolarHBondContact N-O 3.12Å; E5-V24 PolarHBondContact O-N 3.01Å; E7-V24 HydrophobicContact CB-CG2 3.55Å; E22-V24 HydrophobicContact CB-CG2 4.42Å; E22-V24 PolarHBondContact O-N 3.49Å; V24-I26 PolarHBondContact O-N 3.21Å; V24-I26 VanDerWaalsContact O-N 3.07Å
25	N	54	Low	80.6	Confident	103 Å²	103	64.4 Å²	64.4	55%	0.551	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	107	170.1	-82.7	-37.2	0	0	0	108.1	V2 P27	V2-N25 HydrophobicContact CG1-CB 3.78Å; V2-N25 WeakPolarHBondContact CG1-OD1 3.38Å; N25-P27 VanDerWaalsContact O-CD 3.29Å; N25-P27 WeakPolarHBondContact O-CD 3.29Å
26	I	53.5	Low	81.3	Confident	58 Å²	58	60 Å²	60	30%	0.297	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	120.1	167.5	-38.6	169.5	0	0	0	105.1	V2 G3 E5 V24 N28	V2-I26 VanDerWaalsContact CG1-O 3.28Å; V2-I26 WeakPolarHBondContact CG1-O 3.5Å; G3-I26 WeakPolarHBondContact O-CG1 3.46Å; G3-I26 PolarHBondContact O-N 3.32Å; E5-I26 HydrophobicContact CB-CD1 3.64Å; E5-I26 HydrophobicContact CB-CG1 3.95Å; E5-I26 VanDerWaalsContact CD-CD1 3.41Å; E5-I26 HydrophobicContact CG-CD1 3.55Å; E5-I26 HydrophobicContact CG-CG1 4.41Å; V24-I26 PolarHBondContact O-N 3.21Å; V24-I26 VanDerWaalsContact O-N 3.07Å; I26-N28 PolarHBondContact O-N 3.31Å
27	P	55.6	Low	82	Confident	58 Å²	58	58.2 Å²	58.2	38%	0.377	29%	0.292	S	S	.	.			trans	-60.3	125.2	178.1	-21	34.4	0	0	0	107.1	N25 R29	N25-P27 VanDerWaalsContact O-CD 3.29Å; N25-P27 WeakPolarHBondContact O-CD 3.29Å; P27-R29 VanDerWaalsContact C-N 3.34Å; P27-R29 VanDerWaalsContact CB-CZ 3.43Å; P27-R29 VanDerWaalsContact O-CG 3.29Å; P27-R29 WeakPolarHBondContact O-CG 3.17Å; P27-R29 PolarHBondContact O-N 3.23Å
28	N	68.1	Low	83	Confident	54 Å²	54	55.4 Å²	55.4	29%	0.289	28%	0.276	S	S	.	.			trans	-61.1	95.7	-178.5	-175.7	9.8	0	0	0	109.3	I26 R30 H54 H88	I26-N28 PolarHBondContact O-N 3.31Å; N28-R30 PolarHBondContact O-N 2.87Å; N28-H54 WeakPolarHBondContact OD1-CB 3.49Å; N28-H88 PolarHBondContact O-CE1 2.9Å
29	R	85.9	Confident	83.4	Confident	64 Å²	64	48.2 Å²	48.2	24%	0.242	25%	0.25	C	S	.	.			trans	-79.5	105.8	-173.7	-57.3	-58	-174.3	-158.2	-1.9	109.2	P27 W53 H54	P27-R29 VanDerWaalsContact C-N 3.34Å; P27-R29 VanDerWaalsContact CB-CZ 3.43Å; P27-R29 VanDerWaalsContact O-CG 3.29Å; P27-R29 WeakPolarHBondContact O-CG 3.17Å; P27-R29 PolarHBondContact O-N 3.23Å; R29-W53 HydrophobicContact CB-CD2 3.57Å; R29-W53 HydrophobicContact CB-CE3 3.27Å; R29-W53 HydrophobicContact CB-CG 4.36Å; R29-W53 HydrophobicContact CB-CH2 3.7Å; R29-W53 HydrophobicContact CB-CZ2 3.96Å; R29-W53 HydrophobicContact CB-CZ3 3.38Å; R29-W53 HydrophobicContact CG-CD2 4.48Å; R29-W53 HydrophobicContact CG-CE3 4.42Å; R29-W53 HydrophobicContact CG-CH2 4.07Å; R29-W53 HydrophobicContact CG-CZ2 4.14Å; R29-W53 HydrophobicContact CG-CZ3 4.24Å; R29-W53 VanDerWaalsContact O-CE3 3.28Å; R29-H54 PolarHBondContact O-N 3.36Å
30	R	97.9	Very high	84.2	Confident	66 Å²	66	43 Å²	43	25%	0.249	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	128.4	174	-65.3	-174.4	-59.8	-77.3	-1.5	111.5	N28 H54 F85 Q86 H88 V89	N28-R30 PolarHBondContact O-N 2.87Å; R30-H54 WeakPolarHBondContact CA-O 3.47Å; R30-H54 HydrophobicContact CG-CB 4.07Å; R30-F85 HydrophobicContact CB-CE1 3.82Å; R30-F85 HydrophobicContact CB-CE2 4.28Å; R30-F85 HydrophobicContact CB-CZ 3.65Å; R30-F85 WeakPolarHBondContact CD-O 3.35Å; R30-F85 HydrophobicContact CG-CE2 4.19Å; R30-F85 HydrophobicContact CG-CZ 4.02Å; R30-F85 PolarHBondContact NE-O 2.85Å; R30-Q86 PolarHBondContact NE-O 3.42Å; R30-Q86 PolarHBondContact NH2-O 2.86Å; R30-H88 PolarHBondContact N-ND1 3.07Å; R30-H88 PolarHBondContact NH1-CE1 2.99Å; R30-H88 PolarHBondContact O-N 2.91Å; R30-V89 PolarHBondContact O-N 3.25Å
31	V	98.8	Very high	84.8	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	129.7	174.2	58.8	0	0	0	0	110.8	V33 F48 W53 H54 A55 V56 V89 V91	V31-V33 HydrophobicContact CG2-CG2 4.17Å; V31-F48 HydrophobicContact CB-CD1 4.16Å; V31-F48 HydrophobicContact CB-CE1 4.38Å; V31-F48 HydrophobicContact CB-CG 4.44Å; V31-F48 HydrophobicContact CG1-CB 3.7Å; V31-F48 HydrophobicContact CG1-CD1 3.71Å; V31-F48 HydrophobicContact CG1-CD2 4.44Å; V31-F48 HydrophobicContact CG1-CE1 4.41Å; V31-F48 HydrophobicContact CG1-CG 3.71Å; V31-F48 HydrophobicContact CG2-CD1 4.19Å; V31-F48 HydrophobicContact CG2-CD2 4.27Å; V31-F48 HydrophobicContact CG2-CE1 4.13Å; V31-F48 HydrophobicContact CG2-CE2 4.25Å; V31-F48 HydrophobicContact CG2-CG 4.25Å; V31-F48 HydrophobicContact CG2-CZ 4.16Å; V31-W53 HydrophobicContact CB-CE3 3.76Å; V31-W53 HydrophobicContact CB-CZ3 4.19Å; V31-W53 HydrophobicContact CG1-CB 4.01Å; V31-W53 HydrophobicContact CG1-CD2 4.47Å; V31-W53 HydrophobicContact CG1-CE3 3.92Å; V31-H54 PolarHBondContact N-O 3.27Å; V31-A55 HydrophobicContact CG1-CB 3.77Å; V31-A55 WeakPolarHBondContact O-CA 3.49Å; V31-V56 PolarHBondContact O-N 2.98Å; V31-V89 CarbonylContact C-O 3.4Å; V31-V89 VanDerWaalsContact CA-O 3.26Å; V31-V89 WeakPolarHBondContact CA-O 3.31Å; V31-V89 HydrophobicContact CB-CB 4.28Å; V31-V89 HydrophobicContact CG2-CB 4.02Å; V31-V89 HydrophobicContact CG2-CG1 4Å; V31-V91 HydrophobicContact CG2-CG2 4.13Å
32	L	98.9	Very high	85.8	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.7	172.3	177.7	64.6	0	0	0	109.2	V56 I81 I82 F85 P87 V89 I90 V91	L32-V56 CarbonylContact C-O 3.52Å; L32-V56 WeakPolarHBondContact CA-O 3.48Å; L32-V56 HydrophobicContact CD1-CB 4.41Å; L32-V56 HydrophobicContact CD1-CG1 4.02Å; L32-I81 HydrophobicContact CD1-CD1 3.91Å; L32-I81 HydrophobicContact CD1-CG1 4.36Å; L32-I82 HydrophobicContact CD2-CG1 3.81Å; L32-F85 HydrophobicContact CB-CD1 4.15Å; L32-F85 HydrophobicContact CB-CE1 4.2Å; L32-P87 HydrophobicContact CB-CB 4.01Å; L32-P87 HydrophobicContact CB-CG 4.29Å; L32-V89 PolarHBondContact N-O 2.89Å; L32-I90 HydrophobicContact CB-CG1 4.22Å; L32-I90 CarbonylContact O-C 3.43Å; L32-I90 VanDerWaalsContact O-CA 3.3Å; L32-I90 WeakPolarHBondContact O-CA 3.31Å; L32-V91 PolarHBondContact O-N 2.87Å
33	V	98.9	Very high	86.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	108.3	177.3	-175.8	0	0	0	0	109	V31 A36 V44 H45 V56 G57 C58	V31-V33 HydrophobicContact CG2-CG2 4.17Å; V33-A36 HydrophobicContact CG1-CB 4.38Å; V33-V44 HydrophobicContact CG1-CB 4.13Å; V33-V44 HydrophobicContact CG1-CG1 3.87Å; V33-V44 HydrophobicContact CG2-CG1 3.81Å; V33-H45 HydrophobicContact CG2-CB 4.42Å; V33-V56 PolarHBondContact N-O 3.23Å; V33-G57 WeakPolarHBondContact O-CA 3.38Å; V33-C58 PolarHBondContact O-N 3.41Å
34	T	98.8	Very high	88.4	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	147.7	172.8	71.7	0	0	0	0	110.3	A36 L72 V91 H92 C93 L120	T34-A36 VanDerWaalsContact C-N 3.26Å; T34-A36 PolarHBondContact O-N 3.48Å; T34-L72 HydrophobicContact CG2-CD2 4.2Å; T34-V91 PolarHBondContact N-O 2.82Å; T34-H92 VanDerWaalsContact OG1-CA 3.3Å; T34-H92 WeakPolarHBondContact OG1-CA 3.43Å; T34-H92 PolarHBondContact OG1-ND1 2.7Å; T34-C93 VanDerWaalsContact O-CB 3.25Å; T34-C93 WeakPolarHBondContact O-CB 3.48Å; T34-C93 PolarHBondContact O-N 2.86Å; T34-C93 PolarHBondContact OG1-N 2.81Å; T34-L120 HydrophobicContact CG2-CD1 4.32Å; T34-L120 HydrophobicContact CG2-CD2 4.03Å
35	G	98.3	Very high	90.2	Very high	11 Å²	11	26.4 Å²	26.4	11%	0.113	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	25.3	-174.5	0	0	0	0	0	112.6	T37 G38 G41 C58	G35-T37 PolarHBondContact O-N 2.87Å; G35-G38 PolarHBondContact O-N 3.04Å; G35-G41 WeakPolarHBondContact O-CA 3.41Å; G35-C58 PolarHBondContact N-O 2.77Å
36	A	98.6	Very high	92.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-18.7	-179	0	0	0	0	0	113.8	V33 T34 G41 R42 C58 F67	V33-A36 HydrophobicContact CG1-CB 4.38Å; T34-A36 VanDerWaalsContact C-N 3.26Å; T34-A36 PolarHBondContact O-N 3.48Å; A36-G41 CarbonylContact O-C 3.52Å; A36-R42 WeakPolarHBondContact O-CA 2.9Å; A36-R42 WeakPolarHBondContact O-CG 3.42Å; A36-R42 PolarHBondContact O-N 3.41Å; A36-R42 VanDerWaalsContact O-N 3.16Å; A36-C58 PolarHBondContact N-O 3.28Å; A36-F67 HydrophobicContact CB-CD1 4.03Å; A36-F67 HydrophobicContact CB-CD2 4.11Å; A36-F67 HydrophobicContact CB-CE1 3.98Å; A36-F67 HydrophobicContact CB-CE2 4.05Å; A36-F67 HydrophobicContact CB-CG 4.08Å; A36-F67 HydrophobicContact CB-CZ 3.97Å; A36-F67 WeakPolarHBondContact O-CE2 3.38Å
37	T	98.2	Very high	94.5	Very high	16 Å²	16	24.4 Å²	24.4	10%	0.098	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-11.2	173.9	56.3	0	0	0	0	114.1	G35 R42 R62 F67	G35-T37 PolarHBondContact O-N 2.87Å; T37-R42 PolarHBondContact O-NH1 3.27Å; T37-R62 VanDerWaalsContact CG2-C 3.46Å; T37-R62 HydrophobicContact CG2-CB 3.89Å; T37-R62 VanDerWaalsContact CG2-O 3.26Å; T37-R62 WeakPolarHBondContact CG2-O 3.24Å; T37-R62 PolarHBondContact O-NH1 3.22Å; T37-R62 PolarHBondContact O-NH2 3.12Å; T37-F67 HydrophobicContact CG2-CD2 3.76Å; T37-F67 HydrophobicContact CG2-CE2 4.41Å
38	G	97.9	Very high	96.5	Very high	19 Å²	19	21.7 Å²	21.7	20%	0.196	11%	0.107	C	C	.	.	S	Bend	trans	-87.3	169.1	179.7	0	0	0	0	0	112.7	G35 L40 G41 R42	G35-G38 PolarHBondContact O-N 3.04Å; G38-L40 PolarHBondContact O-N 2.88Å; G38-G41 PolarHBondContact O-N 2.84Å; G38-R42 WeakPolarHBondContact O-CG 3.36Å; G38-R42 PolarHBondContact O-N 3.39Å
39	L	98.4	Very high	97.9	Very high	17 Å²	17	24.5 Å²	24.5	9%	0.089	12%	0.118	C	C	.	.	H	α-helix	trans	-48	-55.3	-177.7	-178.7	59.3	0	0	0	113.5	L185 V189 E194 V224	L39-L185 HydrophobicContact CD2-CB 4.3Å; L39-V189 HydrophobicContact CD1-CG1 3.88Å; L39-E194 HydrophobicContact CB-CG 4.23Å; L39-V224 HydrophobicContact CD1-CG1 4.47Å; L39-V224 HydrophobicContact CD2-CG1 4.34Å; L39-V224 HydrophobicContact CG-CG1 3.86Å
40	L	98.8	Very high	98.5	Very high	13 Å²	13	27.3 Å²	27.3	7%	0.068	13%	0.134	C	C	.	.	H	α-helix	trans	-72.4	-45.2	178.8	179.1	60.4	0	0	0	112	G38 R42 A43 V44 I134 I182 L185 V224 V227	G38-L40 PolarHBondContact O-N 2.88Å; L40-R42 VanDerWaalsContact C-N 3.27Å; L40-R42 PolarHBondContact O-N 3.48Å; L40-A43 PolarHBondContact O-N 3.38Å; L40-V44 HydrophobicContact CD1-CG2 3.82Å; L40-V44 HydrophobicContact CG-CG2 3.87Å; L40-V44 WeakPolarHBondContact O-CG2 3.49Å; L40-V44 PolarHBondContact O-N 3.35Å; L40-I134 HydrophobicContact CD2-CB 4.4Å; L40-I134 HydrophobicContact CD2-CD1 4.23Å; L40-I134 HydrophobicContact CD2-CG1 3.92Å; L40-I134 HydrophobicContact CD2-CG2 3.77Å; L40-I182 HydrophobicContact CD2-CD1 3.8Å; L40-L185 HydrophobicContact CB-CD1 4.04Å; L40-L185 HydrophobicContact CD2-CD1 4.21Å; L40-L185 HydrophobicContact CG-CD1 4.49Å; L40-V224 HydrophobicContact CB-CG1 4.36Å; L40-V224 HydrophobicContact CD1-CB 4.06Å; L40-V224 HydrophobicContact CD1-CG1 4.15Å; L40-V227 HydrophobicContact CD1-CB 3.77Å; L40-V227 HydrophobicContact CD1-CG1 3.66Å; L40-V227 HydrophobicContact CD2-CG1 4.17Å
41	G	98.7	Very high	98.4	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-59.5	-35.5	-175.5	0	0	0	0	0	113.5	G35 A36 G38 A43 V44 H45	G35-G41 WeakPolarHBondContact O-CA 3.41Å; A36-G41 CarbonylContact O-C 3.52Å; G38-G41 PolarHBondContact O-N 2.84Å; G41-A43 VanDerWaalsContact C-N 3.35Å; G41-A43 PolarHBondContact O-N 3.08Å; G41-V44 PolarHBondContact O-N 3.45Å; G41-H45 VanDerWaalsContact O-CB 3.31Å; G41-H45 WeakPolarHBondContact O-CB 3.41Å; G41-H45 PolarHBondContact O-N 3.35Å
42	R	98.8	Very high	98.1	Very high	47 Å²	47	33.4 Å²	33.4	18%	0.177	17%	0.171	C	C	.	.	H	α-helix	trans	-60.7	-44	174	-73.4	-167.5	-54.8	-96.8	-3.6	111.7	A36 T37 G38 L40 K46 E188 E190 E194	A36-R42 WeakPolarHBondContact O-CA 2.9Å; A36-R42 WeakPolarHBondContact O-CG 3.42Å; A36-R42 PolarHBondContact O-N 3.41Å; A36-R42 VanDerWaalsContact O-N 3.16Å; T37-R42 PolarHBondContact O-NH1 3.27Å; G38-R42 WeakPolarHBondContact O-CG 3.36Å; G38-R42 PolarHBondContact O-N 3.39Å; L40-R42 VanDerWaalsContact C-N 3.27Å; L40-R42 PolarHBondContact O-N 3.48Å; R42-K46 VanDerWaalsContact O-CB 3.29Å; R42-K46 WeakPolarHBondContact O-CB 3.19Å; R42-K46 PolarHBondContact O-N 3.43Å; R42-K46 VanDerWaalsContact O-N 3.11Å; R42-E188 PolarHBondContact NH2-O 2.93Å; R42-E190 IonicContact CZ-OE1 2.77Å; R42-E190 IonicContact NE-OE1 3.4Å; R42-E190 VanDerWaalsContact NH1-CD 3.28Å; R42-E190 IonicContact NH1-OE1 2.78Å; R42-E190 PolarHBondContact NH1-OE1 2.79Å; R42-E190 IonicContact NH1-OE2 3.49Å; R42-E194 IonicContact CZ-OE1 2.79Å; R42-E194 IonicContact CZ-OE2 3.87Å; R42-E194 IonicContact NH1-OE1 2.76Å; R42-E194 PolarHBondContact NH1-OE1 3.45Å; R42-E194 IonicContact NH1-OE2 2.85Å; R42-E194 PolarHBondContact NH1-OE2 3.26Å; R42-E194 IonicContact NH2-OE1 3.58Å; R42-E194 PolarHBondContact NH2-OE1 3.15Å; R42-E194 IonicContact NH2-OE2 2.88Å; R42-E194 PolarHBondContact NH2-OE2 3.42Å
43	A	98.8	Very high	98	Very high	13 Å²	13	34.3 Å²	34.3	11%	0.107	18%	0.175	C	C	.	.	H	α-helix	trans	-69.7	-45.1	179.5	0	0	0	0	0	111.6	L40 G41 K46 E47 V224 A228	L40-A43 PolarHBondContact O-N 3.38Å; G41-A43 VanDerWaalsContact C-N 3.35Å; G41-A43 PolarHBondContact O-N 3.08Å; A43-K46 PolarHBondContact O-N 3.08Å; A43-E47 WeakPolarHBondContact O-CB 3.43Å; A43-E47 PolarHBondContact O-N 2.86Å; A43-V224 HydrophobicContact CB-CB 3.82Å; A43-V224 HydrophobicContact CB-CG2 3.64Å; A43-A228 HydrophobicContact CB-CB 4.13Å
44	V	98.9	Very high	97.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.8	-52.3	176.7	173.7	0	0	0	0	110.6	V33 L40 G41 K46 E47 F48 V91 A228	V33-V44 HydrophobicContact CG1-CB 4.13Å; V33-V44 HydrophobicContact CG1-CG1 3.87Å; V33-V44 HydrophobicContact CG2-CG1 3.81Å; L40-V44 HydrophobicContact CD1-CG2 3.82Å; L40-V44 HydrophobicContact CG-CG2 3.87Å; L40-V44 WeakPolarHBondContact O-CG2 3.49Å; L40-V44 PolarHBondContact O-N 3.35Å; G41-V44 PolarHBondContact O-N 3.45Å; V44-K46 VanDerWaalsContact C-N 3.3Å; V44-K46 PolarHBondContact O-N 3.47Å; V44-E47 PolarHBondContact O-N 3.43Å; V44-F48 HydrophobicContact CG1-CD2 3.8Å; V44-F48 HydrophobicContact CG1-CE2 3.83Å; V44-F48 WeakPolarHBondContact O-CD2 3.2Å; V44-F48 PolarHBondContact O-N 3.22Å; V44-F48 VanDerWaalsContact O-N 3.08Å; V44-V91 HydrophobicContact CG1-CB 4.01Å; V44-V91 HydrophobicContact CG1-CG1 3.91Å; V44-V91 HydrophobicContact CG1-CG2 4.12Å; V44-A228 HydrophobicContact CB-CB 4.49Å; V44-A228 HydrophobicContact CG2-CB 4.1Å
45	H	98.8	Very high	97.9	Very high	13 Å²	13	38.9 Å²	38.9	6%	0.06	20%	0.198	C	C	.	.	H	α-helix	trans	-57.4	-44.5	178.1	176.5	-83.2	0	0	0	112.1	V33 G41 Q49 G57 F67	V33-H45 HydrophobicContact CG2-CB 4.42Å; G41-H45 VanDerWaalsContact O-CB 3.31Å; G41-H45 WeakPolarHBondContact O-CB 3.41Å; G41-H45 PolarHBondContact O-N 3.35Å; H45-Q49 PolarHBondContact CE1-OE1 2.82Å; H45-Q49 WeakPolarHBondContact O-CB 3.37Å; H45-Q49 PolarHBondContact O-N 3.01Å; H45-G57 PolarHBondContact CD2-N 2.91Å; H45-F67 AromaticContact CD2-CE1 3.66Å; H45-F67 AromaticContact CE1-CE1 3.65Å; H45-F67 AromaticContact CG-CE1 3.72Å; H45-F67 AromaticContact ND1-CE1 3.72Å; H45-F67 AromaticContact NE2-CE1 3.58Å
46	K	98.7	Very high	97.9	Very high	89 Å²	89	39.7 Å²	39.7	39%	0.387	20%	0.201	S	C	.	.	H	α-helix	trans	-62.2	-45.6	178.9	-175.1	175.4	177.3	179.5	0	111.5	R42 A43 V44 Q49 Q50	R42-K46 VanDerWaalsContact O-CB 3.29Å; R42-K46 WeakPolarHBondContact O-CB 3.19Å; R42-K46 PolarHBondContact O-N 3.43Å; R42-K46 VanDerWaalsContact O-N 3.11Å; A43-K46 PolarHBondContact O-N 3.08Å; V44-K46 VanDerWaalsContact C-N 3.3Å; V44-K46 PolarHBondContact O-N 3.47Å; K46-Q49 PolarHBondContact O-N 2.91Å; K46-Q50 HydrophobicContact CG-CG 4.27Å; K46-Q50 VanDerWaalsContact O-CB 3.29Å; K46-Q50 WeakPolarHBondContact O-CB 3.45Å; K46-Q50 VanDerWaalsContact O-CG 3.22Å; K46-Q50 WeakPolarHBondContact O-CG 3.32Å; K46-Q50 PolarHBondContact O-N 3.32Å
47	E	98.8	Very high	97.9	Very high	30 Å²	30	39.8 Å²	39.8	14%	0.14	20%	0.202	C	C	.	.	H	α-helix	trans	-59.6	-50.5	179.1	179.7	64.2	-163.9	0	0	111.6	A43 V44 Q49 Q50 N51 A228 R232	A43-E47 WeakPolarHBondContact O-CB 3.43Å; A43-E47 PolarHBondContact O-N 2.86Å; V44-E47 PolarHBondContact O-N 3.43Å; E47-Q49 PolarHBondContact O-N 3.49Å; E47-Q50 PolarHBondContact O-N 3.43Å; E47-N51 PolarHBondContact O-N 3.29Å; E47-N51 PolarHBondContact O-ND2 3.36Å; E47-N51 PolarHBondContact OE1-ND2 3.43Å; E47-N51 VanDerWaalsContact OE1-ND2 3.17Å; E47-A228 HydrophobicContact CB-CB 3.71Å; E47-A228 HydrophobicContact CG-CB 4.17Å; E47-R232 HydrophobicContact CG-CB 4.01Å; E47-R232 IonicContact OE1-CZ 3.04Å; E47-R232 IonicContact OE1-NE 3.47Å; E47-R232 PolarHBondContact OE1-NE 3.13Å; E47-R232 IonicContact OE1-NH2 2.87Å; E47-R232 PolarHBondContact OE1-NH2 2.69Å
48	F	98.5	Very high	97.9	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62	-46.3	177.8	-83.8	-80.4	0	0	0	112	V31 V44 Q50 N51 W53 A55 V91 C231 R232 A235	V31-F48 HydrophobicContact CB-CD1 4.16Å; V31-F48 HydrophobicContact CB-CE1 4.38Å; V31-F48 HydrophobicContact CB-CG 4.44Å; V31-F48 HydrophobicContact CG1-CB 3.7Å; V31-F48 HydrophobicContact CG1-CD1 3.71Å; V31-F48 HydrophobicContact CG1-CD2 4.44Å; V31-F48 HydrophobicContact CG1-CE1 4.41Å; V31-F48 HydrophobicContact CG1-CG 3.71Å; V31-F48 HydrophobicContact CG2-CD1 4.19Å; V31-F48 HydrophobicContact CG2-CD2 4.27Å; V31-F48 HydrophobicContact CG2-CE1 4.13Å; V31-F48 HydrophobicContact CG2-CE2 4.25Å; V31-F48 HydrophobicContact CG2-CG 4.25Å; V31-F48 HydrophobicContact CG2-CZ 4.16Å; V44-F48 HydrophobicContact CG1-CD2 3.8Å; V44-F48 HydrophobicContact CG1-CE2 3.83Å; V44-F48 WeakPolarHBondContact O-CD2 3.2Å; V44-F48 PolarHBondContact O-N 3.22Å; V44-F48 VanDerWaalsContact O-N 3.08Å; F48-Q50 VanDerWaalsContact C-N 3.34Å; F48-Q50 PolarHBondContact O-N 2.88Å; F48-N51 CarbonylContact O-C 3.37Å; F48-N51 PolarHBondContact O-N 2.9Å; F48-N51 VanDerWaalsContact O-N 3.14Å; F48-W53 HydrophobicContact CB-CB 4.12Å; F48-W53 HydrophobicContact CB-CG 4.41Å; F48-W53 HydrophobicContact CD1-CB 4.12Å; F48-W53 AromaticContact CD1-CD1 3.87Å; F48-W53 AromaticContact CD1-CD2 3.51Å; F48-W53 HydrophobicContact CD1-CD2 3.51Å; F48-W53 AromaticContact CD1-CE2 3.85Å; F48-W53 AromaticContact CD1-CE3 3.87Å; F48-W53 HydrophobicContact CD1-CE3 3.87Å; F48-W53 AromaticContact CD1-CG 3.6Å; F48-W53 HydrophobicContact CD1-CG 3.6Å; F48-W53 AromaticContact CE1-CD2 3.88Å; F48-W53 HydrophobicContact CE1-CD2 3.88Å; F48-W53 AromaticContact CE1-CE2 3.9Å; F48-W53 HydrophobicContact CE1-CE3 4.01Å; F48-W53 HydrophobicContact CE1-CG 4.42Å; F48-W53 HydrophobicContact CE1-CH2 4.27Å; F48-W53 HydrophobicContact CE1-CZ2 4.14Å; F48-W53 HydrophobicContact CE1-CZ3 4.18Å; F48-W53 HydrophobicContact CG-CG 4.5Å; F48-W53 WeakPolarHBondContact O-CB 3.2Å; F48-W53 PolarHBondContact O-N 3.2Å; F48-W53 VanDerWaalsContact O-N 3.16Å; F48-A55 HydrophobicContact CB-CB 4.15Å; F48-V91 HydrophobicContact CE2-CG2 3.86Å; F48-V91 HydrophobicContact CZ-CG2 4.17Å; F48-C231 HydrophobicContact CE2-CB 4.15Å; F48-R232 HydrophobicContact CD1-CB 4.41Å; F48-R232 HydrophobicContact CD1-CG 4.15Å; F48-R232 HydrophobicContact CE1-CB 4.11Å; F48-R232 HydrophobicContact CE1-CG 4.06Å; F48-R232 HydrophobicContact CE2-CB 4.27Å; F48-R232 VanDerWaalsContact CZ-CA 3.47Å; F48-R232 HydrophobicContact CZ-CB 4.04Å; F48-R232 HydrophobicContact CZ-CG 4.5Å; F48-A235 HydrophobicContact CE1-CB 3.9Å; F48-A235 HydrophobicContact CZ-CB 3.82Å
49	Q	97.1	Very high	97.9	Very high	113 Å²	113	38.5 Å²	38.5	53%	0.528	19%	0.192	S	C	.	.	H	α-helix	trans	-62.5	-39.6	179.4	-169.8	-174.5	-58.9	0	0	112.3	H45 K46 E47 N51 N52 A55	H45-Q49 PolarHBondContact CE1-OE1 2.82Å; H45-Q49 WeakPolarHBondContact O-CB 3.37Å; H45-Q49 PolarHBondContact O-N 3.01Å; K46-Q49 PolarHBondContact O-N 2.91Å; E47-Q49 PolarHBondContact O-N 3.49Å; Q49-N51 PolarHBondContact O-N 3.47Å; Q49-N52 PolarHBondContact O-N 3.22Å; Q49-A55 HydrophobicContact CB-CB 4.11Å
50	Q	97.3	Very high	97.8	Very high	124 Å²	124	42.2 Å²	42.2	58%	0.579	21%	0.207	S	C	*	.	H	α-helix	trans	-70.3	-17	178.6	-74.6	179.8	-32.1	0	0	113.2	K46 E47 F48	K46-Q50 HydrophobicContact CG-CG 4.27Å; K46-Q50 VanDerWaalsContact O-CB 3.29Å; K46-Q50 WeakPolarHBondContact O-CB 3.45Å; K46-Q50 VanDerWaalsContact O-CG 3.22Å; K46-Q50 WeakPolarHBondContact O-CG 3.32Å; K46-Q50 PolarHBondContact O-N 3.32Å; E47-Q50 PolarHBondContact O-N 3.43Å; F48-Q50 VanDerWaalsContact C-N 3.34Å; F48-Q50 PolarHBondContact O-N 2.88Å
51	N	96	Very high	97.6	Very high	62 Å²	62	52.4 Å²	52.4	33%	0.332	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	34.9	177.3	-71	-90.7	0	0	0	111.8	E47 F48 Q49 W53 R232	E47-N51 PolarHBondContact O-N 3.29Å; E47-N51 PolarHBondContact O-ND2 3.36Å; E47-N51 PolarHBondContact OE1-ND2 3.43Å; E47-N51 VanDerWaalsContact OE1-ND2 3.17Å; F48-N51 CarbonylContact O-C 3.37Å; F48-N51 PolarHBondContact O-N 2.9Å; F48-N51 VanDerWaalsContact O-N 3.14Å; Q49-N51 PolarHBondContact O-N 3.47Å; N51-W53 VanDerWaalsContact O-CD1 3.31Å; N51-W53 PolarHBondContact O-N 3.06Å; N51-W53 VanDerWaalsContact O-N 3.11Å; N51-R232 VanDerWaalsContact CB-CD 3.47Å; N51-R232 VanDerWaalsContact CG-CD 3.48Å; N51-R232 PolarHBondContact ND2-NE 3.2Å
52	N	93.8	Very high	97.4	Very high	131 Å²	131	58.1 Å²	58.1	70%	0.701	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	18.5	172.4	-59.1	-36.7	0	0	0	116.2	Q49	Q49-N52 PolarHBondContact O-N 3.22Å
53	W	95.9	Very high	97.3	Very high	20 Å²	20	56 Å²	56	8%	0.076	26%	0.258	C	S	.	.			trans	-77.5	145.7	167.7	-71.9	67.2	0	0	0	110.6	R29 V31 F48 N51 A55 V89 A235 E236 M239	R29-W53 HydrophobicContact CB-CD2 3.57Å; R29-W53 HydrophobicContact CB-CE3 3.27Å; R29-W53 HydrophobicContact CB-CG 4.36Å; R29-W53 HydrophobicContact CB-CH2 3.7Å; R29-W53 HydrophobicContact CB-CZ2 3.96Å; R29-W53 HydrophobicContact CB-CZ3 3.38Å; R29-W53 HydrophobicContact CG-CD2 4.48Å; R29-W53 HydrophobicContact CG-CE3 4.42Å; R29-W53 HydrophobicContact CG-CH2 4.07Å; R29-W53 HydrophobicContact CG-CZ2 4.14Å; R29-W53 HydrophobicContact CG-CZ3 4.24Å; R29-W53 VanDerWaalsContact O-CE3 3.28Å; V31-W53 HydrophobicContact CB-CE3 3.76Å; V31-W53 HydrophobicContact CB-CZ3 4.19Å; V31-W53 HydrophobicContact CG1-CB 4.01Å; V31-W53 HydrophobicContact CG1-CD2 4.47Å; V31-W53 HydrophobicContact CG1-CE3 3.92Å; F48-W53 HydrophobicContact CB-CB 4.12Å; F48-W53 HydrophobicContact CB-CG 4.41Å; F48-W53 HydrophobicContact CD1-CB 4.12Å; F48-W53 AromaticContact CD1-CD1 3.87Å; F48-W53 AromaticContact CD1-CD2 3.51Å; F48-W53 HydrophobicContact CD1-CD2 3.51Å; F48-W53 AromaticContact CD1-CE2 3.85Å; F48-W53 AromaticContact CD1-CE3 3.87Å; F48-W53 HydrophobicContact CD1-CE3 3.87Å; F48-W53 AromaticContact CD1-CG 3.6Å; F48-W53 HydrophobicContact CD1-CG 3.6Å; F48-W53 AromaticContact CE1-CD2 3.88Å; F48-W53 HydrophobicContact CE1-CD2 3.88Å; F48-W53 AromaticContact CE1-CE2 3.9Å; F48-W53 HydrophobicContact CE1-CE3 4.01Å; F48-W53 HydrophobicContact CE1-CG 4.42Å; F48-W53 HydrophobicContact CE1-CH2 4.27Å; F48-W53 HydrophobicContact CE1-CZ2 4.14Å; F48-W53 HydrophobicContact CE1-CZ3 4.18Å; F48-W53 HydrophobicContact CG-CG 4.5Å; F48-W53 WeakPolarHBondContact O-CB 3.2Å; F48-W53 PolarHBondContact O-N 3.2Å; F48-W53 VanDerWaalsContact O-N 3.16Å; N51-W53 VanDerWaalsContact O-CD1 3.31Å; N51-W53 PolarHBondContact O-N 3.06Å; N51-W53 VanDerWaalsContact O-N 3.11Å; W53-A55 VanDerWaalsContact C-N 3.26Å; W53-A55 PolarHBondContact O-N 2.97Å; W53-V89 HydrophobicContact CH2-CG2 3.76Å; W53-V89 HydrophobicContact CZ3-CB 4.1Å; W53-V89 HydrophobicContact CZ3-CG2 3.61Å; W53-A235 HydrophobicContact CH2-CB 4.15Å; W53-A235 HydrophobicContact CZ2-CB 4.43Å; W53-E236 HydrophobicContact CZ2-CG 3.8Å; W53-M239 HydrophobicContact CH2-CG 4.06Å
54	H	97.1	Very high	97.1	Very high	83 Å²	83	63.3 Å²	63.3	38%	0.384	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	88.2	163.4	-177.5	-173.3	0	0	0	107.9	N28 R29 R30 V31 F85	N28-H54 WeakPolarHBondContact OD1-CB 3.49Å; R29-H54 PolarHBondContact O-N 3.36Å; R30-H54 WeakPolarHBondContact CA-O 3.47Å; R30-H54 HydrophobicContact CG-CB 4.07Å; V31-H54 PolarHBondContact N-O 3.27Å; H54-F85 AromaticContact CE1-CE2 3.56Å; H54-F85 AromaticContact ND1-CE2 3.8Å; H54-F85 AromaticContact NE2-CE2 3.74Å; H54-F85 WeakPolarHBondContact O-CZ 3.49Å
55	A	98	Very high	97	Very high	14 Å²	14	69.2 Å²	69.2	12%	0.116	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	123.4	-179.9	0	0	0	0	0	110.8	V31 F48 Q49 W53	V31-A55 HydrophobicContact CG1-CB 3.77Å; V31-A55 WeakPolarHBondContact O-CA 3.49Å; F48-A55 HydrophobicContact CB-CB 4.15Å; Q49-A55 HydrophobicContact CB-CB 4.11Å; W53-A55 VanDerWaalsContact C-N 3.26Å; W53-A55 PolarHBondContact O-N 2.97Å
56	V	98.5	Very high	96.9	Very high	29 Å²	29	76 Å²	76	18%	0.176	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	122.7	166.6	170.1	0	0	0	0	107.9	V31 L32 V33 E68 F85	V31-V56 PolarHBondContact O-N 2.98Å; L32-V56 CarbonylContact C-O 3.52Å; L32-V56 WeakPolarHBondContact CA-O 3.48Å; L32-V56 HydrophobicContact CD1-CB 4.41Å; L32-V56 HydrophobicContact CD1-CG1 4.02Å; V33-V56 PolarHBondContact N-O 3.23Å; V56-E68 HydrophobicContact CG1-CG 4.03Å; V56-F85 HydrophobicContact CB-CD1 4.44Å; V56-F85 HydrophobicContact CB-CD2 4.42Å; V56-F85 HydrophobicContact CB-CE1 3.98Å; V56-F85 HydrophobicContact CB-CE2 3.97Å; V56-F85 HydrophobicContact CB-CZ 3.72Å; V56-F85 HydrophobicContact CG2-CD2 3.85Å; V56-F85 HydrophobicContact CG2-CE1 4.18Å; V56-F85 HydrophobicContact CG2-CE2 3.25Å; V56-F85 HydrophobicContact CG2-CZ 3.44Å; V56-F85 VanDerWaalsContact CG2-CZ 3.44Å
57	G	98.6	Very high	96.9	Very high	2 Å²	2	72.3 Å²	72.3	2%	0.021	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	140.8	172.3	0	0	0	0	0	110.9	V33 H45 F67 E68	V33-G57 WeakPolarHBondContact O-CA 3.38Å; H45-G57 PolarHBondContact CD2-N 2.91Å; G57-F67 VanDerWaalsContact O-CB 3.31Å; G57-F67 WeakPolarHBondContact O-CB 3.45Å; G57-E68 PolarHBondContact O-N 2.93Å
58	C	98.3	Very high	96.8	Very high	2 Å²	2	75.3 Å²	75.3	1%	0.014	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.7	166.6	72	0	0	0	0	111.9	V33 G35 A36 E68 V70 I81	V33-C58 PolarHBondContact O-N 3.41Å; G35-C58 PolarHBondContact N-O 2.77Å; A36-C58 PolarHBondContact N-O 3.28Å; C58-E68 CarbonylContact C-O 3.43Å; C58-E68 WeakPolarHBondContact CA-O 3.36Å; C58-E68 HydrophobicContact CB-CB 3.94Å; C58-E68 WeakPolarHBondContact CB-O 3.26Å; C58-V70 HydrophobicContact CB-CB 4.23Å; C58-V70 HydrophobicContact CB-CG2 4.04Å; C58-I81 HydrophobicContact CB-CD1 3.97Å
59	G	97.7	Very high	96.8	Very high	6 Å²	6	81 Å²	81	6%	0.062	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	-170.4	173.5	0	0	0	0	0	110.5	E68 Q69 V70	G59-E68 PolarHBondContact N-O 2.96Å; G59-Q69 WeakPolarHBondContact O-CA 3.31Å; G59-V70 PolarHBondContact O-N 3.06Å
