A0A077ZG12_TRITR Loading...

PA domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZG12, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 181 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.1	Very low	41.5	Very low	242 Å²	242	167.7 Å²	167.7	100%	1.192	84%	0.841	S	S	*	*				0	128.3	0	-76.6	169	170.1	0	0	107.4
2	E	42.5	Very low	40.9	Very low	183 Å²	183	169.3 Å²	169.3	86%	0.855	84%	0.839	S	S	*	*			trans	-70.5	134.9	-134.6	-71.9	136.1	127.3	0	0	116.6	V4	E2-V4 PolarHBondContact O-N 3.43Å
3	R	39.3	Very low	40.3	Very low	249 Å²	249	160.5 Å²	160.5	94%	0.94	82%	0.818	S	S	*	*			trans	-78.8	104.2	157.8	-91.8	-168.8	-99.3	-132.3	-2.4	107.9	Q5	R3-Q5 PolarHBondContact O-N 3.25Å
4	V	47.1	Very low	39.6	Very low	136 Å²	136	157.8 Å²	157.8	82%	0.824	82%	0.821	S	S	*	*			trans	-69.6	111.4	169.5	178.8	0	0	0	0	108.5	E2 S6	E2-V4 PolarHBondContact O-N 3.43Å; V4-S6 PolarHBondContact O-N 3.39Å
5	Q	42.8	Very low	39.7	Very low	186 Å²	186	156.8 Å²	156.8	87%	0.869	82%	0.815	S	S	*	*			trans	-69.6	114.9	167.7	-97.8	162.4	-27.3	0	0	109.2	R3	R3-Q5 PolarHBondContact O-N 3.25Å
6	S	41.9	Very low	39.3	Very low	105 Å²	105	152.3 Å²	152.3	73%	0.734	81%	0.807	S	S	*	*			trans	-81.1	134.6	166.5	-176.7	0	0	0	0	109.7	V4	V4-S6 PolarHBondContact O-N 3.39Å
7	P	42.6	Very low	39	Very low	110 Å²	110	148.9 Å²	148.9	71%	0.714	79%	0.79	S	S	*	*			trans	-71.3	137.9	-173.7	28.8	-32.9	0	0	0	111.6	C9	P7-C9 PolarHBondContact O-N 3.48Å; P7-C9 VanDerWaalsContact O-N 3.17Å
8	R	37.7	Very low	38.6	Very low	225 Å²	225	147.2 Å²	147.2	85%	0.849	79%	0.792	S	S	*	*			trans	-66.5	106.8	171.9	-68.7	179.4	-175.5	-173.9	1	109.8	F10	R8-F10 PolarHBondContact O-N 3.38Å
9	C	42.5	Very low	38.6	Very low	109 Å²	109	147.3 Å²	147.3	74%	0.736	79%	0.792	S	S	*	*			trans	-83.7	97.7	158.3	-73.7	0	0	0	0	109	P7 V11	P7-C9 PolarHBondContact O-N 3.48Å; P7-C9 VanDerWaalsContact O-N 3.17Å; C9-V11 PolarHBondContact O-N 3.17Å
10	F	34.1	Very low	38.6	Very low	166 Å²	166	143.6 Å²	143.6	73%	0.728	79%	0.79	S	S	*	*			trans	-85.9	98.5	168.8	-121.7	-91.8	0	0	0	108	R8 K12	R8-F10 PolarHBondContact O-N 3.38Å; F10-K12 HydrophobicContact CD1-CG 4.31Å
11	V	44.2	Very low	39.4	Very low	134 Å²	134	139.9 Å²	139.9	81%	0.812	77%	0.769	S	S	*	*			trans	-91	104.3	164.1	-175.8	0	0	0	0	107.1	C9	C9-V11 PolarHBondContact O-N 3.17Å
12	K	34.3	Very low	40.2	Very low	186 Å²	186	130 Å²	130	81%	0.809	72%	0.723	S	S	*	*			trans	-81.9	141.7	164.3	-80.5	-176.8	173.6	179.9	0	108.7	F10	F10-K12 HydrophobicContact CD1-CG 4.31Å
13	G	32.9	Very low	42	Very low	55 Å²	55	125.2 Å²	125.2	57%	0.567	70%	0.699	S	S	*	*			trans	117.6	96.6	164.5	0	0	0	0	0	111.1
14	S	30.7	Very low	44.3	Very low	123 Å²	123	116 Å²	116	86%	0.86	67%	0.668	S	S	*	*				42.9	85.4	81	-65.2	0	0	0	0	112	A16	S14-A16 VanDerWaalsContact C-N 3.26Å; S14-A16 PolarHBondContact O-N 2.67Å
15	I	40.8	Very low	46.3	Very low	143 Å²	143	111.4 Å²	111.4	73%	0.733	64%	0.637	S	S	*	*			trans	-85.7	81.7	156.5	-55.6	176	0	0	0	106.2	N17	I15-N17 HydrophobicContact CG2-CB 3.81Å
16	A	32.7	Very low	48.6	Very low	84 Å²	84	104 Å²	104	69%	0.694	60%	0.602	S	S	*	*			trans	-86	95	144.5	0	0	0	0	0	104.1	S14 S18	S14-A16 VanDerWaalsContact C-N 3.26Å; S14-A16 PolarHBondContact O-N 2.67Å; A16-S18 VanDerWaalsContact C-N 3.28Å; A16-S18 PolarHBondContact O-N 3.01Å
17	N	35.5	Very low	51	Low	96 Å²	96	99 Å²	99	51%	0.513	57%	0.567	S	S	.	*			trans	-79.2	89.9	175	-124.5	3.6	0	0	0	107.4	I15 D19	I15-N17 HydrophobicContact CG2-CB 3.81Å; N17-D19 PolarHBondContact O-N 3.25Å
18	S	31.3	Very low	53.4	Low	117 Å²	117	96.8 Å²	96.8	82%	0.818	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	73.6	166.9	54.7	0	0	0	0	109.7	A16	A16-S18 VanDerWaalsContact C-N 3.28Å; A16-S18 PolarHBondContact O-N 3.01Å
19	D	38.3	Very low	56.1	Low	150 Å²	150	86.1 Å²	86.1	80%	0.802	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-170.2	110.3	153	-148.4	6.8	0	0	0	108.9	N17 D21	N17-D19 PolarHBondContact O-N 3.25Å; D19-D21 PolarHBondContact O-N 3.08Å
20	G	39.8	Very low	58.5	Low	73 Å²	73	83 Å²	83	75%	0.753	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	1	179.2	0	0	0	0	0	117.6	V22	G20-V22 PolarHBondContact O-N 3.23Å
21	D	53.8	Low	61.3	Low	65 Å²	65	78.7 Å²	78.7	35%	0.348	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	25.8	66.1	177.9	-149.4	19.4	0	0	0	115.5	D19 K23	D19-D21 PolarHBondContact O-N 3.08Å; D21-K23 WeakPolarHBondContact O-CG 3.16Å; D21-K23 PolarHBondContact O-N 2.87Å; D21-K23 VanDerWaalsContact O-N 3.13Å; D21-K23 IonicContact OD2-NZ 2.88Å; D21-K23 PolarHBondContact OD2-NZ 3.34Å
22	V	60.2	Low	63.6	Low	36 Å²	36	72.8 Å²	72.8	22%	0.218	43%	0.43	C	S	.	.			trans	-60.1	108.8	160	177.8	0	0	0	0	107.7	G20 R42	G20-V22 PolarHBondContact O-N 3.23Å; V22-R42 HydrophobicContact CG1-CG 3.63Å
23	K	80.5	Confident	66.2	Low	81 Å²	81	71.6 Å²	71.6	35%	0.352	42%	0.424	S	S	.	.			trans	-91.6	108.8	-176.2	-61.9	-176.3	-172.8	-74.4	0	110	D21 F25 M43	D21-K23 WeakPolarHBondContact O-CG 3.16Å; D21-K23 PolarHBondContact O-N 2.87Å; D21-K23 VanDerWaalsContact O-N 3.13Å; D21-K23 IonicContact OD2-NZ 2.88Å; D21-K23 PolarHBondContact OD2-NZ 3.34Å; K23-F25 HydrophobicContact CB-CD2 4.23Å; K23-F25 HydrophobicContact CB-CE2 3.5Å; K23-F25 HydrophobicContact CB-CZ 4.26Å; K23-F25 HydrophobicContact CD-CE2 4.48Å; K23-F25 VanDerWaalsContact O-CD2 3.28Å; K23-F25 WeakPolarHBondContact O-CD2 3.21Å; K23-M43 WeakPolarHBondContact O-CB 3.33Å; K23-M43 PolarHBondContact O-N 2.99Å; K23-M43 VanDerWaalsContact O-N 3.16Å
24	D	87	Confident	68.7	Low	55 Å²	55	74 Å²	74	29%	0.294	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	139.7	167.6	-67.6	-18.2	0	0	0	109.9	Q40 I41 R42	D24-Q40 HydrophobicContact CB-CG 4.45Å; D24-Q40 PolarHBondContact OD2-NE2 3.28Å; D24-I41 CarbonylContact C-O 3.59Å; D24-I41 WeakPolarHBondContact CA-O 3.33Å; D24-R42 IonicContact OD1-CZ 2.83Å; D24-R42 IonicContact OD1-NE 3.36Å; D24-R42 PolarHBondContact OD1-NE 3.32Å; D24-R42 IonicContact OD1-NH2 3.36Å; D24-R42 PolarHBondContact OD1-NH2 3.16Å; D24-R42 IonicContact OD2-NH2 3.68Å; D24-R42 PolarHBondContact OD2-NH2 2.81Å
25	F	89.9	Confident	71.4	Confident	41 Å²	41	68.8 Å²	68.8	18%	0.18	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	172.1	177.8	-72.1	-98.9	0	0	0	108.8	K23 I41 M43 P50 F136 P162	K23-F25 HydrophobicContact CB-CD2 4.23Å; K23-F25 HydrophobicContact CB-CE2 3.5Å; K23-F25 HydrophobicContact CB-CZ 4.26Å; K23-F25 HydrophobicContact CD-CE2 4.48Å; K23-F25 VanDerWaalsContact O-CD2 3.28Å; K23-F25 WeakPolarHBondContact O-CD2 3.21Å; F25-I41 HydrophobicContact CB-CD1 4.14Å; F25-I41 HydrophobicContact CB-CG1 3.87Å; F25-I41 PolarHBondContact N-O 3.3Å; F25-I41 WeakPolarHBondContact O-CG1 3.27Å; F25-I41 PolarHBondContact O-N 2.74Å; F25-I41 VanDerWaalsContact O-O 3.07Å; F25-M43 HydrophobicContact CD2-CB 4.14Å; F25-M43 HydrophobicContact CD2-CE 4.11Å; F25-M43 HydrophobicContact CE1-CE 4.44Å; F25-M43 HydrophobicContact CE2-CB 3.97Å; F25-M43 HydrophobicContact CE2-CE 3.23Å; F25-M43 HydrophobicContact CE2-SD 4.08Å; F25-M43 HydrophobicContact CZ-CE 3.44Å; F25-M43 VanDerWaalsContact CZ-CE 3.44Å; F25-P50 HydrophobicContact CD1-CG 4.21Å; F25-P50 HydrophobicContact CE1-CG 3.64Å; F25-P50 HydrophobicContact CZ-CG 3.99Å; F25-F136 HydrophobicContact CB-CD1 4.37Å; F25-F136 HydrophobicContact CB-CE1 3.98Å; F25-F136 HydrophobicContact CD1-CE1 4.46Å; F25-F136 HydrophobicContact CD2-CD1 4.2Å; F25-F136 AromaticContact CD2-CE1 3.59Å; F25-F136 HydrophobicContact CD2-CE1 3.59Å; F25-F136 HydrophobicContact CE2-CE1 4.15Å; F25-F136 HydrophobicContact CG-CD1 4.5Å; F25-F136 AromaticContact CG-CE1 3.77Å; F25-F136 HydrophobicContact CG-CE1 3.77Å; F25-P162 HydrophobicContact CD1-CB 3.73Å; F25-P162 HydrophobicContact CE1-CB 4.37Å
26	F	90.6	Very high	73.6	Confident	30 Å²	30	62.2 Å²	62.2	13%	0.132	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	151.3	176.2	-59.1	-94.5	0	0	0	109.9	F39 Q40 L163 L165 L170 W181	F26-F39 VanDerWaalsContact CA-O 3.23Å; F26-F39 WeakPolarHBondContact CA-O 3.28Å; F26-Q40 HydrophobicContact CD1-CB 3.87Å; F26-Q40 HydrophobicContact CD1-CG 4.19Å; F26-Q40 HydrophobicContact CE1-CB 3.53Å; F26-Q40 HydrophobicContact CE1-CG 3.57Å; F26-Q40 HydrophobicContact CZ-CB 4.36Å; F26-Q40 HydrophobicContact CZ-CG 3.9Å; F26-L163 HydrophobicContact CB-CB 4.17Å; F26-L163 HydrophobicContact CB-CD1 3.91Å; F26-L163 HydrophobicContact CB-CG 4.39Å; F26-L163 PolarHBondContact O-N 2.95Å; F26-L165 HydrophobicContact CB-CD1 3.75Å; F26-L165 HydrophobicContact CB-CG 4.34Å; F26-L165 HydrophobicContact CD1-CD1 4.05Å; F26-L165 HydrophobicContact CD2-CD1 3.37Å; F26-L165 HydrophobicContact CD2-CG 4.17Å; F26-L165 HydrophobicContact CE2-CD1 3.94Å; F26-L165 HydrophobicContact CG-CD1 3.42Å; F26-L165 VanDerWaalsContact CG-CD1 3.42Å; F26-L165 HydrophobicContact CG-CG 4.39Å; F26-L165 HydrophobicContact CZ-CD1 4.5Å; F26-L170 HydrophobicContact CZ-CD2 4.45Å; F26-W181 AromaticContact CE1-CH2 3.84Å; F26-W181 HydrophobicContact CE1-CH2 3.84Å
27	F	92.9	Very high	76.4	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	156.9	163	73.8	-92.4	0	0	0	109.6	V29 S38 F39 I41 L108 L138 L146 I159 K160 I161	F27-V29 HydrophobicContact CE2-CG2 4.05Å; F27-S38 CarbonylContact O-C 3.49Å; F27-S38 WeakPolarHBondContact O-CA 3.34Å; F27-F39 HydrophobicContact CD1-CB 3.89Å; F27-F39 HydrophobicContact CD2-CB 4.44Å; F27-F39 HydrophobicContact CD2-CD2 4.17Å; F27-F39 HydrophobicContact CE1-CB 3.39Å; F27-F39 HydrophobicContact CE1-CD2 4.46Å; F27-F39 HydrophobicContact CE1-CG 4.09Å; F27-F39 HydrophobicContact CE2-CB 3.98Å; F27-F39 AromaticContact CE2-CD2 3.47Å; F27-F39 HydrophobicContact CE2-CD2 3.47Å; F27-F39 VanDerWaalsContact CE2-CD2 3.47Å; F27-F39 HydrophobicContact CE2-CE2 4.26Å; F27-F39 AromaticContact CE2-CG 3.91Å; F27-F39 HydrophobicContact CE2-CG 3.91Å; F27-F39 HydrophobicContact CG-CB 4.41Å; F27-F39 HydrophobicContact CZ-CB 3.43Å; F27-F39 VanDerWaalsContact CZ-CB 3.43Å; F27-F39 HydrophobicContact CZ-CD1 4.42Å; F27-F39 AromaticContact CZ-CD2 3.66Å; F27-F39 HydrophobicContact CZ-CD2 3.66Å; F27-F39 AromaticContact CZ-CG 3.58Å; F27-F39 HydrophobicContact CZ-CG 3.58Å; F27-F39 PolarHBondContact N-O 3.21Å; F27-F39 PolarHBondContact O-N 3.42Å; F27-I41 HydrophobicContact CD1-CD1 4.02Å; F27-I41 HydrophobicContact CD1-CG1 4.36Å; F27-I41 HydrophobicContact CD1-CG2 3.7Å; F27-I41 HydrophobicContact CE1-CG2 3.59Å; F27-L108 HydrophobicContact CE1-CD1 3.9Å; F27-L108 HydrophobicContact CZ-CD1 4.19Å; F27-L138 HydrophobicContact CE1-CD1 4.11Å; F27-L146 HydrophobicContact CE2-CD1 4.46Å; F27-L146 HydrophobicContact CZ-CD1 3.81Å; F27-I159 HydrophobicContact CB-CD1 4.43Å; F27-I159 HydrophobicContact CD2-CB 3.93Å; F27-I159 HydrophobicContact CD2-CD1 3.87Å; F27-I159 HydrophobicContact CD2-CG2 3.94Å; F27-I159 HydrophobicContact CE2-CB 4.5Å; F27-I159 HydrophobicContact CE2-CD1 4.32Å; F27-I159 HydrophobicContact CE2-CG2 4.01Å; F27-I159 HydrophobicContact CG-CD1 4.17Å; F27-K160 VanDerWaalsContact CA-O 3.23Å; F27-K160 WeakPolarHBondContact CA-O 3.34Å; F27-K160 WeakPolarHBondContact CB-O 3.41Å; F27-I161 HydrophobicContact CB-CB 3.86Å; F27-I161 HydrophobicContact CB-CD1 4.1Å; F27-I161 HydrophobicContact CB-CG1 4Å
28	E	92	Very high	79	Confident	63 Å²	63	56.3 Å²	56.3	29%	0.294	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	136.9	175.5	-178.8	179.2	-159.4	0	0	109.3	L30 Y37 I159 K160 L163	E28-L30 HydrophobicContact CG-CD2 4.28Å; E28-Y37 WeakPolarHBondContact CA-O 3.5Å; E28-I159 CarbonylContact O-C 3.46Å; E28-I159 WeakPolarHBondContact O-CA 3.45Å; E28-I159 WeakPolarHBondContact O-CB 3.45Å; E28-K160 PolarHBondContact N-O 2.7Å; E28-K160 VanDerWaalsContact N-O 3.1Å; E28-K160 PolarHBondContact O-N 2.85Å; E28-L163 HydrophobicContact CB-CD1 3.82Å; E28-L163 HydrophobicContact CB-CD2 3.89Å; E28-L163 HydrophobicContact CB-CG 4.28Å
29	V	93.7	Very high	81.9	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.012	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	120	165.8	175.6	0	0	0	0	108.2	F27 E31 L35 G36 Y37 F39 L146 V157 I159	F27-V29 HydrophobicContact CE2-CG2 4.05Å; V29-E31 WeakPolarHBondContact CG1-O 3.24Å; V29-L35 VanDerWaalsContact CB-O 3.23Å; V29-L35 WeakPolarHBondContact CB-O 3.22Å; V29-L35 HydrophobicContact CG1-CB 3.99Å; V29-L35 HydrophobicContact CG1-CD2 4.22Å; V29-L35 HydrophobicContact CG1-CG 4.05Å; V29-L35 WeakPolarHBondContact CG1-O 3.15Å; V29-L35 HydrophobicContact CG2-CD2 4.48Å; V29-L35 HydrophobicContact CG2-CG 4.27Å; V29-G36 VanDerWaalsContact O-CA 3.28Å; V29-G36 WeakPolarHBondContact O-CA 3Å; V29-Y37 PolarHBondContact N-O 2.75Å; V29-F39 HydrophobicContact CB-CE2 4.48Å; V29-F39 HydrophobicContact CG2-CD2 4.1Å; V29-F39 HydrophobicContact CG2-CE2 3.57Å; V29-L146 HydrophobicContact CG2-CD2 4.49Å; V29-V157 HydrophobicContact CG1-CG1 3.99Å; V29-V157 HydrophobicContact CG2-CG1 4.3Å; V29-I159 HydrophobicContact CG2-CG2 3.96Å
30	L	93.1	Very high	84.4	Confident	44 Å²	44	45.5 Å²	45.5	23%	0.23	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-38.4	178.1	-57.1	-179	0	0	0	111.6	E28 R56 W158 K160	E28-L30 HydrophobicContact CG-CD2 4.28Å; L30-R56 HydrophobicContact CD1-CG 4.07Å; L30-W158 WeakPolarHBondContact CB-O 3.42Å; L30-W158 PolarHBondContact N-O 3.22Å; L30-K160 HydrophobicContact CD1-CB 4.07Å; L30-K160 HydrophobicContact CD2-CB 4.05Å; L30-K160 HydrophobicContact CG-CB 4.1Å
31	E	93	Very high	86.9	Confident	74 Å²	74	42 Å²	42	35%	0.346	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	141.1	177.2	-63.8	-65.3	167.9	0	0	109.4	V29 V157 W158	V29-E31 WeakPolarHBondContact CG1-O 3.24Å; E31-V157 CarbonylContact O-C 3.5Å; E31-V157 VanDerWaalsContact O-CA 3.28Å; E31-V157 WeakPolarHBondContact O-CA 3.47Å; E31-W158 HydrophobicContact CB-CB 4.24Å; E31-W158 PolarHBondContact N-O 2.65Å; E31-W158 PolarHBondContact O-N 3.21Å
