A0A5K4F3H0_SCHMA Loading...

Subfamily M12B unassigned peptidase (M12 family)

AlphaFold DB (A0A5K4F5C2), UniProt , Accession A0A5K4F3H0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 291 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	22.1	Very low	30.5	Very low	214 Å²	214	95.9 Å²	95.9	100%	1.054	52%	0.516	S	S	*	.				0	105.3	0	-76	174.1	-170.4	0	0	106.3	F3	M1-F3 PolarHBondContact O-N 3.07Å
2	T	22.4	Very low	31.2	Very low	130 Å²	130	94.3 Å²	94.3	80%	0.798	51%	0.507	S	S	*	.			trans	-62.5	122.5	166.4	27.4	0	0	0	0	107.4	D4	T2-D4 PolarHBondContact O-N 2.83Å
3	F	25.4	Very low	31.6	Very low	92 Å²	92	96.7 Å²	96.7	40%	0.404	51%	0.514	S	S	.	.			trans	-79.9	102.2	172.5	-91.3	-91.4	0	0	0	107.6	M1 S5	M1-F3 PolarHBondContact O-N 3.07Å; F3-S5 PolarHBondContact O-N 3.29Å
4	D	25.9	Very low	31.8	Very low	142 Å²	142	96.4 Å²	96.4	76%	0.759	52%	0.517	S	S	*	.			trans	-69.5	110.5	164.1	-68.6	-29.7	0	0	0	107.2	T2	T2-D4 PolarHBondContact O-N 2.83Å
5	S	30.2	Very low	32.3	Very low	72 Å²	72	94.3 Å²	94.3	50%	0.503	53%	0.527	S	S	.	.			trans	37.9	99.7	160.3	-56.1	0	0	0	0	116.4	F3 N7	F3-S5 PolarHBondContact O-N 3.29Å; S5-N7 PolarHBondContact O-N 2.71Å
6	P	34.1	Very low	32	Very low	47 Å²	47	95.5 Å²	95.5	31%	0.305	54%	0.544	S	S	.	.			trans	-57.4	107.2	173.5	24	-32.3	0	0	0	110	L24 L95	P6-L24 HydrophobicContact CB-CD2 3.84Å; P6-L24 HydrophobicContact CB-CG 4.28Å; P6-L24 HydrophobicContact CG-CD2 4.39Å; P6-L95 HydrophobicContact CG-CD2 4.38Å
7	N	31.7	Very low	31.7	Very low	88 Å²	88	99.9 Å²	99.9	47%	0.471	55%	0.55	S	S	.	.			trans	-81.2	123.3	173	-97.5	-24.1	0	0	0	108.4	S5 S9 E23	S5-N7 PolarHBondContact O-N 2.71Å; N7-S9 PolarHBondContact O-N 3.08Å; N7-E23 PolarHBondContact O-N 3.45Å
8	L	36.8	Very low	31.9	Very low	21 Å²	21	94.6 Å²	94.6	11%	0.11	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	110.6	159.6	-130	95.7	0	0	0	105.6	I20 C22 L90 N93 L95	L8-I20 HydrophobicContact CD1-CG2 3.78Å; L8-I20 HydrophobicContact CD2-CG2 3.98Å; L8-I20 HydrophobicContact CG-CG2 3.71Å; L8-C22 WeakPolarHBondContact CD1-SG 3.47Å; L8-L90 HydrophobicContact CD1-CD2 3.55Å; L8-L90 HydrophobicContact CD2-CD2 4.11Å; L8-L90 HydrophobicContact CG-CD2 4.49Å; L8-N93 WeakPolarHBondContact CB-O 2.95Å; L8-L95 HydrophobicContact CD1-CB 4.35Å
9	S	36.2	Very low	31.9	Very low	70 Å²	70	93.2 Å²	93.2	49%	0.49	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-30.1	-176.5	59.5	0	0	0	0	111.7	N7 S21	N7-S9 PolarHBondContact O-N 3.08Å; S9-S21 PolarHBondContact N-O 2.88Å; S9-S21 PolarHBondContact OG-O 3.35Å
10	E	34.9	Very low	32	Very low	114 Å²	114	88.7 Å²	88.7	53%	0.533	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	133.3	176.7	-112.6	176.3	146.4	0	0	111.4	N12	E10-N12 VanDerWaalsContact CD-ND2 3.27Å; E10-N12 PolarHBondContact OE1-ND2 2.93Å