60	F	95.8	Very high	96.9	Very high	94 Å²	94	76.2 Å²	76.2	41%	0.412	35%	0.354	S	S	.	.	S	Bend	trans	-113.3	-101.2	176.9	-171.7	-133.4	0	0	0	110.4	R62 A63 N71	F60-R62 VanDerWaalsContact C-N 3.26Å; F60-R62 PolarHBondContact O-N 3.35Å; F60-R62 VanDerWaalsContact O-N 3.12Å; F60-A63 WeakPolarHBondContact O-CB 3.4Å; F60-A63 PolarHBondContact O-N 2.82Å; F60-N71 HydrophobicContact CD2-CB 4.01Å; F60-N71 HydrophobicContact CE2-CB 3.71Å; F60-N71 HydrophobicContact CZ-CB 4.48Å
61	R	95.1	Very high	96.9	Very high	227 Å²	227	73.1 Å²	73.1	86%	0.857	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-27	-173.8	-59.8	-177.2	-175.4	-173.8	0.9	115.4
62	R	94.6	Very high	97	Very high	122 Å²	122	71 Å²	71	46%	0.46	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109	12.4	-175.3	-67	-177.2	-69.6	171.3	-3	113.4	T37 F60 E190 E194	T37-R62 VanDerWaalsContact CG2-C 3.46Å; T37-R62 HydrophobicContact CG2-CB 3.89Å; T37-R62 VanDerWaalsContact CG2-O 3.26Å; T37-R62 WeakPolarHBondContact CG2-O 3.24Å; T37-R62 PolarHBondContact O-NH1 3.22Å; T37-R62 PolarHBondContact O-NH2 3.12Å; F60-R62 VanDerWaalsContact C-N 3.26Å; F60-R62 PolarHBondContact O-N 3.35Å; F60-R62 VanDerWaalsContact O-N 3.12Å; R62-E190 IonicContact CZ-OE2 3.48Å; R62-E190 IonicContact NH1-OE1 3.91Å; R62-E190 IonicContact NH1-OE2 3.29Å; R62-E190 PolarHBondContact NH1-OE2 2.85Å; R62-E194 IonicContact CZ-OE1 3.31Å; R62-E194 IonicContact NH1-OE1 2.59Å; R62-E194 PolarHBondContact NH1-OE1 2.87Å; R62-E194 IonicContact NH2-OE1 2.69Å
63	A	96.5	Very high	97.2	Very high	1 Å²	1	68.8 Å²	68.8	1%	0.008	32%	0.317	C	S	.	.			trans	-68	-52.7	-168.1	0	0	0	0	0	113.2	F60 K66 F67 E68 Q69	F60-A63 WeakPolarHBondContact O-CB 3.4Å; F60-A63 PolarHBondContact O-N 2.82Å; A63-K66 PolarHBondContact O-N 2.9Å; A63-F67 CarbonylContact C-O 3.57Å; A63-F67 HydrophobicContact CB-CB 4.33Å; A63-F67 PolarHBondContact O-N 3.41Å; A63-E68 WeakPolarHBondContact CB-O 3.39Å; A63-Q69 HydrophobicContact CB-CB 3.87Å; A63-Q69 HydrophobicContact CB-CG 4.31Å
64	R	95.8	Very high	97.3	Very high	167 Å²	167	71 Å²	71	63%	0.63	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	147.3	-171.9	-61.3	-71.1	-77.4	-174.3	-6.3	111.9	Q69	R64-Q69 HydrophobicContact CG-CB 4.3Å
65	P	96.1	Very high	97.3	Very high	125 Å²	125	70.1 Å²	70.1	81%	0.812	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.1	-5.5	0.8	35.5	-36.3	0	0	0	114.2
66	K	96.9	Very high	97.3	Very high	154 Å²	154	74.7 Å²	74.7	67%	0.67	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-33.4	-166.8	-174.4	175	178.8	177.8	0	114.3	A63	A63-K66 PolarHBondContact O-N 2.9Å
67	F	98.3	Very high	97.3	Very high	13 Å²	13	74.6 Å²	74.6	6%	0.057	36%	0.359	C	S	.	.	S	Bend	trans	-129.4	162.1	-171.6	-63	-54.2	0	0	0	111.4	A36 T37 H45 G57 A63	A36-F67 HydrophobicContact CB-CD1 4.03Å; A36-F67 HydrophobicContact CB-CD2 4.11Å; A36-F67 HydrophobicContact CB-CE1 3.98Å; A36-F67 HydrophobicContact CB-CE2 4.05Å; A36-F67 HydrophobicContact CB-CG 4.08Å; A36-F67 HydrophobicContact CB-CZ 3.97Å; A36-F67 WeakPolarHBondContact O-CE2 3.38Å; T37-F67 HydrophobicContact CG2-CD2 3.76Å; T37-F67 HydrophobicContact CG2-CE2 4.41Å; H45-F67 AromaticContact CD2-CE1 3.66Å; H45-F67 AromaticContact CE1-CE1 3.65Å; H45-F67 AromaticContact CG-CE1 3.72Å; H45-F67 AromaticContact ND1-CE1 3.72Å; H45-F67 AromaticContact NE2-CE1 3.58Å; G57-F67 VanDerWaalsContact O-CB 3.31Å; G57-F67 WeakPolarHBondContact O-CB 3.45Å; A63-F67 CarbonylContact C-O 3.57Å; A63-F67 HydrophobicContact CB-CB 4.33Å; A63-F67 PolarHBondContact O-N 3.41Å
68	E	98.1	Very high	97.3	Very high	92 Å²	92	74.6 Å²	74.6	43%	0.43	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	136.7	173.5	-63.1	-51.3	137	0	0	111	V56 G57 C58 G59 A63 V70 I81	V56-E68 HydrophobicContact CG1-CG 4.03Å; G57-E68 PolarHBondContact O-N 2.93Å; C58-E68 CarbonylContact C-O 3.43Å; C58-E68 WeakPolarHBondContact CA-O 3.36Å; C58-E68 HydrophobicContact CB-CB 3.94Å; C58-E68 WeakPolarHBondContact CB-O 3.26Å; G59-E68 PolarHBondContact N-O 2.96Å; A63-E68 WeakPolarHBondContact CB-O 3.39Å; E68-V70 HydrophobicContact CB-CG2 4.32Å; E68-I81 HydrophobicContact CB-CD1 3.83Å; E68-I81 HydrophobicContact CG-CD1 4.09Å
69	Q	98.4	Very high	97.3	Very high	120 Å²	120	77.8 Å²	77.8	56%	0.561	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	103.1	177.4	-174.1	173.4	15.4	0	0	109.4	G59 A63 R64	G59-Q69 WeakPolarHBondContact O-CA 3.31Å; A63-Q69 HydrophobicContact CB-CB 3.87Å; A63-Q69 HydrophobicContact CB-CG 4.31Å; R64-Q69 HydrophobicContact CG-CB 4.3Å
70	V	98.1	Very high	97.3	Very high	13 Å²	13	82.4 Å²	82.4	8%	0.079	39%	0.393	C	S	.	.			trans	-128.8	124	-178.7	-179	0	0	0	0	109.3	C58 G59 E68 L72 A77 V78 I81	C58-V70 HydrophobicContact CB-CB 4.23Å; C58-V70 HydrophobicContact CB-CG2 4.04Å; G59-V70 PolarHBondContact O-N 3.06Å; E68-V70 HydrophobicContact CB-CG2 4.32Å; V70-L72 HydrophobicContact CG1-CD2 4.33Å; V70-A77 HydrophobicContact CG1-CB 4.12Å; V70-V78 HydrophobicContact CG1-CG2 4.36Å; V70-I81 HydrophobicContact CG1-CG2 4.3Å; V70-I81 HydrophobicContact CG2-CB 4.31Å; V70-I81 HydrophobicContact CG2-CD1 3.61Å; V70-I81 HydrophobicContact CG2-CG2 4.22Å
71	N	98.1	Very high	97.4	Very high	58 Å²	58	79.1 Å²	79.1	31%	0.31	38%	0.379	S	S	.	.			trans	-83.2	114.1	168.2	-175.5	7.6	0	0	0	108.7	F60 L73 D74	F60-N71 HydrophobicContact CD2-CB 4.01Å; F60-N71 HydrophobicContact CE2-CB 3.71Å; F60-N71 HydrophobicContact CZ-CB 4.48Å; N71-L73 PolarHBondContact O-N 3.04Å; N71-L73 VanDerWaalsContact O-N 3.17Å; N71-L73 WeakPolarHBondContact OD1-CB 3.49Å; N71-L73 PolarHBondContact OD1-N 2.93Å; N71-L73 VanDerWaalsContact OD1-N 3.15Å; N71-D74 HydrophobicContact CB-CB 4.29Å; N71-D74 PolarHBondContact O-N 2.92Å
72	L	97.9	Very high	97.6	Very high	17 Å²	17	68.3 Å²	68.3	9%	0.089	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-13.7	179.9	-62.2	-176.7	0	0	0	113.8	T34 V70 D74 V78 A94 L112 A116	T34-L72 HydrophobicContact CG2-CD2 4.2Å; V70-L72 HydrophobicContact CG1-CD2 4.33Å; L72-D74 VanDerWaalsContact C-N 3.29Å; L72-V78 HydrophobicContact CB-CG2 4.49Å; L72-V78 HydrophobicContact CD2-CG2 3.91Å; L72-A94 HydrophobicContact CD1-CB 3.45Å; L72-A94 VanDerWaalsContact CD1-CB 3.45Å; L72-L112 HydrophobicContact CB-CD1 4.32Å; L72-A116 HydrophobicContact CB-CB 4.09Å
73	L	97.6	Very high	97.7	Very high	85 Å²	85	67.2 Å²	67.2	45%	0.445	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-9.5	173	-54.8	-178.2	0	0	0	112.9	N71 Q111 L112 A116	N71-L73 PolarHBondContact O-N 3.04Å; N71-L73 VanDerWaalsContact O-N 3.17Å; N71-L73 WeakPolarHBondContact OD1-CB 3.49Å; N71-L73 PolarHBondContact OD1-N 2.93Å; N71-L73 VanDerWaalsContact OD1-N 3.15Å; L73-Q111 HydrophobicContact CD2-CB 3.99Å; L73-L112 HydrophobicContact CD2-CB 4.33Å; L73-L112 HydrophobicContact CD2-CD1 4.36Å; L73-A116 HydrophobicContact CD2-CB 4.27Å
74	D	98.1	Very high	97.7	Very high	68 Å²	68	73.5 Å²	73.5	36%	0.364	37%	0.372	S	S	.	.			trans	-98.3	101.3	173.3	177.7	-1	0	0	0	109.3	N71 L72 N76 A77 V78	N71-D74 HydrophobicContact CB-CB 4.29Å; N71-D74 PolarHBondContact O-N 2.92Å; L72-D74 VanDerWaalsContact C-N 3.29Å; D74-N76 PolarHBondContact O-N 2.9Å; D74-N76 WeakPolarHBondContact OD1-CB 3.36Å; D74-N76 PolarHBondContact OD1-N 3.47Å; D74-A77 HydrophobicContact CB-CB 3.92Å; D74-A77 PolarHBondContact O-N 2.86Å; D74-A77 VanDerWaalsContact O-N 3.12Å; D74-A77 PolarHBondContact OD1-N 3.06Å; D74-A77 WeakPolarHBondContact OD2-CB 3.46Å; D74-V78 WeakPolarHBondContact O-CG2 3.44Å; D74-V78 PolarHBondContact O-N 2.99Å
75	S	97	Very high	97.8	Very high	64 Å²	64	66.8 Å²	66.8	45%	0.448	35%	0.347	S	S	.	.	H	α-helix	trans	-56	-34.7	-179.7	-61.2	0	0	0	0	113	V78 H79	S75-V78 PolarHBondContact O-N 3.19Å; S75-H79 VanDerWaalsContact O-CB 3.3Å; S75-H79 WeakPolarHBondContact O-CB 3.33Å; S75-H79 PolarHBondContact O-N 2.69Å
76	N	97.9	Very high	97.9	Very high	110 Å²	110	64.1 Å²	64.1	59%	0.588	32%	0.324	S	S	*	.	H	α-helix	trans	-70.3	-43.3	179	-65.5	-47.5	0	0	0	110.5	D74 V78 H79 H80	D74-N76 PolarHBondContact O-N 2.9Å; D74-N76 WeakPolarHBondContact OD1-CB 3.36Å; D74-N76 PolarHBondContact OD1-N 3.47Å; N76-V78 VanDerWaalsContact C-N 3.3Å; N76-V78 PolarHBondContact O-N 2.87Å; N76-H79 PolarHBondContact O-N 2.9Å; N76-H80 PolarHBondContact O-N 3.24Å; N76-H80 PolarHBondContact O-ND1 2.84Å
77	A	97.9	Very high	98	Very high	27 Å²	27	57 Å²	57	22%	0.223	29%	0.293	C	S	.	.	H	α-helix	trans	-61.9	-40.1	177.4	0	0	0	0	0	111.7	V70 D74 I81	V70-A77 HydrophobicContact CG1-CB 4.12Å; D74-A77 HydrophobicContact CB-CB 3.92Å; D74-A77 PolarHBondContact O-N 2.86Å; D74-A77 VanDerWaalsContact O-N 3.12Å; D74-A77 PolarHBondContact OD1-N 3.06Å; D74-A77 WeakPolarHBondContact OD2-CB 3.46Å; A77-I81 WeakPolarHBondContact O-CG2 3.48Å; A77-I81 PolarHBondContact O-N 2.87Å
78	V	98.4	Very high	98	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-64.5	-45.4	175	176.8	0	0	0	0	111.4	V70 L72 D74 S75 N76 I81 I82 L120 E123	V70-V78 HydrophobicContact CG1-CG2 4.36Å; L72-V78 HydrophobicContact CB-CG2 4.49Å; L72-V78 HydrophobicContact CD2-CG2 3.91Å; D74-V78 WeakPolarHBondContact O-CG2 3.44Å; D74-V78 PolarHBondContact O-N 2.99Å; S75-V78 PolarHBondContact O-N 3.19Å; N76-V78 VanDerWaalsContact C-N 3.3Å; N76-V78 PolarHBondContact O-N 2.87Å; V78-I81 WeakPolarHBondContact O-CG2 3.3Å; V78-I82 HydrophobicContact CG1-CD1 3.78Å; V78-I82 WeakPolarHBondContact O-CG1 3.28Å; V78-I82 PolarHBondContact O-N 3.2Å; V78-L120 HydrophobicContact CG1-CD1 3.67Å; V78-E123 HydrophobicContact CG1-CG 4.24Å
79	H	98.4	Very high	98	Very high	69 Å²	69	54.5 Å²	54.5	32%	0.319	28%	0.282	S	S	.	.	H	α-helix	trans	-58.2	-52.9	177.4	176.8	70	0	0	0	111.6	S75 N76 I81 I82 H83 E123	S75-H79 VanDerWaalsContact O-CB 3.3Å; S75-H79 WeakPolarHBondContact O-CB 3.33Å; S75-H79 PolarHBondContact O-N 2.69Å; N76-H79 PolarHBondContact O-N 2.9Å; H79-I81 PolarHBondContact O-N 2.83Å; H79-I82 PolarHBondContact O-N 3.3Å; H79-H83 VanDerWaalsContact O-CB 3.29Å; H79-H83 WeakPolarHBondContact O-CB 3.26Å; H79-H83 PolarHBondContact O-N 3.43Å; H79-E123 IonicContact CE1-OE2 3.9Å; H79-E123 IonicContact CG-OE2 3.75Å; H79-E123 IonicContact ND1-OE1 3.71Å; H79-E123 IonicContact ND1-OE2 2.88Å; H79-E123 PolarHBondContact ND1-OE2 2.8Å
80	H	98.3	Very high	98	Very high	102 Å²	102	48.8 Å²	48.8	47%	0.472	26%	0.255	S	S	.	.	H	α-helix	trans	-60.4	-49.4	-176.9	-68.4	112.9	0	0	0	112.4	N76 I82 H83 D84	N76-H80 PolarHBondContact O-N 3.24Å; N76-H80 PolarHBondContact O-ND1 2.84Å; H80-I82 VanDerWaalsContact C-N 3.3Å; H80-I82 PolarHBondContact O-N 3.19Å; H80-H83 PolarHBondContact O-N 2.99Å; H80-D84 VanDerWaalsContact O-CB 3.22Å; H80-D84 WeakPolarHBondContact O-CB 3.3Å; H80-D84 PolarHBondContact O-N 2.86Å
81	I	98.3	Very high	98.1	Very high	26 Å²	26	48.1 Å²	48.1	13%	0.133	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-38	-178.8	-171.5	171.2	0	0	0	112.1	L32 C58 E68 V70 A77 V78 H79 F85	L32-I81 HydrophobicContact CD1-CD1 3.91Å; L32-I81 HydrophobicContact CD1-CG1 4.36Å; C58-I81 HydrophobicContact CB-CD1 3.97Å; E68-I81 HydrophobicContact CB-CD1 3.83Å; E68-I81 HydrophobicContact CG-CD1 4.09Å; V70-I81 HydrophobicContact CG1-CG2 4.3Å; V70-I81 HydrophobicContact CG2-CB 4.31Å; V70-I81 HydrophobicContact CG2-CD1 3.61Å; V70-I81 HydrophobicContact CG2-CG2 4.22Å; A77-I81 WeakPolarHBondContact O-CG2 3.48Å; A77-I81 PolarHBondContact O-N 2.87Å; V78-I81 WeakPolarHBondContact O-CG2 3.3Å; H79-I81 PolarHBondContact O-N 2.83Å; I81-F85 WeakPolarHBondContact O-CB 3.25Å; I81-F85 PolarHBondContact O-N 3.23Å; I81-F85 VanDerWaalsContact O-N 3.12Å
82	I	98.5	Very high	98.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.4	-45.4	178.5	-69.8	172.6	0	0	0	110.3	L32 V78 H79 H80 Q86 P87 I90 L120 E123 V127	L32-I82 HydrophobicContact CD2-CG1 3.81Å; V78-I82 HydrophobicContact CG1-CD1 3.78Å; V78-I82 WeakPolarHBondContact O-CG1 3.28Å; V78-I82 PolarHBondContact O-N 3.2Å; H79-I82 PolarHBondContact O-N 3.3Å; H80-I82 VanDerWaalsContact C-N 3.3Å; H80-I82 PolarHBondContact O-N 3.19Å; I82-Q86 WeakPolarHBondContact O-CA 3.41Å; I82-Q86 PolarHBondContact O-N 3.23Å; I82-P87 HydrophobicContact CG2-CG 4.24Å; I82-P87 WeakPolarHBondContact O-CD 3.45Å; I82-I90 HydrophobicContact CD1-CD1 4.03Å; I82-I90 HydrophobicContact CG1-CD1 4.26Å; I82-I90 HydrophobicContact CG2-CD1 4.46Å; I82-L120 HydrophobicContact CD1-CD1 3.73Å; I82-E123 HydrophobicContact CD1-CB 3.55Å; I82-E123 HydrophobicContact CD1-CG 4.36Å; I82-E123 HydrophobicContact CG2-CB 4.43Å; I82-V127 HydrophobicContact CG2-CB 4.48Å; I82-V127 HydrophobicContact CG2-CG1 3.93Å; I82-V127 HydrophobicContact CG2-CG2 3.72Å
83	H	97.4	Very high	98.1	Very high	99 Å²	99	45.8 Å²	45.8	46%	0.458	24%	0.24	S	C	.	.	H	α-helix	trans	-74.7	-30.9	-174.8	-152.7	-82.5	0	0	0	112.9	H79 H80 Q86	H79-H83 VanDerWaalsContact O-CB 3.29Å; H79-H83 WeakPolarHBondContact O-CB 3.26Å; H79-H83 PolarHBondContact O-N 3.43Å; H80-H83 PolarHBondContact O-N 2.99Å; H83-Q86 WeakPolarHBondContact O-CG 3.28Å; H83-Q86 PolarHBondContact O-NE2 2.74Å
84	D	96.8	Very high	98.1	Very high	132 Å²	132	42.6 Å²	42.6	71%	0.706	23%	0.226	S	C	*	.	H	α-helix	trans	-75.6	-41	174.9	-67.8	-17.5	0	0	0	111.2	H80	H80-D84 VanDerWaalsContact O-CB 3.22Å; H80-D84 WeakPolarHBondContact O-CB 3.3Å; H80-D84 PolarHBondContact O-N 2.86Å
85	F	97.8	Very high	97.9	Very high	27 Å²	27	41 Å²	41	12%	0.118	22%	0.223	C	C	.	.	H	α-helix	trans	-81.9	-26.9	-177.7	-174.6	-122.4	0	0	0	113.5	R30 L32 H54 V56 I81 P87	R30-F85 HydrophobicContact CB-CE1 3.82Å; R30-F85 HydrophobicContact CB-CE2 4.28Å; R30-F85 HydrophobicContact CB-CZ 3.65Å; R30-F85 WeakPolarHBondContact CD-O 3.35Å; R30-F85 HydrophobicContact CG-CE2 4.19Å; R30-F85 HydrophobicContact CG-CZ 4.02Å; R30-F85 PolarHBondContact NE-O 2.85Å; L32-F85 HydrophobicContact CB-CD1 4.15Å; L32-F85 HydrophobicContact CB-CE1 4.2Å; H54-F85 AromaticContact CE1-CE2 3.56Å; H54-F85 AromaticContact ND1-CE2 3.8Å; H54-F85 AromaticContact NE2-CE2 3.74Å; H54-F85 WeakPolarHBondContact O-CZ 3.49Å; V56-F85 HydrophobicContact CB-CD1 4.44Å; V56-F85 HydrophobicContact CB-CD2 4.42Å; V56-F85 HydrophobicContact CB-CE1 3.98Å; V56-F85 HydrophobicContact CB-CE2 3.97Å; V56-F85 HydrophobicContact CB-CZ 3.72Å; V56-F85 HydrophobicContact CG2-CD2 3.85Å; V56-F85 HydrophobicContact CG2-CE1 4.18Å; V56-F85 HydrophobicContact CG2-CE2 3.25Å; V56-F85 HydrophobicContact CG2-CZ 3.44Å; V56-F85 VanDerWaalsContact CG2-CZ 3.44Å; I81-F85 WeakPolarHBondContact O-CB 3.25Å; I81-F85 PolarHBondContact O-N 3.23Å; I81-F85 VanDerWaalsContact O-N 3.12Å; F85-P87 HydrophobicContact CD1-CB 3.88Å; F85-P87 HydrophobicContact CD1-CG 4.35Å; F85-P87 HydrophobicContact CE1-CB 4.1Å
86	Q	97.4	Very high	97.8	Very high	68 Å²	68	39.3 Å²	39.3	32%	0.318	21%	0.208	S	C	.	.			trans	49.3	59.5	-176.3	-67.1	-69.6	-47.6	0	0	112.2	R30 I82 H83	R30-Q86 PolarHBondContact NE-O 3.42Å; R30-Q86 PolarHBondContact NH2-O 2.86Å; I82-Q86 WeakPolarHBondContact O-CA 3.41Å; I82-Q86 PolarHBondContact O-N 3.23Å; H83-Q86 WeakPolarHBondContact O-CG 3.28Å; H83-Q86 PolarHBondContact O-NE2 2.74Å
87	P	98.2	Very high	97.5	Very high	4 Å²	4	39.1 Å²	39.1	3%	0.026	20%	0.199	C	C	.	.			trans	-63.1	145.5	-177.1	26.4	-32.7	0	0	0	111.8	L32 I82 F85 V89 I90 A129	L32-P87 HydrophobicContact CB-CB 4.01Å; L32-P87 HydrophobicContact CB-CG 4.29Å; I82-P87 HydrophobicContact CG2-CG 4.24Å; I82-P87 WeakPolarHBondContact O-CD 3.45Å; F85-P87 HydrophobicContact CD1-CB 3.88Å; F85-P87 HydrophobicContact CD1-CG 4.35Å; F85-P87 HydrophobicContact CE1-CB 4.1Å; P87-V89 WeakPolarHBondContact CB-O 3.44Å; P87-I90 HydrophobicContact CB-CG1 3.98Å; P87-I90 HydrophobicContact CG-CD1 3.81Å; P87-I90 HydrophobicContact CG-CG1 3.62Å; P87-A129 HydrophobicContact CG-CB 4.36Å; P87-A129 WeakPolarHBondContact O-CB 3.3Å
88	H	98.5	Very high	97.1	Very high	53 Å²	53	44 Å²	44	25%	0.245	21%	0.211	C	C	.	.	S	Bend	trans	-83	-28.3	165.4	-54.3	86.5	0	0	0	110.9	N28 R30 F130 M239	N28-H88 PolarHBondContact O-CE1 2.9Å; R30-H88 PolarHBondContact N-ND1 3.07Å; R30-H88 PolarHBondContact NH1-CE1 2.99Å; R30-H88 PolarHBondContact O-N 2.91Å; H88-F130 PolarHBondContact O-N 3.13Å; H88-M239 HydrophobicContact CB-SD 4.07Å
89	V	98.8	Very high	96.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	137.8	-179.1	179.8	0	0	0	0	109.1	R30 V31 L32 W53 P87 V91 F130 I132 A235 M239	R30-V89 PolarHBondContact O-N 3.25Å; V31-V89 CarbonylContact C-O 3.4Å; V31-V89 VanDerWaalsContact CA-O 3.26Å; V31-V89 WeakPolarHBondContact CA-O 3.31Å; V31-V89 HydrophobicContact CB-CB 4.28Å; V31-V89 HydrophobicContact CG2-CB 4.02Å; V31-V89 HydrophobicContact CG2-CG1 4Å; L32-V89 PolarHBondContact N-O 2.89Å; W53-V89 HydrophobicContact CH2-CG2 3.76Å; W53-V89 HydrophobicContact CZ3-CB 4.1Å; W53-V89 HydrophobicContact CZ3-CG2 3.61Å; P87-V89 WeakPolarHBondContact CB-O 3.44Å; V89-V91 HydrophobicContact CG1-CG2 4.09Å; V89-F130 CarbonylContact C-O 3.59Å; V89-F130 VanDerWaalsContact CA-O 3.28Å; V89-F130 WeakPolarHBondContact CA-O 3.31Å; V89-F130 HydrophobicContact CG1-CD1 4.32Å; V89-F130 HydrophobicContact CG2-CB 4.36Å; V89-F130 HydrophobicContact CG2-CD1 4.37Å; V89-I132 HydrophobicContact CG1-CD1 4.43Å; V89-A235 HydrophobicContact CG1-CB 3.97Å; V89-A235 HydrophobicContact CG2-CB 3.95Å; V89-M239 HydrophobicContact CG2-CE 3.89Å; V89-M239 HydrophobicContact CG2-SD 4.42Å
90	I	98.9	Very high	95.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	125.1	168.9	-60.9	167.7	0	0	0	107.4	L32 I82 P87 L120 A124 A129 F130 L131 I132	L32-I90 HydrophobicContact CB-CG1 4.22Å; L32-I90 CarbonylContact O-C 3.43Å; L32-I90 VanDerWaalsContact O-CA 3.3Å; L32-I90 WeakPolarHBondContact O-CA 3.31Å; I82-I90 HydrophobicContact CD1-CD1 4.03Å; I82-I90 HydrophobicContact CG1-CD1 4.26Å; I82-I90 HydrophobicContact CG2-CD1 4.46Å; P87-I90 HydrophobicContact CB-CG1 3.98Å; P87-I90 HydrophobicContact CG-CD1 3.81Å; P87-I90 HydrophobicContact CG-CG1 3.62Å; I90-L120 HydrophobicContact CG2-CD2 3.98Å; I90-L120 HydrophobicContact CG2-CG 4.38Å; I90-A124 HydrophobicContact CD1-CB 3.73Å; I90-A129 HydrophobicContact CD1-CB 3.91Å; I90-A129 HydrophobicContact CG1-CB 4.1Å; I90-F130 PolarHBondContact N-O 2.85Å; I90-L131 HydrophobicContact CB-CD1 3.96Å; I90-L131 HydrophobicContact CG2-CD1 3.78Å; I90-L131 CarbonylContact O-C 3.56Å; I90-L131 WeakPolarHBondContact O-CA 3.18Å; I90-I132 PolarHBondContact O-N 2.67Å
91	V	98.9	Very high	95.4	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	114.6	171.1	-168.4	0	0	0	0	108.7	V31 L32 T34 V44 F48 V89 C93 I132 I134 C231	V31-V91 HydrophobicContact CG2-CG2 4.13Å; L32-V91 PolarHBondContact O-N 2.87Å; T34-V91 PolarHBondContact N-O 2.82Å; V44-V91 HydrophobicContact CG1-CB 4.01Å; V44-V91 HydrophobicContact CG1-CG1 3.91Å; V44-V91 HydrophobicContact CG1-CG2 4.12Å; F48-V91 HydrophobicContact CE2-CG2 3.86Å; F48-V91 HydrophobicContact CZ-CG2 4.17Å; V89-V91 HydrophobicContact CG1-CG2 4.09Å; V91-C93 PolarHBondContact O-N 3.12Å; V91-I132 HydrophobicContact CG1-CB 4.38Å; V91-I132 HydrophobicContact CG2-CD1 4.32Å; V91-I134 HydrophobicContact CG1-CD1 4.32Å; V91-I134 HydrophobicContact CG1-CG1 4.43Å; V91-C231 HydrophobicContact CG1-CB 4.49Å
92	H	98.9	Very high	95	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.009	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	93	-175.1	-172.9	25.8	0	0	0	112.1	T34 A94 S117 L120 L131 I132 Y133 I134	T34-H92 VanDerWaalsContact OG1-CA 3.3Å; T34-H92 WeakPolarHBondContact OG1-CA 3.43Å; T34-H92 PolarHBondContact OG1-ND1 2.7Å; H92-A94 PolarHBondContact CE1-O 2.94Å; H92-A94 VanDerWaalsContact CE1-O 3.23Å; H92-S117 PolarHBondContact NE2-OG 3Å; H92-L120 HydrophobicContact CB-CD2 3.66Å; H92-L120 VanDerWaalsContact CG-CD2 3.41Å; H92-L131 HydrophobicContact CB-CD1 3.98Å; H92-I132 PolarHBondContact N-O 3.24Å; H92-Y133 AromaticContact CD2-CD2 3.7Å; H92-I134 WeakPolarHBondContact O-CB 3.47Å; H92-I134 WeakPolarHBondContact O-CG1 3.48Å; H92-I134 PolarHBondContact O-N 2.87Å
93	C	98.6	Very high	94.6	Very high	24 Å²	24	48.1 Å²	48.1	16%	0.162	24%	0.24	C	C	.	.			trans	-101.9	-10.7	-179.6	-52.2	0	0	0	0	113.9	T34 V91 A95	T34-C93 VanDerWaalsContact O-CB 3.25Å; T34-C93 WeakPolarHBondContact O-CB 3.48Å; T34-C93 PolarHBondContact O-N 2.86Å; T34-C93 PolarHBondContact OG1-N 2.81Å; V91-C93 PolarHBondContact O-N 3.12Å; C93-A95 PolarHBondContact O-N 3.3Å
94	A	96.3	Very high	94.3	Very high	17 Å²	17	49.7 Å²	49.7	14%	0.14	25%	0.252	C	S	.	.			trans	-72.8	127	-179.8	0	0	0	0	0	111	L72 H92	L72-A94 HydrophobicContact CD1-CB 3.45Å; L72-A94 VanDerWaalsContact CD1-CB 3.45Å; H92-A94 PolarHBondContact CE1-O 2.94Å; H92-A94 VanDerWaalsContact CE1-O 3.23Å
95	A	95.4	Very high	94.2	Very high	36 Å²	36	49 Å²	49	30%	0.298	24%	0.244	S	C	.	.			trans	-162	154.9	175.3	0	0	0	0	0	110.1	C93 N113	C93-A95 PolarHBondContact O-N 3.3Å; A95-N113 VanDerWaalsContact CA-OD1 3.3Å; A95-N113 WeakPolarHBondContact CA-OD1 3.45Å; A95-N113 WeakPolarHBondContact CB-OD1 3.29Å
96	E	95.1	Very high	94	Very high	28 Å²	28	50.3 Å²	50.3	13%	0.131	26%	0.256	C	S	.	.			trans	-84.6	113.7	159.6	-177	53.7	-100.8	0	0	108.6	R98 V101 V102 L112 N113	E96-R98 VanDerWaalsContact OE1-CB 3.27Å; E96-R98 WeakPolarHBondContact OE1-CB 3.5Å; E96-R98 WeakPolarHBondContact OE1-CG 3.48Å; E96-R98 IonicContact OE1-CZ 3.69Å; E96-R98 PolarHBondContact OE1-N 3.44Å; E96-R98 IonicContact OE1-NE 3.84Å; E96-R98 PolarHBondContact OE1-NE 3.37Å; E96-R98 IonicContact OE1-NH2 3.64Å; E96-R98 IonicContact OE2-CZ 3.49Å; E96-R98 IonicContact OE2-NE 3.88Å; E96-R98 PolarHBondContact OE2-NE 3.47Å; E96-R98 IonicContact OE2-NH2 2.69Å; E96-R98 PolarHBondContact OE2-NH2 2.85Å; E96-V101 HydrophobicContact CG-CB 4.11Å; E96-V101 HydrophobicContact CG-CG1 3.85Å; E96-V102 HydrophobicContact CB-CG2 4.49Å; E96-V102 HydrophobicContact CG-CG2 3.86Å; E96-L112 HydrophobicContact CB-CD2 4.24Å; E96-N113 PolarHBondContact N-OD1 2.95Å; E96-N113 PolarHBondContact O-ND2 3.46Å
97	R	90.6	Very high	94	Very high	106 Å²	106	53 Å²	53	40%	0.4	27%	0.272	S	S	.	.			trans	-114.8	-2.8	-173.6	64.8	154.2	-172.7	73	0.6	114	P99 Y159 E194	R97-P99 WeakPolarHBondContact O-CD 3.4Å; R97-Y159 HydrophobicContact CB-CE2 3.82Å; R97-E194 PolarHBondContact NH2-O 3.25Å
98	R	89.8	Confident	93.8	Very high	128 Å²	128	54.7 Å²	54.7	48%	0.483	29%	0.287	S	S	.	.			trans	-86	113.8	-176.4	-64.6	170.7	-69.8	171.6	1	108	E96 D100 V101 V102	E96-R98 VanDerWaalsContact OE1-CB 3.27Å; E96-R98 WeakPolarHBondContact OE1-CB 3.5Å; E96-R98 WeakPolarHBondContact OE1-CG 3.48Å; E96-R98 IonicContact OE1-CZ 3.69Å; E96-R98 PolarHBondContact OE1-N 3.44Å; E96-R98 IonicContact OE1-NE 3.84Å; E96-R98 PolarHBondContact OE1-NE 3.37Å; E96-R98 IonicContact OE1-NH2 3.64Å; E96-R98 IonicContact OE2-CZ 3.49Å; E96-R98 IonicContact OE2-NE 3.88Å; E96-R98 PolarHBondContact OE2-NE 3.47Å; E96-R98 IonicContact OE2-NH2 2.69Å; E96-R98 PolarHBondContact OE2-NH2 2.85Å; R98-D100 PolarHBondContact O-N 2.93Å; R98-V101 HydrophobicContact CB-CB 4.14Å; R98-V101 HydrophobicContact CB-CG2 3.91Å; R98-V101 PolarHBondContact O-N 3.18Å; R98-V102 WeakPolarHBondContact O-CG2 3.3Å; R98-V102 PolarHBondContact O-N 2.97Å
99	P	85.7	Confident	93.6	Very high	42 Å²	42	52.3 Å²	52.3	27%	0.273	28%	0.276	S	S	.	.	H	α-helix	trans	-52.9	-44.2	-176.2	-27.8	36.2	0	0	0	112.4	R97 V101 V102 E103 A287	R97-P99 WeakPolarHBondContact O-CD 3.4Å; P99-V101 VanDerWaalsContact C-N 3.27Å; P99-V101 PolarHBondContact O-N 2.99Å; P99-V102 PolarHBondContact O-N 2.88Å; P99-V102 VanDerWaalsContact O-N 3.13Å; P99-E103 WeakPolarHBondContact O-CG 3.48Å; P99-E103 PolarHBondContact O-N 3.25Å; P99-A287 HydrophobicContact CB-CB 4.16Å
100	D	84.4	Confident	93.4	Very high	118 Å²	118	54.4 Å²	54.4	63%	0.631	29%	0.29	S	S	*	.	H	α-helix	trans	-60.2	-35.1	179.2	-49.9	-27.3	0	0	0	112.7	R98 N104	R98-D100 PolarHBondContact O-N 2.93Å; D100-N104 VanDerWaalsContact O-CB 3.31Å; D100-N104 WeakPolarHBondContact O-CB 3.19Å; D100-N104 VanDerWaalsContact O-CG 3.27Å; D100-N104 PolarHBondContact O-N 3.36Å; D100-N104 PolarHBondContact O-ND2 2.76Å
101	V	88.8	Confident	93.4	Very high	34 Å²	34	58.8 Å²	58.8	21%	0.206	31%	0.311	C	S	.	.	H	α-helix	trans	-77.2	-39.6	177.7	-178.8	0	0	0	0	110.6	E96 R98 P99 N104 Q105	E96-V101 HydrophobicContact CG-CB 4.11Å; E96-V101 HydrophobicContact CG-CG1 3.85Å; R98-V101 HydrophobicContact CB-CB 4.14Å; R98-V101 HydrophobicContact CB-CG2 3.91Å; R98-V101 PolarHBondContact O-N 3.18Å; P99-V101 VanDerWaalsContact C-N 3.27Å; P99-V101 PolarHBondContact O-N 2.99Å; V101-N104 PolarHBondContact O-N 2.85Å; V101-Q105 WeakPolarHBondContact O-CB 3.49Å; V101-Q105 PolarHBondContact O-N 3.05Å
102	V	90.9	Very high	93.3	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-63	-42.8	177.8	175.1	0	0	0	0	111.2	E96 R98 P99 Q105 P106 A109 L158	E96-V102 HydrophobicContact CB-CG2 4.49Å; E96-V102 HydrophobicContact CG-CG2 3.86Å; R98-V102 WeakPolarHBondContact O-CG2 3.3Å; R98-V102 PolarHBondContact O-N 2.97Å; P99-V102 PolarHBondContact O-N 2.88Å; P99-V102 VanDerWaalsContact O-N 3.13Å; V102-Q105 CarbonylContact O-C 3.4Å; V102-P106 VanDerWaalsContact O-CA 3.31Å; V102-P106 WeakPolarHBondContact O-CA 3.4Å; V102-A109 HydrophobicContact CB-CB 4.21Å; V102-A109 HydrophobicContact CG1-CB 3.98Å; V102-A109 HydrophobicContact CG2-CB 4Å; V102-L158 HydrophobicContact CG1-CB 3.92Å; V102-L158 HydrophobicContact CG1-CD2 3.73Å; V102-L158 HydrophobicContact CG1-CG 3.6Å; V102-L158 WeakPolarHBondContact O-CD2 3.43Å
103	E	89	Confident	93.2	Very high	92 Å²	92	60.7 Å²	60.7	43%	0.43	32%	0.321	S	S	.	.	H	α-helix	trans	-69.7	-37.9	178.4	-71.7	179.9	-179.5	0	0	112.5	P99 A287	P99-E103 WeakPolarHBondContact O-CG 3.48Å; P99-E103 PolarHBondContact O-N 3.25Å; E103-A287 VanDerWaalsContact OE1-CA 3.3Å; E103-A287 WeakPolarHBondContact OE1-CA 3.22Å; E103-A287 WeakPolarHBondContact OE1-CB 3.31Å
104	N	91.7	Very high	93.2	Very high	132 Å²	132	60.5 Å²	60.5	71%	0.706	32%	0.319	S	S	*	.	H	α-helix	trans	-81.3	-23.2	-179.9	-72.7	-47.6	0	0	0	113.8	D100 V101	D100-N104 VanDerWaalsContact O-CB 3.31Å; D100-N104 WeakPolarHBondContact O-CB 3.19Å; D100-N104 VanDerWaalsContact O-CG 3.27Å; D100-N104 PolarHBondContact O-N 3.36Å; D100-N104 PolarHBondContact O-ND2 2.76Å; V101-N104 PolarHBondContact O-N 2.85Å
105	Q	94.5	Very high	93.3	Very high	116 Å²	116	64.3 Å²	64.3	54%	0.542	34%	0.337	S	S	.	.			trans	-135.2	63.2	-178.2	-61.1	179.6	38.2	0	0	110.7	V101 V102 D107 A108 A109	V101-Q105 WeakPolarHBondContact O-CB 3.49Å; V101-Q105 PolarHBondContact O-N 3.05Å; V102-Q105 CarbonylContact O-C 3.4Å; Q105-D107 VanDerWaalsContact C-N 3.33Å; Q105-D107 PolarHBondContact O-N 3.05Å; Q105-A108 HydrophobicContact CB-CB 4.19Å; Q105-A108 PolarHBondContact O-N 3.33Å; Q105-A109 WeakPolarHBondContact O-CB 3.02Å; Q105-A109 PolarHBondContact O-N 2.79Å