32	P	93.5	Very high	88.8	Confident	10 Å²	10	41.1 Å²	41.1	7%	0.065	20%	0.195	C	C	.	.	S	Bend	cis	-74	162.2	-5.6	41.7	-48	0	0	0	112	D34 L35 G36 Y149	P32-D34 VanDerWaalsContact C-N 3.32Å; P32-D34 WeakPolarHBondContact CB-OD1 3.03Å; P32-D34 WeakPolarHBondContact CG-OD1 3.43Å; P32-D34 PolarHBondContact O-N 3.47Å; P32-L35 HydrophobicContact CG-CB 3.82Å; P32-L35 PolarHBondContact O-N 2.61Å; P32-G36 PolarHBondContact O-N 3.33Å; P32-Y149 HydrophobicContact CG-CE1 4.09Å; P32-Y149 HydrophobicContact CG-CE2 3.93Å; P32-Y149 VanDerWaalsContact CG-CZ 3.49Å; P32-Y149 VanDerWaalsContact CG-OH 3.26Å; P32-Y149 WeakPolarHBondContact CG-OH 3.3Å
33	K	87.5	Confident	90.4	Very high	161 Å²	161	40.4 Å²	40.4	70%	0.7	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-67.8	-26.5	-175	-67.8	-177.1	-179.4	176.1	0	114.9	L35 G36	K33-L35 VanDerWaalsContact C-N 3.3Å; K33-G36 PolarHBondContact O-N 2.9Å; K33-G36 VanDerWaalsContact O-N 3.15Å
34	D	85.3	Confident	91	Very high	107 Å²	107	36.6 Å²	36.6	57%	0.572	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-70	-27.9	176.2	61.2	-38.9	0	0	0	112.3	P32 G36 Y37	P32-D34 VanDerWaalsContact C-N 3.32Å; P32-D34 WeakPolarHBondContact CB-OD1 3.03Å; P32-D34 WeakPolarHBondContact CG-OD1 3.43Å; P32-D34 PolarHBondContact O-N 3.47Å; D34-G36 VanDerWaalsContact C-N 3.33Å; D34-Y37 VanDerWaalsContact O-CE2 3.31Å; D34-Y37 WeakPolarHBondContact O-CE2 3.47Å
35	L	88	Confident	91.3	Very high	12 Å²	12	38 Å²	38	6%	0.063	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-91.5	5.9	170.2	-165.2	61.5	0	0	0	112.5	V29 P32 K33 Y37 L146 Y149 V157	V29-L35 VanDerWaalsContact CB-O 3.23Å; V29-L35 WeakPolarHBondContact CB-O 3.22Å; V29-L35 HydrophobicContact CG1-CB 3.99Å; V29-L35 HydrophobicContact CG1-CD2 4.22Å; V29-L35 HydrophobicContact CG1-CG 4.05Å; V29-L35 WeakPolarHBondContact CG1-O 3.15Å; V29-L35 HydrophobicContact CG2-CD2 4.48Å; V29-L35 HydrophobicContact CG2-CG 4.27Å; P32-L35 HydrophobicContact CG-CB 3.82Å; P32-L35 PolarHBondContact O-N 2.61Å; K33-L35 VanDerWaalsContact C-N 3.3Å; L35-Y37 WeakPolarHBondContact O-CD2 3.4Å; L35-Y37 PolarHBondContact O-N 3.12Å; L35-L146 HydrophobicContact CD1-CD2 4.3Å; L35-L146 HydrophobicContact CD2-CD2 3.87Å; L35-L146 HydrophobicContact CG-CD2 4.3Å; L35-Y149 HydrophobicContact CD2-CD1 3.92Å; L35-Y149 HydrophobicContact CD2-CD2 4.17Å; L35-Y149 HydrophobicContact CD2-CE1 4.48Å; L35-Y149 HydrophobicContact CD2-CG 3.79Å; L35-V157 HydrophobicContact CD2-CG1 4.25Å; L35-V157 HydrophobicContact CD2-CG2 4.22Å
36	G	87.8	Confident	91.4	Very high	5 Å²	5	36.2 Å²	36.2	5%	0.052	17%	0.171	C	C	.	.			trans	-70.3	59.7	-170.6	0	0	0	0	0	115.5	V29 P32 K33 D34	V29-G36 VanDerWaalsContact O-CA 3.28Å; V29-G36 WeakPolarHBondContact O-CA 3Å; P32-G36 PolarHBondContact O-N 3.33Å; K33-G36 PolarHBondContact O-N 2.9Å; K33-G36 VanDerWaalsContact O-N 3.15Å; D34-G36 VanDerWaalsContact C-N 3.33Å
37	Y	89.8	Confident	91.6	Very high	52 Å²	52	35.6 Å²	35.6	20%	0.204	17%	0.17	C	C	.	.			trans	-111.1	164.4	177.4	-56.6	-73.4	0	0	0	110.5	E28 V29 D34 L35 R174 K175 P176	E28-Y37 WeakPolarHBondContact CA-O 3.5Å; V29-Y37 PolarHBondContact N-O 2.75Å; D34-Y37 VanDerWaalsContact O-CE2 3.31Å; D34-Y37 WeakPolarHBondContact O-CE2 3.47Å; L35-Y37 WeakPolarHBondContact O-CD2 3.4Å; L35-Y37 PolarHBondContact O-N 3.12Å; Y37-R174 CarbonylContact C-O 3.46Å; Y37-R174 VanDerWaalsContact CA-O 3.24Å; Y37-R174 WeakPolarHBondContact CA-O 3.4Å; Y37-R174 WeakPolarHBondContact CB-O 3.14Å; Y37-R174 HydrophobicContact CD1-CB 4.24Å; Y37-K175 WeakPolarHBondContact CD1-O 3.04Å; Y37-K175 VanDerWaalsContact CE1-O 3.3Å; Y37-K175 WeakPolarHBondContact CE1-O 3.43Å; Y37-P176 HydrophobicContact CG-CB 4.44Å; Y37-P176 HydrophobicContact CG-CG 4.39Å
38	S	91	Very high	91.6	Very high	5 Å²	5	36.9 Å²	36.9	4%	0.035	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	139.3	169.6	-53	0	0	0	0	110.8	F27 V173 R174 P176	F27-S38 CarbonylContact O-C 3.49Å; F27-S38 WeakPolarHBondContact O-CA 3.34Å; S38-V173 WeakPolarHBondContact OG-CG1 3.29Å; S38-R174 PolarHBondContact N-O 2.97Å; S38-P176 WeakPolarHBondContact O-CD 3.46Å
39	F	91.7	Very high	91.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	136.3	-173.2	-65.7	-93.6	0	0	0	109.1	F26 F27 V29 L138 D142 L146 P176 W178	F26-F39 VanDerWaalsContact CA-O 3.23Å; F26-F39 WeakPolarHBondContact CA-O 3.28Å; F27-F39 HydrophobicContact CD1-CB 3.89Å; F27-F39 HydrophobicContact CD2-CB 4.44Å; F27-F39 HydrophobicContact CD2-CD2 4.17Å; F27-F39 HydrophobicContact CE1-CB 3.39Å; F27-F39 HydrophobicContact CE1-CD2 4.46Å; F27-F39 HydrophobicContact CE1-CG 4.09Å; F27-F39 HydrophobicContact CE2-CB 3.98Å; F27-F39 AromaticContact CE2-CD2 3.47Å; F27-F39 HydrophobicContact CE2-CD2 3.47Å; F27-F39 VanDerWaalsContact CE2-CD2 3.47Å; F27-F39 HydrophobicContact CE2-CE2 4.26Å; F27-F39 AromaticContact CE2-CG 3.91Å; F27-F39 HydrophobicContact CE2-CG 3.91Å; F27-F39 HydrophobicContact CG-CB 4.41Å; F27-F39 HydrophobicContact CZ-CB 3.43Å; F27-F39 VanDerWaalsContact CZ-CB 3.43Å; F27-F39 HydrophobicContact CZ-CD1 4.42Å; F27-F39 AromaticContact CZ-CD2 3.66Å; F27-F39 HydrophobicContact CZ-CD2 3.66Å; F27-F39 AromaticContact CZ-CG 3.58Å; F27-F39 HydrophobicContact CZ-CG 3.58Å; F27-F39 PolarHBondContact N-O 3.21Å; F27-F39 PolarHBondContact O-N 3.42Å; V29-F39 HydrophobicContact CB-CE2 4.48Å; V29-F39 HydrophobicContact CG2-CD2 4.1Å; V29-F39 HydrophobicContact CG2-CE2 3.57Å; F39-L138 HydrophobicContact CB-CD1 4.3Å; F39-D142 HydrophobicContact CD1-CB 3.81Å; F39-D142 HydrophobicContact CE1-CB 4.09Å; F39-L146 HydrophobicContact CE1-CD1 4.46Å; F39-L146 HydrophobicContact CE1-CD2 4.35Å; F39-L146 HydrophobicContact CE1-CG 4.37Å; F39-L146 HydrophobicContact CE2-CD2 4.31Å; F39-L146 HydrophobicContact CZ-CD2 3.92Å; F39-L146 HydrophobicContact CZ-CG 4.43Å; F39-P176 HydrophobicContact CD1-CG 3.97Å; F39-P176 HydrophobicContact CE1-CB 4.45Å; F39-P176 HydrophobicContact CE1-CG 3.66Å; F39-P176 HydrophobicContact CZ-CG 4.05Å; F39-W178 HydrophobicContact CE1-CZ2 4.27Å
40	Q	90.5	Very high	91.2	Very high	39 Å²	39	42.6 Å²	42.6	18%	0.182	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	135.6	174	-171.9	173.8	-12.9	0	0	109.9	D24 F26 F119	D24-Q40 HydrophobicContact CB-CG 4.45Å; D24-Q40 PolarHBondContact OD2-NE2 3.28Å; F26-Q40 HydrophobicContact CD1-CB 3.87Å; F26-Q40 HydrophobicContact CD1-CG 4.19Å; F26-Q40 HydrophobicContact CE1-CB 3.53Å; F26-Q40 HydrophobicContact CE1-CG 3.57Å; F26-Q40 HydrophobicContact CZ-CB 4.36Å; F26-Q40 HydrophobicContact CZ-CG 3.9Å; Q40-F119 HydrophobicContact CB-CZ 3.83Å; Q40-F119 HydrophobicContact CG-CE1 4.2Å; Q40-F119 HydrophobicContact CG-CE2 4.31Å; Q40-F119 HydrophobicContact CG-CZ 3.54Å
41	I	93.6	Very high	90.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	148.8	-178.3	52.7	168.4	0	0	0	109.7	D24 F25 F27 L108 F136 Y137 L138 I161	D24-I41 CarbonylContact C-O 3.59Å; D24-I41 WeakPolarHBondContact CA-O 3.33Å; F25-I41 HydrophobicContact CB-CD1 4.14Å; F25-I41 HydrophobicContact CB-CG1 3.87Å; F25-I41 PolarHBondContact N-O 3.3Å; F25-I41 WeakPolarHBondContact O-CG1 3.27Å; F25-I41 PolarHBondContact O-N 2.74Å; F25-I41 VanDerWaalsContact O-O 3.07Å; F27-I41 HydrophobicContact CD1-CD1 4.02Å; F27-I41 HydrophobicContact CD1-CG1 4.36Å; F27-I41 HydrophobicContact CD1-CG2 3.7Å; F27-I41 HydrophobicContact CE1-CG2 3.59Å; I41-L108 HydrophobicContact CD1-CD2 4.24Å; I41-L108 HydrophobicContact CG2-CD2 4.11Å; I41-F136 HydrophobicContact CB-CB 3.88Å; I41-F136 HydrophobicContact CB-CG 4.4Å; I41-F136 HydrophobicContact CD1-CB 3.96Å; I41-F136 HydrophobicContact CD1-CD1 3.79Å; I41-F136 HydrophobicContact CD1-CD2 3.91Å; I41-F136 HydrophobicContact CD1-CE1 4.24Å; I41-F136 HydrophobicContact CD1-CE2 4.32Å; I41-F136 HydrophobicContact CD1-CG 3.63Å; I41-F136 HydrophobicContact CD1-CZ 4.49Å; I41-F136 HydrophobicContact CG1-CB 4.29Å; I41-F136 HydrophobicContact CG1-CD1 4.17Å; I41-F136 HydrophobicContact CG1-CG 4.27Å; I41-Y137 CarbonylContact C-O 3.54Å; I41-Y137 VanDerWaalsContact CA-O 3.27Å; I41-Y137 WeakPolarHBondContact CA-O 3.38Å; I41-L138 HydrophobicContact CG2-CB 4.25Å; I41-L138 HydrophobicContact CG2-CD1 3.74Å; I41-I161 HydrophobicContact CD1-CD1 3.61Å; I41-I161 HydrophobicContact CD1-CG1 4.28Å
42	R	93	Very high	90	Very high	46 Å²	46	44.7 Å²	44.7	17%	0.174	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	126.9	-177	177.4	165.9	-69.4	-177.9	5.1	112	V22 D24 F119 D121 F136 Y137	V22-R42 HydrophobicContact CG1-CG 3.63Å; D24-R42 IonicContact OD1-CZ 2.83Å; D24-R42 IonicContact OD1-NE 3.36Å; D24-R42 PolarHBondContact OD1-NE 3.32Å; D24-R42 IonicContact OD1-NH2 3.36Å; D24-R42 PolarHBondContact OD1-NH2 3.16Å; D24-R42 IonicContact OD2-NH2 3.68Å; D24-R42 PolarHBondContact OD2-NH2 2.81Å; R42-F119 HydrophobicContact CB-CD1 3.62Å; R42-F119 HydrophobicContact CB-CE1 4.1Å; R42-F119 VanDerWaalsContact CZ-CB 3.5Å; R42-D121 WeakPolarHBondContact CD-OD1 3.34Å; R42-D121 IonicContact CZ-OD1 3.54Å; R42-D121 IonicContact NE-OD1 2.82Å; R42-D121 IonicContact NH1-OD1 2.61Å; R42-D121 PolarHBondContact NH1-OD1 3.13Å; R42-F136 CarbonylContact O-C 3.57Å; R42-F136 WeakPolarHBondContact O-CA 3.23Å; R42-F136 WeakPolarHBondContact O-CB 3.38Å; R42-Y137 PolarHBondContact N-O 2.9Å; R42-Y137 PolarHBondContact O-N 2.75Å
43	M	93.7	Very high	89.4	Confident	21 Å²	21	50.6 Å²	50.6	10%	0.103	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	140.9	-177.6	179.4	179.4	-79.5	0	0	113	K23 F25 P50 F136	K23-M43 WeakPolarHBondContact O-CB 3.33Å; K23-M43 PolarHBondContact O-N 2.99Å; K23-M43 VanDerWaalsContact O-N 3.16Å; F25-M43 HydrophobicContact CD2-CB 4.14Å; F25-M43 HydrophobicContact CD2-CE 4.11Å; F25-M43 HydrophobicContact CE1-CE 4.44Å; F25-M43 HydrophobicContact CE2-CB 3.97Å; F25-M43 HydrophobicContact CE2-CE 3.23Å; F25-M43 HydrophobicContact CE2-SD 4.08Å; F25-M43 HydrophobicContact CZ-CE 3.44Å; F25-M43 VanDerWaalsContact CZ-CE 3.44Å; M43-P50 HydrophobicContact CE-CG 4.05Å; M43-F136 HydrophobicContact CB-CD1 3.96Å; M43-F136 HydrophobicContact CB-CE1 4.03Å; M43-F136 HydrophobicContact CE-CE1 3.95Å; M43-F136 HydrophobicContact CE-CZ 4.36Å; M43-F136 HydrophobicContact CG-CE1 4.43Å
44	A	94.3	Very high	89.3	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.008	25%	0.247	C	C	.	.			trans	-75.2	136.3	169.9	0	0	0	0	0	111.7	F46 S47 M122 A135	A44-F46 HydrophobicContact CB-CD1 4.05Å; A44-F46 HydrophobicContact CB-CD2 4.38Å; A44-F46 HydrophobicContact CB-CE1 3.73Å; A44-F46 HydrophobicContact CB-CE2 4.06Å; A44-F46 HydrophobicContact CB-CG 4.38Å; A44-F46 HydrophobicContact CB-CZ 3.72Å; A44-F46 PolarHBondContact O-N 2.83Å; A44-F46 VanDerWaalsContact O-N 3.15Å; A44-S47 PolarHBondContact O-N 3.36Å; A44-S47 PolarHBondContact O-OG 2.82Å; A44-M122 HydrophobicContact CB-CB 3.89Å; A44-M122 HydrophobicContact CB-CE 3.6Å; A44-A135 HydrophobicContact CB-CB 4.19Å; A44-A135 PolarHBondContact N-O 3.1Å
45	H	92.3	Very high	89.4	Confident	86 Å²	86	45 Å²	45	40%	0.398	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.4	-179.7	-71.5	-92.2	0	0	0	114.1	M122 K130	H45-M122 PolarHBondContact N-O 3.47Å; H45-K130 PolarHBondContact O-NZ 3.06Å
46	F	93.1	Very high	89.6	Confident	3 Å²	3	50.8 Å²	50.8	1%	0.013	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-7.2	178.6	60.4	-99.4	0	0	0	113.6	A44 F92 I93 V96 M122 D129 K130 A131	A44-F46 HydrophobicContact CB-CD1 4.05Å; A44-F46 HydrophobicContact CB-CD2 4.38Å; A44-F46 HydrophobicContact CB-CE1 3.73Å; A44-F46 HydrophobicContact CB-CE2 4.06Å; A44-F46 HydrophobicContact CB-CG 4.38Å; A44-F46 HydrophobicContact CB-CZ 3.72Å; A44-F46 PolarHBondContact O-N 2.83Å; A44-F46 VanDerWaalsContact O-N 3.15Å; F46-F92 HydrophobicContact CE1-CB 3.75Å; F46-F92 HydrophobicContact CZ-CB 3.72Å; F46-I93 HydrophobicContact CB-CD1 4.01Å; F46-I93 HydrophobicContact CD2-CB 4.29Å; F46-I93 HydrophobicContact CD2-CD1 3.49Å; F46-I93 VanDerWaalsContact CD2-CD1 3.49Å; F46-I93 HydrophobicContact CD2-CG1 4.48Å; F46-I93 HydrophobicContact CE1-CB 4.48Å; F46-I93 HydrophobicContact CE2-CB 4.27Å; F46-I93 HydrophobicContact CE2-CD1 4.12Å; F46-I93 HydrophobicContact CG-CB 4.42Å; F46-I93 HydrophobicContact CG-CD1 3.84Å; F46-I93 HydrophobicContact CZ-CB 4.37Å; F46-V96 HydrophobicContact CE2-CB 3.87Å; F46-V96 HydrophobicContact CE2-CG1 4.19Å; F46-V96 HydrophobicContact CE2-CG2 3.72Å; F46-V96 HydrophobicContact CZ-CG2 3.98Å; F46-M122 HydrophobicContact CE1-CB 4.02Å; F46-D129 WeakPolarHBondContact CB-O 3.21Å; F46-K130 CarbonylContact O-C 3.59Å; F46-K130 WeakPolarHBondContact O-CA 3.33Å; F46-A131 HydrophobicContact CD2-CB 4.2Å; F46-A131 PolarHBondContact O-N 3.36Å
47	S	93.3	Very high	89.9	Confident	16 Å²	16	52.1 Å²	52.1	11%	0.112	27%	0.266	C	S	.	.	S	Bend	trans	-84.4	163.3	-174.8	71.2	0	0	0	0	113.3	A44 A135	A44-S47 PolarHBondContact O-N 3.36Å; A44-S47 PolarHBondContact O-OG 2.82Å; S47-A135 VanDerWaalsContact CB-N 3.33Å; S47-A135 PolarHBondContact OG-O 2.92Å
48	A	92.8	Very high	90.2	Very high	28 Å²	28	53.1 Å²	53.1	23%	0.231	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-71.9	146.1	168.4	0	0	0	0	0	110.6	A131 K132 I133 P134	A48-A131 PolarHBondContact N-O 2.77Å; A48-K132 VanDerWaalsContact CB-C 3.46Å; A48-K132 WeakPolarHBondContact CB-O 3.25Å; A48-I133 PolarHBondContact N-O 2.94Å; A48-P134 WeakPolarHBondContact O-CA 3.21Å
49	K	89.4	Confident	90.4	Very high	163 Å²	163	53 Å²	53	71%	0.709	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-67.3	135.7	171.5	-66	179.1	-179.8	176.4	0	108.9