11	Y	36	Very low	31.9	Very low	65 Å²	65	86.5 Å²	86.5	26%	0.255	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	110.8	159	170.4	-96	0	0	0	106.9	E13	Y11-E13 HydrophobicContact CE1-CB 4.09Å; Y11-E13 PolarHBondContact OH-OE2 3.18Å
12	N	38.5	Very low	32.4	Very low	76 Å²	76	77 Å²	77	41%	0.406	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	113.3	172.4	-80.5	-34	0	0	0	108.8	E10 V14	E10-N12 VanDerWaalsContact CD-ND2 3.27Å; E10-N12 PolarHBondContact OE1-ND2 2.93Å; N12-V14 HydrophobicContact CB-CG2 4.25Å; N12-V14 PolarHBondContact O-N 3.31Å
13	E	37.1	Very low	32.7	Very low	126 Å²	126	76 Å²	76	59%	0.589	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	98.7	173.5	-166.7	166.3	-175	0	0	108.3	Y11	Y11-E13 HydrophobicContact CE1-CB 4.09Å; Y11-E13 PolarHBondContact OH-OE2 3.18Å
14	V	34.1	Very low	33	Very low	92 Å²	92	73.5 Å²	73.5	56%	0.558	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	87.1	178.9	-171.9	0	0	0	0	108.6	N12 S16 R17	N12-V14 HydrophobicContact CB-CG2 4.25Å; N12-V14 PolarHBondContact O-N 3.31Å; V14-S16 PolarHBondContact O-N 3.3Å; V14-R17 PolarHBondContact N-O 3.21Å; V14-R17 PolarHBondContact O-N 3.23Å
15	G	39.3	Very low	33.3	Very low	65 Å²	65	67.7 Å²	67.7	67%	0.67	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	-129.6	-178.7	0	0	0	0	0	112.3	R17	G15-R17 VanDerWaalsContact C-N 3.28Å; G15-R17 PolarHBondContact O-N 3.18Å
16	S	27.2	Very low	33.3	Very low	114 Å²	114	68.3 Å²	68.3	80%	0.797	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	6.1	177.7	56.1	0	0	0	0	114.3	V14	V14-S16 PolarHBondContact O-N 3.3Å
17	R	27.5	Very low	33	Very low	171 Å²	171	69.2 Å²	69.2	65%	0.645	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.6	179	-66.3	-175.6	-175.1	-174.3	2.8	109.4	V14 G15 I19	V14-R17 PolarHBondContact N-O 3.21Å; V14-R17 PolarHBondContact O-N 3.23Å; G15-R17 VanDerWaalsContact C-N 3.28Å; G15-R17 PolarHBondContact O-N 3.18Å; R17-I19 PolarHBondContact O-N 3.32Å
18	N	34.5	Very low	33	Very low	3 Å²	3	72 Å²	72	2%	0.016	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	97.7	169.5	-69.6	-5	0	0	0	108.1	I20 L33 F61	N18-I20 PolarHBondContact O-N 3.27Å; N18-L33 CarbonylContact O-C 3.58Å; N18-F61 HydrophobicContact CB-CD1 4.45Å; N18-F61 HydrophobicContact CB-CE1 3.77Å
19	I	31.9	Very low	32.8	Very low	68 Å²	68	72.9 Å²	72.9	35%	0.349	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	109.4	173	-57.8	173.1	0	0	0	106.1	R17	R17-I19 PolarHBondContact O-N 3.32Å