106	P	94.3	Very high	93.5	Very high	56 Å²	56	63 Å²	63	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-60	-40.8	-173.4	24.5	-35.4	0	0	0	112.8	V102 A109 S110 L158	V102-P106 VanDerWaalsContact O-CA 3.31Å; V102-P106 WeakPolarHBondContact O-CA 3.4Å; P106-A109 PolarHBondContact O-N 2.8Å; P106-S110 PolarHBondContact O-N 2.95Å; P106-L158 HydrophobicContact CB-CD2 3.61Å
107	D	95.9	Very high	93.6	Very high	125 Å²	125	61.6 Å²	61.6	67%	0.668	32%	0.319	S	S	*	.	H	α-helix	trans	-65.6	-46.3	-178.8	-58.8	-32.8	0	0	0	111.4	Q105 A109 S110 Q111	Q105-D107 VanDerWaalsContact C-N 3.33Å; Q105-D107 PolarHBondContact O-N 3.05Å; D107-A109 VanDerWaalsContact C-N 3.32Å; D107-A109 PolarHBondContact O-N 3.21Å; D107-S110 PolarHBondContact O-N 2.88Å; D107-Q111 WeakPolarHBondContact O-CB 3.33Å; D107-Q111 VanDerWaalsContact O-CG 3.31Å; D107-Q111 WeakPolarHBondContact O-CG 3.36Å; D107-Q111 PolarHBondContact O-N 3.07Å
108	A	94.6	Very high	94	Very high	39 Å²	39	56.9 Å²	56.9	32%	0.322	30%	0.303	S	S	.	.	H	α-helix	trans	-65.3	-36.7	177.8	0	0	0	0	0	111.9	Q105 L112	Q105-A108 HydrophobicContact CB-CB 4.19Å; Q105-A108 PolarHBondContact O-N 3.33Å; A108-L112 PolarHBondContact O-N 3.04Å; A108-L112 VanDerWaalsContact O-N 3.08Å
109	A	93.6	Very high	94.5	Very high	2 Å²	2	52.1 Å²	52.1	2%	0.017	29%	0.287	C	S	.	.	H	α-helix	trans	-64.9	-42	174	0	0	0	0	0	111.6	V102 Q105 P106 D107 L112 N113	V102-A109 HydrophobicContact CB-CB 4.21Å; V102-A109 HydrophobicContact CG1-CB 3.98Å; V102-A109 HydrophobicContact CG2-CB 4Å; Q105-A109 WeakPolarHBondContact O-CB 3.02Å; Q105-A109 PolarHBondContact O-N 2.79Å; P106-A109 PolarHBondContact O-N 2.8Å; D107-A109 VanDerWaalsContact C-N 3.32Å; D107-A109 PolarHBondContact O-N 3.21Å; A109-L112 PolarHBondContact O-N 3.06Å; A109-N113 WeakPolarHBondContact O-CB 3.43Å; A109-N113 VanDerWaalsContact O-CG 3.3Å; A109-N113 PolarHBondContact O-N 3Å
110	S	96.4	Very high	95.1	Very high	44 Å²	44	50.2 Å²	50.2	31%	0.308	28%	0.275	S	S	.	.	H	α-helix	trans	-65	-44.7	175.1	-167.8	0	0	0	0	111.8	P106 D107 L112 N113 V114 D115	P106-S110 PolarHBondContact O-N 2.95Å; D107-S110 PolarHBondContact O-N 2.88Å; S110-L112 VanDerWaalsContact C-N 3.29Å; S110-L112 PolarHBondContact O-N 3.43Å; S110-N113 PolarHBondContact O-N 3.16Å; S110-V114 WeakPolarHBondContact O-CA 3.12Å; S110-V114 VanDerWaalsContact O-CB 3.24Å; S110-V114 WeakPolarHBondContact O-CB 3.31Å; S110-V114 PolarHBondContact O-N 3.11Å; S110-D115 PolarHBondContact O-N 2.85Å
111	Q	97.3	Very high	95.8	Very high	93 Å²	93	44.6 Å²	44.6	44%	0.435	25%	0.245	S	C	.	.	I	π-helix	trans	-56.7	-43.1	177	-76.2	176.8	-22.5	0	0	112.1	L73 D107 D115 A116	L73-Q111 HydrophobicContact CD2-CB 3.99Å; D107-Q111 WeakPolarHBondContact O-CB 3.33Å; D107-Q111 VanDerWaalsContact O-CG 3.31Å; D107-Q111 WeakPolarHBondContact O-CG 3.36Å; D107-Q111 PolarHBondContact O-N 3.07Å; Q111-D115 WeakPolarHBondContact CA-OD2 3.39Å; Q111-D115 WeakPolarHBondContact O-CB 3.48Å; Q111-D115 PolarHBondContact O-N 3.16Å; Q111-A116 WeakPolarHBondContact O-CB 3.44Å; Q111-A116 PolarHBondContact O-N 2.93Å
112	L	96.9	Very high	96.2	Very high	42 Å²	42	48.4 Å²	48.4	22%	0.22	26%	0.259	C	S	.	.	I	π-helix	trans	-79.4	-42.6	179.9	-175.9	60.9	0	0	0	113.2	L72 L73 E96 A108 A109 S110	L72-L112 HydrophobicContact CB-CD1 4.32Å; L73-L112 HydrophobicContact CD2-CB 4.33Å; L73-L112 HydrophobicContact CD2-CD1 4.36Å; E96-L112 HydrophobicContact CB-CD2 4.24Å; A108-L112 PolarHBondContact O-N 3.04Å; A108-L112 VanDerWaalsContact O-N 3.08Å; A109-L112 PolarHBondContact O-N 3.06Å; S110-L112 VanDerWaalsContact C-N 3.29Å; S110-L112 PolarHBondContact O-N 3.43Å
113	N	98	Very high	96.6	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.266	C	S	.	.	I	π-helix	trans	-84.7	-25.7	-172.7	-67.4	-8.3	0	0	0	113	A95 E96 A109 S110 S117 T162	A95-N113 VanDerWaalsContact CA-OD1 3.3Å; A95-N113 WeakPolarHBondContact CA-OD1 3.45Å; A95-N113 WeakPolarHBondContact CB-OD1 3.29Å; E96-N113 PolarHBondContact N-OD1 2.95Å; E96-N113 PolarHBondContact O-ND2 3.46Å; A109-N113 WeakPolarHBondContact O-CB 3.43Å; A109-N113 VanDerWaalsContact O-CG 3.3Å; A109-N113 PolarHBondContact O-N 3Å; S110-N113 PolarHBondContact O-N 3.16Å; N113-S117 WeakPolarHBondContact O-CB 3.29Å; N113-S117 PolarHBondContact O-OG 3.23Å; N113-T162 PolarHBondContact ND2-OG1 3.32Å; N113-T162 VanDerWaalsContact ND2-OG1 3.07Å
114	V	98.4	Very high	97.1	Very high	19 Å²	19	45.6 Å²	45.6	12%	0.115	25%	0.246	C	C	.	.	I	π-helix	trans	-113.2	-63.4	-175.2	-171.6	0	0	0	0	110.7	S110 A116 S117 G118 T162 D165 A169	S110-V114 WeakPolarHBondContact O-CA 3.12Å; S110-V114 VanDerWaalsContact O-CB 3.24Å; S110-V114 WeakPolarHBondContact O-CB 3.31Å; S110-V114 PolarHBondContact O-N 3.11Å; V114-A116 PolarHBondContact O-N 3.25Å; V114-S117 WeakPolarHBondContact O-CB 3.42Å; V114-S117 PolarHBondContact O-N 2.76Å; V114-G118 PolarHBondContact O-N 3.47Å; V114-T162 WeakPolarHBondContact CG2-O 3.34Å; V114-D165 HydrophobicContact CG1-CB 4.13Å; V114-D165 HydrophobicContact CG2-CB 3.85Å; V114-A169 HydrophobicContact CG1-CB 4.19Å
115	D	98.4	Very high	97.4	Very high	98 Å²	98	41.4 Å²	41.4	52%	0.524	23%	0.229	S	C	.	.	I	π-helix	trans	-66.2	-46.8	-170.4	-57.7	-24.8	0	0	0	111.5	S110 Q111 S117 G118 N119	S110-D115 PolarHBondContact O-N 2.85Å; Q111-D115 WeakPolarHBondContact CA-OD2 3.39Å; Q111-D115 WeakPolarHBondContact O-CB 3.48Å; Q111-D115 PolarHBondContact O-N 3.16Å; D115-S117 VanDerWaalsContact C-N 3.31Å; D115-S117 PolarHBondContact O-N 2.87Å; D115-G118 PolarHBondContact O-N 3.5Å; D115-N119 WeakPolarHBondContact O-CB 3.4Å; D115-N119 PolarHBondContact O-N 3.45Å
116	A	98.4	Very high	97.6	Very high	7 Å²	7	39.9 Å²	39.9	6%	0.058	24%	0.236	C	C	.	.	H	α-helix	trans	-63.5	-36.6	175.9	0	0	0	0	0	112.3	L72 L73 Q111 V114 N119 L120	L72-A116 HydrophobicContact CB-CB 4.09Å; L73-A116 HydrophobicContact CD2-CB 4.27Å; Q111-A116 WeakPolarHBondContact O-CB 3.44Å; Q111-A116 PolarHBondContact O-N 2.93Å; V114-A116 PolarHBondContact O-N 3.25Å; A116-N119 PolarHBondContact O-N 3.49Å; A116-L120 VanDerWaalsContact O-CB 3.32Å; A116-L120 WeakPolarHBondContact O-CB 3.42Å; A116-L120 PolarHBondContact O-N 3.49Å
117	S	98.8	Very high	97.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.5	-44.6	175	-57.2	0	0	0	0	111.6	H92 N113 V114 D115 L120 A121 Y133	H92-S117 PolarHBondContact NE2-OG 3Å; N113-S117 WeakPolarHBondContact O-CB 3.29Å; N113-S117 PolarHBondContact O-OG 3.23Å; V114-S117 WeakPolarHBondContact O-CB 3.42Å; V114-S117 PolarHBondContact O-N 2.76Å; D115-S117 VanDerWaalsContact C-N 3.31Å; D115-S117 PolarHBondContact O-N 2.87Å; S117-L120 PolarHBondContact O-N 2.84Å; S117-A121 WeakPolarHBondContact O-CB 3.27Å; S117-A121 PolarHBondContact O-N 3.25Å; S117-Y133 WeakPolarHBondContact OG-CE2 3.26Å
118	G	98.7	Very high	97.8	Very high	6 Å²	6	35.8 Å²	35.8	6%	0.062	23%	0.228	C	C	.	.	H	α-helix	trans	-64.6	-42.3	175.3	0	0	0	0	0	112.3	V114 D115 A121 K122	V114-G118 PolarHBondContact O-N 3.47Å; D115-G118 PolarHBondContact O-N 3.5Å; G118-A121 PolarHBondContact O-N 2.96Å; G118-K122 WeakPolarHBondContact O-CG 3.47Å; G118-K122 PolarHBondContact O-N 3.21Å
119	N	98.8	Very high	98	Very high	28 Å²	28	34.1 Å²	34.1	15%	0.15	21%	0.214	C	C	.	.	H	α-helix	trans	-60.5	-45.9	173.8	-173.7	66.9	0	0	0	111.6	D115 A116 A121 K122 E123	D115-N119 WeakPolarHBondContact O-CB 3.4Å; D115-N119 PolarHBondContact O-N 3.45Å; A116-N119 PolarHBondContact O-N 3.49Å; N119-A121 VanDerWaalsContact C-N 3.27Å; N119-A121 PolarHBondContact O-N 2.99Å; N119-K122 WeakPolarHBondContact O-CB 3.42Å; N119-K122 PolarHBondContact O-N 2.97Å; N119-E123 PolarHBondContact O-N 2.95Å
120	L	98.6	Very high	98.3	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-62	-36.5	177.5	-159.6	74.9	0	0	0	111.9	T34 V78 I82 I90 H92 A116 S117 A124 L131	T34-L120 HydrophobicContact CG2-CD1 4.32Å; T34-L120 HydrophobicContact CG2-CD2 4.03Å; V78-L120 HydrophobicContact CG1-CD1 3.67Å; I82-L120 HydrophobicContact CD1-CD1 3.73Å; I90-L120 HydrophobicContact CG2-CD2 3.98Å; I90-L120 HydrophobicContact CG2-CG 4.38Å; H92-L120 HydrophobicContact CB-CD2 3.66Å; H92-L120 VanDerWaalsContact CG-CD2 3.41Å; A116-L120 VanDerWaalsContact O-CB 3.32Å; A116-L120 WeakPolarHBondContact O-CB 3.42Å; A116-L120 PolarHBondContact O-N 3.49Å; S117-L120 PolarHBondContact O-N 2.84Å; L120-A124 WeakPolarHBondContact O-CB 3.46Å; L120-A124 PolarHBondContact O-N 2.82Å; L120-L131 HydrophobicContact CD2-CD1 4.16Å
121	A	98.9	Very high	98.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.3	-42	174.9	0	0	0	0	0	112.8	S117 G118 N119 A124 A125 L131 V170 N173 N174	S117-A121 WeakPolarHBondContact O-CB 3.27Å; S117-A121 PolarHBondContact O-N 3.25Å; G118-A121 PolarHBondContact O-N 2.96Å; N119-A121 VanDerWaalsContact C-N 3.27Å; N119-A121 PolarHBondContact O-N 2.99Å; A121-A124 PolarHBondContact O-N 2.81Å; A121-A125 WeakPolarHBondContact O-CB 3.17Å; A121-A125 PolarHBondContact O-N 2.96Å; A121-L131 HydrophobicContact CB-CD2 3.71Å; A121-V170 HydrophobicContact CB-CB 4.29Å; A121-V170 HydrophobicContact CB-CG1 4.26Å; A121-V170 HydrophobicContact CB-CG2 4.25Å; A121-N173 HydrophobicContact CB-CB 3.9Å; A121-N174 HydrophobicContact CB-CB 4.04Å
122	K	98.8	Very high	98.5	Very high	114 Å²	114	27.8 Å²	27.8	50%	0.496	18%	0.179	S	C	.	.	H	α-helix	trans	-60.1	-50	174	-67.7	173.3	-175.7	174.9	0	111.5	G118 N119 A124 A125 A126 N173	G118-K122 WeakPolarHBondContact O-CG 3.47Å; G118-K122 PolarHBondContact O-N 3.21Å; N119-K122 WeakPolarHBondContact O-CB 3.42Å; N119-K122 PolarHBondContact O-N 2.97Å; K122-A124 PolarHBondContact O-N 2.84Å; K122-A125 PolarHBondContact O-N 2.84Å; K122-A126 PolarHBondContact O-N 3.46Å; K122-N173 WeakPolarHBondContact CE-OD1 3.37Å; K122-N173 HydrophobicContact CG-CB 3.75Å; K122-N173 WeakPolarHBondContact CG-OD1 3.32Å
123	E	98.8	Very high	98.6	Very high	34 Å²	34	25.8 Å²	25.8	16%	0.159	17%	0.169	C	C	.	.	H	α-helix	trans	-63.5	-41.6	179	-66.7	-61.8	145.6	0	0	111.6	V78 H79 I82 N119 A125 A126 V127	V78-E123 HydrophobicContact CG1-CG 4.24Å; H79-E123 IonicContact CE1-OE2 3.9Å; H79-E123 IonicContact CG-OE2 3.75Å; H79-E123 IonicContact ND1-OE1 3.71Å; H79-E123 IonicContact ND1-OE2 2.88Å; H79-E123 PolarHBondContact ND1-OE2 2.8Å; I82-E123 HydrophobicContact CD1-CB 3.55Å; I82-E123 HydrophobicContact CD1-CG 4.36Å; I82-E123 HydrophobicContact CG2-CB 4.43Å; N119-E123 PolarHBondContact O-N 2.95Å; E123-A125 VanDerWaalsContact C-N 3.34Å; E123-A125 PolarHBondContact O-N 2.74Å; E123-A126 PolarHBondContact O-N 3.27Å; E123-V127 PolarHBondContact O-N 2.82Å
124	A	98.7	Very high	98.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.9	-43.6	174.5	0	0	0	0	0	112	I90 L120 A121 K122 A126 V127 G128 A129 L131	I90-A124 HydrophobicContact CD1-CB 3.73Å; L120-A124 WeakPolarHBondContact O-CB 3.46Å; L120-A124 PolarHBondContact O-N 2.82Å; A121-A124 PolarHBondContact O-N 2.81Å; K122-A124 PolarHBondContact O-N 2.84Å; A124-A126 VanDerWaalsContact C-N 3.34Å; A124-V127 PolarHBondContact O-N 3.39Å; A124-G128 PolarHBondContact O-N 3.22Å; A124-G128 VanDerWaalsContact O-N 3.08Å; A124-A129 HydrophobicContact CB-CB 4.28Å; A124-A129 PolarHBondContact O-N 3.33Å; A124-L131 HydrophobicContact CB-CB 4.01Å; A124-L131 HydrophobicContact CB-CD2 4.41Å
125	A	98.6	Very high	98.6	Very high	44 Å²	44	25.7 Å²	25.7	36%	0.364	17%	0.167	S	C	.	.	H	α-helix	trans	-63.9	-40.4	177.6	0	0	0	0	0	111.6	A121 K122 E123 V127 G128 N174	A121-A125 WeakPolarHBondContact O-CB 3.17Å; A121-A125 PolarHBondContact O-N 2.96Å; K122-A125 PolarHBondContact O-N 2.84Å; E123-A125 VanDerWaalsContact C-N 3.34Å; E123-A125 PolarHBondContact O-N 2.74Å; A125-V127 VanDerWaalsContact C-N 3.32Å; A125-V127 PolarHBondContact O-N 2.84Å; A125-G128 PolarHBondContact O-N 3.11Å; A125-G128 VanDerWaalsContact O-N 3.15Å; A125-N174 HydrophobicContact CB-CB 4.18Å; A125-N174 PolarHBondContact N-ND2 3.03Å
126	A	98.4	Very high	98.6	Very high	83 Å²	83	21.4 Å²	21.4	69%	0.686	15%	0.145	S	C	*	.	H	α-helix	trans	-61.3	-36.5	179.8	0	0	0	0	0	113.2	K122 E123 A124	K122-A126 PolarHBondContact O-N 3.46Å; E123-A126 PolarHBondContact O-N 3.27Å; A124-A126 VanDerWaalsContact C-N 3.34Å
127	V	97.9	Very high	98.6	Very high	30 Å²	30	21.7 Å²	21.7	18%	0.182	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.6	177	-56.3	0	0	0	0	113.7	I82 E123 A124 A125 A129	I82-V127 HydrophobicContact CG2-CB 4.48Å; I82-V127 HydrophobicContact CG2-CG1 3.93Å; I82-V127 HydrophobicContact CG2-CG2 3.72Å; E123-V127 PolarHBondContact O-N 2.82Å; A124-V127 PolarHBondContact O-N 3.39Å; A125-V127 VanDerWaalsContact C-N 3.32Å; A125-V127 PolarHBondContact O-N 2.84Å; V127-A129 VanDerWaalsContact C-N 3.29Å; V127-A129 HydrophobicContact CG2-CB 3.77Å; V127-A129 PolarHBondContact O-N 2.93Å
128	G	97.6	Very high	98.6	Very high	65 Å²	65	22.9 Å²	22.9	67%	0.67	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.5	23.2	-177.2	0	0	0	0	0	114.5	A124 A125	A124-G128 PolarHBondContact O-N 3.22Å; A124-G128 VanDerWaalsContact O-N 3.08Å; A125-G128 PolarHBondContact O-N 3.11Å; A125-G128 VanDerWaalsContact O-N 3.15Å
129	A	98.4	Very high	98.6	Very high	4 Å²	4	22.6 Å²	22.6	3%	0.033	15%	0.147	C	C	.	.			trans	-76	140.4	178	0	0	0	0	0	111.8	P87 I90 A124 V127 L131	P87-A129 HydrophobicContact CG-CB 4.36Å; P87-A129 WeakPolarHBondContact O-CB 3.3Å; I90-A129 HydrophobicContact CD1-CB 3.91Å; I90-A129 HydrophobicContact CG1-CB 4.1Å; A124-A129 HydrophobicContact CB-CB 4.28Å; A124-A129 PolarHBondContact O-N 3.33Å; V127-A129 VanDerWaalsContact C-N 3.29Å; V127-A129 HydrophobicContact CG2-CB 3.77Å; V127-A129 PolarHBondContact O-N 2.93Å; A129-L131 PolarHBondContact O-N 2.87Å
130	F	98.8	Very high	98.6	Very high	6 Å²	6	21.2 Å²	21.2	3%	0.026	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	110.9	167.9	175.7	-132.8	0	0	0	110.3	H88 V89 I90 I132 G176 A178 L234 R238 M239	H88-F130 PolarHBondContact O-N 3.13Å; V89-F130 CarbonylContact C-O 3.59Å; V89-F130 VanDerWaalsContact CA-O 3.28Å; V89-F130 WeakPolarHBondContact CA-O 3.31Å; V89-F130 HydrophobicContact CG1-CD1 4.32Å; V89-F130 HydrophobicContact CG2-CB 4.36Å; V89-F130 HydrophobicContact CG2-CD1 4.37Å; I90-F130 PolarHBondContact N-O 2.85Å; F130-I132 HydrophobicContact CD1-CD1 4.25Å; F130-I132 HydrophobicContact CD1-CG1 3.96Å; F130-I132 HydrophobicContact CE1-CD1 3.65Å; F130-I132 HydrophobicContact CE1-CG1 3.44Å; F130-I132 VanDerWaalsContact CE1-CG1 3.44Å; F130-I132 HydrophobicContact CZ-CD1 4.34Å; F130-I132 HydrophobicContact CZ-CG1 3.78Å; F130-G176 WeakPolarHBondContact CD2-O 3.32Å; F130-A178 HydrophobicContact CE2-CB 3.59Å; F130-A178 HydrophobicContact CZ-CB 3.5Å; F130-A178 VanDerWaalsContact CZ-CB 3.5Å; F130-L234 HydrophobicContact CE1-CG 4.36Å; F130-L234 HydrophobicContact CZ-CD2 4.33Å; F130-L234 HydrophobicContact CZ-CG 4.24Å; F130-R238 HydrophobicContact CB-CG 4.05Å; F130-R238 HydrophobicContact CD1-CB 3.8Å; F130-R238 HydrophobicContact CD1-CG 3.66Å; F130-R238 HydrophobicContact CD2-CG 3.72Å; F130-R238 HydrophobicContact CE1-CB 3.72Å; F130-R238 HydrophobicContact CE1-CG 3.92Å; F130-R238 HydrophobicContact CE2-CG 3.99Å; F130-R238 HydrophobicContact CG-CB 4.22Å; F130-R238 HydrophobicContact CG-CG 3.54Å; F130-R238 HydrophobicContact CZ-CB 4.1Å; F130-R238 HydrophobicContact CZ-CG 4.07Å; F130-M239 HydrophobicContact CB-CE 4.2Å
131	L	98.9	Very high	98.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	122.8	176.9	175	60.8	0	0	0	110.8	I90 H92 L120 A121 A124 A129 V170 A177 A178	I90-L131 HydrophobicContact CB-CD1 3.96Å; I90-L131 HydrophobicContact CG2-CD1 3.78Å; I90-L131 CarbonylContact O-C 3.56Å; I90-L131 WeakPolarHBondContact O-CA 3.18Å; H92-L131 HydrophobicContact CB-CD1 3.98Å; L120-L131 HydrophobicContact CD2-CD1 4.16Å; A121-L131 HydrophobicContact CB-CD2 3.71Å; A124-L131 HydrophobicContact CB-CB 4.01Å; A124-L131 HydrophobicContact CB-CD2 4.41Å; A129-L131 PolarHBondContact O-N 2.87Å; L131-V170 HydrophobicContact CD2-CG1 3.79Å; L131-V170 HydrophobicContact CD2-CG2 4.31Å; L131-V170 HydrophobicContact CG-CG1 4.42Å; L131-A177 HydrophobicContact CB-CB 4.08Å; L131-A177 HydrophobicContact CG-CB 4.49Å; L131-A177 CarbonylContact O-C 3.57Å; L131-A177 WeakPolarHBondContact O-CA 3.46Å; L131-A177 WeakPolarHBondContact O-CB 3.44Å; L131-A178 PolarHBondContact O-N 3.27Å
132	I	98.9	Very high	98.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	108.5	166.8	-54.3	176.1	0	0	0	108	V89 I90 V91 H92 F130 I134 A178 L180 C231 L234 A235	V89-I132 HydrophobicContact CG1-CD1 4.43Å; I90-I132 PolarHBondContact O-N 2.67Å; V91-I132 HydrophobicContact CG1-CB 4.38Å; V91-I132 HydrophobicContact CG2-CD1 4.32Å; H92-I132 PolarHBondContact N-O 3.24Å; F130-I132 HydrophobicContact CD1-CD1 4.25Å; F130-I132 HydrophobicContact CD1-CG1 3.96Å; F130-I132 HydrophobicContact CE1-CD1 3.65Å; F130-I132 HydrophobicContact CE1-CG1 3.44Å; F130-I132 VanDerWaalsContact CE1-CG1 3.44Å; F130-I132 HydrophobicContact CZ-CD1 4.34Å; F130-I132 HydrophobicContact CZ-CG1 3.78Å; I132-I134 HydrophobicContact CG2-CD1 4.24Å; I132-A178 CarbonylContact C-O 3.37Å; I132-A178 WeakPolarHBondContact CA-O 3.26Å; I132-L180 HydrophobicContact CG2-CB 4.2Å; I132-C231 HydrophobicContact CD1-CB 4.45Å; I132-C231 WeakPolarHBondContact CD1-O 3.3Å; I132-L234 HydrophobicContact CD1-CB 4.47Å; I132-L234 HydrophobicContact CD1-CD2 4.32Å; I132-A235 HydrophobicContact CD1-CB 4.32Å
133	Y	98.9	Very high	98.4	Very high	1 Å²	1	22.6 Å²	22.6	0%	0.004	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	122.9	173.7	173.9	-108.6	0	0	0	110.7	H92 S117 S135 K163 E167 V170 A178 V179 L180	H92-Y133 AromaticContact CD2-CD2 3.7Å; S117-Y133 WeakPolarHBondContact OG-CE2 3.26Å; Y133-S135 PolarHBondContact O-N 3.34Å; Y133-K163 VanDerWaalsContact OH-CE 3.26Å; Y133-K163 WeakPolarHBondContact OH-CE 3.47Å; Y133-K163 PolarHBondContact OH-NZ 3.03Å; Y133-K163 PolarHBondContact OH-O 3.21Å; Y133-E167 HydrophobicContact CD1-CG 4.1Å; Y133-E167 HydrophobicContact CE1-CB 4.35Å; Y133-E167 HydrophobicContact CE1-CG 3.68Å; Y133-V170 HydrophobicContact CD2-CG2 3.97Å; Y133-V170 HydrophobicContact CG-CG2 3.97Å; Y133-A178 PolarHBondContact N-O 2.99Å; Y133-V179 HydrophobicContact CD1-CG1 4.18Å; Y133-V179 HydrophobicContact CD1-CG2 4.15Å; Y133-V179 WeakPolarHBondContact O-CA 3.46Å; Y133-L180 PolarHBondContact O-N 3.42Å
134	I	98.9	Very high	98.4	Very high	13 Å²	13	26.8 Å²	26.8	7%	0.067	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	116.6	176.3	-56.3	-57.2	0	0	0	109.6	L40 V91 H92 I132 K163 L180 I182	L40-I134 HydrophobicContact CD2-CB 4.4Å; L40-I134 HydrophobicContact CD2-CD1 4.23Å; L40-I134 HydrophobicContact CD2-CG1 3.92Å; L40-I134 HydrophobicContact CD2-CG2 3.77Å; V91-I134 HydrophobicContact CG1-CD1 4.32Å; V91-I134 HydrophobicContact CG1-CG1 4.43Å; H92-I134 WeakPolarHBondContact O-CB 3.47Å; H92-I134 WeakPolarHBondContact O-CG1 3.48Å; H92-I134 PolarHBondContact O-N 2.87Å; I132-I134 HydrophobicContact CG2-CD1 4.24Å; I134-K163 VanDerWaalsContact O-CE 3.26Å; I134-K163 WeakPolarHBondContact O-CE 3.19Å; I134-K163 PolarHBondContact O-NZ 3.2Å; I134-L180 HydrophobicContact CD1-CB 4.22Å; I134-L180 HydrophobicContact CD1-CD2 4.08Å; I134-I182 HydrophobicContact CG2-CD1 3.32Å; I134-I182 HydrophobicContact CG2-CG1 3.93Å
135	S	98.8	Very high	98.3	Very high	3 Å²	3	29 Å²	29	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	-165.9	176	-164.2	0	0	0	0	111.8	Y133 E167 L180 I182	Y133-S135 PolarHBondContact O-N 3.34Å; S135-E167 WeakPolarHBondContact CB-OE1 3.31Å; S135-E167 WeakPolarHBondContact OG-CG 3.16Å; S135-E167 PolarHBondContact OG-OE1 2.96Å; S135-L180 PolarHBondContact N-O 3.33Å; S135-I182 WeakPolarHBondContact O-CG1 3.4Å; S135-I182 PolarHBondContact O-N 2.99Å
136	S	98.6	Very high	98.3	Very high	8 Å²	8	29.8 Å²	29.8	6%	0.056	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	149.9	-171.2	-163.5	0	0	0	0	111.9	Y138 V139 I182	S136-Y138 PolarHBondContact O-N 3.34Å; S136-Y138 PolarHBondContact OG-N 3.13Å; S136-V139 WeakPolarHBondContact O-CG1 3.46Å; S136-V139 VanDerWaalsContact O-CG2 3.28Å; S136-V139 WeakPolarHBondContact O-CG2 3.36Å; S136-V139 PolarHBondContact O-N 3.34Å; S136-I182 CarbonylContact C-O 3.58Å; S136-I182 WeakPolarHBondContact CA-O 3.3Å
137	D	98.5	Very high	98.4	Very high	13 Å²	13	26.2 Å²	26.2	7%	0.07	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-56.5	-23.2	162.2	64	-25.9	0	0	0	114	V139 F140 I182 P183 A293 L295	D137-V139 PolarHBondContact O-N 3.35Å; D137-F140 PolarHBondContact O-N 3.07Å; D137-I182 PolarHBondContact N-O 2.93Å; D137-P183 HydrophobicContact CB-CB 4.25Å; D137-P183 VanDerWaalsContact CG-CA 3.5Å; D137-A293 HydrophobicContact CB-CB 4.04Å; D137-L295 HydrophobicContact CB-CD1 4.29Å; D137-L295 HydrophobicContact CB-CD2 4.14Å; D137-L295 HydrophobicContact CB-CG 4.25Å
138	Y	98.1	Very high	98.4	Very high	25 Å²	25	31 Å²	31	10%	0.098	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-68.6	-2.1	178.5	-84	33.5	0	0	0	114	S136 F140 N157 Y159 G160 Q217 R219 P290	S136-Y138 PolarHBondContact O-N 3.34Å; S136-Y138 PolarHBondContact OG-N 3.13Å; Y138-F140 PolarHBondContact O-N 3.13Å; Y138-N157 VanDerWaalsContact CD2-ND2 3.28Å; Y138-N157 WeakPolarHBondContact CD2-ND2 3.32Å; Y138-Y159 AromaticContact CD2-CD1 3.79Å; Y138-Y159 HydrophobicContact CD2-CD1 3.79Å; Y138-Y159 HydrophobicContact CD2-CE1 4.18Å; Y138-Y159 HydrophobicContact CG-CD1 4.23Å; Y138-Y159 HydrophobicContact CG-CE1 4.26Å; Y138-G160 VanDerWaalsContact O-CA 3.32Å; Y138-G160 WeakPolarHBondContact O-CA 3.38Å; Y138-Q217 PolarHBondContact OH-NE2 3.42Å; Y138-R219 PolarHBondContact OH-NH2 3.09Å; Y138-P290 HydrophobicContact CD1-CG 3.99Å; Y138-P290 HydrophobicContact CE1-CG 4.01Å
139	V	98.6	Very high	98.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-70.2	-17.1	166.6	-56.4	0	0	0	0	112.2	S136 D137 P153 A154 P155 K163 L164	S136-V139 WeakPolarHBondContact O-CG1 3.46Å; S136-V139 VanDerWaalsContact O-CG2 3.28Å; S136-V139 WeakPolarHBondContact O-CG2 3.36Å; S136-V139 PolarHBondContact O-N 3.34Å; D137-V139 PolarHBondContact O-N 3.35Å; V139-P153 HydrophobicContact CB-CB 4.06Å; V139-P153 HydrophobicContact CG2-CB 4.18Å; V139-P153 CarbonylContact O-C 3.57Å; V139-P153 WeakPolarHBondContact O-CA 3.44Å; V139-P153 VanDerWaalsContact O-CB 3.26Å; V139-P153 WeakPolarHBondContact O-CB 3.43Å; V139-A154 CarbonylContact O-C 3.59Å; V139-A154 PolarHBondContact O-N 3.26Å; V139-P155 WeakPolarHBondContact O-CD 3.33Å; V139-K163 HydrophobicContact CG1-CB 4.18Å; V139-L164 HydrophobicContact CB-CB 4.37Å; V139-L164 HydrophobicContact CG1-CB 3.98Å
140	F	98.8	Very high	98.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	-100.8	154.7	177.1	-59.7	-64.7	0	0	0	112.4	D137 Y138 Y147 D151 P153 A154 R181 H249 A293 L295	D137-F140 PolarHBondContact O-N 3.07Å; Y138-F140 PolarHBondContact O-N 3.13Å; F140-Y147 HydrophobicContact CB-CD1 3.95Å; F140-Y147 HydrophobicContact CB-CD2 4.13Å; F140-Y147 HydrophobicContact CB-CE1 3.79Å; F140-Y147 HydrophobicContact CB-CE2 4.03Å; F140-Y147 HydrophobicContact CB-CG 4.1Å; F140-Y147 AromaticContact CD1-CD1 3.16Å; F140-Y147 HydrophobicContact CD1-CD1 3.16Å; F140-Y147 AromaticContact CD1-CE1 3.56Å; F140-Y147 HydrophobicContact CD1-CE1 3.56Å; F140-Y147 AromaticContact CD1-CG 3.77Å; F140-Y147 HydrophobicContact CD1-CG 3.77Å; F140-Y147 HydrophobicContact CD2-CD1 4.1Å; F140-Y147 HydrophobicContact CD2-CD2 4.27Å; F140-Y147 AromaticContact CD2-CG 3.8Å; F140-Y147 HydrophobicContact CD2-CG 3.8Å; F140-Y147 AromaticContact CE1-CD1 3.52Å; F140-Y147 HydrophobicContact CE1-CD1 3.52Å; F140-Y147 HydrophobicContact CE1-CE1 4.3Å; F140-Y147 HydrophobicContact CE1-CG 4.05Å; F140-Y147 HydrophobicContact CE2-CD1 4.38Å; F140-Y147 HydrophobicContact CE2-CG 4.08Å; F140-Y147 AromaticContact CG-CD1 3.48Å; F140-Y147 HydrophobicContact CG-CD1 3.48Å; F140-Y147 VanDerWaalsContact CG-CD1 3.48Å; F140-Y147 HydrophobicContact CG-CD2 4.11Å; F140-Y147 AromaticContact CG-CE1 3.83Å; F140-Y147 HydrophobicContact CG-CE1 3.83Å; F140-Y147 HydrophobicContact CG-CE2 4.45Å; F140-Y147 AromaticContact CG-CG 3.62Å; F140-Y147 HydrophobicContact CG-CG 3.62Å; F140-Y147 HydrophobicContact CZ-CD1 4.1Å; F140-Y147 HydrophobicContact CZ-CG 4.18Å; F140-D151 HydrophobicContact CE1-CB 4.21Å; F140-P153 HydrophobicContact CD1-CB 4.44Å; F140-P153 HydrophobicContact CE1-CB 4.41Å; F140-P153 HydrophobicContact CE1-CG 4.23Å; F140-A154 CarbonylContact C-O 3.54Å; F140-R181 VanDerWaalsContact CZ-NH1 3.3Å; F140-H249 AromaticContact CE2-CE1 3.73Å; F140-H249 AromaticContact CE2-NE2 3.84Å; F140-H249 AromaticContact CZ-CE1 3.81Å; F140-H249 AromaticContact CZ-NE2 3.93Å; F140-A293 HydrophobicContact CB-CB 4.38Å; F140-L295 HydrophobicContact CD2-CD2 3.92Å; F140-L295 HydrophobicContact CE2-CD2 3.66Å
141	D	97.8	Very high	98.5	Very high	38 Å²	38	36.2 Å²	36.2	20%	0.203	19%	0.189	C	C	.	.			trans	-80.8	-16.5	177.1	64.2	-17	0	0	0	113.5	T143 Y147 A154 L156 P290	D141-T143 HydrophobicContact CB-CG2 4.26Å; D141-T143 PolarHBondContact OD1-N 3.41Å; D141-T143 PolarHBondContact OD1-OG1 3.24Å; D141-T143 WeakPolarHBondContact OD2-CG2 3.22Å; D141-T143 PolarHBondContact OD2-OG1 3Å; D141-Y147 PolarHBondContact OD1-OH 3.1Å; D141-A154 WeakPolarHBondContact CA-O 3.43Å; D141-A154 HydrophobicContact CB-CB 4.12Å; D141-A154 VanDerWaalsContact CB-O 3.32Å; D141-A154 WeakPolarHBondContact CB-O 3.27Å; D141-A154 PolarHBondContact N-O 2.87Å; D141-L156 HydrophobicContact CB-CD1 4.42Å; D141-L156 HydrophobicContact CB-CD2 3.91Å; D141-L156 HydrophobicContact CB-CG 4.1Å; D141-L156 WeakPolarHBondContact O-CD1 3.39Å; D141-P290 VanDerWaalsContact O-CA 3.26Å; D141-P290 WeakPolarHBondContact O-CA 3.36Å; D141-P290 VanDerWaalsContact O-CB 3.3Å; D141-P290 WeakPolarHBondContact O-CB 3.25Å
142	G	97.8	Very high	98.4	Very high	4 Å²	4	43.4 Å²	43.4	4%	0.041	23%	0.225	C	C	.	.	S	Bend	trans	71.8	29.9	176.8	0	0	0	0	0	114.7	Y147 N292	G142-Y147 WeakPolarHBondContact CA-OH 3.47Å; G142-Y147 PolarHBondContact N-OH 2.92Å; G142-N292 CarbonylContact C-O 3.58Å; G142-N292 WeakPolarHBondContact CA-O 3.44Å; G142-N292 PolarHBondContact O-N 3.2Å; G142-N292 VanDerWaalsContact O-N 3.16Å