50	P	87.8	Confident	90.6	Very high	21 Å²	21	53.5 Å²	53.5	14%	0.136	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-63.3	151	171	32.1	-37	0	0	0	109.1	F25 M43 P134 F136 P162	F25-P50 HydrophobicContact CD1-CG 4.21Å; F25-P50 HydrophobicContact CE1-CG 3.64Å; F25-P50 HydrophobicContact CZ-CG 3.99Å; M43-P50 HydrophobicContact CE-CG 4.05Å; P50-P134 HydrophobicContact CB-CB 4.33Å; P50-P134 HydrophobicContact CB-CG 4.09Å; P50-F136 HydrophobicContact CB-CZ 4.38Å; P50-F136 HydrophobicContact CG-CZ 4.05Å; P50-P162 HydrophobicContact CB-CG 3.85Å; P50-P162 HydrophobicContact CG-CB 4.4Å; P50-P162 HydrophobicContact CG-CG 3.98Å
51	G	81.8	Confident	90.7	Very high	34 Å²	34	53.2 Å²	53.2	35%	0.351	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-60.5	164.3	171.3	0	0	0	0	0	111.9	Q53	G51-Q53 PolarHBondContact O-N 2.85Å
52	S	79.1	Confident	90.7	Very high	128 Å²	128	53.3 Å²	53.3	90%	0.895	28%	0.275	S	S	*	.	S	Bend	trans	-69.8	-15.6	175.8	-52.6	0	0	0	0	113.4
53	Q	82.1	Confident	90.6	Very high	134 Å²	134	56.2 Å²	56.2	63%	0.626	29%	0.29	S	S	*	.	S	Bend	trans	-89.1	137.9	177.8	-172	174.5	39.2	0	0	110.5	G51 Y55	G51-Q53 PolarHBondContact O-N 2.85Å; Q53-Y55 WeakPolarHBondContact O-CD2 3.46Å; Q53-Y55 WeakPolarHBondContact O-CE2 3.32Å
54	S	84.3	Confident	90.5	Very high	46 Å²	46	57.1 Å²	57.1	32%	0.322	30%	0.298	S	S	.	.			trans	-78.6	134.3	170.1	62.3	0	0	0	0	110.7	K160 P162	S54-K160 VanDerWaalsContact CB-CE 3.49Å; S54-K160 WeakPolarHBondContact OG-CE 3.48Å; S54-P162 WeakPolarHBondContact CB-O 3.23Å
55	Y	87.7	Confident	90.5	Very high	104 Å²	104	58.3 Å²	58.3	41%	0.408	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	142.3	176.3	-55.4	-82.8	0	0	0	110.5	Q53 K160 I161	Q53-Y55 WeakPolarHBondContact O-CD2 3.46Å; Q53-Y55 WeakPolarHBondContact O-CE2 3.32Å; Y55-K160 WeakPolarHBondContact O-CA 3.28Å; Y55-I161 PolarHBondContact N-O 3.07Å; Y55-I161 PolarHBondContact O-N 2.86Å
56	R	93.3	Very high	90.6	Very high	134 Å²	134	56.1 Å²	56.1	51%	0.506	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	113.5	165.1	180	176.8	-178.5	116.2	2.2	108	L30 W158 I159	L30-R56 HydrophobicContact CD1-CG 4.07Å; R56-W158 HydrophobicContact CG-CE3 4.02Å; R56-I159 WeakPolarHBondContact CA-O 3.35Å
57	L	93.9	Very high	90.6	Very high	33 Å²	33	56 Å²	56	17%	0.173	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	149.1	-175.9	-66.9	175.4	0	0	0	110.1	V82 A105 V106 I159 I161	L57-V82 HydrophobicContact CB-CG2 3.7Å; L57-V82 HydrophobicContact CD1-CG2 3.73Å; L57-V82 HydrophobicContact CG-CG2 4.38Å; L57-A105 HydrophobicContact CD1-CB 4.2Å; L57-V106 HydrophobicContact CD1-CG2 4.13Å; L57-I159 PolarHBondContact N-O 2.78Å; L57-I159 PolarHBondContact O-N 3.37Å; L57-I161 HydrophobicContact CD1-CG2 4.18Å
58	Q	95.3	Very high	90.6	Very high	74 Å²	74	55.7 Å²	55.7	35%	0.346	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	129.8	172.9	-169.7	179.5	3.3	0	0	109.3	V60 G81 V82 A156 V157 W158	Q58-V60 HydrophobicContact CB-CG1 4.37Å; Q58-V60 HydrophobicContact CG-CG1 3.82Å; Q58-G81 CarbonylContact O-C 3.57Å; Q58-G81 WeakPolarHBondContact O-CA 3.23Å; Q58-V82 PolarHBondContact O-N 2.81Å; Q58-A156 HydrophobicContact CG-CB 4.5Å; Q58-V157 CarbonylContact C-O 3.58Å; Q58-V157 WeakPolarHBondContact CA-O 3.41Å; Q58-W158 HydrophobicContact CB-CD2 4.36Å; Q58-W158 HydrophobicContact CB-CE3 4.06Å; Q58-W158 HydrophobicContact CB-CH2 4.06Å; Q58-W158 HydrophobicContact CB-CZ2 4.35Å; Q58-W158 HydrophobicContact CB-CZ3 3.91Å
59	L	95.9	Very high	90.5	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.9	168.9	178.4	68.4	0	0	0	108.7	V82 L84 L108 L146 L150 V157 I159	L59-V82 WeakPolarHBondContact CA-O 3.16Å; L59-V82 HydrophobicContact CD1-CB 4.12Å; L59-V82 HydrophobicContact CD1-CG1 3.87Å; L59-L84 HydrophobicContact CD1-CB 4.21Å; L59-L108 HydrophobicContact CD1-CD1 3.94Å; L59-L146 HydrophobicContact CD2-CB 4.41Å; L59-L146 HydrophobicContact CD2-CD1 3.99Å; L59-L146 HydrophobicContact CD2-CD2 4.25Å; L59-L146 HydrophobicContact CD2-CG 4.46Å; L59-L150 HydrophobicContact CD2-CD1 4.15Å; L59-L150 HydrophobicContact CG-CD1 4.08Å; L59-L150 WeakPolarHBondContact O-CD2 3.48Å; L59-V157 HydrophobicContact CB-CB 4.15Å; L59-V157 HydrophobicContact CB-CG1 4Å; L59-V157 HydrophobicContact CD2-CG1 4.08Å; L59-V157 PolarHBondContact N-O 3Å; L59-I159 HydrophobicContact CB-CD1 4.46Å; L59-I159 HydrophobicContact CB-CG2 3.96Å; L59-I159 HydrophobicContact CD2-CG2 4.46Å
60	V	94.5	Very high	90.5	Very high	11 Å²	11	54.5 Å²	54.5	7%	0.067	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.6	-174.3	-58.4	0	0	0	0	109.8	Q58 P77 V82 W83 L84	Q58-V60 HydrophobicContact CB-CG1 4.37Å; Q58-V60 HydrophobicContact CG-CG1 3.82Å; V60-P77 HydrophobicContact CB-CG 3.39Å; V60-P77 HydrophobicContact CG1-CG 3.4Å; V60-P77 VanDerWaalsContact CG1-CG 3.4Å; V60-P77 HydrophobicContact CG2-CG 3.55Å; V60-V82 WeakPolarHBondContact CG2-O 3.31Å; V60-V82 PolarHBondContact N-O 3.28Å; V60-W83 HydrophobicContact CG2-CG 3.98Å; V60-L84 PolarHBondContact O-N 3.47Å
61	L	93.8	Very high	90.2	Very high	34 Å²	34	55.7 Å²	55.7	18%	0.178	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	135.2	172.6	-170.4	66.9	0	0	0	108.6	L84 R147 L150 L151	L61-L84 HydrophobicContact CD1-CD2 4.3Å; L61-L84 HydrophobicContact CD1-CG 4.41Å; L61-R147 HydrophobicContact CD1-CG 4.05Å; L61-R147 HydrophobicContact CD2-CG 4.35Å; L61-L150 HydrophobicContact CB-CB 4.34Å; L61-L150 HydrophobicContact CB-CD1 4.34Å; L61-L151 HydrophobicContact CD2-CD2 3.57Å; L61-L151 HydrophobicContact CD2-CG 3.93Å
62	S	92.9	Very high	89.9	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.014	31%	0.314	C	S	.	.			trans	-76	134.3	174	62.9	0	0	0	0	111.1	P64 A65 L84 I85	S62-P64 CarbonylContact O-C 3.56Å; S62-A65 VanDerWaalsContact O-CA 3.29Å; S62-A65 WeakPolarHBondContact O-CA 3.16Å; S62-A65 PolarHBondContact O-N 2.84Å; S62-A65 PolarHBondContact OG-O 2.75Å; S62-L84 PolarHBondContact N-O 3.36Å; S62-L84 PolarHBondContact OG-O 3.24Å; S62-L84 VanDerWaalsContact OG-O 3.11Å; S62-I85 WeakPolarHBondContact OG-CA 3.45Å
63	E	90.9	Very high	89.7	Confident	106 Å²	106	60.8 Å²	60.8	50%	0.495	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-114.6	124.9	163.9	-172.5	60	-131.5	0	0	108.5
64	P	93.1	Very high	89.2	Confident	41 Å²	41	58.6 Å²	58.6	27%	0.266	30%	0.304	S	S	.	.	S	Bend	cis	-69.6	147.5	-5.6	30.1	-35.9	0	0	0	113.4	S62 K66 F67 V70	S62-P64 CarbonylContact O-C 3.56Å; P64-K66 VanDerWaalsContact C-N 3.25Å; P64-K66 PolarHBondContact O-N 2.81Å; P64-F67 WeakPolarHBondContact O-CD2 3.41Å; P64-F67 PolarHBondContact O-N 3.09Å; P64-V70 HydrophobicContact CG-CG1 3.51Å
65	A	93.2	Very high	88.6	Confident	25 Å²	25	57.5 Å²	57.5	21%	0.207	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-37.1	-173.2	0	0	0	0	0	115	S62 E86	S62-A65 VanDerWaalsContact O-CA 3.29Å; S62-A65 WeakPolarHBondContact O-CA 3.16Å; S62-A65 PolarHBondContact O-N 2.84Å; S62-A65 PolarHBondContact OG-O 2.75Å; A65-E86 HydrophobicContact CB-CB 4.42Å; A65-E86 HydrophobicContact CB-CG 4.19Å; A65-E86 WeakPolarHBondContact O-CB 3.43Å; A65-E86 PolarHBondContact O-N 3.35Å
66	K	94.1	Very high	87.5	Confident	40 Å²	40	56.8 Å²	56.8	17%	0.174	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-16.7	-178.9	-56.3	-64.7	-175.6	-159.7	0	113.5	P64 C68 E86 R87 E89 K95	P64-K66 VanDerWaalsContact C-N 3.25Å; P64-K66 PolarHBondContact O-N 2.81Å; K66-C68 VanDerWaalsContact C-N 3.27Å; K66-C68 PolarHBondContact O-N 2.92Å; K66-C68 VanDerWaalsContact O-N 3.13Å; K66-C68 PolarHBondContact O-SG 2.72Å; K66-C68 VanDerWaalsContact O-SG 3.37Å; K66-E86 HydrophobicContact CD-CB 3.75Å; K66-E86 WeakPolarHBondContact CE-OE2 3.34Å; K66-E86 IonicContact NZ-OE2 3.37Å; K66-E86 PolarHBondContact NZ-OE2 2.86Å; K66-R87 WeakPolarHBondContact CD-O 3.27Å; K66-R87 PolarHBondContact NZ-O 3.34Å; K66-E89 HydrophobicContact CB-CB 4.43Å; K66-E89 HydrophobicContact CB-CG 4.28Å; K66-E89 WeakPolarHBondContact CB-OE2 3.12Å; K66-E89 HydrophobicContact CG-CG 4.11Å; K66-E89 WeakPolarHBondContact CG-OE1 3.44Å; K66-K95 PolarHBondContact O-NZ 3.15Å
67	F	93.4	Very high	85.9	Confident	1 Å²	1	52.8 Å²	52.8	0%	0.004	29%	0.293	C	S	.	.			trans	56.3	28.9	171.9	-133.3	-109.3	0	0	0	117.2	P64 V70 V75 W83 I85 N98 A99 L102	P64-F67 WeakPolarHBondContact O-CD2 3.41Å; P64-F67 PolarHBondContact O-N 3.09Å; F67-V70 HydrophobicContact CD1-CG1 4.29Å; F67-V70 HydrophobicContact CD1-CG2 4.06Å; F67-V70 HydrophobicContact CD2-CG1 3.67Å; F67-V70 HydrophobicContact CE1-CB 4.47Å; F67-V70 HydrophobicContact CE1-CG1 4.35Å; F67-V70 HydrophobicContact CE1-CG2 3.72Å; F67-V70 HydrophobicContact CE2-CB 4.31Å; F67-V70 HydrophobicContact CE2-CG1 3.76Å; F67-V70 HydrophobicContact CE2-CG2 4.41Å; F67-V70 HydrophobicContact CG-CG1 3.92Å; F67-V70 HydrophobicContact CZ-CB 4.21Å; F67-V70 HydrophobicContact CZ-CG1 4.08Å; F67-V70 HydrophobicContact CZ-CG2 3.9Å; F67-V75 HydrophobicContact CE2-CG2 4.38Å; F67-V75 HydrophobicContact CZ-CG1 4.36Å; F67-V75 HydrophobicContact CZ-CG2 4.15Å; F67-W83 HydrophobicContact CE1-CE3 4.21Å; F67-W83 AromaticContact CE1-CZ3 3.76Å; F67-W83 HydrophobicContact CE1-CZ3 3.76Å; F67-W83 HydrophobicContact CE2-CE3 4.4Å; F67-W83 HydrophobicContact CE2-CZ3 4.09Å; F67-W83 AromaticContact CZ-CE3 3.94Å; F67-W83 HydrophobicContact CZ-CE3 3.94Å; F67-W83 HydrophobicContact CZ-CH2 4.32Å; F67-W83 AromaticContact CZ-CZ3 3.33Å; F67-W83 HydrophobicContact CZ-CZ3 3.33Å; F67-I85 HydrophobicContact CB-CD1 4.09Å; F67-I85 HydrophobicContact CB-CG1 4.45Å; F67-I85 HydrophobicContact CB-CG2 3.76Å; F67-I85 HydrophobicContact CD1-CD1 4.07Å; F67-I85 HydrophobicContact CG-CD1 4.1Å; F67-N98 HydrophobicContact CD1-CB 3.61Å; F67-N98 HydrophobicContact CE1-CB 3.72Å; F67-N98 PolarHBondContact O-ND2 2.82Å; F67-A99 HydrophobicContact CD1-CB 4.27Å; F67-A99 HydrophobicContact CE1-CB 4.01Å; F67-L102 HydrophobicContact CE1-CD1 3.72Å; F67-L102 HydrophobicContact CZ-CD1 3.43Å; F67-L102 VanDerWaalsContact CZ-CD1 3.43Å
68	C	93.3	Very high	84.4	Confident	9 Å²	9	53.5 Å²	53.5	6%	0.061	31%	0.309	C	S	.	.	S	Bend	trans	-86.8	-44.1	-177	-64.1	0	0	0	0	113.7	K66 E89 C90 H94 N98	K66-C68 VanDerWaalsContact C-N 3.27Å; K66-C68 PolarHBondContact O-N 2.92Å; K66-C68 VanDerWaalsContact O-N 3.13Å; K66-C68 PolarHBondContact O-SG 2.72Å; K66-C68 VanDerWaalsContact O-SG 3.37Å; C68-E89 VanDerWaalsContact SG-CB 3.52Å; C68-C90 WeakPolarHBondContact CA-SG 3.28Å; C68-C90 HydrophobicContact CB-CB 3.76Å; C68-C90 WeakPolarHBondContact CB-SG 3.37Å; C68-C90 WeakPolarHBondContact SG-CB 3.35Å; C68-C90 PolarHBondContact SG-N 3.09Å; C68-C90 CovalentContact SG-SG 2.04Å; C68-C90 PolarHBondContact SG-SG 2.82Å; C68-H94 PolarHBondContact O-CD2 3.22Å; C68-H94 PolarHBondContact O-NE2 3.37Å; C68-N98 PolarHBondContact O-ND2 2.8Å; C68-N98 VanDerWaalsContact O-ND2 3.13Å
69	N	90.3	Very high	83.4	Confident	151 Å²	151	55.4 Å²	55.4	81%	0.807	33%	0.328	S	S	*	.	S	Bend	trans	-121.2	86.3	-179.3	-64	-36	0	0	0	109.2
70	V	89.1	Confident	82.9	Confident	15 Å²	15	56.7 Å²	56.7	9%	0.091	34%	0.341	C	S	.	.			trans	-122	127.9	-172.7	-60.5	0	0	0	0	112.2	P64 F67 N98 R101 L102	P64-V70 HydrophobicContact CG-CG1 3.51Å; F67-V70 HydrophobicContact CD1-CG1 4.29Å; F67-V70 HydrophobicContact CD1-CG2 4.06Å; F67-V70 HydrophobicContact CD2-CG1 3.67Å; F67-V70 HydrophobicContact CE1-CB 4.47Å; F67-V70 HydrophobicContact CE1-CG1 4.35Å; F67-V70 HydrophobicContact CE1-CG2 3.72Å; F67-V70 HydrophobicContact CE2-CB 4.31Å; F67-V70 HydrophobicContact CE2-CG1 3.76Å; F67-V70 HydrophobicContact CE2-CG2 4.41Å; F67-V70 HydrophobicContact CG-CG1 3.92Å; F67-V70 HydrophobicContact CZ-CB 4.21Å; F67-V70 HydrophobicContact CZ-CG1 4.08Å; F67-V70 HydrophobicContact CZ-CG2 3.9Å; V70-N98 HydrophobicContact CG2-CB 3.67Å; V70-R101 PolarHBondContact O-NH2 3.03Å; V70-L102 HydrophobicContact CB-CD1 4.2Å; V70-L102 HydrophobicContact CG2-CD1 3.59Å
71	S	81.7	Confident	82.8	Confident	46 Å²	46	56.8 Å²	56.8	32%	0.322	34%	0.344	S	S	.	.			trans	-92	168.5	166.7	84.9	0	0	0	0	110.2	E73 D74 V75	S71-E73 PolarHBondContact O-N 3.06Å; S71-E73 PolarHBondContact OG-N 2.86Å; S71-D74 VanDerWaalsContact CB-OD2 3.29Å; S71-D74 WeakPolarHBondContact CB-OD2 3.28Å; S71-D74 PolarHBondContact N-OD2 2.85Å; S71-D74 VanDerWaalsContact OG-CG 3.23Å; S71-D74 PolarHBondContact OG-OD2 2.94Å; S71-V75 WeakPolarHBondContact O-CG2 3.49Å
72	S	76.5	Confident	82.8	Confident	91 Å²	91	55.1 Å²	55.1	64%	0.636	34%	0.336	S	S	*	.	S	Bend	trans	-68.5	-17.1	175	46.3	0	0	0	0	113.8
73	E	75.2	Confident	83	Confident	178 Å²	178	55.2 Å²	55.2	83%	0.832	34%	0.335	S	S	*	.	S	Bend	trans	-86.1	-22.4	-177	-59	-174.5	157	0	0	112.1	S71 V75	S71-E73 PolarHBondContact O-N 3.06Å; S71-E73 PolarHBondContact OG-N 2.86Å; E73-V75 VanDerWaalsContact C-N 3.32Å; E73-V75 PolarHBondContact O-N 2.72Å
74	D	71.6	Confident	83.2	Confident	89 Å²	89	50.1 Å²	50.1	48%	0.476	31%	0.312	S	S	.	.	S	Bend	trans	-88.2	0.3	-173.7	-56.5	-48.2	0	0	0	113.6	S71	S71-D74 VanDerWaalsContact CB-OD2 3.29Å; S71-D74 WeakPolarHBondContact CB-OD2 3.28Å; S71-D74 PolarHBondContact N-OD2 2.85Å; S71-D74 VanDerWaalsContact OG-CG 3.23Å; S71-D74 PolarHBondContact OG-OD2 2.94Å
75	V	70.9	Confident	83.4	Confident	22 Å²	22	48.2 Å²	48.2	13%	0.133	30%	0.299	C	S	.	.			trans	-102.2	115.8	-161.3	-179.5	0	0	0	0	110.1	F67 S71 E73 W83 L102	F67-V75 HydrophobicContact CE2-CG2 4.38Å; F67-V75 HydrophobicContact CZ-CG1 4.36Å; F67-V75 HydrophobicContact CZ-CG2 4.15Å; S71-V75 WeakPolarHBondContact O-CG2 3.49Å; E73-V75 VanDerWaalsContact C-N 3.32Å; E73-V75 PolarHBondContact O-N 2.72Å; V75-W83 HydrophobicContact CG1-CH2 3.41Å; V75-W83 VanDerWaalsContact CG1-CH2 3.41Å; V75-W83 HydrophobicContact CG1-CZ2 4.09Å; V75-W83 HydrophobicContact CG1-CZ3 3.94Å; V75-L102 HydrophobicContact CB-CD1 4.5Å; V75-L102 HydrophobicContact CG1-CD1 4.47Å; V75-L102 HydrophobicContact CG2-CD1 3.39Å; V75-L102 HydrophobicContact CG2-CD2 4.14Å; V75-L102 HydrophobicContact CG2-CG 4.25Å