20	I	34.6	Very low	32.8	Very low	4 Å²	4	75.2 Å²	75.2	2%	0.021	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	110.7	163.7	-56.8	-175	0	0	0	106.7	L8 N18 C22 L33 F61 L90	L8-I20 HydrophobicContact CD1-CG2 3.78Å; L8-I20 HydrophobicContact CD2-CG2 3.98Å; L8-I20 HydrophobicContact CG-CG2 3.71Å; N18-I20 PolarHBondContact O-N 3.27Å; I20-C22 HydrophobicContact CG2-CB 4.39Å; I20-C22 WeakPolarHBondContact CG2-SG 3.23Å; I20-C22 PolarHBondContact O-N 3.49Å; I20-L33 HydrophobicContact CB-CD1 3.48Å; I20-L33 VanDerWaalsContact CB-CD1 3.48Å; I20-L33 HydrophobicContact CB-CG 4.23Å; I20-L33 HydrophobicContact CD1-CD1 3.43Å; I20-L33 VanDerWaalsContact CD1-CD1 3.43Å; I20-L33 HydrophobicContact CG1-CD1 3.63Å; I20-L33 HydrophobicContact CG2-CD1 4.31Å; I20-F61 HydrophobicContact CD1-CD1 3.91Å; I20-F61 HydrophobicContact CD1-CD2 3.96Å; I20-F61 HydrophobicContact CD1-CE1 3.43Å; I20-F61 VanDerWaalsContact CD1-CE1 3.43Å; I20-F61 HydrophobicContact CD1-CE2 3.48Å; I20-F61 VanDerWaalsContact CD1-CE2 3.48Å; I20-F61 HydrophobicContact CD1-CG 4.15Å; I20-F61 HydrophobicContact CD1-CZ 3.18Å; I20-F61 HydrophobicContact CG1-CE1 4.02Å; I20-F61 HydrophobicContact CG1-CZ 4.14Å; I20-L90 HydrophobicContact CD1-CD1 4.21Å
21	S	30.1	Very low	33.1	Very low	42 Å²	42	70.3 Å²	70.3	29%	0.294	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	100.3	161.5	-66.8	0	0	0	0	107	S9	S9-S21 PolarHBondContact N-O 2.88Å; S9-S21 PolarHBondContact OG-O 3.35Å
22	C	31.9	Very low	33.2	Very low	16 Å²	16	70.8 Å²	70.8	11%	0.108	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.4	168.9	-81.6	0	0	0	0	108.6	L8 I20 L24	L8-C22 WeakPolarHBondContact CD1-SG 3.47Å; I20-C22 HydrophobicContact CG2-CB 4.39Å; I20-C22 WeakPolarHBondContact CG2-SG 3.23Å; I20-C22 PolarHBondContact O-N 3.49Å; C22-L24 HydrophobicContact CB-CB 3.74Å; C22-L24 HydrophobicContact CB-CD1 3.49Å; C22-L24 VanDerWaalsContact CB-CD1 3.49Å; C22-L24 HydrophobicContact CB-CG 3.57Å; C22-L24 PolarHBondContact O-N 3.05Å; C22-L24 VanDerWaalsContact SG-CD1 3.57Å
23	E	29	Very low	33.5	Very low	109 Å²	109	67.6 Å²	67.6	51%	0.509	40%	0.395	S	S	.	.			trans	-72.9	40.6	156	-68.6	-176.5	160.7	0	0	110.5	N7 F25	N7-E23 PolarHBondContact O-N 3.45Å; E23-F25 PolarHBondContact O-N 3.23Å; E23-F25 VanDerWaalsContact O-N 3.08Å
24	L	31.8	Very low	33.7	Very low	39 Å²	39	67 Å²	67	20%	0.204	39%	0.39	C	S	.	.			trans	-66.7	-3.9	170.6	-88.9	165	0	0	0	111.7	P6 C22 L95	P6-L24 HydrophobicContact CB-CD2 3.84Å; P6-L24 HydrophobicContact CB-CG 4.28Å; P6-L24 HydrophobicContact CG-CD2 4.39Å; C22-L24 HydrophobicContact CB-CB 3.74Å; C22-L24 HydrophobicContact CB-CD1 3.49Å; C22-L24 VanDerWaalsContact CB-CD1 3.49Å; C22-L24 HydrophobicContact CB-CG 3.57Å; C22-L24 PolarHBondContact O-N 3.05Å; C22-L24 VanDerWaalsContact SG-CD1 3.57Å; L24-L95 HydrophobicContact CD1-CD2 4.36Å; L24-L95 HydrophobicContact CD2-CD2 3.96Å