143	T	97.5	Very high	98.4	Very high	104 Å²	104	45 Å²	45	64%	0.638	24%	0.236	S	C	*	.	S	Bend	trans	-96.8	-27.5	179.3	61.5	0	0	0	0	113.5	D141 Y147	D141-T143 HydrophobicContact CB-CG2 4.26Å; D141-T143 PolarHBondContact OD1-N 3.41Å; D141-T143 PolarHBondContact OD1-OG1 3.24Å; D141-T143 WeakPolarHBondContact OD2-CG2 3.22Å; D141-T143 PolarHBondContact OD2-OG1 3Å; T143-Y147 PolarHBondContact N-OH 3.06Å
144	N	97.6	Very high	98.4	Very high	122 Å²	122	47.1 Å²	47.1	65%	0.652	25%	0.253	S	S	*	.	S	Bend	trans	-132.4	59.4	-176.4	-166.1	53.8	0	0	0	113.8	Y147	N144-Y147 PolarHBondContact N-OH 2.72Å
145	P	97.8	Very high	98.3	Very high	46 Å²	46	48.2 Å²	48.2	30%	0.299	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-70.2	156.8	176.8	31.7	-37.6	0	0	0	113.1	Y147 N292 Q294	P145-Y147 HydrophobicContact CB-CE2 4.44Å; P145-N292 HydrophobicContact CB-CB 4.47Å; P145-N292 HydrophobicContact CG-CB 3.99Å; P145-N292 WeakPolarHBondContact CG-ND2 3.47Å; P145-Q294 HydrophobicContact CB-CB 3.8Å
146	P	98.6	Very high	98.2	Very high	60 Å²	60	51.1 Å²	51.1	39%	0.39	28%	0.276	S	S	.	.	S	Bend	cis	-79.1	144.8	-6.5	33.5	-35	0	0	0	112.1	Q294 D296	P146-Q294 CarbonylContact C-O 3.55Å; P146-Q294 WeakPolarHBondContact CA-O 3.49Å; P146-Q294 HydrophobicContact CB-CB 4.36Å; P146-Q294 HydrophobicContact CB-CG 3.97Å; P146-D296 HydrophobicContact CB-CB 4.23Å
147	Y	98.9	Very high	98	Very high	9 Å²	9	51.6 Å²	51.6	4%	0.035	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-86.9	126.3	178.4	-69.8	-93.7	0	0	0	111.5	F140 D141 G142 T143 N144 P145 D151 H249 Q294 D296	F140-Y147 HydrophobicContact CB-CD1 3.95Å; F140-Y147 HydrophobicContact CB-CD2 4.13Å; F140-Y147 HydrophobicContact CB-CE1 3.79Å; F140-Y147 HydrophobicContact CB-CE2 4.03Å; F140-Y147 HydrophobicContact CB-CG 4.1Å; F140-Y147 AromaticContact CD1-CD1 3.16Å; F140-Y147 HydrophobicContact CD1-CD1 3.16Å; F140-Y147 AromaticContact CD1-CE1 3.56Å; F140-Y147 HydrophobicContact CD1-CE1 3.56Å; F140-Y147 AromaticContact CD1-CG 3.77Å; F140-Y147 HydrophobicContact CD1-CG 3.77Å; F140-Y147 HydrophobicContact CD2-CD1 4.1Å; F140-Y147 HydrophobicContact CD2-CD2 4.27Å; F140-Y147 AromaticContact CD2-CG 3.8Å; F140-Y147 HydrophobicContact CD2-CG 3.8Å; F140-Y147 AromaticContact CE1-CD1 3.52Å; F140-Y147 HydrophobicContact CE1-CD1 3.52Å; F140-Y147 HydrophobicContact CE1-CE1 4.3Å; F140-Y147 HydrophobicContact CE1-CG 4.05Å; F140-Y147 HydrophobicContact CE2-CD1 4.38Å; F140-Y147 HydrophobicContact CE2-CG 4.08Å; F140-Y147 AromaticContact CG-CD1 3.48Å; F140-Y147 HydrophobicContact CG-CD1 3.48Å; F140-Y147 VanDerWaalsContact CG-CD1 3.48Å; F140-Y147 HydrophobicContact CG-CD2 4.11Å; F140-Y147 AromaticContact CG-CE1 3.83Å; F140-Y147 HydrophobicContact CG-CE1 3.83Å; F140-Y147 HydrophobicContact CG-CE2 4.45Å; F140-Y147 AromaticContact CG-CG 3.62Å; F140-Y147 HydrophobicContact CG-CG 3.62Å; F140-Y147 HydrophobicContact CZ-CD1 4.1Å; F140-Y147 HydrophobicContact CZ-CG 4.18Å; D141-Y147 PolarHBondContact OD1-OH 3.1Å; G142-Y147 WeakPolarHBondContact CA-OH 3.47Å; G142-Y147 PolarHBondContact N-OH 2.92Å; T143-Y147 PolarHBondContact N-OH 3.06Å; N144-Y147 PolarHBondContact N-OH 2.72Å; P145-Y147 HydrophobicContact CB-CE2 4.44Å; Y147-D151 VanDerWaalsContact CA-OD2 3.3Å; Y147-D151 WeakPolarHBondContact CA-OD2 3.29Å; Y147-D151 HydrophobicContact CD1-CB 4.02Å; Y147-H249 PolarHBondContact O-CE1 2.76Å; Y147-H249 VanDerWaalsContact O-CE1 3.23Å; Y147-H249 PolarHBondContact O-ND1 3.43Å; Y147-Q294 PolarHBondContact N-O 3.28Å; Y147-D296 WeakPolarHBondContact O-CB 3.23Å; Y147-D296 PolarHBondContact O-N 3.17Å
148	R	98.8	Very high	97.8	Very high	130 Å²	130	53.8 Å²	53.8	49%	0.491	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-84.9	164.2	169.6	-64	172.2	61	162.7	0.7	110.8	E150 D151 H249 D296	R148-E150 HydrophobicContact CB-CG 4.43Å; R148-E150 IonicContact CZ-OE1 3.09Å; R148-E150 IonicContact NE-OE1 3.79Å; R148-E150 PolarHBondContact NE-OE1 3.49Å; R148-E150 IonicContact NH2-OE1 3.4Å; R148-E150 PolarHBondContact NH2-OE1 3.08Å; R148-E150 PolarHBondContact O-N 3.11Å; R148-D151 PolarHBondContact N-OD2 3.49Å; R148-D151 WeakPolarHBondContact O-CB 3.39Å; R148-D151 PolarHBondContact O-N 3.38Å; R148-H249 PolarHBondContact O-CE1 3.05Å; R148-H249 VanDerWaalsContact O-CE1 3.29Å; R148-D296 HydrophobicContact CG-CB 4.15Å
149	E	98.7	Very high	97.7	Very high	19 Å²	19	54.3 Å²	54.3	9%	0.089	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-33.7	-176.7	-69.3	87.2	167.9	0	0	113.6	R181 T247 H249 K299	E149-R181 PolarHBondContact O-NH1 2.78Å; E149-R181 VanDerWaalsContact O-NH1 3.17Å; E149-T247 HydrophobicContact CB-CG2 4.19Å; E149-T247 HydrophobicContact CG-CG2 4.23Å; E149-T247 WeakPolarHBondContact CG-O 3.29Å; E149-H249 HydrophobicContact CG-CB 4.43Å; E149-H249 IonicContact OE1-CG 3.6Å; E149-H249 PolarHBondContact OE1-N 3.09Å; E149-H249 VanDerWaalsContact OE1-N 3.12Å; E149-K299 HydrophobicContact CG-CD 4.1Å; E149-K299 VanDerWaalsContact OE1-CB 3.23Å; E149-K299 WeakPolarHBondContact OE1-CB 3.23Å
150	E	98.4	Very high	97.7	Very high	116 Å²	116	54.3 Å²	54.3	54%	0.542	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-8.2	178.9	61	-92.5	-147	0	0	114.8	R148	R148-E150 HydrophobicContact CB-CG 4.43Å; R148-E150 IonicContact CZ-OE1 3.09Å; R148-E150 IonicContact NE-OE1 3.79Å; R148-E150 PolarHBondContact NE-OE1 3.49Å; R148-E150 IonicContact NH2-OE1 3.4Å; R148-E150 PolarHBondContact NH2-OE1 3.08Å; R148-E150 PolarHBondContact O-N 3.11Å
151	D	98.7	Very high	97.6	Very high	50 Å²	50	59.7 Å²	59.7	27%	0.267	32%	0.315	S	S	.	.	S	Bend	trans	-65.7	143.8	176.7	-70.5	-24.6	0	0	0	110.6	F140 Y147 R148 P153	F140-D151 HydrophobicContact CE1-CB 4.21Å; Y147-D151 VanDerWaalsContact CA-OD2 3.3Å; Y147-D151 WeakPolarHBondContact CA-OD2 3.29Å; Y147-D151 HydrophobicContact CD1-CB 4.02Å; R148-D151 PolarHBondContact N-OD2 3.49Å; R148-D151 WeakPolarHBondContact O-CB 3.39Å; R148-D151 PolarHBondContact O-N 3.38Å; D151-P153 WeakPolarHBondContact O-CD 3.49Å
152	I	98.5	Very high	97.6	Very high	150 Å²	150	58 Å²	58	77%	0.769	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-70.7	118.6	-173.6	-58.8	171.9	0	0	0	109.6
153	P	98.6	Very high	97.7	Very high	35 Å²	35	58.2 Å²	58.2	23%	0.227	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-69.3	140	176.1	-20.5	35.7	0	0	0	112.1	V139 F140 D151 L164	V139-P153 HydrophobicContact CB-CB 4.06Å; V139-P153 HydrophobicContact CG2-CB 4.18Å; V139-P153 CarbonylContact O-C 3.57Å; V139-P153 WeakPolarHBondContact O-CA 3.44Å; V139-P153 VanDerWaalsContact O-CB 3.26Å; V139-P153 WeakPolarHBondContact O-CB 3.43Å; F140-P153 HydrophobicContact CD1-CB 4.44Å; F140-P153 HydrophobicContact CE1-CB 4.41Å; F140-P153 HydrophobicContact CE1-CG 4.23Å; D151-P153 WeakPolarHBondContact O-CD 3.49Å; P153-L164 HydrophobicContact CB-CD1 3.68Å; P153-L164 HydrophobicContact CB-CD2 3.84Å; P153-L164 HydrophobicContact CB-CG 4.38Å; P153-L164 HydrophobicContact CG-CD1 3.74Å
154	A	98.3	Very high	97.7	Very high	44 Å²	44	54.2 Å²	54.2	36%	0.364	28%	0.281	S	S	.	.			trans	-141.9	73.8	179.9	0	0	0	0	0	110.4	V139 F140 D141 L156	V139-A154 CarbonylContact O-C 3.59Å; V139-A154 PolarHBondContact O-N 3.26Å; F140-A154 CarbonylContact C-O 3.54Å; D141-A154 WeakPolarHBondContact CA-O 3.43Å; D141-A154 HydrophobicContact CB-CB 4.12Å; D141-A154 VanDerWaalsContact CB-O 3.32Å; D141-A154 WeakPolarHBondContact CB-O 3.27Å; D141-A154 PolarHBondContact N-O 2.87Å; A154-L156 PolarHBondContact O-N 2.88Å
155	P	97.5	Very high	97.8	Very high	36 Å²	36	50.7 Å²	50.7	23%	0.234	26%	0.262	C	S	.	.			trans	-67	134.3	-172.5	25.1	-32.8	0	0	0	112.2	V139 G160 K161 L164	V139-P155 WeakPolarHBondContact O-CD 3.33Å; P155-G160 VanDerWaalsContact CB-C 3.44Å; P155-K161 HydrophobicContact CB-CB 4.44Å; P155-K161 HydrophobicContact CG-CB 4.11Å; P155-L164 HydrophobicContact CG-CD2 4.02Å
156	L	95.8	Very high	97.8	Very high	65 Å²	65	48.5 Å²	48.5	34%	0.34	25%	0.247	S	C	.	.	S	Bend	trans	-87.1	-16	179.1	-60	177.6	0	0	0	114.1	D141 A154 Q288	D141-L156 HydrophobicContact CB-CD1 4.42Å; D141-L156 HydrophobicContact CB-CD2 3.91Å; D141-L156 HydrophobicContact CB-CG 4.1Å; D141-L156 WeakPolarHBondContact O-CD1 3.39Å; A154-L156 PolarHBondContact O-N 2.88Å; L156-Q288 HydrophobicContact CB-CB 3.9Å; L156-Q288 PolarHBondContact O-OE1 2.95Å
157	N	93.9	Very high	97.8	Very high	17 Å²	17	46 Å²	46	9%	0.091	23%	0.23	C	C	.	.	S	Bend	trans	-134.5	162.6	-176.5	58.3	61.1	0	0	0	111.7	Y138 Y159 G160 K161 A287 Q288	Y138-N157 VanDerWaalsContact CD2-ND2 3.28Å; Y138-N157 WeakPolarHBondContact CD2-ND2 3.32Å; N157-Y159 VanDerWaalsContact C-N 3.29Å; N157-Y159 PolarHBondContact O-N 3.25Å; N157-Y159 PolarHBondContact OD1-N 3.14Å; N157-G160 PolarHBondContact O-N 3.35Å; N157-G160 PolarHBondContact OD1-N 2.79Å; N157-K161 PolarHBondContact O-N 3.28Å; N157-A287 HydrophobicContact CB-CB 4.15Å; N157-Q288 PolarHBondContact ND2-O 3.17Å
158	L	95.7	Very high	97.8	Very high	60 Å²	60	50.1 Å²	50.1	31%	0.314	25%	0.249	S	C	.	.	H	α-helix	trans	-61.9	-36.1	-176.7	-178.3	60.6	0	0	0	112.3	V102 P106 K161 T162	V102-L158 HydrophobicContact CG1-CB 3.92Å; V102-L158 HydrophobicContact CG1-CD2 3.73Å; V102-L158 HydrophobicContact CG1-CG 3.6Å; V102-L158 WeakPolarHBondContact O-CD2 3.43Å; P106-L158 HydrophobicContact CB-CD2 3.61Å; L158-K161 PolarHBondContact O-N 3.09Å; L158-T162 HydrophobicContact CD1-CG2 4.2Å; L158-T162 HydrophobicContact CG-CG2 4.4Å; L158-T162 WeakPolarHBondContact O-CG2 3.43Å; L158-T162 PolarHBondContact O-N 3.41Å; L158-T162 PolarHBondContact O-OG1 3.37Å
159	Y	95.9	Very high	97.8	Very high	35 Å²	35	44.5 Å²	44.5	14%	0.137	23%	0.23	C	C	.	.	H	α-helix	trans	-58.7	-52.3	174.6	166.9	-105.9	0	0	0	111.1	R97 Y138 N157 K161 T162 K163	R97-Y159 HydrophobicContact CB-CE2 3.82Å; Y138-Y159 AromaticContact CD2-CD1 3.79Å; Y138-Y159 HydrophobicContact CD2-CD1 3.79Å; Y138-Y159 HydrophobicContact CD2-CE1 4.18Å; Y138-Y159 HydrophobicContact CG-CD1 4.23Å; Y138-Y159 HydrophobicContact CG-CE1 4.26Å; N157-Y159 VanDerWaalsContact C-N 3.29Å; N157-Y159 PolarHBondContact O-N 3.25Å; N157-Y159 PolarHBondContact OD1-N 3.14Å; Y159-K161 VanDerWaalsContact C-N 3.28Å; Y159-K161 PolarHBondContact O-N 3.2Å; Y159-T162 PolarHBondContact O-N 3.41Å; Y159-T162 PolarHBondContact O-OG1 2.95Å; Y159-K163 HydrophobicContact CD2-CG 4.15Å; Y159-K163 HydrophobicContact CE1-CG 4.26Å; Y159-K163 HydrophobicContact CE2-CD 3.86Å; Y159-K163 HydrophobicContact CE2-CG 3.64Å; Y159-K163 WeakPolarHBondContact O-CG 3.29Å; Y159-K163 PolarHBondContact O-N 3.39Å
160	G	97.4	Very high	97.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-56.8	-41.2	175.9	0	0	0	0	0	112.7	Y138 P155 N157 K163 L164	Y138-G160 VanDerWaalsContact O-CA 3.32Å; Y138-G160 WeakPolarHBondContact O-CA 3.38Å; P155-G160 VanDerWaalsContact CB-C 3.44Å; N157-G160 PolarHBondContact O-N 3.35Å; N157-G160 PolarHBondContact OD1-N 2.79Å; G160-K163 PolarHBondContact O-N 3.27Å; G160-L164 PolarHBondContact O-N 3.23Å
161	K	97.9	Very high	97.9	Very high	113 Å²	113	40.7 Å²	40.7	49%	0.491	21%	0.214	S	C	.	.	H	α-helix	trans	-61.8	-49.8	175.7	-172.1	177.7	178.9	-176.2	0	112.2	P155 N157 L158 Y159 K163 L164 D165	P155-K161 HydrophobicContact CB-CB 4.44Å; P155-K161 HydrophobicContact CG-CB 4.11Å; N157-K161 PolarHBondContact O-N 3.28Å; L158-K161 PolarHBondContact O-N 3.09Å; Y159-K161 VanDerWaalsContact C-N 3.28Å; Y159-K161 PolarHBondContact O-N 3.2Å; K161-K163 VanDerWaalsContact C-N 3.28Å; K161-K163 PolarHBondContact O-N 3.13Å; K161-L164 PolarHBondContact O-N 3.42Å; K161-D165 PolarHBondContact O-N 3.01Å
162	T	98.3	Very high	97.9	Very high	4 Å²	4	45.2 Å²	45.2	3%	0.025	23%	0.233	C	C	.	.	H	α-helix	trans	-63.2	-33.7	177.4	61.9	0	0	0	0	112.5	N113 V114 L158 Y159 G166	N113-T162 PolarHBondContact ND2-OG1 3.32Å; N113-T162 VanDerWaalsContact ND2-OG1 3.07Å; V114-T162 WeakPolarHBondContact CG2-O 3.34Å; L158-T162 HydrophobicContact CD1-CG2 4.2Å; L158-T162 HydrophobicContact CG-CG2 4.4Å; L158-T162 WeakPolarHBondContact O-CG2 3.43Å; L158-T162 PolarHBondContact O-N 3.41Å; L158-T162 PolarHBondContact O-OG1 3.37Å; Y159-T162 PolarHBondContact O-N 3.41Å; Y159-T162 PolarHBondContact O-OG1 2.95Å; T162-G166 PolarHBondContact O-N 3.33Å
163	K	98.4	Very high	97.9	Very high	8 Å²	8	40.7 Å²	40.7	4%	0.035	21%	0.211	C	C	.	.	H	α-helix	trans	-66	-44.9	174.6	-69	-53.5	-59.7	168	0	111.7	Y133 I134 V139 Y159 G160 K161 G166 E167	Y133-K163 VanDerWaalsContact OH-CE 3.26Å; Y133-K163 WeakPolarHBondContact OH-CE 3.47Å; Y133-K163 PolarHBondContact OH-NZ 3.03Å; Y133-K163 PolarHBondContact OH-O 3.21Å; I134-K163 VanDerWaalsContact O-CE 3.26Å; I134-K163 WeakPolarHBondContact O-CE 3.19Å; I134-K163 PolarHBondContact O-NZ 3.2Å; V139-K163 HydrophobicContact CG1-CB 4.18Å; Y159-K163 HydrophobicContact CD2-CG 4.15Å; Y159-K163 HydrophobicContact CE1-CG 4.26Å; Y159-K163 HydrophobicContact CE2-CD 3.86Å; Y159-K163 HydrophobicContact CE2-CG 3.64Å; Y159-K163 WeakPolarHBondContact O-CG 3.29Å; Y159-K163 PolarHBondContact O-N 3.39Å; G160-K163 PolarHBondContact O-N 3.27Å; K161-K163 VanDerWaalsContact C-N 3.28Å; K161-K163 PolarHBondContact O-N 3.13Å; K163-G166 PolarHBondContact O-N 3.22Å; K163-E167 WeakPolarHBondContact O-CG 3.25Å; K163-E167 PolarHBondContact O-N 2.93Å
164	L	98.8	Very high	97.9	Very high	20 Å²	20	39.8 Å²	39.8	11%	0.105	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-43.3	176	179.6	61.8	0	0	0	112.2	V139 P153 P155 G160 K161 G166 E167 K168	V139-L164 HydrophobicContact CB-CB 4.37Å; V139-L164 HydrophobicContact CG1-CB 3.98Å; P153-L164 HydrophobicContact CB-CD1 3.68Å; P153-L164 HydrophobicContact CB-CD2 3.84Å; P153-L164 HydrophobicContact CB-CG 4.38Å; P153-L164 HydrophobicContact CG-CD1 3.74Å; P155-L164 HydrophobicContact CG-CD2 4.02Å; G160-L164 PolarHBondContact O-N 3.23Å; K161-L164 PolarHBondContact O-N 3.42Å; L164-G166 VanDerWaalsContact C-N 3.29Å; L164-G166 PolarHBondContact O-N 2.98Å; L164-E167 WeakPolarHBondContact O-CB 3.47Å; L164-E167 PolarHBondContact O-N 2.83Å; L164-E167 VanDerWaalsContact O-N 3.13Å; L164-K168 PolarHBondContact O-N 3.43Å; L164-K168 VanDerWaalsContact O-N 3.13Å
165	D	98.8	Very high	97.8	Very high	47 Å²	47	44.6 Å²	44.6	25%	0.251	22%	0.223	S	C	.	.	H	α-helix	trans	-66.9	-33.5	177.1	-67.2	-26	0	0	0	111.3	V114 K161 K168 A169	V114-D165 HydrophobicContact CG1-CB 4.13Å; V114-D165 HydrophobicContact CG2-CB 3.85Å; K161-D165 PolarHBondContact O-N 3.01Å; D165-K168 PolarHBondContact O-N 2.81Å; D165-K168 IonicContact OD1-NZ 3.25Å; D165-K168 PolarHBondContact OD1-NZ 2.69Å; D165-A169 WeakPolarHBondContact O-CB 3.49Å; D165-A169 PolarHBondContact O-N 3.24Å
166	G	98.8	Very high	97.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-36.6	168.5	0	0	0	0	0	113.7	T162 K163 L164 K168 A169 V170	T162-G166 PolarHBondContact O-N 3.33Å; K163-G166 PolarHBondContact O-N 3.22Å; L164-G166 VanDerWaalsContact C-N 3.29Å; L164-G166 PolarHBondContact O-N 2.98Å; G166-K168 VanDerWaalsContact C-N 3.35Å; G166-A169 PolarHBondContact O-N 3.19Å; G166-V170 WeakPolarHBondContact O-CB 3.34Å; G166-V170 VanDerWaalsContact O-CG2 3.3Å; G166-V170 WeakPolarHBondContact O-CG2 3.45Å; G166-V170 PolarHBondContact O-N 3.42Å
167	E	98.9	Very high	98	Very high	7 Å²	7	40.6 Å²	40.6	3%	0.033	20%	0.204	C	C	.	.	H	α-helix	trans	-59.1	-47.7	172.3	-63.6	-175.7	-174.2	0	0	110.8	Y133 S135 K163 L164 V170 L171 V179 R181	Y133-E167 HydrophobicContact CD1-CG 4.1Å; Y133-E167 HydrophobicContact CE1-CB 4.35Å; Y133-E167 HydrophobicContact CE1-CG 3.68Å; S135-E167 WeakPolarHBondContact CB-OE1 3.31Å; S135-E167 WeakPolarHBondContact OG-CG 3.16Å; S135-E167 PolarHBondContact OG-OE1 2.96Å; K163-E167 WeakPolarHBondContact O-CG 3.25Å; K163-E167 PolarHBondContact O-N 2.93Å; L164-E167 WeakPolarHBondContact O-CB 3.47Å; L164-E167 PolarHBondContact O-N 2.83Å; L164-E167 VanDerWaalsContact O-N 3.13Å; E167-V170 PolarHBondContact O-N 3.01Å; E167-L171 WeakPolarHBondContact O-CB 3.47Å; E167-L171 WeakPolarHBondContact O-CG 3.28Å; E167-L171 PolarHBondContact O-N 2.91Å; E167-V179 HydrophobicContact CB-CG1 4.48Å; E167-V179 HydrophobicContact CB-CG2 4.27Å; E167-V179 HydrophobicContact CG-CG1 3.69Å; E167-V179 HydrophobicContact CG-CG2 4.31Å; E167-R181 WeakPolarHBondContact OE1-CG 3.42Å; E167-R181 IonicContact OE1-CZ 3.88Å; E167-R181 IonicContact OE1-NE 3.69Å; E167-R181 PolarHBondContact OE1-NE 2.92Å; E167-R181 IonicContact OE1-NH2 2.8Å; E167-R181 IonicContact OE2-CZ 3.9Å; E167-R181 IonicContact OE2-NE 3.86Å; E167-R181 PolarHBondContact OE2-NE 2.51Å; E167-R181 IonicContact OE2-NH2 3.33Å; E167-R181 PolarHBondContact OE2-NH2 2.96Å
168	K	98.9	Very high	98.3	Very high	96 Å²	96	39.8 Å²	39.8	42%	0.417	20%	0.2	S	C	.	.	H	α-helix	trans	-60.3	-51.2	177.7	-62.7	171.1	-166.8	156.2	0	110.8	L164 D165 G166 V170 L171 E172	L164-K168 PolarHBondContact O-N 3.43Å; L164-K168 VanDerWaalsContact O-N 3.13Å; D165-K168 PolarHBondContact O-N 2.81Å; D165-K168 IonicContact OD1-NZ 3.25Å; D165-K168 PolarHBondContact OD1-NZ 2.69Å; G166-K168 VanDerWaalsContact C-N 3.35Å; K168-V170 VanDerWaalsContact C-N 3.26Å; K168-V170 PolarHBondContact O-N 3.36Å; K168-L171 PolarHBondContact O-N 3.44Å; K168-E172 VanDerWaalsContact O-CB 3.31Å; K168-E172 WeakPolarHBondContact O-CB 3.34Å; K168-E172 VanDerWaalsContact O-CG 3.22Å; K168-E172 WeakPolarHBondContact O-CG 3.43Å; K168-E172 PolarHBondContact O-N 3.49Å
169	A	98.8	Very high	98.4	Very high	12 Å²	12	37 Å²	37	10%	0.099	19%	0.185	C	C	.	.	H	α-helix	trans	-57.4	-39.3	-180	0	0	0	0	0	112.2	V114 D165 G166 N173	V114-A169 HydrophobicContact CG1-CB 4.19Å; D165-A169 WeakPolarHBondContact O-CB 3.49Å; D165-A169 PolarHBondContact O-N 3.24Å; G166-A169 PolarHBondContact O-N 3.19Å; A169-N173 WeakPolarHBondContact O-CB 3.28Å; A169-N173 PolarHBondContact O-N 3.12Å; A169-N173 PolarHBondContact O-ND2 2.84Å
170	V	98.9	Very high	98.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-67.6	-50.3	176.5	167.4	0	0	0	0	111.4	A121 L131 Y133 G166 E167 K168 E172 N173 N174 A177	A121-V170 HydrophobicContact CB-CB 4.29Å; A121-V170 HydrophobicContact CB-CG1 4.26Å; A121-V170 HydrophobicContact CB-CG2 4.25Å; L131-V170 HydrophobicContact CD2-CG1 3.79Å; L131-V170 HydrophobicContact CD2-CG2 4.31Å; L131-V170 HydrophobicContact CG-CG1 4.42Å; Y133-V170 HydrophobicContact CD2-CG2 3.97Å; Y133-V170 HydrophobicContact CG-CG2 3.97Å; G166-V170 WeakPolarHBondContact O-CB 3.34Å; G166-V170 VanDerWaalsContact O-CG2 3.3Å; G166-V170 WeakPolarHBondContact O-CG2 3.45Å; G166-V170 PolarHBondContact O-N 3.42Å; E167-V170 PolarHBondContact O-N 3.01Å; K168-V170 VanDerWaalsContact C-N 3.26Å; K168-V170 PolarHBondContact O-N 3.36Å; V170-E172 VanDerWaalsContact C-N 3.35Å; V170-E172 PolarHBondContact O-N 3.19Å; V170-N173 PolarHBondContact O-N 3.36Å; V170-N174 PolarHBondContact O-N 3.45Å; V170-A177 HydrophobicContact CG1-CB 3.69Å
171	L	98.6	Very high	98.6	Very high	56 Å²	56	35.8 Å²	35.8	29%	0.293	18%	0.18	S	C	.	.	H	α-helix	trans	-70.4	-29.9	-175.1	-67.3	173.5	0	0	0	113	E167 K168 V179	E167-L171 WeakPolarHBondContact O-CB 3.47Å; E167-L171 WeakPolarHBondContact O-CG 3.28Å; E167-L171 PolarHBondContact O-N 2.91Å; K168-L171 PolarHBondContact O-N 3.44Å; L171-V179 HydrophobicContact CD1-CG2 4.02Å; L171-V179 HydrophobicContact CD2-CG2 4.1Å; L171-V179 HydrophobicContact CG-CG2 3.99Å
172	E	98.6	Very high	98.7	Very high	144 Å²	144	30.6 Å²	30.6	67%	0.673	16%	0.158	S	C	*	.	H	α-helix	trans	-68.6	-36.3	173.4	-74.6	169.4	-171.1	0	0	112.2	K168 V170	K168-E172 VanDerWaalsContact O-CB 3.31Å; K168-E172 WeakPolarHBondContact O-CB 3.34Å; K168-E172 VanDerWaalsContact O-CG 3.22Å; K168-E172 WeakPolarHBondContact O-CG 3.43Å; K168-E172 PolarHBondContact O-N 3.49Å; V170-E172 VanDerWaalsContact C-N 3.35Å; V170-E172 PolarHBondContact O-N 3.19Å
173	N	98.8	Very high	98.7	Very high	56 Å²	56	30.9 Å²	30.9	30%	0.299	16%	0.16	S	C	.	.	H	α-helix	trans	-96.5	-15.7	-175.5	-70.4	-75.5	0	0	0	113.9	A121 K122 A169 V170	A121-N173 HydrophobicContact CB-CB 3.9Å; K122-N173 WeakPolarHBondContact CE-OD1 3.37Å; K122-N173 HydrophobicContact CG-CB 3.75Å; K122-N173 WeakPolarHBondContact CG-OD1 3.32Å; A169-N173 WeakPolarHBondContact O-CB 3.28Å; A169-N173 PolarHBondContact O-N 3.12Å; A169-N173 PolarHBondContact O-ND2 2.84Å; V170-N173 PolarHBondContact O-N 3.36Å
174	N	98.5	Very high	98.7	Very high	15 Å²	15	31.2 Å²	31.2	8%	0.08	16%	0.162	C	C	.	.			trans	-144.8	97.7	176.7	-171.7	-26.2	0	0	0	111.6	A121 A125 V170 G176 A177	A121-N174 HydrophobicContact CB-CB 4.04Å; A125-N174 HydrophobicContact CB-CB 4.18Å; A125-N174 PolarHBondContact N-ND2 3.03Å; V170-N174 PolarHBondContact O-N 3.45Å; N174-G176 PolarHBondContact O-N 3.31Å; N174-G176 VanDerWaalsContact O-N 3.12Å; N174-G176 WeakPolarHBondContact OD1-CA 3.41Å; N174-G176 PolarHBondContact OD1-N 2.96Å; N174-A177 HydrophobicContact CB-CB 4.07Å; N174-A177 VanDerWaalsContact O-CB 3.31Å; N174-A177 WeakPolarHBondContact O-CB 3.35Å; N174-A177 PolarHBondContact O-N 2.82Å; N174-A177 VanDerWaalsContact O-N 3.11Å; N174-A177 PolarHBondContact OD1-N 3.18Å
175	L	97.8	Very high	98.7	Very high	145 Å²	145	31.9 Å²	31.9	76%	0.759	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-16.7	179.9	-61.5	179.6	0	0	0	114.4
176	G	98.2	Very high	98.7	Very high	18 Å²	18	29.7 Å²	29.7	19%	0.186	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-1.6	178.8	0	0	0	0	0	113.9	F130 N174	F130-G176 WeakPolarHBondContact CD2-O 3.32Å; N174-G176 PolarHBondContact O-N 3.31Å; N174-G176 VanDerWaalsContact O-N 3.12Å; N174-G176 WeakPolarHBondContact OD1-CA 3.41Å; N174-G176 PolarHBondContact OD1-N 2.96Å
177	A	98.8	Very high	98.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.154	C	C	.	.			trans	-71.4	160.7	-178.6	0	0	0	0	0	112.6	L131 V170 N174 G246	L131-A177 HydrophobicContact CB-CB 4.08Å; L131-A177 HydrophobicContact CG-CB 4.49Å; L131-A177 CarbonylContact O-C 3.57Å; L131-A177 WeakPolarHBondContact O-CA 3.46Å; L131-A177 WeakPolarHBondContact O-CB 3.44Å; V170-A177 HydrophobicContact CG1-CB 3.69Å; N174-A177 HydrophobicContact CB-CB 4.07Å; N174-A177 VanDerWaalsContact O-CB 3.31Å; N174-A177 WeakPolarHBondContact O-CB 3.35Å; N174-A177 PolarHBondContact O-N 2.82Å; N174-A177 VanDerWaalsContact O-N 3.11Å; N174-A177 PolarHBondContact OD1-N 3.18Å; A177-G246 PolarHBondContact O-N 3.36Å
178	A	98.9	Very high	98.6	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	143.1	168.1	0	0	0	0	0	110.7	F130 L131 I132 Y133 L234 G246 F248	F130-A178 HydrophobicContact CE2-CB 3.59Å; F130-A178 HydrophobicContact CZ-CB 3.5Å; F130-A178 VanDerWaalsContact CZ-CB 3.5Å; L131-A178 PolarHBondContact O-N 3.27Å; I132-A178 CarbonylContact C-O 3.37Å; I132-A178 WeakPolarHBondContact CA-O 3.26Å; Y133-A178 PolarHBondContact N-O 2.99Å; A178-L234 HydrophobicContact CB-CD2 4.02Å; A178-G246 CarbonylContact C-O 3.58Å; A178-G246 WeakPolarHBondContact CA-O 3.41Å; A178-F248 HydrophobicContact CB-CD2 4.11Å; A178-F248 HydrophobicContact CB-CE2 4.02Å
179	V	98.9	Very high	98.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.7	169.4	171.8	0	0	0	0	107.5	Y133 E167 L171 R181 G246 T247 F248	Y133-V179 HydrophobicContact CD1-CG1 4.18Å; Y133-V179 HydrophobicContact CD1-CG2 4.15Å; Y133-V179 WeakPolarHBondContact O-CA 3.46Å; E167-V179 HydrophobicContact CB-CG1 4.48Å; E167-V179 HydrophobicContact CB-CG2 4.27Å; E167-V179 HydrophobicContact CG-CG1 3.69Å; E167-V179 HydrophobicContact CG-CG2 4.31Å; L171-V179 HydrophobicContact CD1-CG2 4.02Å; L171-V179 HydrophobicContact CD2-CG2 4.1Å; L171-V179 HydrophobicContact CG-CG2 3.99Å; V179-R181 HydrophobicContact CG1-CG 4.29Å; V179-G246 PolarHBondContact N-O 3.24Å; V179-T247 HydrophobicContact CB-CG2 4.28Å; V179-T247 HydrophobicContact CG1-CG2 4.19Å; V179-T247 CarbonylContact O-C 3.59Å; V179-T247 WeakPolarHBondContact O-CA 3.48Å; V179-F248 PolarHBondContact O-N 2.98Å
180	L	98.9	Very high	98.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	102.6	175.9	-176.5	64.3	0	0	0	109.4	I132 Y133 I134 S135 I182 V227 V230 F248 W250 L300	I132-L180 HydrophobicContact CG2-CB 4.2Å; Y133-L180 PolarHBondContact O-N 3.42Å; I134-L180 HydrophobicContact CD1-CB 4.22Å; I134-L180 HydrophobicContact CD1-CD2 4.08Å; S135-L180 PolarHBondContact N-O 3.33Å; L180-I182 HydrophobicContact CD2-CG2 4.38Å; L180-I182 HydrophobicContact CG-CG2 4.04Å; L180-V227 HydrophobicContact CD2-CG1 4.18Å; L180-V230 HydrophobicContact CD1-CG1 4.09Å; L180-V230 HydrophobicContact CD2-CG1 3.94Å; L180-F248 WeakPolarHBondContact CA-O 3.14Å; L180-F248 HydrophobicContact CD1-CB 4.06Å; L180-W250 HydrophobicContact CD1-CB 4.05Å; L180-L300 HydrophobicContact CD1-CD1 3.94Å
181	R	98.9	Very high	98.4	Very high	10 Å²	10	40.1 Å²	40.1	4%	0.038	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	131.8	174	-66.4	161.7	-179.6	164.3	2.4	109.3	F140 E149 E167 V179 F248 H249 W250 L295	F140-R181 VanDerWaalsContact CZ-NH1 3.3Å; E149-R181 PolarHBondContact O-NH1 2.78Å; E149-R181 VanDerWaalsContact O-NH1 3.17Å; E167-R181 WeakPolarHBondContact OE1-CG 3.42Å; E167-R181 IonicContact OE1-CZ 3.88Å; E167-R181 IonicContact OE1-NE 3.69Å; E167-R181 PolarHBondContact OE1-NE 2.92Å; E167-R181 IonicContact OE1-NH2 2.8Å; E167-R181 IonicContact OE2-CZ 3.9Å; E167-R181 IonicContact OE2-NE 3.86Å; E167-R181 PolarHBondContact OE2-NE 2.51Å; E167-R181 IonicContact OE2-NH2 3.33Å; E167-R181 PolarHBondContact OE2-NH2 2.96Å; V179-R181 HydrophobicContact CG1-CG 4.29Å; R181-F248 PolarHBondContact N-O 3.5Å; R181-H249 WeakPolarHBondContact CD-NE2 3.41Å; R181-H249 PolarHBondContact NH1-NE2 3.07Å; R181-H249 VanDerWaalsContact NH1-NE2 3.19Å; R181-W250 PolarHBondContact O-N 2.92Å; R181-L295 HydrophobicContact CB-CD1 4.18Å; R181-L295 WeakPolarHBondContact O-CD1 3.18Å
182	I	98.9	Very high	98.4	Very high	5 Å²	5	38.2 Å²	38.2	3%	0.026	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	152.1	-178.5	55.9	-176.9	0	0	0	110.3	L40 I134 S135 S136 D137 L180 L185 V227 W250	L40-I182 HydrophobicContact CD2-CD1 3.8Å; I134-I182 HydrophobicContact CG2-CD1 3.32Å; I134-I182 HydrophobicContact CG2-CG1 3.93Å; S135-I182 WeakPolarHBondContact O-CG1 3.4Å; S135-I182 PolarHBondContact O-N 2.99Å; S136-I182 CarbonylContact C-O 3.58Å; S136-I182 WeakPolarHBondContact CA-O 3.3Å; D137-I182 PolarHBondContact N-O 2.93Å; L180-I182 HydrophobicContact CD2-CG2 4.38Å; L180-I182 HydrophobicContact CG-CG2 4.04Å; I182-L185 HydrophobicContact CD1-CD1 3.8Å; I182-L185 HydrophobicContact CD1-CD2 4.05Å; I182-L185 HydrophobicContact CD1-CG 4.28Å; I182-V227 HydrophobicContact CD1-CG1 3.95Å; I182-V227 HydrophobicContact CD1-CG2 4.47Å; I182-V227 HydrophobicContact CG2-CG1 4.05Å; I182-V227 HydrophobicContact CG2-CG2 4.16Å; I182-W250 HydrophobicContact CG2-CB 4.32Å