76	T	65.2	Low	83.6	Confident	89 Å²	89	47.4 Å²	47.4	55%	0.546	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-125.2	139.6	167.8	56.4	0	0	0	0	109.8
77	P	60.1	Low	83.7	Confident	50 Å²	50	49.8 Å²	49.8	33%	0.325	30%	0.299	S	S	.	.	S	Bend	cis	-82.9	176.8	-6.3	31.5	-26	0	0	0	112.9	V60	V60-P77 HydrophobicContact CB-CG 3.39Å; V60-P77 HydrophobicContact CG1-CG 3.4Å; V60-P77 VanDerWaalsContact CG1-CG 3.4Å; V60-P77 HydrophobicContact CG2-CG 3.55Å
78	G	62.6	Low	83.7	Confident	49 Å²	49	51.2 Å²	51.2	51%	0.505	31%	0.314	S	S	.	.			trans	-59.9	178.9	-178.2	0	0	0	0	0	115.2
79	P	73.9	Confident	83.7	Confident	114 Å²	114	58.3 Å²	58.3	74%	0.74	35%	0.347	S	S	*	.	S	Bend	trans	-57.8	143.2	-171.8	24.2	-34.8	0	0	0	112.8
80	G	84.6	Confident	83.9	Confident	28 Å²	28	53 Å²	53	29%	0.289	32%	0.32	S	S	.	.	S	Bend	trans	109.4	-172.2	-179.1	0	0	0	0	0	113.5	W83 G103	G80-W83 PolarHBondContact O-NE1 2.93Å; G80-G103 WeakPolarHBondContact CA-O 3.36Å; G80-G103 PolarHBondContact N-O 3.32Å
81	G	91.7	Very high	84.1	Confident	12 Å²	12	54.7 Å²	54.7	12%	0.124	33%	0.333	C	S	.	.	S	Bend	trans	72	-171	174.2	0	0	0	0	0	115.3	Q58 A105 V106	Q58-G81 CarbonylContact O-C 3.57Å; Q58-G81 WeakPolarHBondContact O-CA 3.23Å; G81-A105 WeakPolarHBondContact O-CB 3.37Å; G81-A105 PolarHBondContact O-N 3.34Å; G81-V106 PolarHBondContact O-N 3.1Å
82	V	95.3	Very high	84.8	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	119.3	177.7	-177.8	0	0	0	0	108.8	L57 Q58 L59 V60 V106 L108 I159 I161	L57-V82 HydrophobicContact CB-CG2 3.7Å; L57-V82 HydrophobicContact CD1-CG2 3.73Å; L57-V82 HydrophobicContact CG-CG2 4.38Å; Q58-V82 PolarHBondContact O-N 2.81Å; L59-V82 WeakPolarHBondContact CA-O 3.16Å; L59-V82 HydrophobicContact CD1-CB 4.12Å; L59-V82 HydrophobicContact CD1-CG1 3.87Å; V60-V82 WeakPolarHBondContact CG2-O 3.31Å; V60-V82 PolarHBondContact N-O 3.28Å; V82-V106 WeakPolarHBondContact CA-O 3.48Å; V82-V106 HydrophobicContact CB-CB 4.4Å; V82-V106 HydrophobicContact CG1-CB 4.15Å; V82-V106 HydrophobicContact CG1-CG1 4.17Å; V82-V106 HydrophobicContact CG2-CB 3.88Å; V82-V106 HydrophobicContact CG2-CG2 4.38Å; V82-L108 HydrophobicContact CG1-CD1 3.78Å; V82-L108 HydrophobicContact CG1-CG 3.63Å; V82-I159 HydrophobicContact CB-CD1 3.93Å; V82-I159 HydrophobicContact CG1-CD1 3.99Å; V82-I159 HydrophobicContact CG2-CD1 3.7Å; V82-I159 HydrophobicContact CG2-CG1 4.13Å; V82-I161 HydrophobicContact CG2-CG2 4.12Å
83	W	95.7	Very high	85.7	Confident	3 Å²	3	50 Å²	50	1%	0.011	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	122	-174.7	-67.6	15.7	0	0	0	109.9	V60 F67 V75 G80 I85 A99 L102 A104 V106 L108	V60-W83 HydrophobicContact CG2-CG 3.98Å; F67-W83 HydrophobicContact CE1-CE3 4.21Å; F67-W83 AromaticContact CE1-CZ3 3.76Å; F67-W83 HydrophobicContact CE1-CZ3 3.76Å; F67-W83 HydrophobicContact CE2-CE3 4.4Å; F67-W83 HydrophobicContact CE2-CZ3 4.09Å; F67-W83 AromaticContact CZ-CE3 3.94Å; F67-W83 HydrophobicContact CZ-CE3 3.94Å; F67-W83 HydrophobicContact CZ-CH2 4.32Å; F67-W83 AromaticContact CZ-CZ3 3.33Å; F67-W83 HydrophobicContact CZ-CZ3 3.33Å; V75-W83 HydrophobicContact CG1-CH2 3.41Å; V75-W83 VanDerWaalsContact CG1-CH2 3.41Å; V75-W83 HydrophobicContact CG1-CZ2 4.09Å; V75-W83 HydrophobicContact CG1-CZ3 3.94Å; G80-W83 PolarHBondContact O-NE1 2.93Å; W83-I85 HydrophobicContact CB-CG1 4.43Å; W83-A99 HydrophobicContact CE3-CB 3.79Å; W83-A99 HydrophobicContact CZ3-CB 4.05Å; W83-L102 HydrophobicContact CH2-CB 3.7Å; W83-L102 HydrophobicContact CZ3-CB 4.06Å; W83-A104 HydrophobicContact CB-CB 4.49Å; W83-A104 HydrophobicContact CD2-CB 3.56Å; W83-A104 HydrophobicContact CE3-CB 3.84Å; W83-A104 HydrophobicContact CG-CB 3.84Å; W83-A104 HydrophobicContact CH2-CB 4.39Å; W83-A104 HydrophobicContact CZ2-CB 4.21Å; W83-A104 HydrophobicContact CZ3-CB 4.2Å; W83-V106 PolarHBondContact N-O 2.96Å; W83-L108 PolarHBondContact O-N 3.01Å
84	L	96.9	Very high	86.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	110.9	170.4	-179	61.9	0	0	0	109	L59 V60 L61 S62 L108 I112 L138 L146 R147 L150	L59-L84 HydrophobicContact CD1-CB 4.21Å; V60-L84 PolarHBondContact O-N 3.47Å; L61-L84 HydrophobicContact CD1-CD2 4.3Å; L61-L84 HydrophobicContact CD1-CG 4.41Å; S62-L84 PolarHBondContact N-O 3.36Å; S62-L84 PolarHBondContact OG-O 3.24Å; S62-L84 VanDerWaalsContact OG-O 3.11Å; L84-L108 WeakPolarHBondContact CA-O 3.37Å; L84-L108 HydrophobicContact CD1-CB 4.06Å; L84-I112 HydrophobicContact CD2-CD1 4.19Å; L84-I112 HydrophobicContact CG-CD1 4.34Å; L84-L138 HydrophobicContact CD1-CD2 4.13Å; L84-L146 HydrophobicContact CD2-CB 4.14Å; L84-R147 HydrophobicContact CD2-CB 4.35Å; L84-L150 HydrophobicContact CD2-CD1 4.01Å
85	I	96.6	Very high	87.8	Confident	0 Å²	0	41 Å²	41	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	137.2	-179	-57.7	178	0	0	0	109.3	S62 F67 W83 K95 A99 V107 L108 I109 S110	S62-I85 WeakPolarHBondContact OG-CA 3.45Å; F67-I85 HydrophobicContact CB-CD1 4.09Å; F67-I85 HydrophobicContact CB-CG1 4.45Å; F67-I85 HydrophobicContact CB-CG2 3.76Å; F67-I85 HydrophobicContact CD1-CD1 4.07Å; F67-I85 HydrophobicContact CG-CD1 4.1Å; W83-I85 HydrophobicContact CB-CG1 4.43Å; I85-K95 HydrophobicContact CG2-CB 4.37Å; I85-K95 HydrophobicContact CG2-CD 4.06Å; I85-K95 HydrophobicContact CG2-CG 4.38Å; I85-A99 HydrophobicContact CD1-CB 4Å; I85-V107 HydrophobicContact CD1-CG1 3.74Å; I85-V107 HydrophobicContact CD1-CG2 4.43Å; I85-V107 HydrophobicContact CG1-CG1 4.28Å; I85-L108 PolarHBondContact N-O 3.48Å; I85-I109 VanDerWaalsContact O-CA 3.3Å; I85-I109 WeakPolarHBondContact O-CA 3.34Å; I85-S110 PolarHBondContact O-N 3.3Å
86	E	96.5	Very high	88.9	Confident	8 Å²	8	40 Å²	40	4%	0.037	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	138	176	-72.7	-178.8	-156.3	0	0	112.2	A65 K66 K95 I112 R147	A65-E86 HydrophobicContact CB-CB 4.42Å; A65-E86 HydrophobicContact CB-CG 4.19Å; A65-E86 WeakPolarHBondContact O-CB 3.43Å; A65-E86 PolarHBondContact O-N 3.35Å; K66-E86 HydrophobicContact CD-CB 3.75Å; K66-E86 WeakPolarHBondContact CE-OE2 3.34Å; K66-E86 IonicContact NZ-OE2 3.37Å; K66-E86 PolarHBondContact NZ-OE2 2.86Å; E86-K95 PolarHBondContact O-NZ 2.89Å; E86-I112 HydrophobicContact CG-CB 4.31Å; E86-I112 HydrophobicContact CG-CD1 3.7Å; E86-I112 HydrophobicContact CG-CG1 4.15Å; E86-R147 IonicContact OE1-CZ 2.75Å; E86-R147 IonicContact OE1-NE 2.67Å; E86-R147 PolarHBondContact OE1-NE 3.07Å; E86-R147 IonicContact OE1-NH2 3.27Å; E86-R147 PolarHBondContact OE1-NH2 3.44Å
87	R	96.2	Very high	90.3	Very high	90 Å²	90	40.3 Å²	40.3	34%	0.34	24%	0.236	S	C	.	.			trans	-64	150.1	170.7	-177.1	178	175	-141.1	5.2	111.1	K66 F92 I109 S110 D111	K66-R87 WeakPolarHBondContact CD-O 3.27Å; K66-R87 PolarHBondContact NZ-O 3.34Å; R87-F92 HydrophobicContact CG-CE1 3.89Å; R87-F92 HydrophobicContact CG-CZ 4.34Å; R87-I109 HydrophobicContact CB-CG2 4.17Å; R87-S110 WeakPolarHBondContact CB-O 3.08Å; R87-S110 PolarHBondContact N-O 2.85Å; R87-D111 HydrophobicContact CB-CB 4.2Å; R87-D111 WeakPolarHBondContact CD-OD2 3.47Å; R87-D111 IonicContact CZ-OD2 3.74Å; R87-D111 IonicContact NE-OD2 3.63Å; R87-D111 IonicContact NH1-OD2 3.92Å; R87-D111 PolarHBondContact NH1-OD2 2.82Å
88	G	93.8	Very high	92	Very high	31 Å²	31	38.8 Å²	38.8	32%	0.32	23%	0.225	S	C	.	.			trans	122.6	175.3	174.8	0	0	0	0	0	113.6	C90 K95	G88-C90 PolarHBondContact O-N 2.86Å; G88-K95 WeakPolarHBondContact O-CE 3.18Å; G88-K95 PolarHBondContact O-NZ 3.31Å
89	E	93.2	Very high	93.5	Very high	159 Å²	159	36.5 Å²	36.5	74%	0.743	20%	0.201	S	C	*	.	S	Bend	trans	63	-46.5	174.2	-62.4	-175.8	-173	0	0	118.1	K66 C68	K66-E89 HydrophobicContact CB-CB 4.43Å; K66-E89 HydrophobicContact CB-CG 4.28Å; K66-E89 WeakPolarHBondContact CB-OE2 3.12Å; K66-E89 HydrophobicContact CG-CG 4.11Å; K66-E89 WeakPolarHBondContact CG-OE1 3.44Å; C68-E89 VanDerWaalsContact SG-CB 3.52Å
90	C	94.1	Very high	94.4	Very high	38 Å²	38	33.4 Å²	33.4	26%	0.257	18%	0.176	S	C	.	.	S	Bend	trans	-140.4	170.4	-179.9	61.3	0	0	0	0	111.3	C68 G88 H94 K95	C68-C90 WeakPolarHBondContact CA-SG 3.28Å; C68-C90 HydrophobicContact CB-CB 3.76Å; C68-C90 WeakPolarHBondContact CB-SG 3.37Å; C68-C90 WeakPolarHBondContact SG-CB 3.35Å; C68-C90 PolarHBondContact SG-N 3.09Å; C68-C90 CovalentContact SG-SG 2.04Å; C68-C90 PolarHBondContact SG-SG 2.82Å; G88-C90 PolarHBondContact O-N 2.86Å; C90-H94 HydrophobicContact CB-CB 4.48Å; C90-K95 WeakPolarHBondContact O-CE 3.34Å
91	S	94.6	Very high	94.8	Very high	51 Å²	51	38.7 Å²	38.7	36%	0.357	19%	0.188	S	C	.	.			trans	-66.9	154.2	-176.7	67.4	0	0	0	0	112.9	I93 H94 K95	S91-I93 PolarHBondContact O-N 3.07Å; S91-I93 VanDerWaalsContact OG-CG2 3.28Å; S91-I93 WeakPolarHBondContact OG-CG2 3.05Å; S91-H94 WeakPolarHBondContact O-CB 3.26Å; S91-H94 PolarHBondContact O-N 3.19Å; S91-H94 VanDerWaalsContact O-N 3.12Å; S91-H94 WeakPolarHBondContact OG-CB 3.29Å; S91-H94 PolarHBondContact OG-N 3.45Å; S91-K95 PolarHBondContact O-N 3.2Å
92	F	95.8	Very high	94.9	Very high	35 Å²	35	39.3 Å²	39.3	15%	0.154	19%	0.188	C	C	.	.	H	α-helix	trans	-57.3	-46.5	178.8	-61.2	-58.2	0	0	0	112.5	F46 R87 H94 K95 V96 I109 I120 M122	F46-F92 HydrophobicContact CE1-CB 3.75Å; F46-F92 HydrophobicContact CZ-CB 3.72Å; R87-F92 HydrophobicContact CG-CE1 3.89Å; R87-F92 HydrophobicContact CG-CZ 4.34Å; F92-H94 VanDerWaalsContact C-N 3.26Å; F92-H94 PolarHBondContact O-N 3.24Å; F92-K95 PolarHBondContact O-N 3.36Å; F92-V96 WeakPolarHBondContact O-CG2 2.97Å; F92-V96 PolarHBondContact O-N 3.32Å; F92-I109 HydrophobicContact CB-CD1 4.2Å; F92-I109 HydrophobicContact CD1-CD1 3.87Å; F92-I109 HydrophobicContact CD1-CG2 3.98Å; F92-I109 HydrophobicContact CE1-CG2 3.97Å; F92-I120 HydrophobicContact CE2-CG2 4.24Å; F92-I120 HydrophobicContact CZ-CG2 4.08Å; F92-M122 HydrophobicContact CB-CB 4.34Å; F92-M122 HydrophobicContact CB-CG 4.48Å; F92-M122 HydrophobicContact CB-SD 4.2Å; F92-M122 HydrophobicContact CD1-CG 4.07Å; F92-M122 HydrophobicContact CD1-SD 3.62Å; F92-M122 HydrophobicContact CD2-CB 3.89Å; F92-M122 HydrophobicContact CD2-CG 3.79Å; F92-M122 HydrophobicContact CD2-SD 4.37Å; F92-M122 HydrophobicContact CE1-CG 4.15Å; F92-M122 HydrophobicContact CE1-SD 3.96Å; F92-M122 HydrophobicContact CE2-CB 4.35Å; F92-M122 HydrophobicContact CE2-CG 3.89Å; F92-M122 HydrophobicContact CG-CB 4.12Å; F92-M122 HydrophobicContact CG-CG 3.88Å; F92-M122 HydrophobicContact CG-SD 3.83Å; F92-M122 HydrophobicContact CZ-CG 4.06Å; F92-M122 HydrophobicContact CZ-SD 4.47Å
93	I	95.1	Very high	94.8	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-56.8	-39.9	176.2	178.6	83.2	0	0	0	111.8	F46 S91 V96 R97 D129	F46-I93 HydrophobicContact CB-CD1 4.01Å; F46-I93 HydrophobicContact CD2-CB 4.29Å; F46-I93 HydrophobicContact CD2-CD1 3.49Å; F46-I93 VanDerWaalsContact CD2-CD1 3.49Å; F46-I93 HydrophobicContact CD2-CG1 4.48Å; F46-I93 HydrophobicContact CE1-CB 4.48Å; F46-I93 HydrophobicContact CE2-CB 4.27Å; F46-I93 HydrophobicContact CE2-CD1 4.12Å; F46-I93 HydrophobicContact CG-CB 4.42Å; F46-I93 HydrophobicContact CG-CD1 3.84Å; F46-I93 HydrophobicContact CZ-CB 4.37Å; S91-I93 PolarHBondContact O-N 3.07Å; S91-I93 VanDerWaalsContact OG-CG2 3.28Å; S91-I93 WeakPolarHBondContact OG-CG2 3.05Å; I93-V96 PolarHBondContact O-N 2.87Å; I93-R97 HydrophobicContact CD1-CG 4.43Å; I93-R97 HydrophobicContact CG1-CG 4.38Å; I93-R97 WeakPolarHBondContact O-CB 3.32Å; I93-R97 WeakPolarHBondContact O-CG 3.31Å; I93-R97 PolarHBondContact O-N 3.15Å; I93-D129 HydrophobicContact CD1-CB 3.65Å; I93-D129 HydrophobicContact CG1-CB 3.81Å
94	H	94.9	Very high	94.7	Very high	78 Å²	78	40.9 Å²	40.9	36%	0.361	21%	0.205	S	C	.	.	H	α-helix	trans	-64.5	-46.6	-179.3	-170.2	85.8	0	0	0	111.3	C68 C90 S91 F92 V96 R97 N98	C68-H94 PolarHBondContact O-CD2 3.22Å; C68-H94 PolarHBondContact O-NE2 3.37Å; C90-H94 HydrophobicContact CB-CB 4.48Å; S91-H94 WeakPolarHBondContact O-CB 3.26Å; S91-H94 PolarHBondContact O-N 3.19Å; S91-H94 VanDerWaalsContact O-N 3.12Å; S91-H94 WeakPolarHBondContact OG-CB 3.29Å; S91-H94 PolarHBondContact OG-N 3.45Å; F92-H94 VanDerWaalsContact C-N 3.26Å; F92-H94 PolarHBondContact O-N 3.24Å; H94-V96 PolarHBondContact O-N 2.87Å; H94-R97 PolarHBondContact O-N 3.23Å; H94-N98 PolarHBondContact NE2-ND2 2.78Å; H94-N98 PolarHBondContact O-N 3.22Å
95	K	95.6	Very high	94.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.3	-48.6	174.7	-63.7	169.9	-175.7	-79.4	0	111.7	K66 I85 E86 G88 C90 S91 F92 N98 A99 I109	K66-K95 PolarHBondContact O-NZ 3.15Å; I85-K95 HydrophobicContact CG2-CB 4.37Å; I85-K95 HydrophobicContact CG2-CD 4.06Å; I85-K95 HydrophobicContact CG2-CG 4.38Å; E86-K95 PolarHBondContact O-NZ 2.89Å; G88-K95 WeakPolarHBondContact O-CE 3.18Å; G88-K95 PolarHBondContact O-NZ 3.31Å; C90-K95 WeakPolarHBondContact O-CE 3.34Å; S91-K95 PolarHBondContact O-N 3.2Å; F92-K95 PolarHBondContact O-N 3.36Å; K95-N98 PolarHBondContact O-N 2.83Å; K95-A99 PolarHBondContact O-N 3.02Å; K95-I109 HydrophobicContact CB-CD1 4.23Å; K95-I109 HydrophobicContact CD-CD1 4.11Å