25	F	31	Very low	34	Very low	20 Å²	20	67.3 Å²	67.3	9%	0.088	38%	0.384	C	S	.	.	S	Bend	trans	-127.6	128.2	-169.1	-56.7	-87.6	0	0	0	107.7	E23 S27 V29 T31 F75	E23-F25 PolarHBondContact O-N 3.23Å; E23-F25 VanDerWaalsContact O-N 3.08Å; F25-S27 WeakPolarHBondContact CB-O 3.44Å; F25-S27 PolarHBondContact O-N 2.73Å; F25-V29 HydrophobicContact CB-CB 4Å; F25-V29 HydrophobicContact CB-CG2 3.81Å; F25-V29 HydrophobicContact CD1-CB 3.82Å; F25-V29 HydrophobicContact CD1-CG1 4.36Å; F25-V29 HydrophobicContact CD1-CG2 3.69Å; F25-V29 HydrophobicContact CD2-CB 3.63Å; F25-V29 HydrophobicContact CD2-CG1 4.39Å; F25-V29 HydrophobicContact CD2-CG2 4.31Å; F25-V29 HydrophobicContact CE1-CB 4.09Å; F25-V29 HydrophobicContact CE1-CG1 4.15Å; F25-V29 HydrophobicContact CE1-CG2 4.26Å; F25-V29 HydrophobicContact CE2-CB 3.94Å; F25-V29 HydrophobicContact CE2-CG1 4.21Å; F25-V29 HydrophobicContact CG-CB 3.56Å; F25-V29 HydrophobicContact CG-CG1 4.46Å; F25-V29 HydrophobicContact CG-CG2 3.7Å; F25-V29 HydrophobicContact CZ-CB 4.17Å; F25-V29 HydrophobicContact CZ-CG1 4.09Å; F25-T31 HydrophobicContact CE2-CG2 4.03Å; F25-T31 HydrophobicContact CZ-CG2 4.25Å; F25-F75 HydrophobicContact CE1-CB 3.82Å; F25-F75 HydrophobicContact CZ-CB 4.2Å; F25-F75 HydrophobicContact CZ-CD2 4.46Å
26	S	31.1	Very low	34.1	Very low	85 Å²	85	65.5 Å²	65.5	59%	0.594	36%	0.361	S	S	*	.	S	Bend	trans	-62.4	8.8	169.7	51.6	0	0	0	0	114.2
27	S	27.9	Very low	34.4	Very low	66 Å²	66	65.8 Å²	65.8	46%	0.462	36%	0.363	S	S	.	.	S	Bend	trans	-145.5	133.8	176.2	53.3	0	0	0	0	106	F25 V29	F25-S27 WeakPolarHBondContact CB-O 3.44Å; F25-S27 PolarHBondContact O-N 2.73Å; S27-V29 VanDerWaalsContact C-N 3.34Å; S27-V29 WeakPolarHBondContact O-CG2 3.2Å; S27-V29 PolarHBondContact O-N 3.21Å
28	N	32.6	Very low	34.6	Very low	146 Å²	146	62.7 Å²	62.7	78%	0.781	36%	0.356	S	S	*	.			trans	-52.3	93.6	175.3	-74.2	-15.9	0	0	0	111.3
29	V	32.6	Very low	34.4	Very low	40 Å²	40	67.7 Å²	67.7	24%	0.242	39%	0.389	C	S	.	.			trans	-102.8	101.6	171.4	-180	0	0	0	0	106	F25 S27 T31 Y66	F25-V29 HydrophobicContact CB-CB 4Å; F25-V29 HydrophobicContact CB-CG2 3.81Å; F25-V29 HydrophobicContact CD1-CB 3.82Å; F25-V29 HydrophobicContact CD1-CG1 4.36Å; F25-V29 HydrophobicContact CD1-CG2 3.69Å; F25-V29 HydrophobicContact CD2-CB 3.63Å; F25-V29 HydrophobicContact CD2-CG1 4.39Å; F25-V29 HydrophobicContact CD2-CG2 4.31Å; F25-V29 HydrophobicContact CE1-CB 4.09Å; F25-V29 HydrophobicContact CE1-CG1 4.15Å; F25-V29 HydrophobicContact CE1-CG2 4.26Å; F25-V29 HydrophobicContact CE2-CB 3.94Å; F25-V29 HydrophobicContact CE2-CG1 4.21Å; F25-V29 HydrophobicContact CG-CB 3.56Å; F25-V29 HydrophobicContact CG-CG1 4.46Å; F25-V29 HydrophobicContact CG-CG2 3.7Å; F25-V29 HydrophobicContact CZ-CB 4.17Å; F25-V29 HydrophobicContact CZ-CG1 4.09Å; S27-V29 VanDerWaalsContact C-N 3.34Å; S27-V29 WeakPolarHBondContact O-CG2 3.2Å; S27-V29 PolarHBondContact O-N 3.21Å; V29-T31 VanDerWaalsContact C-N 3.27Å; V29-T31 PolarHBondContact O-N 2.9Å; V29-Y66 HydrophobicContact CG1-CE1 4.37Å