183	P	98.4	Very high	98.2	Very high	9 Å²	9	36.9 Å²	36.9	6%	0.058	18%	0.184	C	C	.	.			trans	-87.8	-157.7	179.7	40	-41.2	0	0	0	111.8	D137 L185 F220 T222 W250	D137-P183 HydrophobicContact CB-CB 4.25Å; D137-P183 VanDerWaalsContact CG-CA 3.5Å; P183-L185 PolarHBondContact O-N 2.7Å; P183-F220 HydrophobicContact CG-CB 4.28Å; P183-F220 WeakPolarHBondContact CG-O 3.44Å; P183-T222 WeakPolarHBondContact CG-OG1 3.27Å; P183-W250 WeakPolarHBondContact CD-O 3.32Å
184	I	98.3	Very high	98.1	Very high	15 Å²	15	35 Å²	35	8%	0.077	17%	0.174	C	C	.	.	S	Bend	trans	-54.9	129.9	175.1	-174.1	176.7	0	0	0	112.2	A196 V197 R219 T222	I184-A196 HydrophobicContact CD1-CB 3.69Å; I184-A196 HydrophobicContact CG1-CB 4.28Å; I184-V197 HydrophobicContact CD1-CG2 3.56Å; I184-V197 HydrophobicContact CG1-CG2 3.89Å; I184-R219 HydrophobicContact CG2-CB 3.9Å; I184-T222 PolarHBondContact O-N 3.44Å
185	L	98.7	Very high	98	Very high	34 Å²	34	34.5 Å²	34.5	18%	0.178	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	148.6	-177	-63	-179.7	0	0	0	113.8	L39 L40 I182 P183 S195 T222 V224 V227	L39-L185 HydrophobicContact CD2-CB 4.3Å; L40-L185 HydrophobicContact CB-CD1 4.04Å; L40-L185 HydrophobicContact CD2-CD1 4.21Å; L40-L185 HydrophobicContact CG-CD1 4.49Å; I182-L185 HydrophobicContact CD1-CD1 3.8Å; I182-L185 HydrophobicContact CD1-CD2 4.05Å; I182-L185 HydrophobicContact CD1-CG 4.28Å; P183-L185 PolarHBondContact O-N 2.7Å; L185-S195 WeakPolarHBondContact O-CB 3.19Å; L185-S195 PolarHBondContact O-OG 3.2Å; L185-T222 WeakPolarHBondContact CA-O 3.16Å; L185-T222 HydrophobicContact CD2-CG2 4.39Å; L185-V224 HydrophobicContact CB-CG1 4.01Å; L185-V224 HydrophobicContact CD1-CG1 4.13Å; L185-V224 HydrophobicContact CD2-CG1 4.45Å; L185-V224 HydrophobicContact CG-CG1 4.44Å; L185-V227 HydrophobicContact CD2-CG2 3.91Å
186	Y	98.8	Very high	97.9	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.008	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	165.6	168.1	78.3	-78.5	0	0	0	111.4	P221 T222 H223 V224 F311 I315	Y186-P221 HydrophobicContact CD1-CB 3.86Å; Y186-P221 HydrophobicContact CE1-CB 3.93Å; Y186-T222 WeakPolarHBondContact CD1-O 3.35Å; Y186-T222 PolarHBondContact N-O 2.9Å; Y186-T222 VanDerWaalsContact N-O 3.09Å; Y186-H223 HydrophobicContact CE1-CB 4.01Å; Y186-H223 HydrophobicContact CE2-CB 4.47Å; Y186-H223 AromaticContact CE2-CD2 3.36Å; Y186-H223 WeakPolarHBondContact CE2-CD2 3.23Å; Y186-H223 AromaticContact CZ-CD2 3.56Å; Y186-H223 CarbonylContact O-C 3.53Å; Y186-H223 WeakPolarHBondContact O-CA 3.18Å; Y186-V224 PolarHBondContact O-N 2.99Å; Y186-F311 HydrophobicContact CD1-CD2 4.47Å; Y186-F311 HydrophobicContact CD1-CE2 4.39Å; Y186-F311 AromaticContact CE1-CD2 3.86Å; Y186-F311 HydrophobicContact CE1-CD2 3.86Å; Y186-F311 HydrophobicContact CE1-CE2 4.22Å; Y186-F311 HydrophobicContact CE2-CD2 4.24Å; Y186-F311 HydrophobicContact CE2-CE2 4.36Å; Y186-F311 AromaticContact CZ-CD2 3.74Å; Y186-F311 WeakPolarHBondContact OH-CA 3.32Å; Y186-I315 HydrophobicContact CD2-CB 4.44Å; Y186-I315 HydrophobicContact CD2-CD1 3.6Å; Y186-I315 HydrophobicContact CE2-CB 4.13Å; Y186-I315 HydrophobicContact CE2-CD1 4.17Å; Y186-I315 HydrophobicContact CG-CD1 4.32Å
187	G	98.5	Very high	97.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	162.1	-164	180	0	0	0	0	0	111.1	V189 S318	G187-V189 WeakPolarHBondContact O-CG1 3.42Å; G187-V189 PolarHBondContact O-N 2.85Å; G187-V189 VanDerWaalsContact O-N 3.14Å; G187-S318 WeakPolarHBondContact CA-OG 3.36Å; G187-S318 VanDerWaalsContact O-CB 3.3Å; G187-S318 WeakPolarHBondContact O-CB 3.42Å; G187-S318 PolarHBondContact O-OG 2.96Å
188	E	98	Very high	97.9	Very high	92 Å²	92	28.6 Å²	28.6	43%	0.43	14%	0.142	S	C	.	.	S	Bend	trans	-58.3	115.1	173.4	-64.6	176.6	157.1	0	0	110.9	R42	R42-E188 PolarHBondContact NH2-O 2.93Å
189	V	98.1	Very high	97.8	Very high	15 Å²	15	31.6 Å²	31.6	9%	0.091	16%	0.16	C	C	.	.			trans	-107.9	147.4	-178.3	-69.2	0	0	0	0	111.8	L39 G187 K191 E194 T198 F322	L39-V189 HydrophobicContact CD1-CG1 3.88Å; G187-V189 WeakPolarHBondContact O-CG1 3.42Å; G187-V189 PolarHBondContact O-N 2.85Å; G187-V189 VanDerWaalsContact O-N 3.14Å; V189-K191 VanDerWaalsContact CB-O 3.3Å; V189-K191 WeakPolarHBondContact CB-O 3.14Å; V189-E194 HydrophobicContact CB-CB 4.1Å; V189-E194 HydrophobicContact CG1-CB 3.95Å; V189-T198 HydrophobicContact CG1-CG2 3.86Å; V189-T198 HydrophobicContact CG2-CG2 4.11Å; V189-F322 HydrophobicContact CG2-CD2 4.49Å; V189-F322 HydrophobicContact CG2-CE2 3.68Å; V189-F322 HydrophobicContact CG2-CZ 3.92Å; V189-F322 WeakPolarHBondContact O-CZ 3.32Å
190	E	96.7	Very high	97.8	Very high	100 Å²	100	31.9 Å²	31.9	47%	0.467	16%	0.161	S	C	.	.	S	Bend	trans	-75.7	-31.1	168.6	-72.8	169.1	-163.1	0	0	111.2	R42 R62 E194	R42-E190 IonicContact CZ-OE1 2.77Å; R42-E190 IonicContact NE-OE1 3.4Å; R42-E190 VanDerWaalsContact NH1-CD 3.28Å; R42-E190 IonicContact NH1-OE1 2.78Å; R42-E190 PolarHBondContact NH1-OE1 2.79Å; R42-E190 IonicContact NH1-OE2 3.49Å; R62-E190 IonicContact CZ-OE2 3.48Å; R62-E190 IonicContact NH1-OE1 3.91Å; R62-E190 IonicContact NH1-OE2 3.29Å; R62-E190 PolarHBondContact NH1-OE2 2.85Å; E190-E194 PolarHBondContact N-OE2 3.37Å
191	K	97.1	Very high	97.7	Very high	127 Å²	127	31.9 Å²	31.9	55%	0.552	16%	0.161	S	C	*	.	S	Bend	trans	-146.5	150.7	176.1	-51.3	-175.3	-178.9	-177.8	0	110.1	V189 E193 E194	V189-K191 VanDerWaalsContact CB-O 3.3Å; V189-K191 WeakPolarHBondContact CB-O 3.14Å; K191-E193 VanDerWaalsContact CB-CD 3.43Å; K191-E193 HydrophobicContact CB-CG 4.25Å; K191-E193 VanDerWaalsContact CB-OE2 3.23Å; K191-E193 WeakPolarHBondContact CB-OE2 3.4Å; K191-E193 WeakPolarHBondContact CD-OE1 3.26Å; K191-E193 PolarHBondContact O-N 3.47Å; K191-E193 VanDerWaalsContact O-N 3.13Å; K191-E194 VanDerWaalsContact O-CB 3.23Å; K191-E194 WeakPolarHBondContact O-CB 3.37Å; K191-E194 PolarHBondContact O-N 3.06Å
192	L	97.6	Very high	97.6	Very high	15 Å²	15	34.7 Å²	34.7	8%	0.079	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-58.3	-31.1	-176.2	-65.8	179.5	0	0	0	113.1	E194 T198 V199 F201 D202 L319 F322	L192-E194 PolarHBondContact O-N 2.74Å; L192-T198 CarbonylContact O-C 3.51Å; L192-T198 PolarHBondContact O-OG1 2.84Å; L192-V199 WeakPolarHBondContact O-CA 3.05Å; L192-V199 PolarHBondContact O-N 3.39Å; L192-F201 HydrophobicContact CD1-CB 4.28Å; L192-F201 HydrophobicContact CD2-CB 4.17Å; L192-F201 HydrophobicContact CD2-CD1 4.29Å; L192-D202 WeakPolarHBondContact CD1-OD1 3.39Å; L192-L319 HydrophobicContact CD2-CD2 3.55Å; L192-F322 HydrophobicContact CD2-CB 3.94Å; L192-F322 HydrophobicContact CD2-CD1 3.9Å; L192-F322 HydrophobicContact CD2-CD2 4Å; L192-F322 HydrophobicContact CD2-CE1 4.42Å; L192-F322 HydrophobicContact CD2-CG 3.67Å; L192-F322 HydrophobicContact CG-CD1 3.94Å; L192-F322 HydrophobicContact CG-CE1 4.39Å; L192-F322 HydrophobicContact CG-CG 4.21Å
193	E	96.2	Very high	97.5	Very high	116 Å²	116	39.4 Å²	39.4	54%	0.542	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-71.3	-8.1	177	64.3	-92.3	-151.2	0	0	114.8	K191 S195	K191-E193 VanDerWaalsContact CB-CD 3.43Å; K191-E193 HydrophobicContact CB-CG 4.25Å; K191-E193 VanDerWaalsContact CB-OE2 3.23Å; K191-E193 WeakPolarHBondContact CB-OE2 3.4Å; K191-E193 WeakPolarHBondContact CD-OE1 3.26Å; K191-E193 PolarHBondContact O-N 3.47Å; K191-E193 VanDerWaalsContact O-N 3.13Å; E193-S195 PolarHBondContact O-N 3.24Å
194	E	95.5	Very high	97.4	Very high	18 Å²	18	39 Å²	39	8%	0.084	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-72.1	-19	-179.7	-159.4	174.8	-152	0	0	112.7	L39 R42 R62 R97 V189 E190 K191 L192	L39-E194 HydrophobicContact CB-CG 4.23Å; R42-E194 IonicContact CZ-OE1 2.79Å; R42-E194 IonicContact CZ-OE2 3.87Å; R42-E194 IonicContact NH1-OE1 2.76Å; R42-E194 PolarHBondContact NH1-OE1 3.45Å; R42-E194 IonicContact NH1-OE2 2.85Å; R42-E194 PolarHBondContact NH1-OE2 3.26Å; R42-E194 IonicContact NH2-OE1 3.58Å; R42-E194 PolarHBondContact NH2-OE1 3.15Å; R42-E194 IonicContact NH2-OE2 2.88Å; R42-E194 PolarHBondContact NH2-OE2 3.42Å; R62-E194 IonicContact CZ-OE1 3.31Å; R62-E194 IonicContact NH1-OE1 2.59Å; R62-E194 PolarHBondContact NH1-OE1 2.87Å; R62-E194 IonicContact NH2-OE1 2.69Å; R97-E194 PolarHBondContact NH2-O 3.25Å; V189-E194 HydrophobicContact CB-CB 4.1Å; V189-E194 HydrophobicContact CG1-CB 3.95Å; E190-E194 PolarHBondContact N-OE2 3.37Å; K191-E194 VanDerWaalsContact O-CB 3.23Å; K191-E194 WeakPolarHBondContact O-CB 3.37Å; K191-E194 PolarHBondContact O-N 3.06Å; L192-E194 PolarHBondContact O-N 2.74Å
195	S	97.6	Very high	97.3	Very high	4 Å²	4	39 Å²	39	3%	0.028	19%	0.194	C	C	.	.	S	Bend	trans	-129.3	142.8	168.7	162.7	0	0	0	0	111.9	L185 E193 V197 T198 V199	L185-S195 WeakPolarHBondContact O-CB 3.19Å; L185-S195 PolarHBondContact O-OG 3.2Å; E193-S195 PolarHBondContact O-N 3.24Å; S195-V197 PolarHBondContact O-N 2.83Å; S195-V197 PolarHBondContact OG-N 2.83Å; S195-T198 VanDerWaalsContact CB-OG1 3.28Å; S195-T198 WeakPolarHBondContact CB-OG1 3.49Å; S195-T198 PolarHBondContact N-OG1 3.46Å; S195-T198 PolarHBondContact O-N 3.49Å; S195-T198 PolarHBondContact O-OG1 3.14Å; S195-V199 PolarHBondContact O-N 3.17Å
196	A	95.4	Very high	97.1	Very high	38 Å²	38	40.4 Å²	40.4	31%	0.314	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-10.6	173.7	0	0	0	0	0	113.6	I184	I184-A196 HydrophobicContact CD1-CB 3.69Å; I184-A196 HydrophobicContact CG1-CB 4.28Å
197	V	98.2	Very high	96.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-51.4	170.9	-176	0	0	0	0	110.2	I184 S195 V199 M200 P221 M261 I265 F311 I315	I184-V197 HydrophobicContact CD1-CG2 3.56Å; I184-V197 HydrophobicContact CG1-CG2 3.89Å; S195-V197 PolarHBondContact O-N 2.83Å; S195-V197 PolarHBondContact OG-N 2.83Å; V197-V199 VanDerWaalsContact C-N 3.29Å; V197-V199 PolarHBondContact O-N 3.27Å; V197-M200 HydrophobicContact CG1-CE 4.12Å; V197-M200 WeakPolarHBondContact O-CB 3.5Å; V197-M200 WeakPolarHBondContact O-CE 3.44Å; V197-M200 PolarHBondContact O-N 3.49Å; V197-P221 HydrophobicContact CG2-CB 4.43Å; V197-M261 HydrophobicContact CB-SD 4.43Å; V197-M261 HydrophobicContact CG1-SD 3.98Å; V197-M261 HydrophobicContact CG2-SD 3.78Å; V197-I265 HydrophobicContact CG1-CD1 4.41Å; V197-F311 HydrophobicContact CG1-CE2 3.89Å; V197-F311 HydrophobicContact CG1-CZ 3.93Å; V197-I315 HydrophobicContact CG1-CD1 3.79Å
198	T	98.3	Very high	96.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-67.4	-28.2	-173.6	53.8	0	0	0	0	113.3	V189 L192 S195 M200 F201 I315 L319	V189-T198 HydrophobicContact CG1-CG2 3.86Å; V189-T198 HydrophobicContact CG2-CG2 4.11Å; L192-T198 CarbonylContact O-C 3.51Å; L192-T198 PolarHBondContact O-OG1 2.84Å; S195-T198 VanDerWaalsContact CB-OG1 3.28Å; S195-T198 WeakPolarHBondContact CB-OG1 3.49Å; S195-T198 PolarHBondContact N-OG1 3.46Å; S195-T198 PolarHBondContact O-N 3.49Å; S195-T198 PolarHBondContact O-OG1 3.14Å; T198-M200 PolarHBondContact O-N 3.34Å; T198-F201 WeakPolarHBondContact O-CB 3.3Å; T198-F201 PolarHBondContact O-N 2.87Å; T198-I315 HydrophobicContact CG2-CD1 4.38Å; T198-L319 HydrophobicContact CG2-CD2 3.78Å; T198-L319 HydrophobicContact CG2-CG 4.44Å
199	V	97.3	Very high	96.1	Very high	64 Å²	64	51.3 Å²	51.3	39%	0.388	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-60.2	-16.6	177.1	75.4	0	0	0	0	113.4	L192 S195 V197 F201	L192-V199 WeakPolarHBondContact O-CA 3.05Å; L192-V199 PolarHBondContact O-N 3.39Å; S195-V199 PolarHBondContact O-N 3.17Å; V197-V199 VanDerWaalsContact C-N 3.29Å; V197-V199 PolarHBondContact O-N 3.27Å; V199-F201 VanDerWaalsContact C-N 3.27Å; V199-F201 PolarHBondContact O-N 2.84Å
200	M	97.8	Very high	96	Very high	6 Å²	6	54.3 Å²	54.3	3%	0.03	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-76.3	-15.3	177.3	-59.3	-174	-63.8	0	0	112.7	V197 T198 D202 K203 V204 M213 K258 M261 A262 I265	V197-M200 HydrophobicContact CG1-CE 4.12Å; V197-M200 WeakPolarHBondContact O-CB 3.5Å; V197-M200 WeakPolarHBondContact O-CE 3.44Å; V197-M200 PolarHBondContact O-N 3.49Å; T198-M200 PolarHBondContact O-N 3.34Å; M200-D202 PolarHBondContact O-N 3.19Å; M200-K203 WeakPolarHBondContact O-CB 3.28Å; M200-K203 PolarHBondContact O-N 3.01Å; M200-V204 WeakPolarHBondContact O-CG2 3.49Å; M200-V204 PolarHBondContact O-N 2.98Å; M200-V204 VanDerWaalsContact O-N 3.11Å; M200-M213 HydrophobicContact CB-CE 4.3Å; M200-K258 HydrophobicContact SD-CB 3.65Å; M200-K258 HydrophobicContact SD-CD 4.01Å; M200-K258 HydrophobicContact SD-CG 3.8Å; M200-K258 VanDerWaalsContact SD-O 3.38Å; M200-M261 HydrophobicContact CE-CB 3.42Å; M200-M261 VanDerWaalsContact CE-CB 3.42Å; M200-M261 HydrophobicContact CE-CG 4.38Å; M200-M261 HydrophobicContact CE-SD 4.16Å; M200-A262 HydrophobicContact SD-CB 4.42Å; M200-I265 HydrophobicContact CE-CD1 4.2Å
201	F	97.9	Very high	96	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-40.8	-168.8	-166.2	-144.4	0	0	0	113.2	L192 T198 V199 K203 V204 Q205 I265 F269 L271 L319 F322 L323	L192-F201 HydrophobicContact CD1-CB 4.28Å; L192-F201 HydrophobicContact CD2-CB 4.17Å; L192-F201 HydrophobicContact CD2-CD1 4.29Å; T198-F201 WeakPolarHBondContact O-CB 3.3Å; T198-F201 PolarHBondContact O-N 2.87Å; V199-F201 VanDerWaalsContact C-N 3.27Å; V199-F201 PolarHBondContact O-N 2.84Å; F201-K203 PolarHBondContact O-N 3.29Å; F201-V204 WeakPolarHBondContact O-CA 3.48Å; F201-V204 WeakPolarHBondContact O-CB 3.22Å; F201-V204 PolarHBondContact O-N 3.18Å; F201-Q205 HydrophobicContact CD2-CG 4.18Å; F201-Q205 HydrophobicContact CE2-CG 4.09Å; F201-Q205 HydrophobicContact CG-CG 4.45Å; F201-Q205 HydrophobicContact CZ-CG 4.27Å; F201-Q205 WeakPolarHBondContact O-CG 3.44Å; F201-Q205 PolarHBondContact O-N 2.62Å; F201-I265 HydrophobicContact CD2-CG2 3.52Å; F201-I265 HydrophobicContact CE2-CG2 3.87Å; F201-F269 AromaticContact CE2-CD2 3.7Å; F201-F269 HydrophobicContact CE2-CD2 3.7Å; F201-F269 AromaticContact CE2-CE2 3.87Å; F201-F269 HydrophobicContact CE2-CE2 3.87Å; F201-F269 HydrophobicContact CE2-CG 4.17Å; F201-F269 HydrophobicContact CE2-CZ 4.46Å; F201-F269 HydrophobicContact CZ-CD1 4.36Å; F201-F269 HydrophobicContact CZ-CD2 4.02Å; F201-F269 HydrophobicContact CZ-CE1 4.28Å; F201-F269 AromaticContact CZ-CE2 3.93Å; F201-F269 HydrophobicContact CZ-CE2 3.93Å; F201-F269 HydrophobicContact CZ-CG 4.24Å; F201-F269 HydrophobicContact CZ-CZ 4.06Å; F201-L271 HydrophobicContact CE2-CD1 4.38Å; F201-L319 HydrophobicContact CB-CD1 3.92Å; F201-L319 HydrophobicContact CB-CD2 4.02Å; F201-L319 HydrophobicContact CD1-CB 3.98Å; F201-L319 HydrophobicContact CD1-CD1 4.21Å; F201-L319 HydrophobicContact CD1-CD2 3.92Å; F201-L319 HydrophobicContact CD1-CG 4.27Å; F201-L319 HydrophobicContact CD2-CD1 3.82Å; F201-L319 HydrophobicContact CE1-CB 3.83Å; F201-L319 VanDerWaalsContact CE1-O 3.3Å; F201-L319 WeakPolarHBondContact CE1-O 3.43Å; F201-L319 HydrophobicContact CE2-CB 4.44Å; F201-L319 HydrophobicContact CE2-CD1 4.31Å; F201-L319 HydrophobicContact CG-CB 4.34Å; F201-L319 HydrophobicContact CG-CD1 3.74Å; F201-L319 HydrophobicContact CG-CD2 4.08Å; F201-L319 HydrophobicContact CG-CG 4.29Å; F201-L319 HydrophobicContact CZ-CB 4.07Å; F201-F322 HydrophobicContact CD1-CB 3.88Å; F201-F322 HydrophobicContact CE1-CB 3.92Å; F201-L323 HydrophobicContact CE1-CB 4.39Å; F201-L323 HydrophobicContact CZ-CB 4.24Å; F201-L323 HydrophobicContact CZ-CD1 3.89Å
202	D	95.8	Very high	96	Very high	69 Å²	69	48.8 Å²	48.8	37%	0.369	26%	0.262	S	S	.	.	H	α-helix	trans	-59.3	-48.8	175.1	-71.2	-25.2	0	0	0	111	L192 M200 V204 Q205 F206	L192-D202 WeakPolarHBondContact CD1-OD1 3.39Å; M200-D202 PolarHBondContact O-N 3.19Å; D202-V204 PolarHBondContact O-N 3Å; D202-V204 VanDerWaalsContact O-N 3.07Å; D202-Q205 PolarHBondContact O-N 2.99Å; D202-F206 HydrophobicContact CB-CD2 4.19Å; D202-F206 HydrophobicContact CB-CE2 4.2Å; D202-F206 VanDerWaalsContact O-CD2 3.23Å; D202-F206 WeakPolarHBondContact O-CD2 3.32Å; D202-F206 PolarHBondContact O-N 3.25Å
203	K	96.6	Very high	96	Very high	104 Å²	104	48.5 Å²	48.5	45%	0.452	26%	0.26	S	S	.	.	H	α-helix	trans	-57.3	-30.5	176.4	-68.6	-179.5	172.2	-171.2	0	112.9	M200 F201 A211 M213 H275	M200-K203 WeakPolarHBondContact O-CB 3.28Å; M200-K203 PolarHBondContact O-N 3.01Å; F201-K203 PolarHBondContact O-N 3.29Å; K203-A211 HydrophobicContact CB-CB 3.97Å; K203-A211 HydrophobicContact CD-CB 4.23Å; K203-A211 HydrophobicContact CG-CB 4.24Å; K203-M213 HydrophobicContact CB-CE 3.38Å; K203-M213 HydrophobicContact CD-CE 3.5Å; K203-M213 HydrophobicContact CD-SD 3.9Å; K203-M213 HydrophobicContact CG-CE 4.11Å; K203-H275 PolarHBondContact O-CD2 2.85Å; K203-H275 PolarHBondContact O-NE2 3.07Å
204	V	97.4	Very high	96	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-71.4	-42.6	172.9	175	0	0	0	0	111.4	M200 F201 D202 A262 I265 A266 L271 H275 L276	M200-V204 WeakPolarHBondContact O-CG2 3.49Å; M200-V204 PolarHBondContact O-N 2.98Å; M200-V204 VanDerWaalsContact O-N 3.11Å; F201-V204 WeakPolarHBondContact O-CA 3.48Å; F201-V204 WeakPolarHBondContact O-CB 3.22Å; F201-V204 PolarHBondContact O-N 3.18Å; D202-V204 PolarHBondContact O-N 3Å; D202-V204 VanDerWaalsContact O-N 3.07Å; V204-A262 HydrophobicContact CG2-CB 3.97Å; V204-A262 WeakPolarHBondContact CG2-O 3.47Å; V204-I265 HydrophobicContact CB-CG2 4.45Å; V204-I265 HydrophobicContact CG1-CG2 4.25Å; V204-I265 HydrophobicContact CG2-CB 4.46Å; V204-I265 HydrophobicContact CG2-CG2 4.22Å; V204-A266 HydrophobicContact CG1-CB 3.64Å; V204-L271 HydrophobicContact CG1-CB 4.48Å; V204-L271 HydrophobicContact CG1-CD1 4.14Å; V204-H275 PolarHBondContact O-CE1 3.35Å; V204-H275 PolarHBondContact O-NE2 2.89Å; V204-L276 HydrophobicContact CG2-CD1 4.32Å
205	Q	96.4	Very high	96.1	Very high	14 Å²	14	45.8 Å²	45.8	7%	0.065	25%	0.248	C	C	.	.	H	α-helix	trans	-70.8	-37.8	-178.1	-65.8	-170.8	93.3	0	0	114	F201 D202 S207 L271 F322	F201-Q205 HydrophobicContact CD2-CG 4.18Å; F201-Q205 HydrophobicContact CE2-CG 4.09Å; F201-Q205 HydrophobicContact CG-CG 4.45Å; F201-Q205 HydrophobicContact CZ-CG 4.27Å; F201-Q205 WeakPolarHBondContact O-CG 3.44Å; F201-Q205 PolarHBondContact O-N 2.62Å; D202-Q205 PolarHBondContact O-N 2.99Å; Q205-S207 VanDerWaalsContact C-N 3.29Å; Q205-S207 PolarHBondContact O-N 3.08Å; Q205-L271 HydrophobicContact CG-CD1 4.22Å; Q205-F322 PolarHBondContact NE2-O 2.59Å
206	F	93.8	Very high	96	Very high	64 Å²	64	48 Å²	48	28%	0.281	26%	0.256	S	S	.	.			trans	-81.1	68.3	-177.6	-74.4	-96.6	0	0	0	112.1	D202 N208 K209 I324 F333	D202-F206 HydrophobicContact CB-CD2 4.19Å; D202-F206 HydrophobicContact CB-CE2 4.2Å; D202-F206 VanDerWaalsContact O-CD2 3.23Å; D202-F206 WeakPolarHBondContact O-CD2 3.32Å; D202-F206 PolarHBondContact O-N 3.25Å; F206-N208 PolarHBondContact O-N 2.9Å; F206-N208 VanDerWaalsContact O-N 3.17Å; F206-K209 PolarHBondContact O-N 3.12Å; F206-K209 VanDerWaalsContact O-N 3.16Å; F206-I324 HydrophobicContact CE2-CD1 4.17Å; F206-I324 HydrophobicContact CZ-CD1 4.39Å; F206-F333 HydrophobicContact CD1-CB 4.24Å; F206-F333 AromaticContact CD1-CD1 3.62Å; F206-F333 HydrophobicContact CD1-CD1 3.62Å; F206-F333 HydrophobicContact CD1-CG 4.43Å; F206-F333 HydrophobicContact CE1-CB 4.35Å; F206-F333 AromaticContact CE1-CD1 3.72Å; F206-F333 HydrophobicContact CE1-CD1 3.72Å; F206-F333 HydrophobicContact CE1-CG 4.48Å; F206-F333 HydrophobicContact CG-CD1 4.05Å; F206-F333 HydrophobicContact CZ-CD1 4.19Å
207	S	91.3	Very high	96.1	Very high	66 Å²	66	46.4 Å²	46.4	46%	0.462	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-13.2	-176.1	59.7	0	0	0	0	115.2	Q205 K209	Q205-S207 VanDerWaalsContact C-N 3.29Å; Q205-S207 PolarHBondContact O-N 3.08Å; S207-K209 VanDerWaalsContact C-N 3.25Å; S207-K209 PolarHBondContact O-N 3.12Å
208	N	90.3	Very high	96.1	Very high	105 Å²	105	48.3 Å²	48.3	56%	0.561	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-10.8	174	63.4	-44.2	0	0	0	113.6	F206 F333	F206-N208 PolarHBondContact O-N 2.9Å; F206-N208 VanDerWaalsContact O-N 3.17Å; N208-F333 PolarHBondContact ND2-O 2.86Å
209	K	92.4	Very high	96.2	Very high	152 Å²	152	49 Å²	49	66%	0.661	25%	0.253	S	S	*	.	S	Bend	trans	-124.3	127.5	179.4	-172	175.8	-179.8	176.3	0	110	F206 S207 A211 H275	F206-K209 PolarHBondContact O-N 3.12Å; F206-K209 VanDerWaalsContact O-N 3.16Å; S207-K209 VanDerWaalsContact C-N 3.25Å; S207-K209 PolarHBondContact O-N 3.12Å; K209-A211 PolarHBondContact O-N 3.37Å; K209-H275 PolarHBondContact O-CD2 2.94Å
210	S	95.9	Very high	96.2	Very high	78 Å²	78	46.5 Å²	46.5	55%	0.545	24%	0.237	S	C	.	.			trans	-63.3	137	172.3	58.6	0	0	0	0	110.8	H275	S210-H275 CarbonylContact C-O 3.56Å; S210-H275 VanDerWaalsContact CA-O 3.29Å; S210-H275 WeakPolarHBondContact CA-O 3.48Å
211	A	97.3	Very high	96.3	Very high	12 Å²	12	46.4 Å²	46.4	10%	0.099	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	118.5	-178.8	0	0	0	0	0	111.2	K203 K209 H275 L276 R277	K203-A211 HydrophobicContact CB-CB 3.97Å; K203-A211 HydrophobicContact CD-CB 4.23Å; K203-A211 HydrophobicContact CG-CB 4.24Å; K209-A211 PolarHBondContact O-N 3.37Å; A211-H275 PolarHBondContact N-O 3.29Å; A211-L276 HydrophobicContact CB-CD2 4.08Å; A211-L276 WeakPolarHBondContact O-CA 3.45Å; A211-R277 PolarHBondContact O-N 3.29Å
212	N	96.7	Very high	96.3	Very high	99 Å²	99	46.5 Å²	46.5	53%	0.529	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	131.6	171.7	-69.8	-4.8	0	0	0	110.2	R277 I279	N212-R277 WeakPolarHBondContact CA-O 3.33Å; N212-I279 HydrophobicContact CB-CD1 4.08Å; N212-I279 HydrophobicContact CB-CG1 3.8Å
213	M	97.2	Very high	96.5	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.039	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	134.7	-179.3	-65.5	-61.9	-163.2	0	0	110.4	M200 K203 H215 Y259 A262 L276 R277 P278 I279	M200-M213 HydrophobicContact CB-CE 4.3Å; K203-M213 HydrophobicContact CB-CE 3.38Å; K203-M213 HydrophobicContact CD-CE 3.5Å; K203-M213 HydrophobicContact CD-SD 3.9Å; K203-M213 HydrophobicContact CG-CE 4.11Å; M213-H215 PolarHBondContact O-N 3.29Å; M213-Y259 HydrophobicContact CB-CD2 4.13Å; M213-A262 HydrophobicContact CE-CB 3.86Å; M213-A262 HydrophobicContact CG-CB 4.38Å; M213-A262 HydrophobicContact SD-CB 4.47Å; M213-L276 HydrophobicContact CE-CD2 3.83Å; M213-L276 HydrophobicContact CG-CD2 4.34Å; M213-R277 PolarHBondContact N-O 2.65Å; M213-P278 CarbonylContact O-C 3.49Å; M213-I279 PolarHBondContact O-N 2.78Å
214	D	96.6	Very high	96.6	Very high	25 Å²	25	38.6 Å²	38.6	13%	0.134	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	124.3	176.3	159.4	-125	0	0	0	111.1	W216 Q217 K258 Y259	D214-W216 WeakPolarHBondContact OD2-CB 3.37Å; D214-W216 PolarHBondContact OD2-N 3.22Å; D214-Q217 PolarHBondContact OD2-N 3Å; D214-K258 HydrophobicContact CB-CB 4.11Å; D214-K258 HydrophobicContact CB-CD 4.48Å; D214-K258 CarbonylContact O-C 3.57Å; D214-K258 WeakPolarHBondContact O-CB 3.19Å; D214-K258 PolarHBondContact O-N 2.77Å; D214-Y259 PolarHBondContact O-N 2.99Å
215	H	98	Very high	96.6	Very high	52 Å²	52	41.4 Å²	41.4	24%	0.241	21%	0.212	C	C	.	.			trans	-124.8	20.7	175.5	-161.6	38.5	0	0	0	111.1	M213 T257 Y259 E260 P278 I279 T280	M213-H215 PolarHBondContact O-N 3.29Å; H215-T257 PolarHBondContact ND1-OG1 3.38Å; H215-Y259 HydrophobicContact CB-CG 4.43Å; H215-Y259 AromaticContact CE1-CD1 3.93Å; H215-Y259 AromaticContact CG-CD1 3.94Å; H215-Y259 AromaticContact ND1-CD1 3.73Å; H215-E260 IonicContact CE1-OE1 3.59Å; H215-E260 IonicContact CE1-OE2 3.93Å; H215-P278 HydrophobicContact CB-CB 3.67Å; H215-I279 CarbonylContact C-O 3.52Å; H215-I279 WeakPolarHBondContact CA-O 3.32Å; H215-I279 PolarHBondContact N-O 3.35Å; H215-T280 HydrophobicContact CB-CG2 4.25Å
216	W	96.5	Very high	96.8	Very high	52 Å²	52	40.9 Å²	40.9	20%	0.197	21%	0.21	C	C	.	.	S	Bend	trans	-98.7	-45.5	177.5	173	81.8	0	0	0	111.7	D214 P283 R289 R291	D214-W216 WeakPolarHBondContact OD2-CB 3.37Å; D214-W216 PolarHBondContact OD2-N 3.22Å; W216-P283 VanDerWaalsContact CE3-CD 3.47Å; W216-P283 HydrophobicContact CE3-CG 4.24Å; W216-R289 HydrophobicContact CZ3-CB 4.44Å; W216-R291 HydrophobicContact CH2-CB 4.13Å; W216-R291 HydrophobicContact CZ2-CB 3.95Å; W216-R291 HydrophobicContact CZ2-CG 4.1Å
217	Q	97.2	Very high	97	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.019	20%	0.197	C	C	.	.			trans	-86.4	120.1	-172.1	-165.7	175.1	11.4	0	0	113.1	Y138 D214 R219 T257 R289 P290	Y138-Q217 PolarHBondContact OH-NE2 3.42Å; D214-Q217 PolarHBondContact OD2-N 3Å; Q217-R219 HydrophobicContact CG-CG 4.22Å; Q217-R219 VanDerWaalsContact OE1-CZ 3.26Å; Q217-T257 WeakPolarHBondContact O-CA 3.45Å; Q217-T257 WeakPolarHBondContact O-CG2 3.31Å; Q217-R289 VanDerWaalsContact OE1-CD 3.24Å; Q217-P290 VanDerWaalsContact CG-O 3.31Å; Q217-P290 WeakPolarHBondContact CG-O 3.42Å; Q217-P290 PolarHBondContact NE2-O 2.63Å
218	Q	98.4	Very high	97.4	Very high	40 Å²	40	34.7 Å²	34.7	19%	0.187	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-77.4	132.3	173.3	-54.1	-55.9	-45.9	0	0	110.2	Q255 R291 N292	Q218-Q255 HydrophobicContact CB-CG 4.33Å; Q218-R291 PolarHBondContact N-O 3.37Å; Q218-N292 HydrophobicContact CB-CB 3.82Å; Q218-N292 HydrophobicContact CG-CB 4.17Å
219	R	98.6	Very high	97.8	Very high	15 Å²	15	29.9 Å²	29.9	6%	0.057	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-140.4	164.9	-178.9	-54.9	176	168.9	-106.4	3.6	110.3	Y138 I184 Q217 Q255 M256 M261	Y138-R219 PolarHBondContact OH-NH2 3.09Å; I184-R219 HydrophobicContact CG2-CB 3.9Å; Q217-R219 HydrophobicContact CG-CG 4.22Å; Q217-R219 VanDerWaalsContact OE1-CZ 3.26Å; R219-Q255 WeakPolarHBondContact O-CA 3.4Å; R219-M256 CarbonylContact C-O 3.6Å; R219-M256 WeakPolarHBondContact CA-O 3.2Å; R219-M256 VanDerWaalsContact CB-O 3.31Å; R219-M256 WeakPolarHBondContact CB-O 3.37Å; R219-M256 PolarHBondContact N-O 2.72Å; R219-M256 PolarHBondContact O-N 3.11Å; R219-M256 VanDerWaalsContact O-O 3.05Å; R219-M261 HydrophobicContact CB-CE 4.25Å