96	V	95.7	Very high	94.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.8	-40.9	-178.1	177.2	0	0	0	0	111.5	F46 F92 I93 H94 A99 E100 V107 I109 A131 I133 A135	F46-V96 HydrophobicContact CE2-CB 3.87Å; F46-V96 HydrophobicContact CE2-CG1 4.19Å; F46-V96 HydrophobicContact CE2-CG2 3.72Å; F46-V96 HydrophobicContact CZ-CG2 3.98Å; F92-V96 WeakPolarHBondContact O-CG2 2.97Å; F92-V96 PolarHBondContact O-N 3.32Å; I93-V96 PolarHBondContact O-N 2.87Å; H94-V96 PolarHBondContact O-N 2.87Å; V96-A99 PolarHBondContact O-N 3.03Å; V96-E100 WeakPolarHBondContact O-CB 3.34Å; V96-E100 PolarHBondContact O-N 2.84Å; V96-V107 HydrophobicContact CG1-CG2 4.5Å; V96-V107 HydrophobicContact CG2-CB 4.29Å; V96-V107 HydrophobicContact CG2-CG1 4.03Å; V96-I109 HydrophobicContact CG2-CD1 3.98Å; V96-A131 HydrophobicContact CB-CB 4.48Å; V96-A131 HydrophobicContact CG1-CB 3.51Å; V96-I133 HydrophobicContact CG1-CD1 4.21Å; V96-I133 HydrophobicContact CG1-CG1 3.94Å; V96-A135 HydrophobicContact CB-CB 4.41Å; V96-A135 HydrophobicContact CG1-CB 3.87Å; V96-A135 HydrophobicContact CG2-CB 3.58Å
97	R	94.5	Very high	94.5	Very high	97 Å²	97	42.9 Å²	42.9	37%	0.366	22%	0.221	S	C	.	.	H	α-helix	trans	-65.1	-38.4	176.5	-79.6	-178.3	169.2	157.3	-1.3	112.7	I93 H94 A99 R101 D129	I93-R97 HydrophobicContact CD1-CG 4.43Å; I93-R97 HydrophobicContact CG1-CG 4.38Å; I93-R97 WeakPolarHBondContact O-CB 3.32Å; I93-R97 WeakPolarHBondContact O-CG 3.31Å; I93-R97 PolarHBondContact O-N 3.15Å; H94-R97 PolarHBondContact O-N 3.23Å; R97-A99 VanDerWaalsContact C-N 3.35Å; R97-R101 WeakPolarHBondContact O-CB 3.32Å; R97-R101 PolarHBondContact O-N 2.82Å; R97-D129 IonicContact CZ-OD1 2.82Å; R97-D129 VanDerWaalsContact CZ-OD1 3.27Å; R97-D129 IonicContact NH1-OD1 3.46Å; R97-D129 PolarHBondContact NH1-OD1 3.41Å; R97-D129 IonicContact NH2-OD1 2.76Å; R97-D129 PolarHBondContact NH2-OD1 3.32Å
98	N	94.3	Very high	94.6	Very high	18 Å²	18	38.6 Å²	38.6	10%	0.096	21%	0.205	C	C	.	.	H	α-helix	trans	-60.8	-47.4	172.8	-81.6	-19.3	0	0	0	110.6	F67 C68 V70 H94 K95 R101 L102	F67-N98 HydrophobicContact CD1-CB 3.61Å; F67-N98 HydrophobicContact CE1-CB 3.72Å; F67-N98 PolarHBondContact O-ND2 2.82Å; C68-N98 PolarHBondContact O-ND2 2.8Å; C68-N98 VanDerWaalsContact O-ND2 3.13Å; V70-N98 HydrophobicContact CG2-CB 3.67Å; H94-N98 PolarHBondContact NE2-ND2 2.78Å; H94-N98 PolarHBondContact O-N 3.22Å; K95-N98 PolarHBondContact O-N 2.83Å; N98-R101 PolarHBondContact O-N 3.17Å; N98-L102 WeakPolarHBondContact O-CD1 3.32Å; N98-L102 VanDerWaalsContact O-CG 3.31Å; N98-L102 WeakPolarHBondContact O-CG 3.45Å; N98-L102 PolarHBondContact O-N 3.43Å
99	A	94.3	Very high	94.7	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.6	-41.8	179.6	0	0	0	0	0	112	F67 W83 I85 K95 V96 R97 L102 G103 A104 V107	F67-A99 HydrophobicContact CD1-CB 4.27Å; F67-A99 HydrophobicContact CE1-CB 4.01Å; W83-A99 HydrophobicContact CE3-CB 3.79Å; W83-A99 HydrophobicContact CZ3-CB 4.05Å; I85-A99 HydrophobicContact CD1-CB 4Å; K95-A99 PolarHBondContact O-N 3.02Å; V96-A99 PolarHBondContact O-N 3.03Å; R97-A99 VanDerWaalsContact C-N 3.35Å; A99-L102 CarbonylContact O-C 3.41Å; A99-L102 PolarHBondContact O-N 2.85Å; A99-G103 PolarHBondContact O-N 2.96Å; A99-G103 VanDerWaalsContact O-N 3.07Å; A99-A104 HydrophobicContact CB-CB 3.8Å; A99-A104 WeakPolarHBondContact O-CB 3.41Å; A99-A104 PolarHBondContact O-N 3.08Å; A99-V107 HydrophobicContact CB-CG2 3.52Å
100	E	94.2	Very high	94.9	Very high	49 Å²	49	29.5 Å²	29.5	23%	0.229	15%	0.154	C	C	.	.	H	α-helix	trans	-56.6	-50	173.2	178.9	-178.8	159.7	0	0	111.6	V96 L102 G103 A131 K132 I133	V96-E100 WeakPolarHBondContact O-CB 3.34Å; V96-E100 PolarHBondContact O-N 2.84Å; E100-L102 PolarHBondContact O-N 3.39Å; E100-G103 PolarHBondContact O-N 2.85Å; E100-G103 VanDerWaalsContact O-N 3.08Å; E100-A131 WeakPolarHBondContact OE2-CA 3.11Å; E100-K132 WeakPolarHBondContact OE1-CB 3.24Å; E100-K132 VanDerWaalsContact OE1-CD 3.25Å; E100-K132 WeakPolarHBondContact OE1-CD 3.21Å; E100-K132 WeakPolarHBondContact OE1-CG 3.18Å; E100-K132 PolarHBondContact OE2-N 3.29Å; E100-I133 HydrophobicContact CB-CD1 3.86Å; E100-I133 HydrophobicContact CB-CG1 4.07Å; E100-I133 HydrophobicContact CB-CG2 4.47Å; E100-I133 HydrophobicContact CG-CG1 4.48Å; E100-I133 HydrophobicContact CG-CG2 4.14Å
101	R	93	Very high	95	Very high	140 Å²	140	28.9 Å²	28.9	53%	0.528	15%	0.149	S	C	.	.	H	α-helix	trans	-58.9	-29.8	179.1	178.8	175.9	59.6	83.4	-2.9	112.5	V70 R97 N98	V70-R101 PolarHBondContact O-NH2 3.03Å; R97-R101 WeakPolarHBondContact O-CB 3.32Å; R97-R101 PolarHBondContact O-N 2.82Å; N98-R101 PolarHBondContact O-N 3.17Å
102	L	92.5	Very high	94.9	Very high	25 Å²	25	26.8 Å²	26.8	13%	0.131	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	4	-177.1	-63.9	167.2	0	0	0	113	F67 V70 V75 W83 N98 A99 E100	F67-L102 HydrophobicContact CE1-CD1 3.72Å; F67-L102 HydrophobicContact CZ-CD1 3.43Å; F67-L102 VanDerWaalsContact CZ-CD1 3.43Å; V70-L102 HydrophobicContact CB-CD1 4.2Å; V70-L102 HydrophobicContact CG2-CD1 3.59Å; V75-L102 HydrophobicContact CB-CD1 4.5Å; V75-L102 HydrophobicContact CG1-CD1 4.47Å; V75-L102 HydrophobicContact CG2-CD1 3.39Å; V75-L102 HydrophobicContact CG2-CD2 4.14Å; V75-L102 HydrophobicContact CG2-CG 4.25Å; W83-L102 HydrophobicContact CH2-CB 3.7Å; W83-L102 HydrophobicContact CZ3-CB 4.06Å; N98-L102 WeakPolarHBondContact O-CD1 3.32Å; N98-L102 VanDerWaalsContact O-CG 3.31Å; N98-L102 WeakPolarHBondContact O-CG 3.45Å; N98-L102 PolarHBondContact O-N 3.43Å; A99-L102 CarbonylContact O-C 3.41Å; A99-L102 PolarHBondContact O-N 2.85Å; E100-L102 PolarHBondContact O-N 3.39Å
103	G	92.8	Very high	94.6	Very high	31 Å²	31	31.3 Å²	31.3	32%	0.32	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.6	15.9	168.8	0	0	0	0	0	115.4	G80 A99 E100 A105	G80-G103 WeakPolarHBondContact CA-O 3.36Å; G80-G103 PolarHBondContact N-O 3.32Å; A99-G103 PolarHBondContact O-N 2.96Å; A99-G103 VanDerWaalsContact O-N 3.07Å; E100-G103 PolarHBondContact O-N 2.85Å; E100-G103 VanDerWaalsContact O-N 3.08Å; G103-A105 PolarHBondContact O-N 3.49Å
104	A	94.1	Very high	94.3	Very high	5 Å²	5	33.8 Å²	33.8	4%	0.041	18%	0.176	C	C	.	.			trans	-58.9	137.7	170.3	0	0	0	0	0	110.6	W83 A99 V107 I133	W83-A104 HydrophobicContact CB-CB 4.49Å; W83-A104 HydrophobicContact CD2-CB 3.56Å; W83-A104 HydrophobicContact CE3-CB 3.84Å; W83-A104 HydrophobicContact CG-CB 3.84Å; W83-A104 HydrophobicContact CH2-CB 4.39Å; W83-A104 HydrophobicContact CZ2-CB 4.21Å; W83-A104 HydrophobicContact CZ3-CB 4.2Å; A99-A104 HydrophobicContact CB-CB 3.8Å; A99-A104 WeakPolarHBondContact O-CB 3.41Å; A99-A104 PolarHBondContact O-N 3.08Å; A104-V107 HydrophobicContact CB-CG2 4.3Å; A104-I133 HydrophobicContact CB-CD1 4.18Å
105	A	93.9	Very high	94	Very high	39 Å²	39	31.2 Å²	31.2	32%	0.322	17%	0.17	S	C	.	.	S	Bend	trans	-86.2	-35.8	176.7	0	0	0	0	0	112	L57 G81 G103	L57-A105 HydrophobicContact CD1-CB 4.2Å; G81-A105 WeakPolarHBondContact O-CB 3.37Å; G81-A105 PolarHBondContact O-N 3.34Å; G103-A105 PolarHBondContact O-N 3.49Å
106	V	95.2	Very high	93.7	Very high	10 Å²	10	33.7 Å²	33.7	6%	0.061	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	146.4	175.8	-179.7	0	0	0	0	109.1	L57 G81 V82 W83 P134 F136 I161	L57-V106 HydrophobicContact CD1-CG2 4.13Å; G81-V106 PolarHBondContact O-N 3.1Å; V82-V106 WeakPolarHBondContact CA-O 3.48Å; V82-V106 HydrophobicContact CB-CB 4.4Å; V82-V106 HydrophobicContact CG1-CB 4.15Å; V82-V106 HydrophobicContact CG1-CG1 4.17Å; V82-V106 HydrophobicContact CG2-CB 3.88Å; V82-V106 HydrophobicContact CG2-CG2 4.38Å; W83-V106 PolarHBondContact N-O 2.96Å; V106-P134 WeakPolarHBondContact CA-O 3.27Å; V106-P134 HydrophobicContact CG1-CB 4.36Å; V106-P134 HydrophobicContact CG2-CB 4.41Å; V106-P134 HydrophobicContact CG2-CG 4.48Å; V106-F136 HydrophobicContact CG1-CD2 3.82Å; V106-F136 HydrophobicContact CG1-CE2 3.71Å; V106-I161 HydrophobicContact CG1-CD1 4Å
107	V	96.6	Very high	93.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	134.2	174.5	175.1	0	0	0	0	110.7	I85 V96 A99 A104 I109 I133 P134 A135 F136	I85-V107 HydrophobicContact CD1-CG1 3.74Å; I85-V107 HydrophobicContact CD1-CG2 4.43Å; I85-V107 HydrophobicContact CG1-CG1 4.28Å; V96-V107 HydrophobicContact CG1-CG2 4.5Å; V96-V107 HydrophobicContact CG2-CB 4.29Å; V96-V107 HydrophobicContact CG2-CG1 4.03Å; A99-V107 HydrophobicContact CB-CG2 3.52Å; A104-V107 HydrophobicContact CB-CG2 4.3Å; V107-I109 HydrophobicContact CG1-CD1 4.39Å; V107-I109 HydrophobicContact CG1-CG1 3.77Å; V107-I133 HydrophobicContact CG2-CD1 3.66Å; V107-P134 PolarHBondContact N-O 2.88Å; V107-A135 HydrophobicContact CB-CB 4.18Å; V107-A135 CarbonylContact O-C 3.55Å; V107-A135 VanDerWaalsContact O-CA 3.31Å; V107-A135 WeakPolarHBondContact O-CA 3.43Å; V107-F136 PolarHBondContact O-N 2.81Å
108	L	97.5	Very high	93.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	124.2	164.6	-61.3	-179.4	0	0	0	108.3	F27 I41 L59 V82 W83 L84 I85 F136	F27-L108 HydrophobicContact CE1-CD1 3.9Å; F27-L108 HydrophobicContact CZ-CD1 4.19Å; I41-L108 HydrophobicContact CD1-CD2 4.24Å; I41-L108 HydrophobicContact CG2-CD2 4.11Å; L59-L108 HydrophobicContact CD1-CD1 3.94Å; V82-L108 HydrophobicContact CG1-CD1 3.78Å; V82-L108 HydrophobicContact CG1-CG 3.63Å; W83-L108 PolarHBondContact O-N 3.01Å; L84-L108 WeakPolarHBondContact CA-O 3.37Å; L84-L108 HydrophobicContact CD1-CB 4.06Å; I85-L108 PolarHBondContact N-O 3.48Å; L108-F136 CarbonylContact C-O 3.53Å; L108-F136 WeakPolarHBondContact CA-O 3.38Å; L108-F136 HydrophobicContact CD2-CB 3.86Å; L108-F136 HydrophobicContact CD2-CD2 4.17Å; L108-F136 HydrophobicContact CD2-CG 4.43Å
109	I	97.6	Very high	93	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	132	172.4	-56.9	-174.8	0	0	0	108.5	I85 R87 F92 K95 V96 V107 M122 F136 Y137 L138	I85-I109 VanDerWaalsContact O-CA 3.3Å; I85-I109 WeakPolarHBondContact O-CA 3.34Å; R87-I109 HydrophobicContact CB-CG2 4.17Å; F92-I109 HydrophobicContact CB-CD1 4.2Å; F92-I109 HydrophobicContact CD1-CD1 3.87Å; F92-I109 HydrophobicContact CD1-CG2 3.98Å; F92-I109 HydrophobicContact CE1-CG2 3.97Å; K95-I109 HydrophobicContact CB-CD1 4.23Å; K95-I109 HydrophobicContact CD-CD1 4.11Å; V96-I109 HydrophobicContact CG2-CD1 3.98Å; V107-I109 HydrophobicContact CG1-CD1 4.39Å; V107-I109 HydrophobicContact CG1-CG1 3.77Å; I109-M122 HydrophobicContact CB-CE 4.5Å; I109-M122 HydrophobicContact CB-SD 3.82Å; I109-M122 HydrophobicContact CD1-CE 4.5Å; I109-M122 HydrophobicContact CD1-SD 3.89Å; I109-M122 HydrophobicContact CG1-SD 4.2Å; I109-M122 HydrophobicContact CG2-SD 4.31Å; I109-F136 PolarHBondContact N-O 2.84Å; I109-Y137 CarbonylContact O-C 3.6Å; I109-Y137 WeakPolarHBondContact O-CA 3.34Å; I109-Y137 WeakPolarHBondContact O-CD2 3.3Å; I109-L138 PolarHBondContact O-N 2.85Å
110	S	97.5	Very high	92.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	143.4	178.4	-171.6	0	0	0	0	112.4	I85 R87 I112 L138 P139 G143	I85-S110 PolarHBondContact O-N 3.3Å; R87-S110 WeakPolarHBondContact CB-O 3.08Å; R87-S110 PolarHBondContact N-O 2.85Å; S110-I112 VanDerWaalsContact C-N 3.28Å; S110-I112 PolarHBondContact O-N 3.49Å; S110-I112 VanDerWaalsContact O-N 3.16Å; S110-L138 WeakPolarHBondContact CA-O 3.47Å; S110-L138 VanDerWaalsContact CB-O 3.26Å; S110-L138 WeakPolarHBondContact CB-O 3.47Å; S110-L138 PolarHBondContact OG-O 3.16Å; S110-P139 PolarHBondContact OG-O 2.94Å; S110-G143 WeakPolarHBondContact OG-CA 3.21Å
111	D	95.2	Very high	92.7	Very high	25 Å²	25	43.2 Å²	43.2	13%	0.134	24%	0.237	C	C	.	.			trans	-84.5	73.5	168.4	-159	-22	0	0	0	111.2	R87 E113 A114 G115 G140	R87-D111 HydrophobicContact CB-CB 4.2Å; R87-D111 WeakPolarHBondContact CD-OD2 3.47Å; R87-D111 IonicContact CZ-OD2 3.74Å; R87-D111 IonicContact NE-OD2 3.63Å; R87-D111 IonicContact NH1-OD2 3.92Å; R87-D111 PolarHBondContact NH1-OD2 2.82Å; D111-E113 PolarHBondContact O-N 3.21Å; D111-A114 HydrophobicContact CB-CB 4.09Å; D111-A114 VanDerWaalsContact CG-CB 3.44Å; D111-A114 PolarHBondContact O-N 2.99Å; D111-A114 WeakPolarHBondContact OD1-CB 3.44Å; D111-A114 PolarHBondContact OD1-N 3.49Å; D111-G115 PolarHBondContact O-N 3.36Å; D111-G115 VanDerWaalsContact O-N 3.08Å; D111-G140 WeakPolarHBondContact O-CA 3.49Å
112	I	92.2	Very high	92.7	Very high	6 Å²	6	36.5 Å²	36.5	3%	0.031	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-31.4	-172.8	-59.5	-173.4	0	0	0	112.2	L84 E86 S110 K144 R147	L84-I112 HydrophobicContact CD2-CD1 4.19Å; L84-I112 HydrophobicContact CG-CD1 4.34Å; E86-I112 HydrophobicContact CG-CB 4.31Å; E86-I112 HydrophobicContact CG-CD1 3.7Å; E86-I112 HydrophobicContact CG-CG1 4.15Å; S110-I112 VanDerWaalsContact C-N 3.28Å; S110-I112 PolarHBondContact O-N 3.49Å; S110-I112 VanDerWaalsContact O-N 3.16Å; I112-K144 HydrophobicContact CG2-CB 3.95Å; I112-K144 HydrophobicContact CG2-CG 4.25Å; I112-R147 HydrophobicContact CD1-CB 3.89Å; I112-R147 HydrophobicContact CD1-CG 4.33Å; I112-R147 HydrophobicContact CG2-CB 4.49Å
113	E	89.6	Confident	92.6	Very high	131 Å²	131	41.8 Å²	41.8	61%	0.612	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-43	179.1	-67.1	-57.3	136.8	0	0	111.5	D111 G115	D111-E113 PolarHBondContact O-N 3.21Å; E113-G115 VanDerWaalsContact C-N 3.3Å; E113-G115 PolarHBondContact O-N 3.34Å
114	A	89.6	Confident	92.2	Very high	56 Å²	56	41.6 Å²	41.6	46%	0.463	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-40.6	173.8	0	0	0	0	0	111.3	D111 D116	D111-A114 HydrophobicContact CB-CB 4.09Å; D111-A114 VanDerWaalsContact CG-CB 3.44Å; D111-A114 PolarHBondContact O-N 2.99Å; D111-A114 WeakPolarHBondContact OD1-CB 3.44Å; D111-A114 PolarHBondContact OD1-N 3.49Å; A114-D116 PolarHBondContact O-N 2.81Å
115	G	87.8	Confident	91.7	Very high	23 Å²	23	45.4 Å²	45.4	24%	0.237	26%	0.258	C	S	.	.			trans	63.1	23.1	176.7	0	0	0	0	0	113.6	D111 E113	D111-G115 PolarHBondContact O-N 3.36Å; D111-G115 VanDerWaalsContact O-N 3.08Å; E113-G115 VanDerWaalsContact C-N 3.3Å; E113-G115 PolarHBondContact O-N 3.34Å