220	F	98.8	Very high	98.1	Very high	10 Å²	10	22.7 Å²	22.7	4%	0.044	12%	0.118	C	C	.	.			trans	-127.5	87.4	177.6	-68	-96.6	0	0	0	108.9	P183 T222 S251 G252 Q255 Q294	P183-F220 HydrophobicContact CG-CB 4.28Å; P183-F220 WeakPolarHBondContact CG-O 3.44Å; F220-T222 PolarHBondContact O-N 3.22Å; F220-T222 VanDerWaalsContact O-N 3.08Å; F220-T222 PolarHBondContact O-OG1 3.49Å; F220-S251 WeakPolarHBondContact CB-OG 3.33Å; F220-G252 WeakPolarHBondContact CD1-O 3.22Å; F220-Q255 HydrophobicContact CD1-CB 4.29Å; F220-Q255 HydrophobicContact CE1-CB 3.6Å; F220-Q255 HydrophobicContact CE1-CG 4.12Å; F220-Q255 HydrophobicContact CE2-CB 4.44Å; F220-Q255 HydrophobicContact CE2-CG 4.06Å; F220-Q255 HydrophobicContact CZ-CB 3.68Å; F220-Q255 HydrophobicContact CZ-CG 3.66Å; F220-Q294 HydrophobicContact CD2-CB 4.29Å; F220-Q294 HydrophobicContact CD2-CG 4.32Å; F220-Q294 HydrophobicContact CE1-CG 4.19Å; F220-Q294 HydrophobicContact CE2-CB 3.51Å; F220-Q294 HydrophobicContact CE2-CG 3.58Å; F220-Q294 HydrophobicContact CZ-CB 3.9Å; F220-Q294 VanDerWaalsContact CZ-CD 3.45Å; F220-Q294 HydrophobicContact CZ-CG 3.49Å; F220-Q294 VanDerWaalsContact CZ-CG 3.49Å
221	P	98.8	Very high	98.2	Very high	5 Å²	5	19 Å²	19	3%	0.032	9%	0.092	C	C	.	.			trans	-55.2	117.6	179.1	24	-34.6	0	0	0	110.8	Y186 V197 E254 M256 M261 F311	Y186-P221 HydrophobicContact CD1-CB 3.86Å; Y186-P221 HydrophobicContact CE1-CB 3.93Å; V197-P221 HydrophobicContact CG2-CB 4.43Å; P221-E254 WeakPolarHBondContact CD-O 3.29Å; P221-M256 HydrophobicContact CG-SD 4.29Å; P221-M261 HydrophobicContact CB-SD 3.9Å; P221-M261 HydrophobicContact CG-CG 4.23Å; P221-M261 HydrophobicContact CG-SD 4.01Å; P221-F311 HydrophobicContact CB-CD2 3.69Å; P221-F311 HydrophobicContact CB-CE2 3.65Å; P221-F311 HydrophobicContact CG-CD2 3.6Å; P221-F311 HydrophobicContact CG-CE2 3.84Å; P221-F311 HydrophobicContact CG-CG 4.35Å
222	T	98.9	Very high	98.3	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.006	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.8	-175.4	-59.1	0	0	0	0	110.1	P183 I184 L185 Y186 F220 V227 G252	P183-T222 WeakPolarHBondContact CG-OG1 3.27Å; I184-T222 PolarHBondContact O-N 3.44Å; L185-T222 WeakPolarHBondContact CA-O 3.16Å; L185-T222 HydrophobicContact CD2-CG2 4.39Å; Y186-T222 WeakPolarHBondContact CD1-O 3.35Å; Y186-T222 PolarHBondContact N-O 2.9Å; Y186-T222 VanDerWaalsContact N-O 3.09Å; F220-T222 PolarHBondContact O-N 3.22Å; F220-T222 VanDerWaalsContact O-N 3.08Å; F220-T222 PolarHBondContact O-OG1 3.49Å; T222-V227 HydrophobicContact CG2-CG2 3.61Å; T222-G252 PolarHBondContact OG1-N 3.25Å
223	H	98.9	Very high	98.4	Very high	2 Å²	2	17.3 Å²	17.3	1%	0.009	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	134.1	-176.6	-161.1	-77	0	0	0	110.3	Y186 K225 D226 V227	Y186-H223 HydrophobicContact CE1-CB 4.01Å; Y186-H223 HydrophobicContact CE2-CB 4.47Å; Y186-H223 AromaticContact CE2-CD2 3.36Å; Y186-H223 WeakPolarHBondContact CE2-CD2 3.23Å; Y186-H223 AromaticContact CZ-CD2 3.56Å; Y186-H223 CarbonylContact O-C 3.53Å; Y186-H223 WeakPolarHBondContact O-CA 3.18Å; H223-K225 VanDerWaalsContact CE1-CG 3.48Å; H223-K225 WeakPolarHBondContact CE1-CG 3.26Å; H223-K225 VanDerWaalsContact ND1-CB 3.32Å; H223-K225 WeakPolarHBondContact ND1-CB 3.3Å; H223-K225 PolarHBondContact ND1-N 2.85Å; H223-K225 PolarHBondContact O-N 3.41Å; H223-D226 HydrophobicContact CB-CB 4.41Å; H223-D226 WeakPolarHBondContact CB-OD2 3.4Å; H223-D226 WeakPolarHBondContact O-CB 3.11Å; H223-D226 PolarHBondContact O-N 3.19Å; H223-V227 PolarHBondContact O-N 3.04Å
224	V	98.9	Very high	98.5	Very high	6 Å²	6	16.9 Å²	16.9	4%	0.036	8%	0.076	C	C	.	.	H	α-helix	trans	-63.6	-28	-179.7	-67.5	0	0	0	0	114	L39 L40 A43 L185 Y186 D226 A228	L39-V224 HydrophobicContact CD1-CG1 4.47Å; L39-V224 HydrophobicContact CD2-CG1 4.34Å; L39-V224 HydrophobicContact CG-CG1 3.86Å; L40-V224 HydrophobicContact CB-CG1 4.36Å; L40-V224 HydrophobicContact CD1-CB 4.06Å; L40-V224 HydrophobicContact CD1-CG1 4.15Å; A43-V224 HydrophobicContact CB-CB 3.82Å; A43-V224 HydrophobicContact CB-CG2 3.64Å; L185-V224 HydrophobicContact CB-CG1 4.01Å; L185-V224 HydrophobicContact CD1-CG1 4.13Å; L185-V224 HydrophobicContact CD2-CG1 4.45Å; L185-V224 HydrophobicContact CG-CG1 4.44Å; Y186-V224 PolarHBondContact O-N 2.99Å; V224-D226 VanDerWaalsContact C-N 3.32Å; V224-A228 VanDerWaalsContact O-CB 3.27Å; V224-A228 WeakPolarHBondContact O-CB 3.43Å; V224-A228 PolarHBondContact O-N 2.87Å
225	K	98.8	Very high	98.6	Very high	59 Å²	59	15.7 Å²	15.7	26%	0.257	7%	0.07	S	C	.	.	H	α-helix	trans	-61.2	-40.7	170.4	-68.3	176.7	-177.6	177	0	111.7	H223 A228 T229 E317	H223-K225 VanDerWaalsContact CE1-CG 3.48Å; H223-K225 WeakPolarHBondContact CE1-CG 3.26Å; H223-K225 VanDerWaalsContact ND1-CB 3.32Å; H223-K225 WeakPolarHBondContact ND1-CB 3.3Å; H223-K225 PolarHBondContact ND1-N 2.85Å; H223-K225 PolarHBondContact O-N 3.41Å; K225-A228 WeakPolarHBondContact O-CB 3.35Å; K225-A228 PolarHBondContact O-N 2.92Å; K225-T229 PolarHBondContact O-N 3.19Å; K225-T229 PolarHBondContact O-OG1 3.23Å; K225-T229 VanDerWaalsContact O-OG1 3.12Å; K225-E317 IonicContact NZ-OE1 3.49Å; K225-E317 PolarHBondContact NZ-OE1 3.23Å; K225-E317 IonicContact NZ-OE2 2.7Å; K225-E317 PolarHBondContact NZ-OE2 3.37Å
226	D	98.9	Very high	98.6	Very high	3 Å²	3	16.4 Å²	16.4	2%	0.016	7%	0.073	C	C	.	.	H	α-helix	trans	-67.6	-43.9	-180	-62.9	-17.7	0	0	0	111.1	H223 V224 A228 T229 V230 Q307 T309	H223-D226 HydrophobicContact CB-CB 4.41Å; H223-D226 WeakPolarHBondContact CB-OD2 3.4Å; H223-D226 WeakPolarHBondContact O-CB 3.11Å; H223-D226 PolarHBondContact O-N 3.19Å; V224-D226 VanDerWaalsContact C-N 3.32Å; D226-A228 VanDerWaalsContact C-N 3.3Å; D226-A228 PolarHBondContact O-N 3.12Å; D226-T229 WeakPolarHBondContact O-CB 3.43Å; D226-T229 PolarHBondContact O-N 3.29Å; D226-V230 WeakPolarHBondContact O-CG2 3.47Å; D226-V230 PolarHBondContact O-N 3.17Å; D226-Q307 HydrophobicContact CB-CB 4.3Å; D226-Q307 VanDerWaalsContact CB-O 3.26Å; D226-Q307 WeakPolarHBondContact CB-O 3.48Å; D226-Q307 WeakPolarHBondContact OD1-CG 3.49Å; D226-Q307 PolarHBondContact OD1-NE2 3.48Å; D226-T309 PolarHBondContact OD1-N 3.04Å; D226-T309 PolarHBondContact OD1-OG1 3.36Å; D226-T309 WeakPolarHBondContact OD2-CB 3.32Å; D226-T309 PolarHBondContact OD2-N 2.74Å; D226-T309 PolarHBondContact OD2-OG1 2.79Å
227	V	98.9	Very high	98.6	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62.5	-39.4	174.1	-177.8	0	0	0	0	111	L40 L180 I182 L185 T222 H223 V230 C231	L40-V227 HydrophobicContact CD1-CB 3.77Å; L40-V227 HydrophobicContact CD1-CG1 3.66Å; L40-V227 HydrophobicContact CD2-CG1 4.17Å; L180-V227 HydrophobicContact CD2-CG1 4.18Å; I182-V227 HydrophobicContact CD1-CG1 3.95Å; I182-V227 HydrophobicContact CD1-CG2 4.47Å; I182-V227 HydrophobicContact CG2-CG1 4.05Å; I182-V227 HydrophobicContact CG2-CG2 4.16Å; L185-V227 HydrophobicContact CD2-CG2 3.91Å; T222-V227 HydrophobicContact CG2-CG2 3.61Å; H223-V227 PolarHBondContact O-N 3.04Å; V227-V230 PolarHBondContact O-N 3.28Å; V227-C231 PolarHBondContact O-N 2.78Å; V227-C231 PolarHBondContact O-SG 3.15Å; V227-C231 VanDerWaalsContact O-SG 3.33Å
228	A	98.9	Very high	98.6	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.008	9%	0.089	C	C	.	.	H	α-helix	trans	-60.9	-45.9	175.6	0	0	0	0	0	112	A43 V44 E47 V224 K225 D226 V230 C231 R232	A43-A228 HydrophobicContact CB-CB 4.13Å; V44-A228 HydrophobicContact CB-CB 4.49Å; V44-A228 HydrophobicContact CG2-CB 4.1Å; E47-A228 HydrophobicContact CB-CB 3.71Å; E47-A228 HydrophobicContact CG-CB 4.17Å; V224-A228 VanDerWaalsContact O-CB 3.27Å; V224-A228 WeakPolarHBondContact O-CB 3.43Å; V224-A228 PolarHBondContact O-N 2.87Å; K225-A228 WeakPolarHBondContact O-CB 3.35Å; K225-A228 PolarHBondContact O-N 2.92Å; D226-A228 VanDerWaalsContact C-N 3.3Å; D226-A228 PolarHBondContact O-N 3.12Å; A228-V230 VanDerWaalsContact C-N 3.3Å; A228-V230 PolarHBondContact O-N 3.29Å; A228-C231 WeakPolarHBondContact O-CB 3.42Å; A228-C231 PolarHBondContact O-N 3.49Å; A228-R232 PolarHBondContact O-N 3.02Å
229	T	98.9	Very high	98.5	Very high	4 Å²	4	20.5 Å²	20.5	3%	0.025	9%	0.091	C	C	.	.	H	α-helix	trans	-56.7	-45.4	173.6	-59.1	0	0	0	0	111	K225 D226 C231 R232 Q233 Q307	K225-T229 PolarHBondContact O-N 3.19Å; K225-T229 PolarHBondContact O-OG1 3.23Å; K225-T229 VanDerWaalsContact O-OG1 3.12Å; D226-T229 WeakPolarHBondContact O-CB 3.43Å; D226-T229 PolarHBondContact O-N 3.29Å; T229-C231 PolarHBondContact O-N 3.48Å; T229-R232 PolarHBondContact O-N 2.56Å; T229-Q233 HydrophobicContact CG2-CG 4.2Å; T229-Q233 WeakPolarHBondContact O-CB 3.35Å; T229-Q233 WeakPolarHBondContact O-CG 3.46Å; T229-Q233 PolarHBondContact O-N 3.1Å; T229-Q307 HydrophobicContact CG2-CB 4.08Å; T229-Q307 PolarHBondContact OG1-NE2 3Å; T229-Q307 PolarHBondContact OG1-OE1 3.17Å; T229-Q307 VanDerWaalsContact OG1-OE1 3.12Å
230	V	98.9	Very high	98.3	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.8	-44	177.7	168	0	0	0	0	111.9	L180 D226 V227 A228 R232 Q233 L234 W250 L300 I305	L180-V230 HydrophobicContact CD1-CG1 4.09Å; L180-V230 HydrophobicContact CD2-CG1 3.94Å; D226-V230 WeakPolarHBondContact O-CG2 3.47Å; D226-V230 PolarHBondContact O-N 3.17Å; V227-V230 PolarHBondContact O-N 3.28Å; A228-V230 VanDerWaalsContact C-N 3.3Å; A228-V230 PolarHBondContact O-N 3.29Å; V230-R232 VanDerWaalsContact C-N 3.32Å; V230-R232 PolarHBondContact O-N 2.7Å; V230-Q233 PolarHBondContact O-N 3.14Å; V230-L234 VanDerWaalsContact O-CB 3.22Å; V230-L234 WeakPolarHBondContact O-CB 3.38Å; V230-L234 PolarHBondContact O-N 2.68Å; V230-W250 HydrophobicContact CB-CG 4.4Å; V230-W250 HydrophobicContact CG1-CB 4.31Å; V230-W250 HydrophobicContact CG1-CG 4.31Å; V230-W250 HydrophobicContact CG2-CD2 3.58Å; V230-W250 HydrophobicContact CG2-CE3 4.17Å; V230-W250 HydrophobicContact CG2-CG 3.72Å; V230-W250 HydrophobicContact CG2-CZ2 4.34Å; V230-L300 HydrophobicContact CG1-CD1 3.66Å; V230-I305 HydrophobicContact CB-CG2 4.33Å; V230-I305 HydrophobicContact CG1-CG2 3.93Å; V230-I305 HydrophobicContact CG2-CG2 4.2Å
231	C	98.9	Very high	98.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.8	-44.2	175.2	-70.5	0	0	0	0	111.7	F48 V91 I132 V227 A228 T229 A235	F48-C231 HydrophobicContact CE2-CB 4.15Å; V91-C231 HydrophobicContact CG1-CB 4.49Å; I132-C231 HydrophobicContact CD1-CB 4.45Å; I132-C231 WeakPolarHBondContact CD1-O 3.3Å; V227-C231 PolarHBondContact O-N 2.78Å; V227-C231 PolarHBondContact O-SG 3.15Å; V227-C231 VanDerWaalsContact O-SG 3.33Å; A228-C231 WeakPolarHBondContact O-CB 3.42Å; A228-C231 PolarHBondContact O-N 3.49Å; T229-C231 PolarHBondContact O-N 3.48Å; C231-A235 VanDerWaalsContact O-CB 3.25Å; C231-A235 WeakPolarHBondContact O-CB 3.36Å; C231-A235 PolarHBondContact O-N 3.22Å
232	R	98.8	Very high	98	Very high	30 Å²	30	33.1 Å²	33.1	11%	0.113	16%	0.164	C	C	.	.	H	α-helix	trans	-65.2	-49	177.7	-176.8	-172.6	56.3	73.1	1.7	111.8	E47 F48 N51 A228 T229 V230 L234 A235 E236	E47-R232 HydrophobicContact CG-CB 4.01Å; E47-R232 IonicContact OE1-CZ 3.04Å; E47-R232 IonicContact OE1-NE 3.47Å; E47-R232 PolarHBondContact OE1-NE 3.13Å; E47-R232 IonicContact OE1-NH2 2.87Å; E47-R232 PolarHBondContact OE1-NH2 2.69Å; F48-R232 HydrophobicContact CD1-CB 4.41Å; F48-R232 HydrophobicContact CD1-CG 4.15Å; F48-R232 HydrophobicContact CE1-CB 4.11Å; F48-R232 HydrophobicContact CE1-CG 4.06Å; F48-R232 HydrophobicContact CE2-CB 4.27Å; F48-R232 VanDerWaalsContact CZ-CA 3.47Å; F48-R232 HydrophobicContact CZ-CB 4.04Å; F48-R232 HydrophobicContact CZ-CG 4.5Å; N51-R232 VanDerWaalsContact CB-CD 3.47Å; N51-R232 VanDerWaalsContact CG-CD 3.48Å; N51-R232 PolarHBondContact ND2-NE 3.2Å; A228-R232 PolarHBondContact O-N 3.02Å; T229-R232 PolarHBondContact O-N 2.56Å; V230-R232 VanDerWaalsContact C-N 3.32Å; V230-R232 PolarHBondContact O-N 2.7Å; R232-L234 VanDerWaalsContact C-N 3.33Å; R232-L234 PolarHBondContact O-N 2.78Å; R232-A235 WeakPolarHBondContact O-CB 3.49Å; R232-A235 PolarHBondContact O-N 3.18Å; R232-E236 WeakPolarHBondContact CD-OE1 3.23Å; R232-E236 HydrophobicContact CG-CG 4.36Å; R232-E236 VanDerWaalsContact CG-OE1 3.29Å; R232-E236 WeakPolarHBondContact CG-OE1 3.49Å; R232-E236 IonicContact CZ-OE1 2.93Å; R232-E236 IonicContact NE-OE1 3.17Å; R232-E236 IonicContact NH1-OE1 2.65Å; R232-E236 PolarHBondContact NH1-OE1 3.31Å; R232-E236 IonicContact NH1-OE2 3.47Å; R232-E236 PolarHBondContact NH1-OE2 3.31Å; R232-E236 WeakPolarHBondContact O-CB 3.47Å; R232-E236 WeakPolarHBondContact O-CG 3.36Å; R232-E236 PolarHBondContact O-N 3.04Å
233	Q	98.8	Very high	98	Very high	46 Å²	46	36.7 Å²	36.7	22%	0.215	19%	0.189	C	C	.	.	H	α-helix	trans	-60.7	-41.5	178.4	-73.4	174.7	-25.5	0	0	111.9	T229 V230 E236 K237 I305	T229-Q233 HydrophobicContact CG2-CG 4.2Å; T229-Q233 WeakPolarHBondContact O-CB 3.35Å; T229-Q233 WeakPolarHBondContact O-CG 3.46Å; T229-Q233 PolarHBondContact O-N 3.1Å; V230-Q233 PolarHBondContact O-N 3.14Å; Q233-E236 PolarHBondContact O-N 3.33Å; Q233-K237 VanDerWaalsContact O-CB 3.29Å; Q233-K237 WeakPolarHBondContact O-CB 3.36Å; Q233-K237 PolarHBondContact O-N 3.5Å; Q233-I305 HydrophobicContact CB-CG1 4.21Å; Q233-I305 HydrophobicContact CB-CG2 3.97Å
234	L	98.7	Very high	97.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.6	-42.6	176.5	-167.1	68.6	0	0	0	111.3	F130 I132 A178 V230 R232 R238 I244 F248 L300 I305	F130-L234 HydrophobicContact CE1-CG 4.36Å; F130-L234 HydrophobicContact CZ-CD2 4.33Å; F130-L234 HydrophobicContact CZ-CG 4.24Å; I132-L234 HydrophobicContact CD1-CB 4.47Å; I132-L234 HydrophobicContact CD1-CD2 4.32Å; A178-L234 HydrophobicContact CB-CD2 4.02Å; V230-L234 VanDerWaalsContact O-CB 3.22Å; V230-L234 WeakPolarHBondContact O-CB 3.38Å; V230-L234 PolarHBondContact O-N 2.68Å; R232-L234 VanDerWaalsContact C-N 3.33Å; R232-L234 PolarHBondContact O-N 2.78Å; L234-R238 WeakPolarHBondContact O-CB 3.3Å; L234-R238 PolarHBondContact O-N 3.49Å; L234-I244 HydrophobicContact CD1-CG2 3.45Å; L234-I244 VanDerWaalsContact CD1-CG2 3.45Å; L234-I244 HydrophobicContact CG-CG2 4.02Å; L234-F248 HydrophobicContact CD1-CD2 4.24Å; L234-F248 HydrophobicContact CD1-CE1 4.45Å; L234-F248 HydrophobicContact CD1-CE2 4.03Å; L234-F248 HydrophobicContact CD1-CZ 4.14Å; L234-F248 HydrophobicContact CD2-CD2 4.02Å; L234-F248 HydrophobicContact CD2-CE2 4.31Å; L234-L300 HydrophobicContact CD1-CD2 4.04Å; L234-I305 HydrophobicContact CB-CD1 4.38Å; L234-I305 HydrophobicContact CD1-CD1 3.73Å
235	A	98.6	Very high	97.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.7	-50.8	174.6	0	0	0	0	0	112.3	F48 W53 V89 I132 C231 R232 K237 R238 M239	F48-A235 HydrophobicContact CE1-CB 3.9Å; F48-A235 HydrophobicContact CZ-CB 3.82Å; W53-A235 HydrophobicContact CH2-CB 4.15Å; W53-A235 HydrophobicContact CZ2-CB 4.43Å; V89-A235 HydrophobicContact CG1-CB 3.97Å; V89-A235 HydrophobicContact CG2-CB 3.95Å; I132-A235 HydrophobicContact CD1-CB 4.32Å; C231-A235 VanDerWaalsContact O-CB 3.25Å; C231-A235 WeakPolarHBondContact O-CB 3.36Å; C231-A235 PolarHBondContact O-N 3.22Å; R232-A235 WeakPolarHBondContact O-CB 3.49Å; R232-A235 PolarHBondContact O-N 3.18Å; A235-K237 VanDerWaalsContact C-N 3.34Å; A235-K237 PolarHBondContact O-N 3.27Å; A235-R238 PolarHBondContact O-N 3.23Å; A235-M239 WeakPolarHBondContact O-CG 3.49Å; A235-M239 PolarHBondContact O-N 3.12Å
236	E	97.6	Very high	97.9	Very high	66 Å²	66	40 Å²	40	31%	0.308	21%	0.209	S	C	.	.	H	α-helix	trans	-58.5	-45.1	177.5	-75.1	171.4	-174.9	0	0	111.7	W53 R232 Q233 R238 M239	W53-E236 HydrophobicContact CZ2-CG 3.8Å; R232-E236 WeakPolarHBondContact CD-OE1 3.23Å; R232-E236 HydrophobicContact CG-CG 4.36Å; R232-E236 VanDerWaalsContact CG-OE1 3.29Å; R232-E236 WeakPolarHBondContact CG-OE1 3.49Å; R232-E236 IonicContact CZ-OE1 2.93Å; R232-E236 IonicContact NE-OE1 3.17Å; R232-E236 IonicContact NH1-OE1 2.65Å; R232-E236 PolarHBondContact NH1-OE1 3.31Å; R232-E236 IonicContact NH1-OE2 3.47Å; R232-E236 PolarHBondContact NH1-OE2 3.31Å; R232-E236 WeakPolarHBondContact O-CB 3.47Å; R232-E236 WeakPolarHBondContact O-CG 3.36Å; R232-E236 PolarHBondContact O-N 3.04Å; Q233-E236 PolarHBondContact O-N 3.33Å; E236-R238 VanDerWaalsContact C-N 3.33Å; E236-R238 PolarHBondContact O-N 3.2Å; E236-M239 WeakPolarHBondContact O-CB 3.5Å; E236-M239 PolarHBondContact O-N 2.59Å
237	K	97.8	Very high	97.9	Very high	73 Å²	73	41 Å²	41	32%	0.317	22%	0.215	S	C	.	.	H	α-helix	trans	-62.2	-42.2	176.9	-154.4	177.2	-174.8	88.4	0	110.9	Q233 A235 M239 L240 D241 I244 L303 I305	Q233-K237 VanDerWaalsContact O-CB 3.29Å; Q233-K237 WeakPolarHBondContact O-CB 3.36Å; Q233-K237 PolarHBondContact O-N 3.5Å; A235-K237 VanDerWaalsContact C-N 3.34Å; A235-K237 PolarHBondContact O-N 3.27Å; K237-M239 VanDerWaalsContact C-N 3.3Å; K237-M239 PolarHBondContact O-N 2.75Å; K237-L240 PolarHBondContact O-N 2.91Å; K237-L240 VanDerWaalsContact O-N 3.12Å; K237-D241 WeakPolarHBondContact O-CB 3.36Å; K237-D241 PolarHBondContact O-N 3.44Å; K237-I244 HydrophobicContact CB-CG1 4.25Å; K237-I244 HydrophobicContact CD-CD1 3.83Å; K237-I244 HydrophobicContact CD-CG1 4.29Å; K237-I244 HydrophobicContact CG-CD1 4.09Å; K237-I244 HydrophobicContact CG-CG1 4.01Å; K237-L303 HydrophobicContact CD-CB 4.43Å; K237-L303 PolarHBondContact NZ-O 2.92Å; K237-I305 HydrophobicContact CD-CD1 3.83Å; K237-I305 HydrophobicContact CD-CG1 4.34Å
238	R	97.6	Very high	97.9	Very high	63 Å²	63	41.2 Å²	41.2	24%	0.238	22%	0.216	C	C	.	.	H	α-helix	trans	-65.1	-28.1	176.5	179.8	51.3	176	96.3	-2.1	114.2	F130 L234 A235 E236 L240 D241 I244	F130-R238 HydrophobicContact CB-CG 4.05Å; F130-R238 HydrophobicContact CD1-CB 3.8Å; F130-R238 HydrophobicContact CD1-CG 3.66Å; F130-R238 HydrophobicContact CD2-CG 3.72Å; F130-R238 HydrophobicContact CE1-CB 3.72Å; F130-R238 HydrophobicContact CE1-CG 3.92Å; F130-R238 HydrophobicContact CE2-CG 3.99Å; F130-R238 HydrophobicContact CG-CB 4.22Å; F130-R238 HydrophobicContact CG-CG 3.54Å; F130-R238 HydrophobicContact CZ-CB 4.1Å; F130-R238 HydrophobicContact CZ-CG 4.07Å; L234-R238 WeakPolarHBondContact O-CB 3.3Å; L234-R238 PolarHBondContact O-N 3.49Å; A235-R238 PolarHBondContact O-N 3.23Å; E236-R238 VanDerWaalsContact C-N 3.33Å; E236-R238 PolarHBondContact O-N 3.2Å; R238-L240 PolarHBondContact O-N 3.04Å; R238-D241 WeakPolarHBondContact CA-O 3.2Å; R238-D241 VanDerWaalsContact CD-O 3.32Å; R238-D241 WeakPolarHBondContact CD-O 3.4Å; R238-I244 HydrophobicContact CB-CB 3.95Å; R238-I244 HydrophobicContact CB-CG2 4.05Å; R238-I244 WeakPolarHBondContact CD-O 3.26Å; R238-I244 HydrophobicContact CG-CB 4.49Å
239	M	95.4	Very high	97.9	Very high	46 Å²	46	41.1 Å²	41.1	23%	0.227	22%	0.216	C	C	.	.	H	α-helix	trans	-67.7	-21.4	175	-66.5	-58	94.4	0	0	112.7	W53 H88 V89 F130 A235 E236 K237	W53-M239 HydrophobicContact CH2-CG 4.06Å; H88-M239 HydrophobicContact CB-SD 4.07Å; V89-M239 HydrophobicContact CG2-CE 3.89Å; V89-M239 HydrophobicContact CG2-SD 4.42Å; F130-M239 HydrophobicContact CB-CE 4.2Å; A235-M239 WeakPolarHBondContact O-CG 3.49Å; A235-M239 PolarHBondContact O-N 3.12Å; E236-M239 WeakPolarHBondContact O-CB 3.5Å; E236-M239 PolarHBondContact O-N 2.59Å; K237-M239 VanDerWaalsContact C-N 3.3Å; K237-M239 PolarHBondContact O-N 2.75Å
240	L	94.4	Very high	97.9	Very high	152 Å²	152	41.2 Å²	41.2	80%	0.796	22%	0.216	S	C	*	.	H	α-helix	trans	-107.2	-28.6	179.4	-57.5	178.2	0	0	0	112.5	K237 R238	K237-L240 PolarHBondContact O-N 2.91Å; K237-L240 VanDerWaalsContact O-N 3.12Å; R238-L240 PolarHBondContact O-N 3.04Å
241	D	96.4	Very high	97.9	Very high	54 Å²	54	41.3 Å²	41.3	29%	0.289	22%	0.216	S	C	.	.			trans	-127.1	107.9	-174.8	-179.7	-0.1	0	0	0	111.1	K237 R238 S243 I244	K237-D241 WeakPolarHBondContact O-CB 3.36Å; K237-D241 PolarHBondContact O-N 3.44Å; R238-D241 WeakPolarHBondContact CA-O 3.2Å; R238-D241 VanDerWaalsContact CD-O 3.32Å; R238-D241 WeakPolarHBondContact CD-O 3.4Å; D241-S243 PolarHBondContact O-N 3.44Å; D241-S243 WeakPolarHBondContact OD1-CB 3.43Å; D241-S243 PolarHBondContact OD1-N 3.28Å; D241-S243 PolarHBondContact OD1-OG 2.73Å; D241-S243 PolarHBondContact OD2-OG 3.37Å; D241-I244 HydrophobicContact CB-CG1 3.96Å; D241-I244 WeakPolarHBondContact O-CG1 3.49Å; D241-I244 PolarHBondContact O-N 2.99Å
242	P	95.1	Very high	97.9	Very high	89 Å²	89	41.8 Å²	41.8	58%	0.578	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-8.8	179.5	30.3	-35.1	0	0	0	114.4	I244	P242-I244 VanDerWaalsContact C-N 3.27Å
243	S	97.8	Very high	97.9	Very high	76 Å²	76	45.2 Å²	45.2	53%	0.531	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-14.5	175.6	80.6	0	0	0	0	113.4	D241 K245	D241-S243 PolarHBondContact O-N 3.44Å; D241-S243 WeakPolarHBondContact OD1-CB 3.43Å; D241-S243 PolarHBondContact OD1-N 3.28Å; D241-S243 PolarHBondContact OD1-OG 2.73Å; D241-S243 PolarHBondContact OD2-OG 3.37Å; S243-K245 PolarHBondContact O-N 3.32Å
244	I	98.6	Very high	97.9	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.026	25%	0.245	C	C	.	.			trans	-73.1	89.3	179.1	-53.9	-58.9	0	0	0	110.7	L234 K237 R238 D241 P242 F248 L303	L234-I244 HydrophobicContact CD1-CG2 3.45Å; L234-I244 VanDerWaalsContact CD1-CG2 3.45Å; L234-I244 HydrophobicContact CG-CG2 4.02Å; K237-I244 HydrophobicContact CB-CG1 4.25Å; K237-I244 HydrophobicContact CD-CD1 3.83Å; K237-I244 HydrophobicContact CD-CG1 4.29Å; K237-I244 HydrophobicContact CG-CD1 4.09Å; K237-I244 HydrophobicContact CG-CG1 4.01Å; R238-I244 HydrophobicContact CB-CB 3.95Å; R238-I244 HydrophobicContact CB-CG2 4.05Å; R238-I244 WeakPolarHBondContact CD-O 3.26Å; R238-I244 HydrophobicContact CG-CB 4.49Å; D241-I244 HydrophobicContact CB-CG1 3.96Å; D241-I244 WeakPolarHBondContact O-CG1 3.49Å; D241-I244 PolarHBondContact O-N 2.99Å; P242-I244 VanDerWaalsContact C-N 3.27Å; I244-F248 HydrophobicContact CG2-CZ 4.35Å; I244-L303 HydrophobicContact CD1-CD1 4.43Å; I244-L303 HydrophobicContact CD1-CD2 4.38Å
245	K	98.7	Very high	97.9	Very high	109 Å²	109	50.1 Å²	50.1	47%	0.474	27%	0.265	S	S	.	.			trans	-155.8	171	178.7	59.1	-178.6	179.6	176.2	0	110.7	S243	S243-K245 PolarHBondContact O-N 3.32Å
246	G	98.6	Very high	97.9	Very high	23 Å²	23	51.2 Å²	51.2	24%	0.237	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	86.7	-162.2	-179.3	0	0	0	0	0	113.3	A177 A178 V179 F248	A177-G246 PolarHBondContact O-N 3.36Å; A178-G246 CarbonylContact C-O 3.58Å; A178-G246 WeakPolarHBondContact CA-O 3.41Å; V179-G246 PolarHBondContact N-O 3.24Å; G246-F248 VanDerWaalsContact O-CD2 3.32Å; G246-F248 WeakPolarHBondContact O-CD2 3.45Å; G246-F248 WeakPolarHBondContact O-CE2 3.45Å
247	T	98.9	Very high	97.9	Very high	23 Å²	23	48 Å²	48	14%	0.141	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	141.4	-172.4	-50.5	0	0	0	0	111.9	E149 V179 K299	E149-T247 HydrophobicContact CB-CG2 4.19Å; E149-T247 HydrophobicContact CG-CG2 4.23Å; E149-T247 WeakPolarHBondContact CG-O 3.29Å; V179-T247 HydrophobicContact CB-CG2 4.28Å; V179-T247 HydrophobicContact CG1-CG2 4.19Å; V179-T247 CarbonylContact O-C 3.59Å; V179-T247 WeakPolarHBondContact O-CA 3.48Å; T247-K299 PolarHBondContact O-NZ 3.38Å
248	F	98.9	Very high	97.9	Very high	5 Å²	5	46.5 Å²	46.5	2%	0.022	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	150.1	176.3	-60.8	-81.3	0	0	0	110.4	A178 V179 L180 R181 L234 I244 G246 K299 L300 L303	A178-F248 HydrophobicContact CB-CD2 4.11Å; A178-F248 HydrophobicContact CB-CE2 4.02Å; V179-F248 PolarHBondContact O-N 2.98Å; L180-F248 WeakPolarHBondContact CA-O 3.14Å; L180-F248 HydrophobicContact CD1-CB 4.06Å; R181-F248 PolarHBondContact N-O 3.5Å; L234-F248 HydrophobicContact CD1-CD2 4.24Å; L234-F248 HydrophobicContact CD1-CE1 4.45Å; L234-F248 HydrophobicContact CD1-CE2 4.03Å; L234-F248 HydrophobicContact CD1-CZ 4.14Å; L234-F248 HydrophobicContact CD2-CD2 4.02Å; L234-F248 HydrophobicContact CD2-CE2 4.31Å; I244-F248 HydrophobicContact CG2-CZ 4.35Å; G246-F248 VanDerWaalsContact O-CD2 3.32Å; G246-F248 WeakPolarHBondContact O-CD2 3.45Å; G246-F248 WeakPolarHBondContact O-CE2 3.45Å; F248-K299 HydrophobicContact CD1-CD 3.87Å; F248-K299 HydrophobicContact CD1-CG 4.12Å; F248-K299 HydrophobicContact CE1-CD 4.1Å; F248-K299 HydrophobicContact CE1-CG 4.28Å; F248-L300 HydrophobicContact CB-CD1 4.12Å; F248-L300 HydrophobicContact CB-CD2 4Å; F248-L300 HydrophobicContact CB-CG 4.01Å; F248-L300 HydrophobicContact CD1-CD2 3.42Å; F248-L300 VanDerWaalsContact CD1-CD2 3.42Å; F248-L300 HydrophobicContact CD1-CG 4.03Å; F248-L300 HydrophobicContact CE1-CD2 4.09Å; F248-L300 HydrophobicContact CG-CD2 3.85Å; F248-L300 HydrophobicContact CG-CG 4.36Å; F248-L303 HydrophobicContact CE1-CD1 3.81Å
249	H	98.9	Very high	98	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.9	175.5	-76.1	-179	0	0	0	111.6	F140 Y147 R148 E149 R181 L295 D296 L300	F140-H249 AromaticContact CE2-CE1 3.73Å; F140-H249 AromaticContact CE2-NE2 3.84Å; F140-H249 AromaticContact CZ-CE1 3.81Å; F140-H249 AromaticContact CZ-NE2 3.93Å; Y147-H249 PolarHBondContact O-CE1 2.76Å; Y147-H249 VanDerWaalsContact O-CE1 3.23Å; Y147-H249 PolarHBondContact O-ND1 3.43Å; R148-H249 PolarHBondContact O-CE1 3.05Å; R148-H249 VanDerWaalsContact O-CE1 3.29Å; E149-H249 HydrophobicContact CG-CB 4.43Å; E149-H249 IonicContact OE1-CG 3.6Å; E149-H249 PolarHBondContact OE1-N 3.09Å; E149-H249 VanDerWaalsContact OE1-N 3.12Å; R181-H249 WeakPolarHBondContact CD-NE2 3.41Å; R181-H249 PolarHBondContact NH1-NE2 3.07Å; R181-H249 VanDerWaalsContact NH1-NE2 3.19Å; H249-L295 HydrophobicContact CB-CB 4.02Å; H249-L295 HydrophobicContact CB-CD1 4.46Å; H249-D296 WeakPolarHBondContact CB-O 3.35Å; H249-D296 PolarHBondContact ND1-O 3.35Å; H249-L300 WeakPolarHBondContact O-CD1 3.32Å
250	W	98.9	Very high	98.2	Very high	5 Å²	5	47.5 Å²	47.5	2%	0.019	25%	0.254	C	S	.	.			trans	-137.1	135.8	167.1	-166.8	-106.6	0	0	0	112.6	L180 R181 I182 P183 V230 C297 L300 E301 I305 Q307 R308	L180-W250 HydrophobicContact CD1-CB 4.05Å; R181-W250 PolarHBondContact O-N 2.92Å; I182-W250 HydrophobicContact CG2-CB 4.32Å; P183-W250 WeakPolarHBondContact CD-O 3.32Å; V230-W250 HydrophobicContact CB-CG 4.4Å; V230-W250 HydrophobicContact CG1-CB 4.31Å; V230-W250 HydrophobicContact CG1-CG 4.31Å; V230-W250 HydrophobicContact CG2-CD2 3.58Å; V230-W250 HydrophobicContact CG2-CE3 4.17Å; V230-W250 HydrophobicContact CG2-CG 3.72Å; V230-W250 HydrophobicContact CG2-CZ2 4.34Å; W250-C297 HydrophobicContact CE3-CB 4.24Å; W250-C297 HydrophobicContact CZ3-CB 4.26Å; W250-L300 HydrophobicContact CB-CD1 4.14Å; W250-L300 HydrophobicContact CD2-CD1 4.5Å; W250-L300 HydrophobicContact CE3-CB 3.98Å; W250-L300 HydrophobicContact CE3-CD1 3.85Å; W250-L300 HydrophobicContact CZ3-CB 4.14Å; W250-E301 HydrophobicContact CH2-CG 4.5Å; W250-E301 HydrophobicContact CZ3-CG 4.14Å; W250-I305 WeakPolarHBondContact CZ3-O 3.26Å; W250-Q307 WeakPolarHBondContact CZ2-O 3.4Å; W250-Q307 PolarHBondContact NE1-O 3.25Å; W250-R308 HydrophobicContact CZ2-CG 3.96Å
251	S	98.9	Very high	98.4	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.014	22%	0.216	C	C	.	.			trans	-152.2	147.9	-178.2	-179.3	0	0	0	0	111.5	F220 C297 R308	F220-S251 WeakPolarHBondContact CB-OG 3.33Å; S251-C297 PolarHBondContact N-SG 3.18Å; S251-R308 PolarHBondContact O-NE 3.07Å; S251-R308 PolarHBondContact O-NH2 3.38Å
252	G	98.4	Very high	98.5	Very high	10 Å²	10	37.7 Å²	37.7	10%	0.103	20%	0.202	C	C	.	.			trans	-56.5	157.2	158.1	0	0	0	0	0	111	F220 T222	F220-G252 WeakPolarHBondContact CD1-O 3.22Å; T222-G252 PolarHBondContact OG1-N 3.25Å
253	N	98.1	Very high	98.7	Very high	102 Å²	102	34.5 Å²	34.5	55%	0.545	18%	0.181	S	C	.	.	S	Bend	trans	-103.6	0.4	-177.6	60.1	-9.7	0	0	0	113.7	R308	N253-R308 VanDerWaalsContact CG-CD 3.4Å
254	E	98.8	Very high	98.7	Very high	59 Å²	59	31 Å²	31	28%	0.276	16%	0.157	S	C	.	.			trans	-93.4	103.3	177	-69.4	169.2	96.2	0	0	109.7	P221 M256 F311	P221-E254 WeakPolarHBondContact CD-O 3.29Å; E254-M256 HydrophobicContact CB-CE 4.28Å; E254-M256 PolarHBondContact O-N 3.21Å; E254-F311 WeakPolarHBondContact OE2-CB 3.47Å; E254-F311 PolarHBondContact OE2-N 2.94Å
255	Q	98.8	Very high	98.7	Very high	91 Å²	91	30.8 Å²	30.8	43%	0.425	16%	0.156	S	C	.	.			trans	-71.7	127.1	174.8	-171.5	179.1	-63	0	0	110.1	Q218 R219 F220	Q218-Q255 HydrophobicContact CB-CG 4.33Å; R219-Q255 WeakPolarHBondContact O-CA 3.4Å; F220-Q255 HydrophobicContact CD1-CB 4.29Å; F220-Q255 HydrophobicContact CE1-CB 3.6Å; F220-Q255 HydrophobicContact CE1-CG 4.12Å; F220-Q255 HydrophobicContact CE2-CB 4.44Å; F220-Q255 HydrophobicContact CE2-CG 4.06Å; F220-Q255 HydrophobicContact CZ-CB 3.68Å; F220-Q255 HydrophobicContact CZ-CG 3.66Å
256	M	98.8	Very high	98.7	Very high	22 Å²	22	25.6 Å²	25.6	11%	0.108	13%	0.134	C	C	.	.	B	Isolated β-bridge	trans	-149	142.7	177.7	-61.9	-173.9	178.8	0	0	112.3	R219 P221 E254 E260 M261 A264 F311	R219-M256 CarbonylContact C-O 3.6Å; R219-M256 WeakPolarHBondContact CA-O 3.2Å; R219-M256 VanDerWaalsContact CB-O 3.31Å; R219-M256 WeakPolarHBondContact CB-O 3.37Å; R219-M256 PolarHBondContact N-O 2.72Å; R219-M256 PolarHBondContact O-N 3.11Å; R219-M256 VanDerWaalsContact O-O 3.05Å; P221-M256 HydrophobicContact CG-SD 4.29Å; E254-M256 HydrophobicContact CB-CE 4.28Å; E254-M256 PolarHBondContact O-N 3.21Å; M256-E260 HydrophobicContact CB-CB 4.09Å; M256-E260 HydrophobicContact CG-CB 4.34Å; M256-M261 HydrophobicContact CB-CG 3.61Å; M256-M261 HydrophobicContact CG-CG 4.29Å; M256-M261 HydrophobicContact SD-CB 4.42Å; M256-M261 HydrophobicContact SD-CG 3.71Å; M256-A264 HydrophobicContact CE-CB 4.16Å; M256-A264 HydrophobicContact SD-CB 4.34Å; M256-F311 HydrophobicContact CE-CB 4.23Å; M256-F311 HydrophobicContact CE-CD1 3.84Å; M256-F311 HydrophobicContact CE-CG 4.15Å; M256-F311 HydrophobicContact SD-CD1 3.89Å; M256-F311 HydrophobicContact SD-CE1 4.08Å; M256-F311 HydrophobicContact SD-CG 4.22Å
257	T	98.7	Very high	98.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.142	C	C	.	.			trans	-79.4	173.4	159.4	60.5	0	0	0	0	111.2	H215 Q217 Y259 E260 M261	H215-T257 PolarHBondContact ND1-OG1 3.38Å; Q217-T257 WeakPolarHBondContact O-CA 3.45Å; Q217-T257 WeakPolarHBondContact O-CG2 3.31Å; T257-Y259 VanDerWaalsContact C-N 3.32Å; T257-Y259 PolarHBondContact O-N 3.08Å; T257-E260 WeakPolarHBondContact CB-OE2 3.41Å; T257-E260 WeakPolarHBondContact CG2-OE2 3.33Å; T257-E260 PolarHBondContact N-OE2 3.48Å; T257-E260 PolarHBondContact O-N 3.06Å; T257-E260 WeakPolarHBondContact OG1-CG 3.06Å; T257-E260 PolarHBondContact OG1-N 3.42Å; T257-E260 PolarHBondContact OG1-OE2 2.85Å; T257-M261 WeakPolarHBondContact O-CB 3.45Å; T257-M261 WeakPolarHBondContact O-CE 3.46Å; T257-M261 WeakPolarHBondContact O-CG 3.47Å; T257-M261 PolarHBondContact O-N 3.25Å
258	K	98.2	Very high	98.7	Very high	41 Å²	41	27.8 Å²	27.8	18%	0.178	14%	0.141	C	C	.	.	H	α-helix	trans	-62.6	-38.2	173.1	-78.4	-164.3	171	-164.9	0	113	M200 D214 M261 A262	M200-K258 HydrophobicContact SD-CB 3.65Å; M200-K258 HydrophobicContact SD-CD 4.01Å; M200-K258 HydrophobicContact SD-CG 3.8Å; M200-K258 VanDerWaalsContact SD-O 3.38Å; D214-K258 HydrophobicContact CB-CB 4.11Å; D214-K258 HydrophobicContact CB-CD 4.48Å; D214-K258 CarbonylContact O-C 3.57Å; D214-K258 WeakPolarHBondContact O-CB 3.19Å; D214-K258 PolarHBondContact O-N 2.77Å; K258-M261 HydrophobicContact CG-CE 4.15Å; K258-A262 VanDerWaalsContact O-CB 3.32Å; K258-A262 WeakPolarHBondContact O-CB 3.31Å; K258-A262 PolarHBondContact O-N 3.04Å
259	Y	98.8	Very high	98.6	Very high	59 Å²	59	29 Å²	29	23%	0.231	15%	0.146	C	C	.	.	H	α-helix	trans	-60.1	-49.6	174.2	172.6	-104.3	0	0	0	111.4	M213 D214 H215 T257 M261 A262 C263 L276 P278	M213-Y259 HydrophobicContact CB-CD2 4.13Å; D214-Y259 PolarHBondContact O-N 2.99Å; H215-Y259 HydrophobicContact CB-CG 4.43Å; H215-Y259 AromaticContact CE1-CD1 3.93Å; H215-Y259 AromaticContact CG-CD1 3.94Å; H215-Y259 AromaticContact ND1-CD1 3.73Å; T257-Y259 VanDerWaalsContact C-N 3.32Å; T257-Y259 PolarHBondContact O-N 3.08Å; Y259-M261 PolarHBondContact O-N 2.93Å; Y259-A262 PolarHBondContact O-N 3.36Å; Y259-A262 VanDerWaalsContact O-N 3.16Å; Y259-C263 PolarHBondContact O-N 2.97Å; Y259-C263 PolarHBondContact O-SG 2.89Å; Y259-C263 VanDerWaalsContact O-SG 3.41Å; Y259-L276 HydrophobicContact CD2-CB 4.31Å; Y259-L276 HydrophobicContact CE2-CB 4.01Å; Y259-P278 HydrophobicContact CD1-CB 3.93Å; Y259-P278 HydrophobicContact CD2-CB 3.87Å; Y259-P278 HydrophobicContact CD2-CG 4.48Å; Y259-P278 HydrophobicContact CE1-CB 4.12Å; Y259-P278 HydrophobicContact CE1-CG 4.4Å; Y259-P278 HydrophobicContact CE2-CB 4.06Å; Y259-P278 HydrophobicContact CE2-CG 4.19Å; Y259-P278 HydrophobicContact CG-CB 3.8Å
260	E	98.9	Very high	98.5	Very high	71 Å²	71	36.2 Å²	36.2	33%	0.332	19%	0.185	S	C	.	.	H	α-helix	trans	-64.8	-40.7	179.5	-71.2	159.8	144.4	0	0	112.2	H215 M256 T257 A262 C263 A264	H215-E260 IonicContact CE1-OE1 3.59Å; H215-E260 IonicContact CE1-OE2 3.93Å; M256-E260 HydrophobicContact CB-CB 4.09Å; M256-E260 HydrophobicContact CG-CB 4.34Å; T257-E260 WeakPolarHBondContact CB-OE2 3.41Å; T257-E260 WeakPolarHBondContact CG2-OE2 3.33Å; T257-E260 PolarHBondContact N-OE2 3.48Å; T257-E260 PolarHBondContact O-N 3.06Å; T257-E260 WeakPolarHBondContact OG1-CG 3.06Å; T257-E260 PolarHBondContact OG1-N 3.42Å; T257-E260 PolarHBondContact OG1-OE2 2.85Å; E260-A262 VanDerWaalsContact C-N 3.34Å; E260-A262 PolarHBondContact O-N 3.41Å; E260-C263 PolarHBondContact O-N 3.26Å; E260-A264 WeakPolarHBondContact O-CB 3.14Å; E260-A264 PolarHBondContact O-N 3.39Å
261	M	98.9	Very high	98.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.8	-43.5	172.2	-76.7	-174.5	-91.1	0	0	111.7	V197 M200 R219 P221 M256 T257 K258 Y259 A264 I265 F311	V197-M261 HydrophobicContact CB-SD 4.43Å; V197-M261 HydrophobicContact CG1-SD 3.98Å; V197-M261 HydrophobicContact CG2-SD 3.78Å; M200-M261 HydrophobicContact CE-CB 3.42Å; M200-M261 VanDerWaalsContact CE-CB 3.42Å; M200-M261 HydrophobicContact CE-CG 4.38Å; M200-M261 HydrophobicContact CE-SD 4.16Å; R219-M261 HydrophobicContact CB-CE 4.25Å; P221-M261 HydrophobicContact CB-SD 3.9Å; P221-M261 HydrophobicContact CG-CG 4.23Å; P221-M261 HydrophobicContact CG-SD 4.01Å; M256-M261 HydrophobicContact CB-CG 3.61Å; M256-M261 HydrophobicContact CG-CG 4.29Å; M256-M261 HydrophobicContact SD-CB 4.42Å; M256-M261 HydrophobicContact SD-CG 3.71Å; T257-M261 WeakPolarHBondContact O-CB 3.45Å; T257-M261 WeakPolarHBondContact O-CE 3.46Å; T257-M261 WeakPolarHBondContact O-CG 3.47Å; T257-M261 PolarHBondContact O-N 3.25Å; K258-M261 HydrophobicContact CG-CE 4.15Å; Y259-M261 PolarHBondContact O-N 2.93Å; M261-A264 PolarHBondContact O-N 2.95Å; M261-I265 WeakPolarHBondContact O-CB 3.34Å; M261-I265 WeakPolarHBondContact O-CG1 3.25Å; M261-I265 PolarHBondContact O-N 2.98Å; M261-F311 HydrophobicContact CB-CZ 4.14Å; M261-F311 HydrophobicContact CG-CE2 4.41Å; M261-F311 HydrophobicContact CG-CZ 4.05Å
262	A	98.8	Very high	98.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.3	-40.1	178.9	0	0	0	0	0	112.2	M200 V204 M213 K258 Y259 E260 I265 A266 L276	M200-A262 HydrophobicContact SD-CB 4.42Å; V204-A262 HydrophobicContact CG2-CB 3.97Å; V204-A262 WeakPolarHBondContact CG2-O 3.47Å; M213-A262 HydrophobicContact CE-CB 3.86Å; M213-A262 HydrophobicContact CG-CB 4.38Å; M213-A262 HydrophobicContact SD-CB 4.47Å; K258-A262 VanDerWaalsContact O-CB 3.32Å; K258-A262 WeakPolarHBondContact O-CB 3.31Å; K258-A262 PolarHBondContact O-N 3.04Å; Y259-A262 PolarHBondContact O-N 3.36Å; Y259-A262 VanDerWaalsContact O-N 3.16Å; E260-A262 VanDerWaalsContact C-N 3.34Å; E260-A262 PolarHBondContact O-N 3.41Å; A262-I265 PolarHBondContact O-N 3Å; A262-A266 PolarHBondContact O-N 3.02Å; A262-L276 HydrophobicContact CB-CD1 3.79Å
263	C	98.8	Very high	98.3	Very high	21 Å²	21	42.9 Å²	42.9	14%	0.142	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-44.6	172.1	-68.5	0	0	0	0	111.7	Y259 E260 I265 A266 D267	Y259-C263 PolarHBondContact O-N 2.97Å; Y259-C263 PolarHBondContact O-SG 2.89Å; Y259-C263 VanDerWaalsContact O-SG 3.41Å; E260-C263 PolarHBondContact O-N 3.26Å; C263-I265 VanDerWaalsContact C-N 3.31Å; C263-I265 PolarHBondContact O-N 3.26Å; C263-A266 WeakPolarHBondContact O-CB 3.09Å; C263-A266 PolarHBondContact O-N 3.09Å; C263-A266 VanDerWaalsContact O-N 3.13Å; C263-D267 VanDerWaalsContact O-CG 3.27Å; C263-D267 PolarHBondContact O-N 3.07Å
264	A	98.8	Very high	98.3	Very high	4 Å²	4	42.5 Å²	42.5	3%	0.033	23%	0.23	C	C	.	.	H	α-helix	trans	-64.3	-34.2	177.1	0	0	0	0	0	112.7	M256 E260 M261 A268 F311	M256-A264 HydrophobicContact CE-CB 4.16Å; M256-A264 HydrophobicContact SD-CB 4.34Å; E260-A264 WeakPolarHBondContact O-CB 3.14Å; E260-A264 PolarHBondContact O-N 3.39Å; M261-A264 PolarHBondContact O-N 2.95Å; A264-A268 WeakPolarHBondContact O-CB 3.46Å; A264-A268 PolarHBondContact O-N 3.44Å; A264-F311 HydrophobicContact CB-CD1 3.9Å; A264-F311 HydrophobicContact CB-CE1 3.73Å
265	I	98.8	Very high	98.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.6	-50.3	169.5	-71.5	163.2	0	0	0	110.2	V197 M200 F201 V204 M261 A262 C263 D267 A268 F269 F311 I315 L319	V197-I265 HydrophobicContact CG1-CD1 4.41Å; M200-I265 HydrophobicContact CE-CD1 4.2Å; F201-I265 HydrophobicContact CD2-CG2 3.52Å; F201-I265 HydrophobicContact CE2-CG2 3.87Å; V204-I265 HydrophobicContact CB-CG2 4.45Å; V204-I265 HydrophobicContact CG1-CG2 4.25Å; V204-I265 HydrophobicContact CG2-CB 4.46Å; V204-I265 HydrophobicContact CG2-CG2 4.22Å; M261-I265 WeakPolarHBondContact O-CB 3.34Å; M261-I265 WeakPolarHBondContact O-CG1 3.25Å; M261-I265 PolarHBondContact O-N 2.98Å; A262-I265 PolarHBondContact O-N 3Å; C263-I265 VanDerWaalsContact C-N 3.31Å; C263-I265 PolarHBondContact O-N 3.26Å; I265-D267 VanDerWaalsContact C-N 3.29Å; I265-D267 PolarHBondContact O-N 2.84Å; I265-A268 PolarHBondContact O-N 3.32Å; I265-F269 HydrophobicContact CG2-CD2 4.24Å; I265-F269 WeakPolarHBondContact O-CD2 3.49Å; I265-F269 PolarHBondContact O-N 2.81Å; I265-F311 HydrophobicContact CG1-CE1 4.31Å; I265-F311 HydrophobicContact CG1-CZ 4.24Å; I265-I315 HydrophobicContact CD1-CG1 4.1Å; I265-I315 HydrophobicContact CG1-CG1 3.6Å; I265-I315 HydrophobicContact CG1-CG2 4.31Å; I265-L319 HydrophobicContact CD1-CD1 4.18Å; I265-L319 HydrophobicContact CG1-CD1 4.21Å; I265-L319 HydrophobicContact CG2-CD1 3.91Å
266	A	98.5	Very high	98.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-54.8	-48.4	179.2	0	0	0	0	0	111	V204 A262 C263 A268 F269 N270 L271	V204-A266 HydrophobicContact CG1-CB 3.64Å; A262-A266 PolarHBondContact O-N 3.02Å; C263-A266 WeakPolarHBondContact O-CB 3.09Å; C263-A266 PolarHBondContact O-N 3.09Å; C263-A266 VanDerWaalsContact O-N 3.13Å; A266-A268 PolarHBondContact O-N 2.86Å; A266-F269 CarbonylContact O-C 3.49Å; A266-F269 PolarHBondContact O-N 3.39Å; A266-N270 PolarHBondContact O-N 2.79Å; A266-L271 HydrophobicContact CB-CB 4.41Å; A266-L271 PolarHBondContact O-N 2.85Å
267	D	98.5	Very high	98.2	Very high	77 Å²	77	41.6 Å²	41.6	41%	0.412	22%	0.22	S	C	.	.	H	α-helix	trans	-64	-39	179.3	-62.8	-15.3	0	0	0	112.9	C263 I265 F269 N270 R312	C263-D267 VanDerWaalsContact O-CG 3.27Å; C263-D267 PolarHBondContact O-N 3.07Å; I265-D267 VanDerWaalsContact C-N 3.29Å; I265-D267 PolarHBondContact O-N 2.84Å; D267-F269 PolarHBondContact O-N 2.72Å; D267-N270 PolarHBondContact O-N 3.16Å; D267-N270 VanDerWaalsContact O-N 3.12Å; D267-R312 IonicContact OD2-CZ 3.79Å; D267-R312 IonicContact OD2-NH1 3.82Å; D267-R312 PolarHBondContact OD2-NH1 2.92Å; D267-R312 IonicContact OD2-NH2 2.74Å; D267-R312 PolarHBondContact OD2-NH2 3.16Å
268	A	98.1	Very high	98.2	Very high	14 Å²	14	44.3 Å²	44.3	12%	0.116	24%	0.238	C	C	.	.	H	α-helix	trans	-62.4	-27.6	179.4	0	0	0	0	0	113	A264 I265 A266 I315 K316	A264-A268 WeakPolarHBondContact O-CB 3.46Å; A264-A268 PolarHBondContact O-N 3.44Å; I265-A268 PolarHBondContact O-N 3.32Å; A266-A268 PolarHBondContact O-N 2.86Å; A268-I315 HydrophobicContact CB-CG2 4.32Å; A268-K316 HydrophobicContact CB-CB 4.43Å; A268-K316 PolarHBondContact O-NZ 3.18Å
269	F	97.6	Very high	98.2	Very high	30 Å²	30	45.3 Å²	45.3	13%	0.132	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	3.9	177.2	-72	-79.9	0	0	0	113.9	F201 I265 A266 D267 L271 K316 L319 W320 L323	F201-F269 AromaticContact CE2-CD2 3.7Å; F201-F269 HydrophobicContact CE2-CD2 3.7Å; F201-F269 AromaticContact CE2-CE2 3.87Å; F201-F269 HydrophobicContact CE2-CE2 3.87Å; F201-F269 HydrophobicContact CE2-CG 4.17Å; F201-F269 HydrophobicContact CE2-CZ 4.46Å; F201-F269 HydrophobicContact CZ-CD1 4.36Å; F201-F269 HydrophobicContact CZ-CD2 4.02Å; F201-F269 HydrophobicContact CZ-CE1 4.28Å; F201-F269 AromaticContact CZ-CE2 3.93Å; F201-F269 HydrophobicContact CZ-CE2 3.93Å; F201-F269 HydrophobicContact CZ-CG 4.24Å; F201-F269 HydrophobicContact CZ-CZ 4.06Å; I265-F269 HydrophobicContact CG2-CD2 4.24Å; I265-F269 WeakPolarHBondContact O-CD2 3.49Å; I265-F269 PolarHBondContact O-N 2.81Å; A266-F269 CarbonylContact O-C 3.49Å; A266-F269 PolarHBondContact O-N 3.39Å; D267-F269 PolarHBondContact O-N 2.72Å; F269-L271 HydrophobicContact CB-CD1 3.86Å; F269-L271 HydrophobicContact CB-CG 3.85Å; F269-L271 PolarHBondContact O-N 3.16Å; F269-K316 HydrophobicContact CE1-CG 4.22Å; F269-K316 HydrophobicContact CZ-CB 4.39Å; F269-K316 HydrophobicContact CZ-CG 4.1Å; F269-L319 HydrophobicContact CE2-CB 3.75Å; F269-L319 HydrophobicContact CE2-CD1 4.37Å; F269-L319 HydrophobicContact CZ-CB 3.65Å; F269-W320 HydrophobicContact CE1-CB 4.08Å; F269-W320 HydrophobicContact CZ-CB 4.43Å; F269-L323 HydrophobicContact CD1-CD1 4.2Å; F269-L323 HydrophobicContact CD1-CD2 4.1Å
270	N	97.3	Very high	98	Very high	153 Å²	153	46.6 Å²	46.6	82%	0.818	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	41.7	-174.9	-165.9	54.3	0	0	0	112.8	A266 D267	A266-N270 PolarHBondContact O-N 2.79Å; D267-N270 PolarHBondContact O-N 3.16Å; D267-N270 VanDerWaalsContact O-N 3.12Å
271	L	97	Very high	97.7	Very high	49 Å²	49	49 Å²	49	26%	0.257	27%	0.273	S	S	.	.			trans	-100.5	151.5	176.4	-64.4	175.4	0	0	0	110.3	F201 V204 Q205 A266 F269 L323	F201-L271 HydrophobicContact CE2-CD1 4.38Å; V204-L271 HydrophobicContact CG1-CB 4.48Å; V204-L271 HydrophobicContact CG1-CD1 4.14Å; Q205-L271 HydrophobicContact CG-CD1 4.22Å; A266-L271 HydrophobicContact CB-CB 4.41Å; A266-L271 PolarHBondContact O-N 2.85Å; F269-L271 HydrophobicContact CB-CD1 3.86Å; F269-L271 HydrophobicContact CB-CG 3.85Å; F269-L271 PolarHBondContact O-N 3.16Å; L271-L323 HydrophobicContact CD1-CD1 4.18Å
272	P	97.3	Very high	97.1	Very high	70 Å²	70	52.1 Å²	52.1	46%	0.455	30%	0.295	S	S	.	.			trans	-67.6	146.8	174.1	29.9	-35.2	0	0	0	111.1	H275	P272-H275 PolarHBondContact O-CE1 3.03Å
273	S	98	Very high	96.1	Very high	37 Å²	37	55 Å²	55	26%	0.259	31%	0.314	S	S	.	.			trans	-119.1	1.9	176.4	52.7	0	0	0	0	113.5	H275 L276	S273-H275 PolarHBondContact O-N 2.74Å; S273-H275 VanDerWaalsContact O-N 3.13Å; S273-L276 VanDerWaalsContact O-CB 3.32Å; S273-L276 WeakPolarHBondContact O-CB 3.3Å; S273-L276 WeakPolarHBondContact O-CG 3.18Å; S273-L276 PolarHBondContact O-N 2.93Å
274	S	97.7	Very high	94.8	Very high	95 Å²	95	60.7 Å²	60.7	66%	0.664	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-20.3	-175.3	61.5	0	0	0	0	114.7
275	H	98.1	Very high	93.3	Very high	12 Å²	12	68.2 Å²	68.2	6%	0.056	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-11.3	176.1	65	-70.8	0	0	0	113.2	K203 V204 K209 S210 A211 P272 S273	K203-H275 PolarHBondContact O-CD2 2.85Å; K203-H275 PolarHBondContact O-NE2 3.07Å; V204-H275 PolarHBondContact O-CE1 3.35Å; V204-H275 PolarHBondContact O-NE2 2.89Å; K209-H275 PolarHBondContact O-CD2 2.94Å; S210-H275 CarbonylContact C-O 3.56Å; S210-H275 VanDerWaalsContact CA-O 3.29Å; S210-H275 WeakPolarHBondContact CA-O 3.48Å; A211-H275 PolarHBondContact N-O 3.29Å; P272-H275 PolarHBondContact O-CE1 3.03Å; S273-H275 PolarHBondContact O-N 2.74Å; S273-H275 VanDerWaalsContact O-N 3.13Å
276	L	98.4	Very high	91.8	Very high	4 Å²	4	71.1 Å²	71.1	2%	0.021	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	127.1	176.4	-54.3	179.5	0	0	0	109.6	V204 A211 M213 Y259 A262 S273	V204-L276 HydrophobicContact CG2-CD1 4.32Å; A211-L276 HydrophobicContact CB-CD2 4.08Å; A211-L276 WeakPolarHBondContact O-CA 3.45Å; M213-L276 HydrophobicContact CE-CD2 3.83Å; M213-L276 HydrophobicContact CG-CD2 4.34Å; Y259-L276 HydrophobicContact CD2-CB 4.31Å; Y259-L276 HydrophobicContact CE2-CB 4.01Å; A262-L276 HydrophobicContact CB-CD1 3.79Å; S273-L276 VanDerWaalsContact O-CB 3.32Å; S273-L276 WeakPolarHBondContact O-CB 3.3Å; S273-L276 WeakPolarHBondContact O-CG 3.18Å; S273-L276 PolarHBondContact O-N 2.93Å
277	R	98.1	Very high	90.6	Very high	136 Å²	136	71.8 Å²	71.8	51%	0.513	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	118.6	-178.4	-59.6	-60.8	-171.2	-158.2	-0.1	110	A211 N212 M213	A211-R277 PolarHBondContact O-N 3.29Å; N212-R277 WeakPolarHBondContact CA-O 3.33Å; M213-R277 PolarHBondContact N-O 2.65Å
278	P	98.1	Very high	90	Very high	57 Å²	57	74.5 Å²	74.5	37%	0.37	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	135	177.2	28.7	-32.4	0	0	0	110.5	M213 H215 Y259	M213-P278 CarbonylContact O-C 3.49Å; H215-P278 HydrophobicContact CB-CB 3.67Å; Y259-P278 HydrophobicContact CD1-CB 3.93Å; Y259-P278 HydrophobicContact CD2-CB 3.87Å; Y259-P278 HydrophobicContact CD2-CG 4.48Å; Y259-P278 HydrophobicContact CE1-CB 4.12Å; Y259-P278 HydrophobicContact CE1-CG 4.4Å; Y259-P278 HydrophobicContact CE2-CB 4.06Å; Y259-P278 HydrophobicContact CE2-CG 4.19Å; Y259-P278 HydrophobicContact CG-CB 3.8Å
279	I	96.9	Very high	89.6	Confident	62 Å²	62	77.8 Å²	77.8	32%	0.318	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	109.4	172	-54.4	-59	0	0	0	108	N212 M213 H215 D281	N212-I279 HydrophobicContact CB-CD1 4.08Å; N212-I279 HydrophobicContact CB-CG1 3.8Å; M213-I279 PolarHBondContact O-N 2.78Å; H215-I279 CarbonylContact C-O 3.52Å; H215-I279 WeakPolarHBondContact CA-O 3.32Å; H215-I279 PolarHBondContact N-O 3.35Å; I279-D281 HydrophobicContact CG2-CB 4.49Å
280	T	95.9	Very high	89.5	Confident	87 Å²	87	76.4 Å²	76.4	53%	0.534	44%	0.436	S	S	.	.			trans	-91.8	-13.7	-176.3	49.3	0	0	0	0	113.5	H215	H215-T280 HydrophobicContact CB-CG2 4.25Å
281	D	91.6	Very high	89.4	Confident	120 Å²	120	76.8 Å²	76.8	64%	0.642	43%	0.426	S	S	*	.	S	Bend	trans	-68.3	144.7	177.2	-57.3	-68.9	0	0	0	111.2	I279	I279-D281 HydrophobicContact CG2-CB 4.49Å
282	S	86.9	Confident	89.5	Confident	66 Å²	66	75.5 Å²	75.5	46%	0.462	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-60.3	130.7	173.9	-173.7	0	0	0	0	109.9	V284	S282-V284 PolarHBondContact O-N 3.45Å
283	P	78.5	Confident	89.5	Confident	62 Å²	62	72.4 Å²	72.4	40%	0.403	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-59.1	127.4	176.8	-22.7	32.5	0	0	0	111.7	W216	W216-P283 VanDerWaalsContact CE3-CD 3.47Å; W216-P283 HydrophobicContact CE3-CG 4.24Å
284	V	71.5	Confident	89.6	Confident	140 Å²	140	73.5 Å²	73.5	85%	0.848	40%	0.401	S	S	*	.			trans	-85	-22.3	-178.7	-176.5	0	0	0	0	112.4	S282	S282-V284 PolarHBondContact O-N 3.45Å
285	L	66.4	Low	89.6	Confident	162 Å²	162	69.3 Å²	69.3	85%	0.848	37%	0.371	S	S	*	.	S	Bend	trans	-119.3	142.4	-172.4	-64.6	170.9	0	0	0	112.2
286	G	67.8	Low	89.7	Confident	61 Å²	61	70.8 Å²	70.8	63%	0.629	38%	0.379	S	S	*	.	S	Bend	trans	95.9	-177.4	176.7	0	0	0	0	0	114.1	Q288	G286-Q288 PolarHBondContact O-N 3.5Å
287	A	73.6	Confident	89.7	Confident	14 Å²	14	70.9 Å²	70.9	12%	0.116	38%	0.38	C	S	.	.	S	Bend	trans	-48.1	131.6	177.1	0	0	0	0	0	111.9	P99 E103 N157 R289	P99-A287 HydrophobicContact CB-CB 4.16Å; E103-A287 VanDerWaalsContact OE1-CA 3.3Å; E103-A287 WeakPolarHBondContact OE1-CA 3.22Å; E103-A287 WeakPolarHBondContact OE1-CB 3.31Å; N157-A287 HydrophobicContact CB-CB 4.15Å; A287-R289 VanDerWaalsContact O-CG 3.27Å; A287-R289 WeakPolarHBondContact O-CG 3.45Å
288	Q	85.6	Confident	89.7	Confident	134 Å²	134	67.1 Å²	67.1	63%	0.626	38%	0.375	S	S	*	.			trans	-58	139.9	173	-66.4	-177.2	-24.1	0	0	110.3	L156 N157 G286	L156-Q288 HydrophobicContact CB-CB 3.9Å; L156-Q288 PolarHBondContact O-OE1 2.95Å; N157-Q288 PolarHBondContact ND2-O 3.17Å; G286-Q288 PolarHBondContact O-N 3.5Å
289	R	90.1	Very high	89.7	Confident	83 Å²	83	68.3 Å²	68.3	31%	0.313	37%	0.374	S	S	.	.			trans	-128	140.5	-173.4	-59.8	-170	-179.7	156.4	2.7	111.6	W216 Q217 A287 R291	W216-R289 HydrophobicContact CZ3-CB 4.44Å; Q217-R289 VanDerWaalsContact OE1-CD 3.24Å; A287-R289 VanDerWaalsContact O-CG 3.27Å; A287-R289 WeakPolarHBondContact O-CG 3.45Å; R289-R291 PolarHBondContact O-N 2.92Å
290	P	94.3	Very high	89.8	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.006	36%	0.359	C	S	.	.			trans	-65.6	134.7	174.6	26.3	-33.4	0	0	0	110.3	Y138 D141 Q217 A293	Y138-P290 HydrophobicContact CD1-CG 3.99Å; Y138-P290 HydrophobicContact CE1-CG 4.01Å; D141-P290 VanDerWaalsContact O-CA 3.26Å; D141-P290 WeakPolarHBondContact O-CA 3.36Å; D141-P290 VanDerWaalsContact O-CB 3.3Å; D141-P290 WeakPolarHBondContact O-CB 3.25Å; Q217-P290 VanDerWaalsContact CG-O 3.31Å; Q217-P290 WeakPolarHBondContact CG-O 3.42Å; Q217-P290 PolarHBondContact NE2-O 2.63Å; P290-A293 HydrophobicContact CB-CB 3.91Å; P290-A293 HydrophobicContact CG-CB 3.96Å
291	R	96.4	Very high	90	Very high	160 Å²	160	65.3 Å²	65.3	60%	0.604	35%	0.353	S	S	*	.	S	Bend	trans	-64.9	-46.8	179.7	-177.6	-177.5	174.6	-136.9	-0.3	111.2	W216 Q218 R289	W216-R291 HydrophobicContact CH2-CB 4.13Å; W216-R291 HydrophobicContact CZ2-CB 3.95Å; W216-R291 HydrophobicContact CZ2-CG 4.1Å; Q218-R291 PolarHBondContact N-O 3.37Å; R289-R291 PolarHBondContact O-N 2.92Å
292	N	98.3	Very high	90.3	Very high	22 Å²	22	65.5 Å²	65.5	12%	0.118	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-148.7	100.4	173.6	-175.5	6.1	0	0	0	110.7	G142 P145 Q218 Q294	G142-N292 CarbonylContact C-O 3.58Å; G142-N292 WeakPolarHBondContact CA-O 3.44Å; G142-N292 PolarHBondContact O-N 3.2Å; G142-N292 VanDerWaalsContact O-N 3.16Å; P145-N292 HydrophobicContact CB-CB 4.47Å; P145-N292 HydrophobicContact CG-CB 3.99Å; P145-N292 WeakPolarHBondContact CG-ND2 3.47Å; Q218-N292 HydrophobicContact CB-CB 3.82Å; Q218-N292 HydrophobicContact CG-CB 4.17Å; N292-Q294 VanDerWaalsContact C-N 3.35Å; N292-Q294 WeakPolarHBondContact OD1-CB 3.22Å; N292-Q294 PolarHBondContact OD1-N 2.91Å; N292-Q294 VanDerWaalsContact OD1-N 3.16Å
293	A	98.3	Very high	90.8	Very high	6 Å²	6	64.8 Å²	64.8	5%	0.05	35%	0.349	C	S	.	.			trans	-98.5	44.3	175.6	0	0	0	0	0	111.8	D137 F140 P290 L295	D137-A293 HydrophobicContact CB-CB 4.04Å; F140-A293 HydrophobicContact CB-CB 4.38Å; P290-A293 HydrophobicContact CB-CB 3.91Å; P290-A293 HydrophobicContact CG-CB 3.96Å; A293-L295 PolarHBondContact O-N 3.22Å
294	Q	98.8	Very high	91.8	Very high	60 Å²	60	64.9 Å²	64.9	28%	0.28	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-53.3	130	177.7	-177.8	175.5	-1.9	0	0	110.7	P145 P146 Y147 F220 N292	P145-Q294 HydrophobicContact CB-CB 3.8Å; P146-Q294 CarbonylContact C-O 3.55Å; P146-Q294 WeakPolarHBondContact CA-O 3.49Å; P146-Q294 HydrophobicContact CB-CB 4.36Å; P146-Q294 HydrophobicContact CB-CG 3.97Å; Y147-Q294 PolarHBondContact N-O 3.28Å; F220-Q294 HydrophobicContact CD2-CB 4.29Å; F220-Q294 HydrophobicContact CD2-CG 4.32Å; F220-Q294 HydrophobicContact CE1-CG 4.19Å; F220-Q294 HydrophobicContact CE2-CB 3.51Å; F220-Q294 HydrophobicContact CE2-CG 3.58Å; F220-Q294 HydrophobicContact CZ-CB 3.9Å; F220-Q294 VanDerWaalsContact CZ-CD 3.45Å; F220-Q294 HydrophobicContact CZ-CG 3.49Å; F220-Q294 VanDerWaalsContact CZ-CG 3.49Å; N292-Q294 VanDerWaalsContact C-N 3.35Å; N292-Q294 WeakPolarHBondContact OD1-CB 3.22Å; N292-Q294 PolarHBondContact OD1-N 2.91Å; N292-Q294 VanDerWaalsContact OD1-N 3.16Å
295	L	98.9	Very high	93.1	Very high	7 Å²	7	58.6 Å²	58.6	4%	0.037	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-95.6	126.6	176.3	-56.3	-178.1	0	0	0	110.1	D137 F140 R181 H249 A293	D137-L295 HydrophobicContact CB-CD1 4.29Å; D137-L295 HydrophobicContact CB-CD2 4.14Å; D137-L295 HydrophobicContact CB-CG 4.25Å; F140-L295 HydrophobicContact CD2-CD2 3.92Å; F140-L295 HydrophobicContact CE2-CD2 3.66Å; R181-L295 HydrophobicContact CB-CD1 4.18Å; R181-L295 WeakPolarHBondContact O-CD1 3.18Å; H249-L295 HydrophobicContact CB-CB 4.02Å; H249-L295 HydrophobicContact CB-CD1 4.46Å; A293-L295 PolarHBondContact O-N 3.22Å
296	D	98.9	Very high	94.6	Very high	42 Å²	42	52.1 Å²	52.1	23%	0.225	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-70.6	125.6	166	-167.2	-41.6	0	0	0	109	P146 Y147 R148 H249 S298	P146-D296 HydrophobicContact CB-CB 4.23Å; Y147-D296 WeakPolarHBondContact O-CB 3.23Å; Y147-D296 PolarHBondContact O-N 3.17Å; R148-D296 HydrophobicContact CG-CB 4.15Å; H249-D296 WeakPolarHBondContact CB-O 3.35Å; H249-D296 PolarHBondContact ND1-O 3.35Å; D296-S298 WeakPolarHBondContact OD1-CB 3.27Å; D296-S298 PolarHBondContact OD1-N 3.3Å; D296-S298 PolarHBondContact OD1-OG 3.39Å
297	C	98.8	Very high	96	Very high	7 Å²	7	52.9 Å²	52.9	5%	0.047	28%	0.283	C	S	.	.			trans	-103.6	5.7	-177.3	-59.2	0	0	0	0	113.1	W250 S251 K299 L300 E301	W250-C297 HydrophobicContact CE3-CB 4.24Å; W250-C297 HydrophobicContact CZ3-CB 4.26Å; S251-C297 PolarHBondContact N-SG 3.18Å; C297-K299 PolarHBondContact O-N 3.43Å; C297-K299 VanDerWaalsContact O-N 3.07Å; C297-L300 PolarHBondContact O-N 3.32Å; C297-L300 VanDerWaalsContact O-N 3.09Å; C297-E301 HydrophobicContact CB-CG 4.36Å; C297-E301 WeakPolarHBondContact O-CG 3.48Å; C297-E301 PolarHBondContact O-N 3.46Å