116	D	89.9	Confident	91.2	Very high	53 Å²	53	51.1 Å²	51.1	28%	0.283	27%	0.273	S	S	.	.			trans	-92.1	168.9	-177.5	70.5	12.8	0	0	0	112.8	A114 N118 P139 G140 A141	A114-D116 PolarHBondContact O-N 2.81Å; D116-N118 VanDerWaalsContact C-N 3.3Å; D116-N118 PolarHBondContact OD1-N 3.48Å; D116-N118 PolarHBondContact OD2-ND2 3.01Å; D116-P139 CarbonylContact O-C 3.54Å; D116-G140 CarbonylContact O-C 3.39Å; D116-G140 WeakPolarHBondContact O-CA 3.26Å; D116-G140 PolarHBondContact O-N 3.21Å; D116-A141 PolarHBondContact O-N 2.67Å
117	E	88.5	Confident	90.2	Very high	100 Å²	100	56.3 Å²	56.3	47%	0.467	31%	0.309	S	S	.	.			trans	-91.4	6.2	179.7	-65.4	171	-171.6	0	0	112.2	A141 P180	E117-A141 HydrophobicContact CG-CB 4.03Å; E117-P180 WeakPolarHBondContact OE1-CD 3.41Å; E117-P180 WeakPolarHBondContact OE2-CD 3.29Å; E117-P180 WeakPolarHBondContact OE2-CG 3.01Å
118	N	90.1	Very high	89.3	Confident	102 Å²	102	60.7 Å²	60.7	55%	0.545	34%	0.34	S	S	.	.			trans	-78.9	134.3	-171.3	-65.4	-48.3	0	0	0	111.3	D116 Y137	D116-N118 VanDerWaalsContact C-N 3.3Å; D116-N118 PolarHBondContact OD1-N 3.48Å; D116-N118 PolarHBondContact OD2-ND2 3.01Å; N118-Y137 WeakPolarHBondContact O-CE1 3.45Å
119	F	90.8	Very high	88.5	Confident	56 Å²	56	61.5 Å²	61.5	25%	0.246	34%	0.344	C	S	.	.			trans	-80.4	142.9	167.7	-75.9	-82.1	0	0	0	111.6	Q40 R42 Y137 P139	Q40-F119 HydrophobicContact CB-CZ 3.83Å; Q40-F119 HydrophobicContact CG-CE1 4.2Å; Q40-F119 HydrophobicContact CG-CE2 4.31Å; Q40-F119 HydrophobicContact CG-CZ 3.54Å; R42-F119 HydrophobicContact CB-CD1 3.62Å; R42-F119 HydrophobicContact CB-CE1 4.1Å; R42-F119 VanDerWaalsContact CZ-CB 3.5Å; F119-Y137 HydrophobicContact CD1-CD1 4.15Å; F119-P139 HydrophobicContact CD1-CG 4.07Å; F119-P139 HydrophobicContact CD2-CG 4.31Å; F119-P139 HydrophobicContact CE1-CG 3.57Å; F119-P139 HydrophobicContact CE2-CG 3.83Å; F119-P139 HydrophobicContact CG-CG 4.41Å; F119-P139 HydrophobicContact CZ-CG 3.42Å; F119-P139 VanDerWaalsContact CZ-CG 3.42Å
120	I	91.7	Very high	88.2	Confident	37 Å²	37	67.3 Å²	67.3	19%	0.19	37%	0.369	C	S	.	.			trans	-118.4	128.9	173.4	-59.3	-178.8	0	0	0	109.3	F92 M122 Y137	F92-I120 HydrophobicContact CE2-CG2 4.24Å; F92-I120 HydrophobicContact CZ-CG2 4.08Å; I120-M122 PolarHBondContact O-N 3.27Å; I120-Y137 HydrophobicContact CB-CD1 4.26Å; I120-Y137 HydrophobicContact CB-CD2 3.95Å; I120-Y137 HydrophobicContact CB-CE1 4.1Å; I120-Y137 HydrophobicContact CB-CE2 3.77Å; I120-Y137 HydrophobicContact CB-CG 4.18Å; I120-Y137 HydrophobicContact CD1-CE2 3.78Å; I120-Y137 WeakPolarHBondContact CD1-OH 3.45Å; I120-Y137 HydrophobicContact CG1-CE1 4.04Å; I120-Y137 HydrophobicContact CG1-CE2 3.92Å
121	D	91.4	Very high	88	Confident	68 Å²	68	67.6 Å²	67.6	36%	0.364	37%	0.372	S	S	.	.			trans	-77.8	104.9	174.2	-63.2	-17.3	0	0	0	109.5	R42 M123	R42-D121 WeakPolarHBondContact CD-OD1 3.34Å; R42-D121 IonicContact CZ-OD1 3.54Å; R42-D121 IonicContact NE-OD1 2.82Å; R42-D121 IonicContact NH1-OD1 2.61Å; R42-D121 PolarHBondContact NH1-OD1 3.13Å; D121-M123 PolarHBondContact O-N 2.86Å
122	M	93	Very high	88	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	40%	0.401	C	S	.	.			trans	-79.7	104.8	-178.1	-64	-167.2	-55.3	0	0	110.9	A44 H45 F46 F92 I109 I120 Y137	A44-M122 HydrophobicContact CB-CB 3.89Å; A44-M122 HydrophobicContact CB-CE 3.6Å; H45-M122 PolarHBondContact N-O 3.47Å; F46-M122 HydrophobicContact CE1-CB 4.02Å; F92-M122 HydrophobicContact CB-CB 4.34Å; F92-M122 HydrophobicContact CB-CG 4.48Å; F92-M122 HydrophobicContact CB-SD 4.2Å; F92-M122 HydrophobicContact CD1-CG 4.07Å; F92-M122 HydrophobicContact CD1-SD 3.62Å; F92-M122 HydrophobicContact CD2-CB 3.89Å; F92-M122 HydrophobicContact CD2-CG 3.79Å; F92-M122 HydrophobicContact CD2-SD 4.37Å; F92-M122 HydrophobicContact CE1-CG 4.15Å; F92-M122 HydrophobicContact CE1-SD 3.96Å; F92-M122 HydrophobicContact CE2-CB 4.35Å; F92-M122 HydrophobicContact CE2-CG 3.89Å; F92-M122 HydrophobicContact CG-CB 4.12Å; F92-M122 HydrophobicContact CG-CG 3.88Å; F92-M122 HydrophobicContact CG-SD 3.83Å; F92-M122 HydrophobicContact CZ-CG 4.06Å; F92-M122 HydrophobicContact CZ-SD 4.47Å; I109-M122 HydrophobicContact CB-CE 4.5Å; I109-M122 HydrophobicContact CB-SD 3.82Å; I109-M122 HydrophobicContact CD1-CE 4.5Å; I109-M122 HydrophobicContact CD1-SD 3.89Å; I109-M122 HydrophobicContact CG1-SD 4.2Å; I109-M122 HydrophobicContact CG2-SD 4.31Å; I120-M122 PolarHBondContact O-N 3.27Å; M122-Y137 VanDerWaalsContact CE-N 3.32Å; M122-Y137 HydrophobicContact CG-CD2 4.22Å; M122-Y137 HydrophobicContact SD-CD2 4.03Å
123	M	90	Very high	88.1	Confident	135 Å²	135	75.3 Å²	75.3	67%	0.665	41%	0.405	S	S	*	.			trans	-98.7	151.2	175.7	-62.3	-171.6	-73.4	0	0	111.9	D121	D121-M123 PolarHBondContact O-N 2.86Å
124	G	84.2	Confident	88.4	Confident	27 Å²	27	70 Å²	70	28%	0.278	38%	0.381	S	S	.	.			trans	-80.4	163.6	171.3	0	0	0	0	0	110.9
125	T	83.3	Confident	88.7	Confident	85 Å²	85	67.3 Å²	67.3	52%	0.521	36%	0.359	S	S	.	.	S	Bend	trans	-71.1	-42.5	175.4	-51.5	0	0	0	0	110.8
126	Y	83.7	Confident	89.1	Confident	160 Å²	160	66.3 Å²	66.3	63%	0.627	35%	0.348	S	S	*	.	S	Bend	trans	-123.6	155.7	178.5	-54.4	-73	0	0	0	111.2	S128 D129	Y126-S128 PolarHBondContact O-N 3.5Å; Y126-D129 WeakPolarHBondContact CD2-OD2 3.43Å; Y126-D129 PolarHBondContact N-OD2 3.03Å; Y126-D129 VanDerWaalsContact O-CB 3.27Å; Y126-D129 WeakPolarHBondContact O-CB 3.47Å; Y126-D129 PolarHBondContact O-N 2.76Å
127	S	73.4	Confident	89.4	Confident	118 Å²	118	63.8 Å²	63.8	83%	0.825	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.2	177.5	57.4	0	0	0	0	113.2	D129	S127-D129 PolarHBondContact O-N 2.99Å
128	S	79.1	Confident	89.8	Confident	92 Å²	92	59 Å²	59	64%	0.643	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-13.1	174.3	55.8	0	0	0	0	113.3	Y126 K130	Y126-S128 PolarHBondContact O-N 3.5Å; S128-K130 PolarHBondContact O-N 3.07Å
129	D	80.3	Confident	90	Very high	17 Å²	17	54.5 Å²	54.5	9%	0.091	29%	0.289	C	S	.	.			trans	-74.6	99.7	178.1	-74	-34.4	0	0	0	110.1	F46 I93 R97 Y126 S127	F46-D129 WeakPolarHBondContact CB-O 3.21Å; I93-D129 HydrophobicContact CD1-CB 3.65Å; I93-D129 HydrophobicContact CG1-CB 3.81Å; R97-D129 IonicContact CZ-OD1 2.82Å; R97-D129 VanDerWaalsContact CZ-OD1 3.27Å; R97-D129 IonicContact NH1-OD1 3.46Å; R97-D129 PolarHBondContact NH1-OD1 3.41Å; R97-D129 IonicContact NH2-OD1 2.76Å; R97-D129 PolarHBondContact NH2-OD1 3.32Å; Y126-D129 WeakPolarHBondContact CD2-OD2 3.43Å; Y126-D129 PolarHBondContact N-OD2 3.03Å; Y126-D129 VanDerWaalsContact O-CB 3.27Å; Y126-D129 WeakPolarHBondContact O-CB 3.47Å; Y126-D129 PolarHBondContact O-N 2.76Å; S127-D129 PolarHBondContact O-N 2.99Å
130	K	91	Very high	90.2	Very high	123 Å²	123	51.8 Å²	51.8	54%	0.535	28%	0.277	S	S	.	.			trans	-119.2	140.5	172.3	-60.7	-62.5	179.6	-171.1	0	110.5	H45 F46 S128	H45-K130 PolarHBondContact O-NZ 3.06Å; F46-K130 CarbonylContact O-C 3.59Å; F46-K130 WeakPolarHBondContact O-CA 3.33Å; S128-K130 PolarHBondContact O-N 3.07Å
131	A	93.5	Very high	90.3	Very high	6 Å²	6	50.8 Å²	50.8	5%	0.05	27%	0.274	C	S	.	.			trans	-103.8	147.3	167	0	0	0	0	0	109.2	F46 A48 V96 E100	F46-A131 HydrophobicContact CD2-CB 4.2Å; F46-A131 PolarHBondContact O-N 3.36Å; A48-A131 PolarHBondContact N-O 2.77Å; V96-A131 HydrophobicContact CB-CB 4.48Å; V96-A131 HydrophobicContact CG1-CB 3.51Å; E100-A131 WeakPolarHBondContact OE2-CA 3.11Å
132	K	94.6	Very high	90.4	Very high	172 Å²	172	47.8 Å²	47.8	75%	0.748	26%	0.258	S	S	*	.	S	Bend	trans	-90.2	-9.3	-177.7	-56.9	177	-171.1	166.7	0	113.4	A48 E100	A48-K132 VanDerWaalsContact CB-C 3.46Å; A48-K132 WeakPolarHBondContact CB-O 3.25Å; E100-K132 WeakPolarHBondContact OE1-CB 3.24Å; E100-K132 VanDerWaalsContact OE1-CD 3.25Å; E100-K132 WeakPolarHBondContact OE1-CD 3.21Å; E100-K132 WeakPolarHBondContact OE1-CG 3.18Å; E100-K132 PolarHBondContact OE2-N 3.29Å
133	I	94.6	Very high	90.6	Very high	21 Å²	21	47.8 Å²	47.8	11%	0.108	26%	0.258	C	S	.	.	S	Bend	trans	-104.7	151.6	176.3	63.2	173	0	0	0	110.9	A48 V96 E100 A104 V107	A48-I133 PolarHBondContact N-O 2.94Å; V96-I133 HydrophobicContact CG1-CD1 4.21Å; V96-I133 HydrophobicContact CG1-CG1 3.94Å; E100-I133 HydrophobicContact CB-CD1 3.86Å; E100-I133 HydrophobicContact CB-CG1 4.07Å; E100-I133 HydrophobicContact CB-CG2 4.47Å; E100-I133 HydrophobicContact CG-CG1 4.48Å; E100-I133 HydrophobicContact CG-CG2 4.14Å; A104-I133 HydrophobicContact CB-CD1 4.18Å; V107-I133 HydrophobicContact CG2-CD1 3.66Å
134	P	95.2	Very high	90.8	Very high	19 Å²	19	46.5 Å²	46.5	12%	0.123	25%	0.249	C	C	.	.			trans	-62.5	135.7	169.4	-21.9	34.5	0	0	0	111.2	A48 P50 V106 V107 F136	A48-P134 WeakPolarHBondContact O-CA 3.21Å; P50-P134 HydrophobicContact CB-CB 4.33Å; P50-P134 HydrophobicContact CB-CG 4.09Å; V106-P134 WeakPolarHBondContact CA-O 3.27Å; V106-P134 HydrophobicContact CG1-CB 4.36Å; V106-P134 HydrophobicContact CG2-CB 4.41Å; V106-P134 HydrophobicContact CG2-CG 4.48Å; V107-P134 PolarHBondContact N-O 2.88Å; P134-F136 HydrophobicContact CB-CE2 3.61Å; P134-F136 HydrophobicContact CB-CZ 3.93Å
135	A	96	Very high	91.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	138.4	174.5	0	0	0	0	0	109.8	A44 S47 V96 V107	A44-A135 HydrophobicContact CB-CB 4.19Å; A44-A135 PolarHBondContact N-O 3.1Å; S47-A135 VanDerWaalsContact CB-N 3.33Å; S47-A135 PolarHBondContact OG-O 2.92Å; V96-A135 HydrophobicContact CB-CB 4.41Å; V96-A135 HydrophobicContact CG1-CB 3.87Å; V96-A135 HydrophobicContact CG2-CB 3.58Å; V107-A135 HydrophobicContact CB-CB 4.18Å; V107-A135 CarbonylContact O-C 3.55Å; V107-A135 VanDerWaalsContact O-CA 3.31Å; V107-A135 WeakPolarHBondContact O-CA 3.43Å
136	F	96.6	Very high	91.7	Very high	1 Å²	1	47.7 Å²	47.7	0%	0.004	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	151.6	-177.3	-49.4	-96.5	0	0	0	111.7	F25 I41 R42 M43 P50 V106 V107 L108 I109 P134 I161	F25-F136 HydrophobicContact CB-CD1 4.37Å; F25-F136 HydrophobicContact CB-CE1 3.98Å; F25-F136 HydrophobicContact CD1-CE1 4.46Å; F25-F136 HydrophobicContact CD2-CD1 4.2Å; F25-F136 AromaticContact CD2-CE1 3.59Å; F25-F136 HydrophobicContact CD2-CE1 3.59Å; F25-F136 HydrophobicContact CE2-CE1 4.15Å; F25-F136 HydrophobicContact CG-CD1 4.5Å; F25-F136 AromaticContact CG-CE1 3.77Å; F25-F136 HydrophobicContact CG-CE1 3.77Å; I41-F136 HydrophobicContact CB-CB 3.88Å; I41-F136 HydrophobicContact CB-CG 4.4Å; I41-F136 HydrophobicContact CD1-CB 3.96Å; I41-F136 HydrophobicContact CD1-CD1 3.79Å; I41-F136 HydrophobicContact CD1-CD2 3.91Å; I41-F136 HydrophobicContact CD1-CE1 4.24Å; I41-F136 HydrophobicContact CD1-CE2 4.32Å; I41-F136 HydrophobicContact CD1-CG 3.63Å; I41-F136 HydrophobicContact CD1-CZ 4.49Å; I41-F136 HydrophobicContact CG1-CB 4.29Å; I41-F136 HydrophobicContact CG1-CD1 4.17Å; I41-F136 HydrophobicContact CG1-CG 4.27Å; R42-F136 CarbonylContact O-C 3.57Å; R42-F136 WeakPolarHBondContact O-CA 3.23Å; R42-F136 WeakPolarHBondContact O-CB 3.38Å; M43-F136 HydrophobicContact CB-CD1 3.96Å; M43-F136 HydrophobicContact CB-CE1 4.03Å; M43-F136 HydrophobicContact CE-CE1 3.95Å; M43-F136 HydrophobicContact CE-CZ 4.36Å; M43-F136 HydrophobicContact CG-CE1 4.43Å; P50-F136 HydrophobicContact CB-CZ 4.38Å; P50-F136 HydrophobicContact CG-CZ 4.05Å; V106-F136 HydrophobicContact CG1-CD2 3.82Å; V106-F136 HydrophobicContact CG1-CE2 3.71Å; V107-F136 PolarHBondContact O-N 2.81Å; L108-F136 CarbonylContact C-O 3.53Å; L108-F136 WeakPolarHBondContact CA-O 3.38Å; L108-F136 HydrophobicContact CD2-CB 3.86Å; L108-F136 HydrophobicContact CD2-CD2 4.17Å; L108-F136 HydrophobicContact CD2-CG 4.43Å; I109-F136 PolarHBondContact N-O 2.84Å; P134-F136 HydrophobicContact CB-CE2 3.61Å; P134-F136 HydrophobicContact CB-CZ 3.93Å; F136-I161 HydrophobicContact CD2-CD1 4.29Å; F136-I161 HydrophobicContact CE2-CD1 4.09Å
137	Y	96.7	Very high	92.2	Very high	1 Å²	1	43.5 Å²	43.5	0%	0.004	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	135.1	168.1	-173.8	-94	0	0	0	109.2	I41 R42 I109 N118 F119 I120 M122	I41-Y137 CarbonylContact C-O 3.54Å; I41-Y137 VanDerWaalsContact CA-O 3.27Å; I41-Y137 WeakPolarHBondContact CA-O 3.38Å; R42-Y137 PolarHBondContact N-O 2.9Å; R42-Y137 PolarHBondContact O-N 2.75Å; I109-Y137 CarbonylContact O-C 3.6Å; I109-Y137 WeakPolarHBondContact O-CA 3.34Å; I109-Y137 WeakPolarHBondContact O-CD2 3.3Å; N118-Y137 WeakPolarHBondContact O-CE1 3.45Å; F119-Y137 HydrophobicContact CD1-CD1 4.15Å; I120-Y137 HydrophobicContact CB-CD1 4.26Å; I120-Y137 HydrophobicContact CB-CD2 3.95Å; I120-Y137 HydrophobicContact CB-CE1 4.1Å; I120-Y137 HydrophobicContact CB-CE2 3.77Å; I120-Y137 HydrophobicContact CB-CG 4.18Å; I120-Y137 HydrophobicContact CD1-CE2 3.78Å; I120-Y137 WeakPolarHBondContact CD1-OH 3.45Å; I120-Y137 HydrophobicContact CG1-CE1 4.04Å; I120-Y137 HydrophobicContact CG1-CE2 3.92Å; M122-Y137 VanDerWaalsContact CE-N 3.32Å; M122-Y137 HydrophobicContact CG-CD2 4.22Å; M122-Y137 HydrophobicContact SD-CD2 4.03Å
138	L	96.3	Very high	93.2	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	127.6	173.6	175.9	72.7	0	0	0	108.1	F27 F39 I41 L84 I109 S110 D142 L146	F27-L138 HydrophobicContact CE1-CD1 4.11Å; F39-L138 HydrophobicContact CB-CD1 4.3Å; I41-L138 HydrophobicContact CG2-CB 4.25Å; I41-L138 HydrophobicContact CG2-CD1 3.74Å; L84-L138 HydrophobicContact CD1-CD2 4.13Å; I109-L138 PolarHBondContact O-N 2.85Å; S110-L138 WeakPolarHBondContact CA-O 3.47Å; S110-L138 VanDerWaalsContact CB-O 3.26Å; S110-L138 WeakPolarHBondContact CB-O 3.47Å; S110-L138 PolarHBondContact OG-O 3.16Å; L138-D142 HydrophobicContact CD1-CB 3.76Å; L138-D142 HydrophobicContact CD2-CB 4.3Å; L138-D142 HydrophobicContact CG-CB 4Å; L138-L146 HydrophobicContact CD2-CD1 3.7Å
139	P	94.9	Very high	93.9	Very high	6 Å²	6	38.5 Å²	38.5	4%	0.039	18%	0.175	C	C	.	.			trans	-49	144.3	175.4	-29.3	37.5	0	0	0	112.9	S110 D116 F119 A141 D142 G143	S110-P139 PolarHBondContact OG-O 2.94Å; D116-P139 CarbonylContact O-C 3.54Å; F119-P139 HydrophobicContact CD1-CG 4.07Å; F119-P139 HydrophobicContact CD2-CG 4.31Å; F119-P139 HydrophobicContact CE1-CG 3.57Å; F119-P139 HydrophobicContact CE2-CG 3.83Å; F119-P139 HydrophobicContact CG-CG 4.41Å; F119-P139 HydrophobicContact CZ-CG 3.42Å; F119-P139 VanDerWaalsContact CZ-CG 3.42Å; P139-A141 VanDerWaalsContact C-N 3.28Å; P139-A141 PolarHBondContact O-N 3.19Å; P139-D142 PolarHBondContact O-N 2.93Å; P139-G143 PolarHBondContact O-N 2.85Å
140	G	95	Very high	94.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.3	-38.6	-175.2	0	0	0	0	0	113.3	D111 D116 D142 G143 K144	D111-G140 WeakPolarHBondContact O-CA 3.49Å; D116-G140 CarbonylContact O-C 3.39Å; D116-G140 WeakPolarHBondContact O-CA 3.26Å; D116-G140 PolarHBondContact O-N 3.21Å; G140-D142 PolarHBondContact O-N 3.21Å; G140-G143 PolarHBondContact O-N 3.11Å; G140-K144 WeakPolarHBondContact O-CB 3.24Å; G140-K144 PolarHBondContact O-N 3.04Å
141	A	93.8	Very high	94.6	Very high	16 Å²	16	37.5 Å²	37.5	13%	0.132	18%	0.175	C	C	.	.	H	α-helix	trans	-57.7	-47	178.5	0	0	0	0	0	111.6	D116 E117 P139 R145	D116-A141 PolarHBondContact O-N 2.67Å; E117-A141 HydrophobicContact CG-CB 4.03Å; P139-A141 VanDerWaalsContact C-N 3.28Å; P139-A141 PolarHBondContact O-N 3.19Å; A141-R145 VanDerWaalsContact O-CG 3.29Å; A141-R145 WeakPolarHBondContact O-CG 3.45Å; A141-R145 PolarHBondContact O-N 2.75Å
142	D	94.2	Very high	94.5	Very high	5 Å²	5	46 Å²	46	3%	0.027	21%	0.207	C	C	.	.	H	α-helix	trans	-71.2	-45.8	177.5	-74.9	-23.1	0	0	0	112.2	F39 L138 P139 G140 K144 R145 L146 W178	F39-D142 HydrophobicContact CD1-CB 3.81Å; F39-D142 HydrophobicContact CE1-CB 4.09Å; L138-D142 HydrophobicContact CD1-CB 3.76Å; L138-D142 HydrophobicContact CD2-CB 4.3Å; L138-D142 HydrophobicContact CG-CB 4Å; P139-D142 PolarHBondContact O-N 2.93Å; G140-D142 PolarHBondContact O-N 3.21Å; D142-K144 PolarHBondContact O-N 3.46Å; D142-R145 PolarHBondContact O-N 3.18Å; D142-R145 VanDerWaalsContact O-N 3.1Å; D142-L146 WeakPolarHBondContact O-CG 3.33Å; D142-L146 PolarHBondContact O-N 2.71Å; D142-W178 PolarHBondContact OD1-NE1 3.35Å
143	G	95.7	Very high	94.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-58.2	-39.1	177.8	0	0	0	0	0	112.4	S110 P139 G140 R145 L146 R147	S110-G143 WeakPolarHBondContact OG-CA 3.21Å; P139-G143 PolarHBondContact O-N 2.85Å; G140-G143 PolarHBondContact O-N 3.11Å; G143-R145 PolarHBondContact O-N 3.18Å; G143-L146 PolarHBondContact O-N 3.09Å; G143-R147 VanDerWaalsContact O-CB 3.24Å; G143-R147 WeakPolarHBondContact O-CB 3.44Å; G143-R147 PolarHBondContact O-N 3.33Å
144	K	94.8	Very high	93.6	Very high	108 Å²	108	47.9 Å²	47.9	47%	0.47	22%	0.223	S	C	.	.	H	α-helix	trans	-60.6	-44.5	175	-172.9	170.7	-174.6	166.3	0	112.2	I112 G140 D142 R147 T148	I112-K144 HydrophobicContact CG2-CB 3.95Å; I112-K144 HydrophobicContact CG2-CG 4.25Å; G140-K144 WeakPolarHBondContact O-CB 3.24Å; G140-K144 PolarHBondContact O-N 3.04Å; D142-K144 PolarHBondContact O-N 3.46Å; K144-R147 PolarHBondContact O-N 2.88Å; K144-T148 PolarHBondContact O-N 2.82Å; K144-T148 PolarHBondContact O-OG1 2.95Å
145	R	92.6	Very high	93.4	Very high	136 Å²	136	52 Å²	52	51%	0.513	24%	0.244	S	C	.	.	H	α-helix	trans	-67.6	-46.3	179.8	-65.1	-74.9	-177.4	-168	1	111.6	A141 D142 G143 R147 T148 Y149 W178	A141-R145 VanDerWaalsContact O-CG 3.29Å; A141-R145 WeakPolarHBondContact O-CG 3.45Å; A141-R145 PolarHBondContact O-N 2.75Å; D142-R145 PolarHBondContact O-N 3.18Å; D142-R145 VanDerWaalsContact O-N 3.1Å; G143-R145 PolarHBondContact O-N 3.18Å; R145-R147 VanDerWaalsContact C-N 3.35Å; R145-R147 PolarHBondContact O-N 3.08Å; R145-T148 PolarHBondContact O-N 3.18Å; R145-Y149 PolarHBondContact O-N 3.12Å; R145-W178 HydrophobicContact CB-CH2 3.88Å; R145-W178 HydrophobicContact CB-CZ2 3.55Å; R145-W178 HydrophobicContact CG-CD2 4.04Å; R145-W178 HydrophobicContact CG-CE3 4.37Å; R145-W178 HydrophobicContact CG-CH2 3.95Å; R145-W178 HydrophobicContact CG-CZ2 3.55Å; R145-W178 HydrophobicContact CG-CZ3 4.34Å
146	L	94.3	Very high	93.2	Very high	1 Å²	1	54 Å²	54	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-43.2	175.8	-67.1	177.2	0	0	0	111.3	F27 V29 L35 F39 L59 L84 L138 D142 G143 Y149 L150	F27-L146 HydrophobicContact CE2-CD1 4.46Å; F27-L146 HydrophobicContact CZ-CD1 3.81Å; V29-L146 HydrophobicContact CG2-CD2 4.49Å; L35-L146 HydrophobicContact CD1-CD2 4.3Å; L35-L146 HydrophobicContact CD2-CD2 3.87Å; L35-L146 HydrophobicContact CG-CD2 4.3Å; F39-L146 HydrophobicContact CE1-CD1 4.46Å; F39-L146 HydrophobicContact CE1-CD2 4.35Å; F39-L146 HydrophobicContact CE1-CG 4.37Å; F39-L146 HydrophobicContact CE2-CD2 4.31Å; F39-L146 HydrophobicContact CZ-CD2 3.92Å; F39-L146 HydrophobicContact CZ-CG 4.43Å; L59-L146 HydrophobicContact CD2-CB 4.41Å; L59-L146 HydrophobicContact CD2-CD1 3.99Å; L59-L146 HydrophobicContact CD2-CD2 4.25Å; L59-L146 HydrophobicContact CD2-CG 4.46Å; L84-L146 HydrophobicContact CD2-CB 4.14Å; L138-L146 HydrophobicContact CD2-CD1 3.7Å; D142-L146 WeakPolarHBondContact O-CG 3.33Å; D142-L146 PolarHBondContact O-N 2.71Å; G143-L146 PolarHBondContact O-N 3.09Å; L146-Y149 PolarHBondContact O-N 2.91Å; L146-L150 WeakPolarHBondContact O-CB 3.36Å; L146-L150 VanDerWaalsContact O-CG 3.24Å; L146-L150 WeakPolarHBondContact O-CG 3.4Å; L146-L150 PolarHBondContact O-N 3.33Å
147	R	94.7	Very high	93.1	Very high	72 Å²	72	54 Å²	54	27%	0.272	26%	0.261	S	S	.	.	H	α-helix	trans	-61.2	-46.8	175.6	178.6	-173.6	-173.6	-90.1	7.6	112.1	L61 L84 E86 I112 G143 K144 R145 Y149 L150 L151	L61-R147 HydrophobicContact CD1-CG 4.05Å; L61-R147 HydrophobicContact CD2-CG 4.35Å; L84-R147 HydrophobicContact CD2-CB 4.35Å; E86-R147 IonicContact OE1-CZ 2.75Å; E86-R147 IonicContact OE1-NE 2.67Å; E86-R147 PolarHBondContact OE1-NE 3.07Å; E86-R147 IonicContact OE1-NH2 3.27Å; E86-R147 PolarHBondContact OE1-NH2 3.44Å; I112-R147 HydrophobicContact CD1-CB 3.89Å; I112-R147 HydrophobicContact CD1-CG 4.33Å; I112-R147 HydrophobicContact CG2-CB 4.49Å; G143-R147 VanDerWaalsContact O-CB 3.24Å; G143-R147 WeakPolarHBondContact O-CB 3.44Å; G143-R147 PolarHBondContact O-N 3.33Å; K144-R147 PolarHBondContact O-N 2.88Å; R145-R147 VanDerWaalsContact C-N 3.35Å; R145-R147 PolarHBondContact O-N 3.08Å; R147-Y149 VanDerWaalsContact C-N 3.25Å; R147-Y149 PolarHBondContact O-N 3.4Å; R147-L150 PolarHBondContact O-N 2.82Å; R147-L151 HydrophobicContact CG-CD1 3.82Å; R147-L151 HydrophobicContact CG-CG 4.3Å; R147-L151 WeakPolarHBondContact O-CB 3.43Å; R147-L151 WeakPolarHBondContact O-CG 3.11Å; R147-L151 PolarHBondContact O-N 2.94Å
148	T	93.4	Very high	93.1	Very high	66 Å²	66	58.2 Å²	58.2	41%	0.405	28%	0.277	S	S	.	.	H	α-helix	trans	-56.3	-44.2	175.4	-61.5	0	0	0	0	110.6	K144 R145 L151 Y152	K144-T148 PolarHBondContact O-N 2.82Å; K144-T148 PolarHBondContact O-OG1 2.95Å; R145-T148 PolarHBondContact O-N 3.18Å; T148-L151 PolarHBondContact O-N 3.34Å; T148-Y152 HydrophobicContact CG2-CD2 3.81Å; T148-Y152 HydrophobicContact CG2-CE2 4.22Å; T148-Y152 VanDerWaalsContact O-CD2 3.23Å; T148-Y152 WeakPolarHBondContact O-CD2 3.36Å; T148-Y152 PolarHBondContact O-N 3.38Å; T148-Y152 VanDerWaalsContact O-N 3.09Å
149	Y	93.3	Very high	93	Very high	39 Å²	39	58.2 Å²	58.2	15%	0.153	28%	0.277	C	S	.	.	H	α-helix	trans	-65	-44.5	176.5	-170	-80.9	0	0	0	112.2	P32 L35 R145 L146 R147 L151 G153 V157	P32-Y149 HydrophobicContact CG-CE1 4.09Å; P32-Y149 HydrophobicContact CG-CE2 3.93Å; P32-Y149 VanDerWaalsContact CG-CZ 3.49Å; P32-Y149 VanDerWaalsContact CG-OH 3.26Å; P32-Y149 WeakPolarHBondContact CG-OH 3.3Å; L35-Y149 HydrophobicContact CD2-CD1 3.92Å; L35-Y149 HydrophobicContact CD2-CD2 4.17Å; L35-Y149 HydrophobicContact CD2-CE1 4.48Å; L35-Y149 HydrophobicContact CD2-CG 3.79Å; R145-Y149 PolarHBondContact O-N 3.12Å; L146-Y149 PolarHBondContact O-N 2.91Å; R147-Y149 VanDerWaalsContact C-N 3.25Å; R147-Y149 PolarHBondContact O-N 3.4Å; Y149-L151 VanDerWaalsContact C-N 3.27Å; Y149-L151 PolarHBondContact O-N 3Å; Y149-G153 WeakPolarHBondContact O-CA 3.23Å; Y149-G153 PolarHBondContact O-N 3.25Å; Y149-V157 HydrophobicContact CD1-CG2 3.4Å; Y149-V157 HydrophobicContact CE1-CG2 3.5Å; Y149-V157 VanDerWaalsContact CE1-CG2 3.5Å
150	L	93.3	Very high	92.9	Very high	42 Å²	42	61.5 Å²	61.5	22%	0.22	29%	0.291	C	S	.	.	H	α-helix	trans	-66.2	-27.9	-179.8	-69.9	165	0	0	0	113.1	L59 L61 L84 L146 R147 V157	L59-L150 HydrophobicContact CD2-CD1 4.15Å; L59-L150 HydrophobicContact CG-CD1 4.08Å; L59-L150 WeakPolarHBondContact O-CD2 3.48Å; L61-L150 HydrophobicContact CB-CB 4.34Å; L61-L150 HydrophobicContact CB-CD1 4.34Å; L84-L150 HydrophobicContact CD2-CD1 4.01Å; L146-L150 WeakPolarHBondContact O-CB 3.36Å; L146-L150 VanDerWaalsContact O-CG 3.24Å; L146-L150 WeakPolarHBondContact O-CG 3.4Å; L146-L150 PolarHBondContact O-N 3.33Å; R147-L150 PolarHBondContact O-N 2.82Å; L150-V157 HydrophobicContact CD2-CB 4.09Å; L150-V157 HydrophobicContact CD2-CG2 3.72Å; L150-V157 HydrophobicContact CG-CG2 4.49Å
151	L	92.6	Very high	92.7	Very high	77 Å²	77	61.6 Å²	61.6	40%	0.403	29%	0.291	S	S	.	.	H	α-helix	trans	-81.7	-40.6	178.1	-74.2	173	0	0	0	113.4	L61 R147 T148 Y149	L61-L151 HydrophobicContact CD2-CD2 3.57Å; L61-L151 HydrophobicContact CD2-CG 3.93Å; R147-L151 HydrophobicContact CG-CD1 3.82Å; R147-L151 HydrophobicContact CG-CG 4.3Å; R147-L151 WeakPolarHBondContact O-CB 3.43Å; R147-L151 WeakPolarHBondContact O-CG 3.11Å; R147-L151 PolarHBondContact O-N 2.94Å; T148-L151 PolarHBondContact O-N 3.34Å; Y149-L151 VanDerWaalsContact C-N 3.27Å; Y149-L151 PolarHBondContact O-N 3Å
152	Y	92.3	Very high	92.3	Very high	183 Å²	183	61.5 Å²	61.5	72%	0.718	29%	0.289	S	S	*	.	H	α-helix	trans	-112.8	-15.4	-170.8	-56.9	-64.7	0	0	0	113.9	T148	T148-Y152 HydrophobicContact CG2-CD2 3.81Å; T148-Y152 HydrophobicContact CG2-CE2 4.22Å; T148-Y152 VanDerWaalsContact O-CD2 3.23Å; T148-Y152 WeakPolarHBondContact O-CD2 3.36Å; T148-Y152 PolarHBondContact O-N 3.38Å; T148-Y152 VanDerWaalsContact O-N 3.09Å
153	G	86.9	Confident	91.5	Very high	31 Å²	31	62.2 Å²	62.2	32%	0.32	29%	0.293	S	S	.	.			trans	-69.8	153.9	174.8	0	0	0	0	0	111.3	Y149	Y149-G153 WeakPolarHBondContact O-CA 3.23Å; Y149-G153 PolarHBondContact O-N 3.25Å
154	K	83	Confident	90.2	Very high	203 Å²	203	67.3 Å²	67.3	88%	0.883	32%	0.32	S	S	*	.	S	Bend	trans	-97.5	-24.4	178.3	-65	-177.4	180	179.3	0	112.5
155	D	90.5	Very high	88.6	Confident	104 Å²	104	63.8 Å²	63.8	56%	0.556	31%	0.306	S	S	*	.	S	Bend	trans	-96.2	144.3	-171.7	-57.6	-46.3	0	0	0	111.3	V157	D155-V157 PolarHBondContact O-N 3.46Å
156	A	92.6	Very high	86.9	Confident	43 Å²	43	61.5 Å²	61.5	36%	0.355	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-65.7	130.1	172.3	0	0	0	0	0	110.2	Q58 W158	Q58-A156 HydrophobicContact CG-CB 4.5Å; A156-W158 PolarHBondContact O-N 3.13Å
157	V	94.8	Very high	85	Confident	1 Å²	1	70.4 Å²	70.4	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	116	176.2	-176.6	0	0	0	0	109.3	V29 E31 L35 Q58 L59 Y149 L150 D155 I159	V29-V157 HydrophobicContact CG1-CG1 3.99Å; V29-V157 HydrophobicContact CG2-CG1 4.3Å; E31-V157 CarbonylContact O-C 3.5Å; E31-V157 VanDerWaalsContact O-CA 3.28Å; E31-V157 WeakPolarHBondContact O-CA 3.47Å; L35-V157 HydrophobicContact CD2-CG1 4.25Å; L35-V157 HydrophobicContact CD2-CG2 4.22Å; Q58-V157 CarbonylContact C-O 3.58Å; Q58-V157 WeakPolarHBondContact CA-O 3.41Å; L59-V157 HydrophobicContact CB-CB 4.15Å; L59-V157 HydrophobicContact CB-CG1 4Å; L59-V157 HydrophobicContact CD2-CG1 4.08Å; L59-V157 PolarHBondContact N-O 3Å; Y149-V157 HydrophobicContact CD1-CG2 3.4Å; Y149-V157 HydrophobicContact CE1-CG2 3.5Å; Y149-V157 VanDerWaalsContact CE1-CG2 3.5Å; L150-V157 HydrophobicContact CD2-CB 4.09Å; L150-V157 HydrophobicContact CD2-CG2 3.72Å; L150-V157 HydrophobicContact CG-CG2 4.49Å; D155-V157 PolarHBondContact O-N 3.46Å; V157-I159 HydrophobicContact CG1-CG2 4.04Å
158	W	95	Very high	83.3	Confident	90 Å²	90	69.8 Å²	69.8	34%	0.341	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.7	176	-69.2	90.1	0	0	0	109.8	L30 E31 R56 Q58 A156	L30-W158 WeakPolarHBondContact CB-O 3.42Å; L30-W158 PolarHBondContact N-O 3.22Å; E31-W158 HydrophobicContact CB-CB 4.24Å; E31-W158 PolarHBondContact N-O 2.65Å; E31-W158 PolarHBondContact O-N 3.21Å; R56-W158 HydrophobicContact CG-CE3 4.02Å; Q58-W158 HydrophobicContact CB-CD2 4.36Å; Q58-W158 HydrophobicContact CB-CE3 4.06Å; Q58-W158 HydrophobicContact CB-CH2 4.06Å; Q58-W158 HydrophobicContact CB-CZ2 4.35Å; Q58-W158 HydrophobicContact CB-CZ3 3.91Å; A156-W158 PolarHBondContact O-N 3.13Å
159	I	94.5	Very high	81.8	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	156.9	-178.2	70.9	169.1	0	0	0	112.3	F27 E28 V29 R56 L57 L59 V82 V157 I161	F27-I159 HydrophobicContact CB-CD1 4.43Å; F27-I159 HydrophobicContact CD2-CB 3.93Å; F27-I159 HydrophobicContact CD2-CD1 3.87Å; F27-I159 HydrophobicContact CD2-CG2 3.94Å; F27-I159 HydrophobicContact CE2-CB 4.5Å; F27-I159 HydrophobicContact CE2-CD1 4.32Å; F27-I159 HydrophobicContact CE2-CG2 4.01Å; F27-I159 HydrophobicContact CG-CD1 4.17Å; E28-I159 CarbonylContact O-C 3.46Å; E28-I159 WeakPolarHBondContact O-CA 3.45Å; E28-I159 WeakPolarHBondContact O-CB 3.45Å; V29-I159 HydrophobicContact CG2-CG2 3.96Å; R56-I159 WeakPolarHBondContact CA-O 3.35Å; L57-I159 PolarHBondContact N-O 2.78Å; L57-I159 PolarHBondContact O-N 3.37Å; L59-I159 HydrophobicContact CB-CD1 4.46Å; L59-I159 HydrophobicContact CB-CG2 3.96Å; L59-I159 HydrophobicContact CD2-CG2 4.46Å; V82-I159 HydrophobicContact CB-CD1 3.93Å; V82-I159 HydrophobicContact CG1-CD1 3.99Å; V82-I159 HydrophobicContact CG2-CD1 3.7Å; V82-I159 HydrophobicContact CG2-CG1 4.13Å; V157-I159 HydrophobicContact CG1-CG2 4.04Å; I159-I161 HydrophobicContact CD1-CB 4.43Å; I159-I161 HydrophobicContact CD1-CG2 4.31Å; I159-I161 HydrophobicContact CG1-CG2 4.48Å