298	S	98.8	Very high	97.2	Very high	57 Å²	57	56.3 Å²	56.3	40%	0.399	29%	0.293	S	S	.	.	H	α-helix	trans	-55.8	-32.1	-171.1	-60.5	0	0	0	0	112.9	D296 T302	D296-S298 WeakPolarHBondContact OD1-CB 3.27Å; D296-S298 PolarHBondContact OD1-N 3.3Å; D296-S298 PolarHBondContact OD1-OG 3.39Å; S298-T302 VanDerWaalsContact O-CB 3.25Å; S298-T302 WeakPolarHBondContact O-CB 3.46Å; S298-T302 PolarHBondContact O-N 3.39Å; S298-T302 PolarHBondContact O-OG1 3.06Å
299	K	98.8	Very high	97.8	Very high	82 Å²	82	51.4 Å²	51.4	36%	0.357	27%	0.272	S	S	.	.	H	α-helix	trans	-64.1	-46.8	178.9	-169.8	176.9	-176.8	178.8	0	112.3	E149 T247 F248 C297 L303	E149-K299 HydrophobicContact CG-CD 4.1Å; E149-K299 VanDerWaalsContact OE1-CB 3.23Å; E149-K299 WeakPolarHBondContact OE1-CB 3.23Å; T247-K299 PolarHBondContact O-NZ 3.38Å; F248-K299 HydrophobicContact CD1-CD 3.87Å; F248-K299 HydrophobicContact CD1-CG 4.12Å; F248-K299 HydrophobicContact CE1-CD 4.1Å; F248-K299 HydrophobicContact CE1-CG 4.28Å; C297-K299 PolarHBondContact O-N 3.43Å; C297-K299 VanDerWaalsContact O-N 3.07Å; K299-L303 WeakPolarHBondContact O-CG 3.29Å; K299-L303 PolarHBondContact O-N 3.48Å
300	L	98.8	Very high	98.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-73	-39.2	176.4	-75.6	-173.4	0	0	0	111.6	L180 V230 L234 F248 H249 W250 C297 T302 L303 G304 I305	L180-L300 HydrophobicContact CD1-CD1 3.94Å; V230-L300 HydrophobicContact CG1-CD1 3.66Å; L234-L300 HydrophobicContact CD1-CD2 4.04Å; F248-L300 HydrophobicContact CB-CD1 4.12Å; F248-L300 HydrophobicContact CB-CD2 4Å; F248-L300 HydrophobicContact CB-CG 4.01Å; F248-L300 HydrophobicContact CD1-CD2 3.42Å; F248-L300 VanDerWaalsContact CD1-CD2 3.42Å; F248-L300 HydrophobicContact CD1-CG 4.03Å; F248-L300 HydrophobicContact CE1-CD2 4.09Å; F248-L300 HydrophobicContact CG-CD2 3.85Å; F248-L300 HydrophobicContact CG-CG 4.36Å; H249-L300 WeakPolarHBondContact O-CD1 3.32Å; W250-L300 HydrophobicContact CB-CD1 4.14Å; W250-L300 HydrophobicContact CD2-CD1 4.5Å; W250-L300 HydrophobicContact CE3-CB 3.98Å; W250-L300 HydrophobicContact CE3-CD1 3.85Å; W250-L300 HydrophobicContact CZ3-CB 4.14Å; C297-L300 PolarHBondContact O-N 3.32Å; C297-L300 VanDerWaalsContact O-N 3.09Å; L300-T302 VanDerWaalsContact C-N 3.32Å; L300-T302 PolarHBondContact O-N 3.16Å; L300-L303 HydrophobicContact CD2-CD1 4.33Å; L300-L303 CarbonylContact O-C 3.58Å; L300-L303 WeakPolarHBondContact O-CA 3.47Å; L300-L303 WeakPolarHBondContact O-CB 3.48Å; L300-L303 PolarHBondContact O-N 3.45Å; L300-G304 PolarHBondContact O-N 2.83Å; L300-I305 CarbonylContact C-O 3.49Å; L300-I305 HydrophobicContact CB-CB 4.24Å; L300-I305 HydrophobicContact CB-CG2 4.39Å; L300-I305 HydrophobicContact CD1-CG2 4.28Å; L300-I305 HydrophobicContact CD2-CB 4.12Å; L300-I305 HydrophobicContact CD2-CD1 4.01Å; L300-I305 HydrophobicContact CD2-CG2 4.03Å; L300-I305 HydrophobicContact CG-CG2 4.49Å; L300-I305 PolarHBondContact O-N 2.81Å
301	E	98.6	Very high	98.5	Very high	86 Å²	86	50.6 Å²	50.6	40%	0.402	28%	0.277	S	S	.	.	H	α-helix	trans	-59.5	-43	176.5	-68.7	175.8	172.1	0	0	111.6	W250 C297 L303 G304 R308	W250-E301 HydrophobicContact CH2-CG 4.5Å; W250-E301 HydrophobicContact CZ3-CG 4.14Å; C297-E301 HydrophobicContact CB-CG 4.36Å; C297-E301 WeakPolarHBondContact O-CG 3.48Å; C297-E301 PolarHBondContact O-N 3.46Å; E301-L303 PolarHBondContact O-N 3.42Å; E301-G304 PolarHBondContact O-N 2.86Å; E301-R308 IonicContact OE1-CZ 2.81Å; E301-R308 IonicContact OE1-NH1 3.42Å; E301-R308 PolarHBondContact OE1-NH1 2.93Å; E301-R308 IonicContact OE1-NH2 4Å; E301-R308 PolarHBondContact OE1-NH2 3.2Å
302	T	98.6	Very high	98.6	Very high	124 Å²	124	48.4 Å²	48.4	76%	0.761	27%	0.269	S	S	*	.	H	α-helix	trans	-60.9	-32.1	174.2	-60.4	0	0	0	0	112.3	S298 L300 G304	S298-T302 VanDerWaalsContact O-CB 3.25Å; S298-T302 WeakPolarHBondContact O-CB 3.46Å; S298-T302 PolarHBondContact O-N 3.39Å; S298-T302 PolarHBondContact O-OG1 3.06Å; L300-T302 VanDerWaalsContact C-N 3.32Å; L300-T302 PolarHBondContact O-N 3.16Å; T302-G304 PolarHBondContact O-N 2.96Å
303	L	98	Very high	98.6	Very high	51 Å²	51	52.4 Å²	52.4	27%	0.267	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-2.9	176.5	-67.4	170.1	0	0	0	113.3	K237 I244 F248 K299 L300 E301 I305	K237-L303 HydrophobicContact CD-CB 4.43Å; K237-L303 PolarHBondContact NZ-O 2.92Å; I244-L303 HydrophobicContact CD1-CD1 4.43Å; I244-L303 HydrophobicContact CD1-CD2 4.38Å; F248-L303 HydrophobicContact CE1-CD1 3.81Å; K299-L303 WeakPolarHBondContact O-CG 3.29Å; K299-L303 PolarHBondContact O-N 3.48Å; L300-L303 HydrophobicContact CD2-CD1 4.33Å; L300-L303 CarbonylContact O-C 3.58Å; L300-L303 WeakPolarHBondContact O-CA 3.47Å; L300-L303 WeakPolarHBondContact O-CB 3.48Å; L300-L303 PolarHBondContact O-N 3.45Å; E301-L303 PolarHBondContact O-N 3.42Å; L303-I305 VanDerWaalsContact C-N 3.28Å; L303-I305 HydrophobicContact CB-CD1 4.13Å; L303-I305 HydrophobicContact CB-CG1 4.15Å; L303-I305 HydrophobicContact CD1-CD1 4.5Å
304	G	98.4	Very high	98.6	Very high	64 Å²	64	52.1 Å²	52.1	66%	0.66	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.2	21.7	-173	0	0	0	0	0	113.4	L300 E301 T302	L300-G304 PolarHBondContact O-N 2.83Å; E301-G304 PolarHBondContact O-N 2.86Å; T302-G304 PolarHBondContact O-N 2.96Å
305	I	98.7	Very high	98.5	Very high	7 Å²	7	49.3 Å²	49.3	4%	0.036	27%	0.274	C	S	.	.			trans	-100.3	130.1	179.2	-63.9	176.3	0	0	0	108.4	V230 Q233 L234 K237 W250 L300 L303	V230-I305 HydrophobicContact CB-CG2 4.33Å; V230-I305 HydrophobicContact CG1-CG2 3.93Å; V230-I305 HydrophobicContact CG2-CG2 4.2Å; Q233-I305 HydrophobicContact CB-CG1 4.21Å; Q233-I305 HydrophobicContact CB-CG2 3.97Å; L234-I305 HydrophobicContact CB-CD1 4.38Å; L234-I305 HydrophobicContact CD1-CD1 3.73Å; K237-I305 HydrophobicContact CD-CD1 3.83Å; K237-I305 HydrophobicContact CD-CG1 4.34Å; W250-I305 WeakPolarHBondContact CZ3-O 3.26Å; L300-I305 CarbonylContact C-O 3.49Å; L300-I305 HydrophobicContact CB-CB 4.24Å; L300-I305 HydrophobicContact CB-CG2 4.39Å; L300-I305 HydrophobicContact CD1-CG2 4.28Å; L300-I305 HydrophobicContact CD2-CB 4.12Å; L300-I305 HydrophobicContact CD2-CD1 4.01Å; L300-I305 HydrophobicContact CD2-CG2 4.03Å; L300-I305 HydrophobicContact CG-CG2 4.49Å; L300-I305 PolarHBondContact O-N 2.81Å; L303-I305 VanDerWaalsContact C-N 3.28Å; L303-I305 HydrophobicContact CB-CD1 4.13Å; L303-I305 HydrophobicContact CB-CG1 4.15Å; L303-I305 HydrophobicContact CD1-CD1 4.5Å
306	G	98.3	Very high	98.5	Very high	27 Å²	27	54.1 Å²	54.1	28%	0.278	30%	0.295	S	S	.	.			trans	155.9	154.2	178.7	0	0	0	0	0	115.9
307	Q	98.2	Very high	98.4	Very high	77 Å²	77	55.6 Å²	55.6	36%	0.36	30%	0.3	S	S	.	.			trans	-153.2	140	166.7	-171.6	177.5	-77.4	0	0	109.5	D226 T229 W250	D226-Q307 HydrophobicContact CB-CB 4.3Å; D226-Q307 VanDerWaalsContact CB-O 3.26Å; D226-Q307 WeakPolarHBondContact CB-O 3.48Å; D226-Q307 WeakPolarHBondContact OD1-CG 3.49Å; D226-Q307 PolarHBondContact OD1-NE2 3.48Å; T229-Q307 HydrophobicContact CG2-CB 4.08Å; T229-Q307 PolarHBondContact OG1-NE2 3Å; T229-Q307 PolarHBondContact OG1-OE1 3.17Å; T229-Q307 VanDerWaalsContact OG1-OE1 3.12Å; W250-Q307 WeakPolarHBondContact CZ2-O 3.4Å; W250-Q307 PolarHBondContact NE1-O 3.25Å
308	R	98.6	Very high	98.4	Very high	85 Å²	85	55.4 Å²	55.4	32%	0.321	30%	0.299	S	S	.	.			trans	-133.9	104.5	175.8	-67.2	-170.5	175.2	117.1	-2.3	110.8	W250 S251 N253 E301	W250-R308 HydrophobicContact CZ2-CG 3.96Å; S251-R308 PolarHBondContact O-NE 3.07Å; S251-R308 PolarHBondContact O-NH2 3.38Å; N253-R308 VanDerWaalsContact CG-CD 3.4Å; E301-R308 IonicContact OE1-CZ 2.81Å; E301-R308 IonicContact OE1-NH1 3.42Å; E301-R308 PolarHBondContact OE1-NH1 2.93Å; E301-R308 IonicContact OE1-NH2 4Å; E301-R308 PolarHBondContact OE1-NH2 3.2Å
309	T	98.7	Very high	98.3	Very high	31 Å²	31	52.7 Å²	52.7	19%	0.19	28%	0.28	C	S	.	.			trans	-78	123	171.1	-60.7	0	0	0	0	108.9	D226 F311	D226-T309 PolarHBondContact OD1-N 3.04Å; D226-T309 PolarHBondContact OD1-OG1 3.36Å; D226-T309 WeakPolarHBondContact OD2-CB 3.32Å; D226-T309 PolarHBondContact OD2-N 2.74Å; D226-T309 PolarHBondContact OD2-OG1 2.79Å; T309-F311 PolarHBondContact O-N 2.86Å
310	P	98.8	Very high	98.2	Very high	67 Å²	67	56.8 Å²	56.8	44%	0.435	29%	0.293	S	S	.	.			trans	-56	133	176.2	-26.1	35	0	0	0	111.7	R312 I313 G314	P310-R312 VanDerWaalsContact C-N 3.31Å; P310-R312 PolarHBondContact O-N 3.41Å; P310-I313 HydrophobicContact CB-CD1 4.08Å; P310-I313 HydrophobicContact CB-CG1 4.26Å; P310-I313 HydrophobicContact CG-CD1 3.97Å; P310-I313 WeakPolarHBondContact O-CB 3.41Å; P310-I313 PolarHBondContact O-N 3.47Å; P310-G314 PolarHBondContact O-N 3.32Å
311	F	98.8	Very high	98.1	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-53	-47.3	-170.4	177.7	-101.4	0	0	0	112.4	Y186 V197 P221 E254 M256 M261 A264 I265 T309 I313 G314 I315	Y186-F311 HydrophobicContact CD1-CD2 4.47Å; Y186-F311 HydrophobicContact CD1-CE2 4.39Å; Y186-F311 AromaticContact CE1-CD2 3.86Å; Y186-F311 HydrophobicContact CE1-CD2 3.86Å; Y186-F311 HydrophobicContact CE1-CE2 4.22Å; Y186-F311 HydrophobicContact CE2-CD2 4.24Å; Y186-F311 HydrophobicContact CE2-CE2 4.36Å; Y186-F311 AromaticContact CZ-CD2 3.74Å; Y186-F311 WeakPolarHBondContact OH-CA 3.32Å; V197-F311 HydrophobicContact CG1-CE2 3.89Å; V197-F311 HydrophobicContact CG1-CZ 3.93Å; P221-F311 HydrophobicContact CB-CD2 3.69Å; P221-F311 HydrophobicContact CB-CE2 3.65Å; P221-F311 HydrophobicContact CG-CD2 3.6Å; P221-F311 HydrophobicContact CG-CE2 3.84Å; P221-F311 HydrophobicContact CG-CG 4.35Å; E254-F311 WeakPolarHBondContact OE2-CB 3.47Å; E254-F311 PolarHBondContact OE2-N 2.94Å; M256-F311 HydrophobicContact CE-CB 4.23Å; M256-F311 HydrophobicContact CE-CD1 3.84Å; M256-F311 HydrophobicContact CE-CG 4.15Å; M256-F311 HydrophobicContact SD-CD1 3.89Å; M256-F311 HydrophobicContact SD-CE1 4.08Å; M256-F311 HydrophobicContact SD-CG 4.22Å; M261-F311 HydrophobicContact CB-CZ 4.14Å; M261-F311 HydrophobicContact CG-CE2 4.41Å; M261-F311 HydrophobicContact CG-CZ 4.05Å; A264-F311 HydrophobicContact CB-CD1 3.9Å; A264-F311 HydrophobicContact CB-CE1 3.73Å; I265-F311 HydrophobicContact CG1-CE1 4.31Å; I265-F311 HydrophobicContact CG1-CZ 4.24Å; T309-F311 PolarHBondContact O-N 2.86Å; F311-I313 PolarHBondContact O-N 2.92Å; F311-G314 PolarHBondContact O-N 2.94Å; F311-I315 HydrophobicContact CD1-CG2 4.2Å; F311-I315 HydrophobicContact CE1-CB 4.19Å; F311-I315 HydrophobicContact CE1-CG1 4.31Å; F311-I315 HydrophobicContact CE1-CG2 3.93Å; F311-I315 HydrophobicContact CE2-CB 4.18Å; F311-I315 HydrophobicContact CE2-CD1 4.34Å; F311-I315 HydrophobicContact CE2-CG1 4.22Å; F311-I315 HydrophobicContact CZ-CB 4Å; F311-I315 HydrophobicContact CZ-CD1 4.28Å; F311-I315 HydrophobicContact CZ-CG1 3.82Å; F311-I315 HydrophobicContact CZ-CG2 4.24Å; F311-I315 VanDerWaalsContact O-CB 3.27Å; F311-I315 WeakPolarHBondContact O-CB 3.36Å; F311-I315 WeakPolarHBondContact O-CG2 3.39Å; F311-I315 PolarHBondContact O-N 2.85Å
312	R	98.1	Very high	98	Very high	114 Å²	114	59.1 Å²	59.1	43%	0.43	31%	0.31	S	S	.	.	H	α-helix	trans	-59.6	-33.2	179.7	-70.9	176.7	177	-106.5	-6.6	113.2	D267 P310 K316	D267-R312 IonicContact OD2-CZ 3.79Å; D267-R312 IonicContact OD2-NH1 3.82Å; D267-R312 PolarHBondContact OD2-NH1 2.92Å; D267-R312 IonicContact OD2-NH2 2.74Å; D267-R312 PolarHBondContact OD2-NH2 3.16Å; P310-R312 VanDerWaalsContact C-N 3.31Å; P310-R312 PolarHBondContact O-N 3.41Å; R312-K316 VanDerWaalsContact O-CB 3.25Å; R312-K316 WeakPolarHBondContact O-CB 3.4Å; R312-K316 PolarHBondContact O-N 2.84Å
313	I	98.4	Very high	97.8	Very high	107 Å²	107	56.9 Å²	56.9	55%	0.549	29%	0.293	S	S	.	.	H	α-helix	trans	-74.6	-54.4	177.3	-61.7	177.2	0	0	0	109.2	P310 F311 I315 K316 E317	P310-I313 HydrophobicContact CB-CD1 4.08Å; P310-I313 HydrophobicContact CB-CG1 4.26Å; P310-I313 HydrophobicContact CG-CD1 3.97Å; P310-I313 WeakPolarHBondContact O-CB 3.41Å; P310-I313 PolarHBondContact O-N 3.47Å; F311-I313 PolarHBondContact O-N 2.92Å; I313-I315 VanDerWaalsContact C-N 3.34Å; I313-I315 PolarHBondContact O-N 3.46Å; I313-K316 PolarHBondContact O-N 3.47Å; I313-E317 PolarHBondContact O-N 3.32Å; I313-E317 VanDerWaalsContact O-N 3.09Å
314	G	98.4	Very high	97.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-41.2	-177.1	0	0	0	0	0	112.8	P310 F311 E317 S318	P310-G314 PolarHBondContact O-N 3.32Å; F311-G314 PolarHBondContact O-N 2.94Å; G314-E317 PolarHBondContact O-N 2.81Å; G314-S318 WeakPolarHBondContact O-CB 3.48Å; G314-S318 PolarHBondContact O-N 2.71Å; G314-S318 PolarHBondContact O-OG 2.81Å
315	I	98.4	Very high	96.9	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-72.9	-32.4	-176.7	-157.8	57.4	0	0	0	111.6	Y186 V197 T198 I265 A268 F311 I313 S318 L319	Y186-I315 HydrophobicContact CD2-CB 4.44Å; Y186-I315 HydrophobicContact CD2-CD1 3.6Å; Y186-I315 HydrophobicContact CE2-CB 4.13Å; Y186-I315 HydrophobicContact CE2-CD1 4.17Å; Y186-I315 HydrophobicContact CG-CD1 4.32Å; V197-I315 HydrophobicContact CG1-CD1 3.79Å; T198-I315 HydrophobicContact CG2-CD1 4.38Å; I265-I315 HydrophobicContact CD1-CG1 4.1Å; I265-I315 HydrophobicContact CG1-CG1 3.6Å; I265-I315 HydrophobicContact CG1-CG2 4.31Å; A268-I315 HydrophobicContact CB-CG2 4.32Å; F311-I315 HydrophobicContact CD1-CG2 4.2Å; F311-I315 HydrophobicContact CE1-CB 4.19Å; F311-I315 HydrophobicContact CE1-CG1 4.31Å; F311-I315 HydrophobicContact CE1-CG2 3.93Å; F311-I315 HydrophobicContact CE2-CB 4.18Å; F311-I315 HydrophobicContact CE2-CD1 4.34Å; F311-I315 HydrophobicContact CE2-CG1 4.22Å; F311-I315 HydrophobicContact CZ-CB 4Å; F311-I315 HydrophobicContact CZ-CD1 4.28Å; F311-I315 HydrophobicContact CZ-CG1 3.82Å; F311-I315 HydrophobicContact CZ-CG2 4.24Å; F311-I315 VanDerWaalsContact O-CB 3.27Å; F311-I315 WeakPolarHBondContact O-CB 3.36Å; F311-I315 WeakPolarHBondContact O-CG2 3.39Å; F311-I315 PolarHBondContact O-N 2.85Å; I313-I315 VanDerWaalsContact C-N 3.34Å; I313-I315 PolarHBondContact O-N 3.46Å; I315-S318 PolarHBondContact O-N 2.81Å; I315-L319 HydrophobicContact CD1-CD1 3.86Å; I315-L319 HydrophobicContact CD1-CG 4.15Å; I315-L319 HydrophobicContact CG1-CD1 3.74Å; I315-L319 HydrophobicContact CG1-CG 4.33Å; I315-L319 WeakPolarHBondContact O-CB 3.42Å; I315-L319 WeakPolarHBondContact O-CG 3.43Å; I315-L319 PolarHBondContact O-N 3.5Å
316	K	97.8	Very high	95.6	Very high	109 Å²	109	62.8 Å²	62.8	47%	0.474	30%	0.303	S	S	.	.	H	α-helix	trans	-66.5	-45.6	173.9	-173.8	172.3	-175	160.5	0	111.3	A268 F269 R312 I313 S318 L319 W320	A268-K316 HydrophobicContact CB-CB 4.43Å; A268-K316 PolarHBondContact O-NZ 3.18Å; F269-K316 HydrophobicContact CE1-CG 4.22Å; F269-K316 HydrophobicContact CZ-CB 4.39Å; F269-K316 HydrophobicContact CZ-CG 4.1Å; R312-K316 VanDerWaalsContact O-CB 3.25Å; R312-K316 WeakPolarHBondContact O-CB 3.4Å; R312-K316 PolarHBondContact O-N 2.84Å; I313-K316 PolarHBondContact O-N 3.47Å; K316-S318 PolarHBondContact O-N 2.73Å; K316-L319 PolarHBondContact O-N 2.73Å; K316-W320 WeakPolarHBondContact O-CB 3.43Å; K316-W320 PolarHBondContact O-N 2.73Å; K316-W320 VanDerWaalsContact O-N 3.12Å
317	E	97.1	Very high	94.6	Very high	73 Å²	73	71 Å²	71	34%	0.341	33%	0.326	S	S	.	.	H	α-helix	trans	-58.9	-38.1	173.4	-171.2	-173.5	180	0	0	111.5	K225 I313 G314 W320	K225-E317 IonicContact NZ-OE1 3.49Å; K225-E317 PolarHBondContact NZ-OE1 3.23Å; K225-E317 IonicContact NZ-OE2 2.7Å; K225-E317 PolarHBondContact NZ-OE2 3.37Å; I313-E317 PolarHBondContact O-N 3.32Å; I313-E317 VanDerWaalsContact O-N 3.09Å; G314-E317 PolarHBondContact O-N 2.81Å; E317-W320 PolarHBondContact O-NE1 3.31Å
318	S	97.6	Very high	93.1	Very high	2 Å²	2	76.5 Å²	76.5	1%	0.014	34%	0.344	C	S	.	.	H	α-helix	trans	-72.3	-37.7	-177.8	-59.9	0	0	0	0	113.8	G187 G314 I315 K316	G187-S318 WeakPolarHBondContact CA-OG 3.36Å; G187-S318 VanDerWaalsContact O-CB 3.3Å; G187-S318 WeakPolarHBondContact O-CB 3.42Å; G187-S318 PolarHBondContact O-OG 2.96Å; G314-S318 WeakPolarHBondContact O-CB 3.48Å; G314-S318 PolarHBondContact O-N 2.71Å; G314-S318 PolarHBondContact O-OG 2.81Å; I315-S318 PolarHBondContact O-N 2.81Å; K316-S318 PolarHBondContact O-N 2.73Å
319	L	98.1	Very high	91.7	Very high	0 Å²	0	77 Å²	77	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-105.1	-13.7	-166.9	-69.7	178.8	0	0	0	114.8	L192 T198 F201 I265 F269 I315 K316 P321 F322 L323	L192-L319 HydrophobicContact CD2-CD2 3.55Å; T198-L319 HydrophobicContact CG2-CD2 3.78Å; T198-L319 HydrophobicContact CG2-CG 4.44Å; F201-L319 HydrophobicContact CB-CD1 3.92Å; F201-L319 HydrophobicContact CB-CD2 4.02Å; F201-L319 HydrophobicContact CD1-CB 3.98Å; F201-L319 HydrophobicContact CD1-CD1 4.21Å; F201-L319 HydrophobicContact CD1-CD2 3.92Å; F201-L319 HydrophobicContact CD1-CG 4.27Å; F201-L319 HydrophobicContact CD2-CD1 3.82Å; F201-L319 HydrophobicContact CE1-CB 3.83Å; F201-L319 VanDerWaalsContact CE1-O 3.3Å; F201-L319 WeakPolarHBondContact CE1-O 3.43Å; F201-L319 HydrophobicContact CE2-CB 4.44Å; F201-L319 HydrophobicContact CE2-CD1 4.31Å; F201-L319 HydrophobicContact CG-CB 4.34Å; F201-L319 HydrophobicContact CG-CD1 3.74Å; F201-L319 HydrophobicContact CG-CD2 4.08Å; F201-L319 HydrophobicContact CG-CG 4.29Å; F201-L319 HydrophobicContact CZ-CB 4.07Å; I265-L319 HydrophobicContact CD1-CD1 4.18Å; I265-L319 HydrophobicContact CG1-CD1 4.21Å; I265-L319 HydrophobicContact CG2-CD1 3.91Å; F269-L319 HydrophobicContact CE2-CB 3.75Å; F269-L319 HydrophobicContact CE2-CD1 4.37Å; F269-L319 HydrophobicContact CZ-CB 3.65Å; I315-L319 HydrophobicContact CD1-CD1 3.86Å; I315-L319 HydrophobicContact CD1-CG 4.15Å; I315-L319 HydrophobicContact CG1-CD1 3.74Å; I315-L319 HydrophobicContact CG1-CG 4.33Å; I315-L319 WeakPolarHBondContact O-CB 3.42Å; I315-L319 WeakPolarHBondContact O-CG 3.43Å; I315-L319 PolarHBondContact O-N 3.5Å; K316-L319 PolarHBondContact O-N 2.73Å; L319-P321 VanDerWaalsContact C-N 3.28Å; L319-P321 VanDerWaalsContact O-N 3.15Å; L319-F322 PolarHBondContact O-N 2.79Å; L319-L323 PolarHBondContact O-N 3.37Å
320	W	96.2	Very high	89.8	Confident	168 Å²	168	83.4 Å²	83.4	64%	0.636	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-54.3	-33.9	-177.8	80.1	-93.5	0	0	0	114.9	F269 K316 E317 F322 L323	F269-W320 HydrophobicContact CE1-CB 4.08Å; F269-W320 HydrophobicContact CZ-CB 4.43Å; K316-W320 WeakPolarHBondContact O-CB 3.43Å; K316-W320 PolarHBondContact O-N 2.73Å; K316-W320 VanDerWaalsContact O-N 3.12Å; E317-W320 PolarHBondContact O-NE1 3.31Å; W320-F322 PolarHBondContact O-N 2.87Å; W320-L323 WeakPolarHBondContact O-CB 3.49Å; W320-L323 PolarHBondContact O-N 3.28Å
321	P	96.7	Very high	88.3	Confident	77 Å²	77	85.1 Å²	85.1	50%	0.5	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-68.2	-20	177.6	-19.1	34	0	0	0	113.4	L319	L319-P321 VanDerWaalsContact C-N 3.28Å; L319-P321 VanDerWaalsContact O-N 3.15Å
322	F	96.2	Very high	87.1	Confident	59 Å²	59	87.6 Å²	87.6	26%	0.259	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-96.3	0.2	-177.8	-60.9	-86.7	0	0	0	112.8	V189 L192 F201 Q205 L319 W320 I324	V189-F322 HydrophobicContact CG2-CD2 4.49Å; V189-F322 HydrophobicContact CG2-CE2 3.68Å; V189-F322 HydrophobicContact CG2-CZ 3.92Å; V189-F322 WeakPolarHBondContact O-CZ 3.32Å; L192-F322 HydrophobicContact CD2-CB 3.94Å; L192-F322 HydrophobicContact CD2-CD1 3.9Å; L192-F322 HydrophobicContact CD2-CD2 4Å; L192-F322 HydrophobicContact CD2-CE1 4.42Å; L192-F322 HydrophobicContact CD2-CG 3.67Å; L192-F322 HydrophobicContact CG-CD1 3.94Å; L192-F322 HydrophobicContact CG-CE1 4.39Å; L192-F322 HydrophobicContact CG-CG 4.21Å; F201-F322 HydrophobicContact CD1-CB 3.88Å; F201-F322 HydrophobicContact CE1-CB 3.92Å; Q205-F322 PolarHBondContact NE2-O 2.59Å; L319-F322 PolarHBondContact O-N 2.79Å; W320-F322 PolarHBondContact O-N 2.87Å; F322-I324 PolarHBondContact O-N 2.84Å
323	L	95.2	Very high	85.7	Confident	77 Å²	77	84.2 Å²	84.2	40%	0.403	39%	0.386	S	S	.	.			trans	-70.3	119.8	178.6	-176.5	69.6	0	0	0	109.7	F201 F269 L271 L319 W320 D325	F201-L323 HydrophobicContact CE1-CB 4.39Å; F201-L323 HydrophobicContact CZ-CB 4.24Å; F201-L323 HydrophobicContact CZ-CD1 3.89Å; F269-L323 HydrophobicContact CD1-CD1 4.2Å; F269-L323 HydrophobicContact CD1-CD2 4.1Å; L271-L323 HydrophobicContact CD1-CD1 4.18Å; L319-L323 PolarHBondContact O-N 3.37Å; W320-L323 WeakPolarHBondContact O-CB 3.49Å; W320-L323 PolarHBondContact O-N 3.28Å; L323-D325 PolarHBondContact O-N 3.12Å
324	I	90.6	Very high	83.7	Confident	47 Å²	47	89.1 Å²	89.1	24%	0.241	41%	0.406	C	S	.	.			trans	-73.6	111	-179.2	-61.5	169.1	0	0	0	109.1	F206 F322 K326 V332 F333	F206-I324 HydrophobicContact CE2-CD1 4.17Å; F206-I324 HydrophobicContact CZ-CD1 4.39Å; F322-I324 PolarHBondContact O-N 2.84Å; I324-K326 PolarHBondContact O-N 2.99Å; I324-V332 HydrophobicContact CG2-CG1 3.9Å; I324-V332 HydrophobicContact CG2-CG2 4.09Å; I324-F333 HydrophobicContact CB-CE1 4.42Å; I324-F333 HydrophobicContact CB-CZ 4.01Å; I324-F333 HydrophobicContact CD1-CE1 3.89Å; I324-F333 HydrophobicContact CD1-CZ 4.33Å; I324-F333 HydrophobicContact CG2-CE1 4.28Å; I324-F333 HydrophobicContact CG2-CE2 4.27Å; I324-F333 HydrophobicContact CG2-CZ 3.67Å
325	D	85.8	Confident	83	Confident	76 Å²	76	93.6 Å²	93.6	41%	0.406	43%	0.426	S	S	.	.			trans	-80.8	115.9	167.9	-170.3	-8.1	0	0	0	109.9	L323 R327 R329	L323-D325 PolarHBondContact O-N 3.12Å; D325-R327 VanDerWaalsContact C-N 3.34Å; D325-R327 PolarHBondContact O-N 3.24Å; D325-R327 WeakPolarHBondContact OD1-CG 3.11Å; D325-R327 PolarHBondContact OD1-N 3.24Å; D325-R327 WeakPolarHBondContact OD2-CG 3.38Å; D325-R327 IonicContact OD2-CZ 2.72Å; D325-R327 IonicContact OD2-NE 3.28Å; D325-R327 PolarHBondContact OD2-NE 3.43Å; D325-R327 IonicContact OD2-NH2 3.49Å; D325-R327 PolarHBondContact OD2-NH2 3.03Å; D325-R329 PolarHBondContact O-NH1 2.7Å
326	K	71.9	Confident	82.2	Confident	123 Å²	123	98.5 Å²	98.5	54%	0.535	45%	0.449	S	S	.	.			trans	-64.1	-35.1	-172.6	-164.9	173.6	-178.9	176.7	0	112.6	I324 W328 R329 F333	I324-K326 PolarHBondContact O-N 2.99Å; K326-W328 PolarHBondContact O-N 3.2Å; K326-W328 VanDerWaalsContact O-N 3.13Å; K326-R329 WeakPolarHBondContact O-CA 3.39Å; K326-R329 WeakPolarHBondContact O-CB 3.32Å; K326-R329 PolarHBondContact O-N 2.92Å; K326-F333 HydrophobicContact CB-CE2 4.43Å; K326-F333 HydrophobicContact CD-CE2 4.25Å; K326-F333 HydrophobicContact CG-CE2 4.14Å
327	R	76.8	Confident	81.3	Confident	198 Å²	198	97.9 Å²	97.9	75%	0.747	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	15.7	-107.8	-173.1	-63.9	-170.5	-172	-169.3	1.2	114.3	D325	D325-R327 VanDerWaalsContact C-N 3.34Å; D325-R327 PolarHBondContact O-N 3.24Å; D325-R327 WeakPolarHBondContact OD1-CG 3.11Å; D325-R327 PolarHBondContact OD1-N 3.24Å; D325-R327 WeakPolarHBondContact OD2-CG 3.38Å; D325-R327 IonicContact OD2-CZ 2.72Å; D325-R327 IonicContact OD2-NE 3.28Å; D325-R327 PolarHBondContact OD2-NE 3.43Å; D325-R327 IonicContact OD2-NH2 3.49Å; D325-R327 PolarHBondContact OD2-NH2 3.03Å
328	W	67	Low	80.4	Confident	194 Å²	194	99.4 Å²	99.4	74%	0.735	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-2.9	-177.6	55	-94.7	0	0	0	113.6	K326 Q330	K326-W328 PolarHBondContact O-N 3.2Å; K326-W328 VanDerWaalsContact O-N 3.13Å; W328-Q330 VanDerWaalsContact C-N 3.29Å; W328-Q330 PolarHBondContact O-N 3.13Å
329	R	68.9	Low	79.3	Confident	96 Å²	96	105.4 Å²	105.4	36%	0.362	48%	0.481	S	S	.	.			trans	-87.6	63.1	-172.8	-48.8	175.8	178	104.1	-2.1	110.9	D325 K326 T331 V332	D325-R329 PolarHBondContact O-NH1 2.7Å; K326-R329 WeakPolarHBondContact O-CA 3.39Å; K326-R329 WeakPolarHBondContact O-CB 3.32Å; K326-R329 PolarHBondContact O-N 2.92Å; R329-T331 PolarHBondContact O-N 3.4Å; R329-T331 VanDerWaalsContact O-N 3.1Å; R329-V332 HydrophobicContact CB-CB 3.83Å; R329-V332 HydrophobicContact CB-CG1 4.05Å; R329-V332 WeakPolarHBondContact O-CG1 3.36Å; R329-V332 PolarHBondContact O-N 3.13Å; R329-V332 VanDerWaalsContact O-N 3.14Å
330	Q	59.7	Low	78	Confident	164 Å²	164	112.5 Å²	112.5	77%	0.766	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-28.7	-174.4	-68.8	167.6	3.1	0	0	113.2	W328	W328-Q330 VanDerWaalsContact C-N 3.29Å; W328-Q330 PolarHBondContact O-N 3.13Å
331	T	65.8	Low	76.7	Confident	104 Å²	104	108.5 Å²	108.5	64%	0.638	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	12.8	-179	58.7	0	0	0	0	114.7	R329 F333 H334	R329-T331 PolarHBondContact O-N 3.4Å; R329-T331 VanDerWaalsContact O-N 3.1Å; T331-F333 PolarHBondContact O-N 2.99Å; T331-H334 WeakPolarHBondContact O-CB 3.35Å; T331-H334 PolarHBondContact O-N 3.36Å
332	V	73.4	Confident	75.2	Confident	51 Å²	51	110.9 Å²	110.9	31%	0.309	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-23.8	-179.1	71.6	0	0	0	0	113.5	I324 R329	I324-V332 HydrophobicContact CG2-CG1 3.9Å; I324-V332 HydrophobicContact CG2-CG2 4.09Å; R329-V332 HydrophobicContact CB-CB 3.83Å; R329-V332 HydrophobicContact CB-CG1 4.05Å; R329-V332 WeakPolarHBondContact O-CG1 3.36Å; R329-V332 PolarHBondContact O-N 3.13Å; R329-V332 VanDerWaalsContact O-N 3.14Å
333	F	70	Confident	73.5	Confident	43 Å²	43	115.3 Å²	115.3	19%	0.189	53%	0.525	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	7.4	179.3	-60.6	-69.9	0	0	0	113.2	F206 N208 I324 K326 T331	F206-F333 HydrophobicContact CD1-CB 4.24Å; F206-F333 AromaticContact CD1-CD1 3.62Å; F206-F333 HydrophobicContact CD1-CD1 3.62Å; F206-F333 HydrophobicContact CD1-CG 4.43Å; F206-F333 HydrophobicContact CE1-CB 4.35Å; F206-F333 AromaticContact CE1-CD1 3.72Å; F206-F333 HydrophobicContact CE1-CD1 3.72Å; F206-F333 HydrophobicContact CE1-CG 4.48Å; F206-F333 HydrophobicContact CG-CD1 4.05Å; F206-F333 HydrophobicContact CZ-CD1 4.19Å; N208-F333 PolarHBondContact ND2-O 2.86Å; I324-F333 HydrophobicContact CB-CE1 4.42Å; I324-F333 HydrophobicContact CB-CZ 4.01Å; I324-F333 HydrophobicContact CD1-CE1 3.89Å; I324-F333 HydrophobicContact CD1-CZ 4.33Å; I324-F333 HydrophobicContact CG2-CE1 4.28Å; I324-F333 HydrophobicContact CG2-CE2 4.27Å; I324-F333 HydrophobicContact CG2-CZ 3.67Å; K326-F333 HydrophobicContact CB-CE2 4.43Å; K326-F333 HydrophobicContact CD-CE2 4.25Å; K326-F333 HydrophobicContact CG-CE2 4.14Å; T331-F333 PolarHBondContact O-N 2.99Å
334	H	56.3	Low	71.5	Confident	210 Å²	210	118.7 Å²	118.7	97%	0.972	54%	0.536	S	S	*	.			trans	-82.1	0	-171.1	-120.9	-60.2	0	0	0	114.5	T331	T331-H334 WeakPolarHBondContact O-CB 3.35Å; T331-H334 PolarHBondContact O-N 3.36Å

Retrieved 334 of 334 residues in 625.8 ms (Link to these results)

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