160	K	92.8	Very high	80.4	Confident	75 Å²	75	71.6 Å²	71.6	33%	0.326	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117.5	170.8	-172	178.1	177.8	-175.9	0	110	F27 E28 L30 S54 Y55 L163	F27-K160 VanDerWaalsContact CA-O 3.23Å; F27-K160 WeakPolarHBondContact CA-O 3.34Å; F27-K160 WeakPolarHBondContact CB-O 3.41Å; E28-K160 PolarHBondContact N-O 2.7Å; E28-K160 VanDerWaalsContact N-O 3.1Å; E28-K160 PolarHBondContact O-N 2.85Å; L30-K160 HydrophobicContact CD1-CB 4.07Å; L30-K160 HydrophobicContact CD2-CB 4.05Å; L30-K160 HydrophobicContact CG-CB 4.1Å; S54-K160 VanDerWaalsContact CB-CE 3.49Å; S54-K160 WeakPolarHBondContact OG-CE 3.48Å; Y55-K160 WeakPolarHBondContact O-CA 3.28Å; K160-L163 HydrophobicContact CB-CD2 4.11Å; K160-L163 HydrophobicContact CD-CD2 3.82Å; K160-L163 HydrophobicContact CG-CD2 3.93Å
161	I	90.8	Very high	79.1	Confident	2 Å²	2	76.3 Å²	76.3	1%	0.01	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	142.2	-175.3	-170.4	167.8	0	0	0	112.2	F27 I41 Y55 L57 V82 V106 F136 I159	F27-I161 HydrophobicContact CB-CB 3.86Å; F27-I161 HydrophobicContact CB-CD1 4.1Å; F27-I161 HydrophobicContact CB-CG1 4Å; I41-I161 HydrophobicContact CD1-CD1 3.61Å; I41-I161 HydrophobicContact CD1-CG1 4.28Å; Y55-I161 PolarHBondContact N-O 3.07Å; Y55-I161 PolarHBondContact O-N 2.86Å; L57-I161 HydrophobicContact CD1-CG2 4.18Å; V82-I161 HydrophobicContact CG2-CG2 4.12Å; V106-I161 HydrophobicContact CG1-CD1 4Å; F136-I161 HydrophobicContact CD2-CD1 4.29Å; F136-I161 HydrophobicContact CE2-CD1 4.09Å; I159-I161 HydrophobicContact CD1-CB 4.43Å; I159-I161 HydrophobicContact CD1-CG2 4.31Å; I159-I161 HydrophobicContact CG1-CG2 4.48Å
162	P	85.8	Confident	77.7	Confident	14 Å²	14	78.2 Å²	78.2	9%	0.091	40%	0.396	C	S	.	.	S	Bend	cis	-68.6	152.7	-21.5	32.9	-35.4	0	0	0	110.8	F25 P50 S54	F25-P162 HydrophobicContact CD1-CB 3.73Å; F25-P162 HydrophobicContact CE1-CB 4.37Å; P50-P162 HydrophobicContact CB-CG 3.85Å; P50-P162 HydrophobicContact CG-CB 4.4Å; P50-P162 HydrophobicContact CG-CG 3.98Å; S54-P162 WeakPolarHBondContact CB-O 3.23Å
163	L	77.7	Confident	76.8	Confident	19 Å²	19	70 Å²	70	10%	0.099	37%	0.365	C	S	.	.			trans	-76.1	128.2	164.6	-63.9	177.8	0	0	0	109.3	F26 E28 K160 L165	F26-L163 HydrophobicContact CB-CB 4.17Å; F26-L163 HydrophobicContact CB-CD1 3.91Å; F26-L163 HydrophobicContact CB-CG 4.39Å; F26-L163 PolarHBondContact O-N 2.95Å; E28-L163 HydrophobicContact CB-CD1 3.82Å; E28-L163 HydrophobicContact CB-CD2 3.89Å; E28-L163 HydrophobicContact CB-CG 4.28Å; K160-L163 HydrophobicContact CB-CD2 4.11Å; K160-L163 HydrophobicContact CD-CD2 3.82Å; K160-L163 HydrophobicContact CG-CD2 3.93Å; L163-L165 VanDerWaalsContact C-N 3.34Å; L163-L165 HydrophobicContact CB-CD2 3.87Å; L163-L165 HydrophobicContact CB-CG 3.89Å; L163-L165 HydrophobicContact CD1-CD2 4.03Å; L163-L165 HydrophobicContact CD1-CG 4.46Å; L163-L165 PolarHBondContact O-N 3.35Å; L163-L165 VanDerWaalsContact O-N 3.12Å
164	N	67.5	Low	76.4	Confident	107 Å²	107	75.9 Å²	75.9	57%	0.572	38%	0.377	S	S	*	.			trans	-81.6	84.5	166.3	-172.7	-3.4	0	0	0	109	S166	N164-S166 PolarHBondContact O-N 3.32Å; N164-S166 VanDerWaalsContact OD1-CB 3.27Å; N164-S166 WeakPolarHBondContact OD1-CB 3.42Å; N164-S166 PolarHBondContact OD1-N 3.05Å; N164-S166 PolarHBondContact OD1-OG 2.76Å
165	L	62.8	Low	76.2	Confident	34 Å²	34	68.8 Å²	68.8	18%	0.178	35%	0.346	C	S	.	.			trans	-82.3	12	178.3	-62.4	-171.6	0	0	0	113.8	F26 L163 F167 V168 L170 V173	F26-L165 HydrophobicContact CB-CD1 3.75Å; F26-L165 HydrophobicContact CB-CG 4.34Å; F26-L165 HydrophobicContact CD1-CD1 4.05Å; F26-L165 HydrophobicContact CD2-CD1 3.37Å; F26-L165 HydrophobicContact CD2-CG 4.17Å; F26-L165 HydrophobicContact CE2-CD1 3.94Å; F26-L165 HydrophobicContact CG-CD1 3.42Å; F26-L165 VanDerWaalsContact CG-CD1 3.42Å; F26-L165 HydrophobicContact CG-CG 4.39Å; F26-L165 HydrophobicContact CZ-CD1 4.5Å; L163-L165 VanDerWaalsContact C-N 3.34Å; L163-L165 HydrophobicContact CB-CD2 3.87Å; L163-L165 HydrophobicContact CB-CG 3.89Å; L163-L165 HydrophobicContact CD1-CD2 4.03Å; L163-L165 HydrophobicContact CD1-CG 4.46Å; L163-L165 PolarHBondContact O-N 3.35Å; L163-L165 VanDerWaalsContact O-N 3.12Å; L165-F167 PolarHBondContact O-N 3.37Å; L165-V168 HydrophobicContact CD2-CB 3.91Å; L165-V168 HydrophobicContact CD2-CG1 4.31Å; L165-V168 HydrophobicContact CD2-CG2 4.09Å; L165-V168 PolarHBondContact O-N 2.91Å; L165-V168 VanDerWaalsContact O-N 3.08Å; L165-L170 HydrophobicContact CD1-CD2 4.34Å; L165-V173 HydrophobicContact CD1-CG2 4.11Å; L165-V173 HydrophobicContact CD2-CG2 4.35Å
166	S	56.7	Low	75.7	Confident	89 Å²	89	64 Å²	64	62%	0.622	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-23.6	-176.4	-56.5	0	0	0	0	114	N164	N164-S166 PolarHBondContact O-N 3.32Å; N164-S166 VanDerWaalsContact OD1-CB 3.27Å; N164-S166 WeakPolarHBondContact OD1-CB 3.42Å; N164-S166 PolarHBondContact OD1-N 3.05Å; N164-S166 PolarHBondContact OD1-OG 2.76Å
167	F	53.2	Low	75.1	Confident	188 Å²	188	66.5 Å²	66.5	83%	0.825	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.7	8.7	-178.7	-55	-73.8	0	0	0	114.3	L165 P169	L165-F167 PolarHBondContact O-N 3.37Å; F167-P169 WeakPolarHBondContact O-CD 3.31Å
168	V	59.4	Low	74.3	Confident	59 Å²	59	70 Å²	70	36%	0.358	35%	0.346	S	S	.	.	S	Bend	trans	-102.2	107.4	179.8	-177.2	0	0	0	0	108.6	L165 L170 M172 V173	L165-V168 HydrophobicContact CD2-CB 3.91Å; L165-V168 HydrophobicContact CD2-CG1 4.31Å; L165-V168 HydrophobicContact CD2-CG2 4.09Å; L165-V168 PolarHBondContact O-N 2.91Å; L165-V168 VanDerWaalsContact O-N 3.08Å; V168-L170 PolarHBondContact O-N 3.44Å; V168-M172 HydrophobicContact CG1-CB 4.32Å; V168-V173 HydrophobicContact CG1-CG2 4Å
169	P	61.6	Low	73.1	Confident	59 Å²	59	67.5 Å²	67.5	38%	0.383	34%	0.34	S	S	.	.			trans	-47.8	126.2	167.2	-31.6	31.4	0	0	0	111.6	F167 H171 M172	F167-P169 WeakPolarHBondContact O-CD 3.31Å; P169-H171 WeakPolarHBondContact CB-CE1 3.06Å; P169-H171 VanDerWaalsContact CB-ND1 3.33Å; P169-H171 WeakPolarHBondContact CB-ND1 3.36Å; P169-H171 PolarHBondContact O-N 2.86Å; P169-M172 HydrophobicContact CB-CE 3.9Å; P169-M172 HydrophobicContact CG-CE 3.54Å; P169-M172 WeakPolarHBondContact O-CB 3.44Å; P169-M172 PolarHBondContact O-N 3.5Å
170	L	64.8	Low	71.5	Confident	83 Å²	83	72 Å²	72	44%	0.435	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-56.7	-23	-175.4	-67.4	175.2	0	0	0	113.7	F26 L165 V168 M172 V173 K175	F26-L170 HydrophobicContact CZ-CD2 4.45Å; L165-L170 HydrophobicContact CD1-CD2 4.34Å; V168-L170 PolarHBondContact O-N 3.44Å; L170-M172 VanDerWaalsContact C-N 3.26Å; L170-M172 PolarHBondContact O-N 3.13Å; L170-V173 HydrophobicContact CD2-CG2 4.46Å; L170-V173 WeakPolarHBondContact O-CB 3.36Å; L170-V173 PolarHBondContact O-N 2.91Å; L170-K175 WeakPolarHBondContact O-CE 3.42Å
171	H	65.7	Low	69.7	Low	142 Å²	142	74.1 Å²	74.1	66%	0.657	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-70.7	-19.5	175	71.3	-97.2	0	0	0	113.8	P169	P169-H171 WeakPolarHBondContact CB-CE1 3.06Å; P169-H171 VanDerWaalsContact CB-ND1 3.33Å; P169-H171 WeakPolarHBondContact CB-ND1 3.36Å; P169-H171 PolarHBondContact O-N 2.86Å
172	M	62.3	Low	68.7	Low	116 Å²	116	77.7 Å²	77.7	57%	0.571	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-87.8	-11	175.1	-65.8	-164.2	-72.5	0	0	112.5	V168 P169 L170 R174	V168-M172 HydrophobicContact CG1-CB 4.32Å; P169-M172 HydrophobicContact CB-CE 3.9Å; P169-M172 HydrophobicContact CG-CE 3.54Å; P169-M172 WeakPolarHBondContact O-CB 3.44Å; P169-M172 PolarHBondContact O-N 3.5Å; L170-M172 VanDerWaalsContact C-N 3.26Å; L170-M172 PolarHBondContact O-N 3.13Å; M172-R174 PolarHBondContact O-N 2.04Å
173	V	74	Confident	67.8	Low	12 Å²	12	81.1 Å²	81.1	7%	0.073	41%	0.409	C	S	.	.	S	Bend	trans	-72.6	125.4	174.5	-179.9	0	0	0	0	107.6	S38 L165 V168 L170 K175	S38-V173 WeakPolarHBondContact OG-CG1 3.29Å; L165-V173 HydrophobicContact CD1-CG2 4.11Å; L165-V173 HydrophobicContact CD2-CG2 4.35Å; V168-V173 HydrophobicContact CG1-CG2 4Å; L170-V173 HydrophobicContact CD2-CG2 4.46Å; L170-V173 WeakPolarHBondContact O-CB 3.36Å; L170-V173 PolarHBondContact O-N 2.91Å; V173-K175 WeakPolarHBondContact O-CG 3.47Å; V173-K175 PolarHBondContact O-N 3.34Å
174	R	78.6	Confident	67.2	Low	153 Å²	153	84.5 Å²	84.5	58%	0.577	43%	0.427	S	S	*	.			trans	-74.6	111.8	176.3	-65.1	-174.2	88	-162.7	6.5	108.3	Y37 S38 M172	Y37-R174 CarbonylContact C-O 3.46Å; Y37-R174 VanDerWaalsContact CA-O 3.24Å; Y37-R174 WeakPolarHBondContact CA-O 3.4Å; Y37-R174 WeakPolarHBondContact CB-O 3.14Å; Y37-R174 HydrophobicContact CD1-CB 4.24Å; S38-R174 PolarHBondContact N-O 2.97Å; M172-R174 PolarHBondContact O-N 2.04Å
175	K	79.8	Confident	67.2	Low	55 Å²	55	83.2 Å²	83.2	24%	0.239	42%	0.418	C	S	.	.			trans	-95.7	142.8	-172.3	-73.9	166.1	159.8	-153.9	0	110.9	Y37 L170 V173 W181	Y37-K175 WeakPolarHBondContact CD1-O 3.04Å; Y37-K175 VanDerWaalsContact CE1-O 3.3Å; Y37-K175 WeakPolarHBondContact CE1-O 3.43Å; L170-K175 WeakPolarHBondContact O-CE 3.42Å; V173-K175 WeakPolarHBondContact O-CG 3.47Å; V173-K175 PolarHBondContact O-N 3.34Å; K175-W181 HydrophobicContact CB-CD2 4.48Å; K175-W181 HydrophobicContact CB-CG 3.97Å; K175-W181 VanDerWaalsContact CB-NE1 3.35Å; K175-W181 HydrophobicContact CD-CB 3.56Å; K175-W181 VanDerWaalsContact CD-CD1 3.43Å; K175-W181 HydrophobicContact CD-CD2 3.39Å; K175-W181 HydrophobicContact CD-CE3 4.09Å; K175-W181 HydrophobicContact CD-CG 3.16Å; K175-W181 HydrophobicContact CD-CZ2 4.21Å; K175-W181 VanDerWaalsContact CE-CZ3 3.48Å; K175-W181 HydrophobicContact CG-CB 4.49Å; K175-W181 VanDerWaalsContact CG-CD1 3.42Å; K175-W181 HydrophobicContact CG-CD2 3.77Å; K175-W181 HydrophobicContact CG-CG 3.69Å; K175-W181 HydrophobicContact CG-CZ2 3.78Å; K175-W181 VanDerWaalsContact CG-NE1 3.26Å
176	P	79	Confident	67.5	Low	2 Å²	2	86.3 Å²	86.3	1%	0.013	43%	0.433	C	S	.	.			trans	-57.5	138.4	174.5	-20.2	31.4	0	0	0	110	Y37 S38 F39 W178 D179	Y37-P176 HydrophobicContact CG-CB 4.44Å; Y37-P176 HydrophobicContact CG-CG 4.39Å; S38-P176 WeakPolarHBondContact O-CD 3.46Å; F39-P176 HydrophobicContact CD1-CG 3.97Å; F39-P176 HydrophobicContact CE1-CB 4.45Å; F39-P176 HydrophobicContact CE1-CG 3.66Å; F39-P176 HydrophobicContact CZ-CG 4.05Å; P176-W178 HydrophobicContact CB-CD2 3.95Å; P176-W178 HydrophobicContact CB-CG 4.42Å; P176-W178 HydrophobicContact CB-CH2 4.17Å; P176-W178 HydrophobicContact CB-CZ2 3.54Å; P176-W178 HydrophobicContact CG-CZ2 4.38Å; P176-W178 PolarHBondContact O-N 3.46Å; P176-W178 VanDerWaalsContact O-N 3.09Å; P176-D179 HydrophobicContact CB-CB 4.33Å; P176-D179 PolarHBondContact O-N 3.33Å; P176-D179 VanDerWaalsContact O-N 3.09Å
177	P	79.6	Confident	68.2	Low	96 Å²	96	86.1 Å²	86.1	62%	0.623	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-11.7	-172.2	26.2	-34.7	0	0	0	114
178	W	77.6	Confident	69.3	Low	74 Å²	74	78.8 Å²	78.8	28%	0.28	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-9.2	176.7	53.5	77.6	0	0	0	113.5	F39 D142 R145 P176	F39-W178 HydrophobicContact CE1-CZ2 4.27Å; D142-W178 PolarHBondContact OD1-NE1 3.35Å; R145-W178 HydrophobicContact CB-CH2 3.88Å; R145-W178 HydrophobicContact CB-CZ2 3.55Å; R145-W178 HydrophobicContact CG-CD2 4.04Å; R145-W178 HydrophobicContact CG-CE3 4.37Å; R145-W178 HydrophobicContact CG-CH2 3.95Å; R145-W178 HydrophobicContact CG-CZ2 3.55Å; R145-W178 HydrophobicContact CG-CZ3 4.34Å; P176-W178 HydrophobicContact CB-CD2 3.95Å; P176-W178 HydrophobicContact CB-CG 4.42Å; P176-W178 HydrophobicContact CB-CH2 4.17Å; P176-W178 HydrophobicContact CB-CZ2 3.54Å; P176-W178 HydrophobicContact CG-CZ2 4.38Å; P176-W178 PolarHBondContact O-N 3.46Å; P176-W178 VanDerWaalsContact O-N 3.09Å
179	D	71	Confident	70	Confident	38 Å²	38	80.3 Å²	80.3	20%	0.203	39%	0.394	C	S	.	.	S	Bend	trans	-92.3	119.1	179.5	-175.3	-7.3	0	0	0	108.2	P176 W181	P176-D179 HydrophobicContact CB-CB 4.33Å; P176-D179 PolarHBondContact O-N 3.33Å; P176-D179 VanDerWaalsContact O-N 3.09Å; D179-W181 VanDerWaalsContact C-N 3.28Å; D179-W181 VanDerWaalsContact O-CD1 3.25Å; D179-W181 PolarHBondContact O-N 3.23Å; D179-W181 PolarHBondContact OD2-NE1 2.59Å
180	P	61	Low	70.7	Confident	96 Å²	96	82.1 Å²	82.1	62%	0.623	40%	0.395	S	S	*	.			trans	-75.9	-0.3	-165.6	27.2	-34.4	0	0	0	116.7	E117	E117-P180 WeakPolarHBondContact OE1-CD 3.41Å; E117-P180 WeakPolarHBondContact OE2-CD 3.29Å; E117-P180 WeakPolarHBondContact OE2-CG 3.01Å
181	W	55.2	Low	71.3	Confident	118 Å²	118	82 Å²	82	45%	0.447	39%	0.392	S	S	.	.			trans	19.7	0	163.1	-79.8	116.4	0	0	0	121.6	F26 K175 D179	F26-W181 AromaticContact CE1-CH2 3.84Å; F26-W181 HydrophobicContact CE1-CH2 3.84Å; K175-W181 HydrophobicContact CB-CD2 4.48Å; K175-W181 HydrophobicContact CB-CG 3.97Å; K175-W181 VanDerWaalsContact CB-NE1 3.35Å; K175-W181 HydrophobicContact CD-CB 3.56Å; K175-W181 VanDerWaalsContact CD-CD1 3.43Å; K175-W181 HydrophobicContact CD-CD2 3.39Å; K175-W181 HydrophobicContact CD-CE3 4.09Å; K175-W181 HydrophobicContact CD-CG 3.16Å; K175-W181 HydrophobicContact CD-CZ2 4.21Å; K175-W181 VanDerWaalsContact CE-CZ3 3.48Å; K175-W181 HydrophobicContact CG-CB 4.49Å; K175-W181 VanDerWaalsContact CG-CD1 3.42Å; K175-W181 HydrophobicContact CG-CD2 3.77Å; K175-W181 HydrophobicContact CG-CG 3.69Å; K175-W181 HydrophobicContact CG-CZ2 3.78Å; K175-W181 VanDerWaalsContact CG-NE1 3.26Å; D179-W181 VanDerWaalsContact C-N 3.28Å; D179-W181 VanDerWaalsContact O-CD1 3.25Å; D179-W181 PolarHBondContact O-N 3.23Å; D179-W181 PolarHBondContact OD2-NE1 2.59Å

Retrieved 181 of 181 residues in 268.8 ms (Link to these results)

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