30	T	35	Very low	34.7	Very low	118 Å²	118	66.6 Å²	66.6	72%	0.724	38%	0.383	S	S	*	.			trans	-70.3	89.6	167.4	-35	0	0	0	0	107.5
31	T	41.7	Very low	34.7	Very low	11 Å²	11	74.3 Å²	74.3	7%	0.067	41%	0.413	C	S	.	.			trans	-91.4	129.4	173.2	-164.5	0	0	0	0	109.7	F25 V29 L33 Y66	F25-T31 HydrophobicContact CE2-CG2 4.03Å; F25-T31 HydrophobicContact CZ-CG2 4.25Å; V29-T31 VanDerWaalsContact C-N 3.27Å; V29-T31 PolarHBondContact O-N 2.9Å; T31-L33 HydrophobicContact CG2-CD2 4.23Å; T31-L33 HydrophobicContact CG2-CG 4.39Å; T31-L33 PolarHBondContact O-N 2.77Å; T31-Y66 WeakPolarHBondContact OG1-CE2 3.4Å
32	S	38.4	Very low	35	Very low	75 Å²	75	74.5 Å²	74.5	52%	0.524	41%	0.41	S	S	.	.			trans	-80.9	100.5	173.8	56.5	0	0	0	0	108.8
33	L	43.2	Very low	35.2	Very low	10 Å²	10	78 Å²	78	5%	0.052	43%	0.425	C	S	.	.			trans	-70.9	135.9	165.9	-63.3	-173.4	0	0	0	109	N18 I20 T31 F61 V63	N18-L33 CarbonylContact O-C 3.58Å; I20-L33 HydrophobicContact CB-CD1 3.48Å; I20-L33 VanDerWaalsContact CB-CD1 3.48Å; I20-L33 HydrophobicContact CB-CG 4.23Å; I20-L33 HydrophobicContact CD1-CD1 3.43Å; I20-L33 VanDerWaalsContact CD1-CD1 3.43Å; I20-L33 HydrophobicContact CG1-CD1 3.63Å; I20-L33 HydrophobicContact CG2-CD1 4.31Å; T31-L33 HydrophobicContact CG2-CD2 4.23Å; T31-L33 HydrophobicContact CG2-CG 4.39Å; T31-L33 PolarHBondContact O-N 2.77Å; L33-F61 HydrophobicContact CB-CB 4.29Å; L33-F61 HydrophobicContact CB-CD1 3.89Å; L33-F61 HydrophobicContact CB-CG 4.39Å; L33-F61 HydrophobicContact CD1-CB 4.12Å; L33-F61 HydrophobicContact CD1-CD1 4.13Å; L33-F61 HydrophobicContact CD1-CG 4.06Å; L33-F61 HydrophobicContact CD2-CB 4.46Å; L33-V63 HydrophobicContact CD2-CB 4.38Å; L33-V63 HydrophobicContact CD2-CG1 4.42Å; L33-V63 HydrophobicContact CD2-CG2 3.53Å
34	K	41.3	Very low	35.4	Very low	112 Å²	112	73.3 Å²	73.3	49%	0.487	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	129.9	169.9	-72	-176.9	-178.5	175	0	108	C36 C62	K34-C36 PolarHBondContact O-N 3.36Å; K34-C62 PolarHBondContact N-O 2.93Å; K34-C62 PolarHBondContact O-N 2.85Å
35	K	42.1	Very low	35.4	Very low	99 Å²	99	76.3 Å²	76.3	43%	0.43	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	123.8	163.9	-166.8	172	-173.5	153.9	0	106.6	S37 N59	K35-S37 PolarHBondContact O-N 2.84Å; K35-N59 VanDerWaalsContact CE-OD1 3.29Å; K35-N59 WeakPolarHBondContact CE-OD1 3.34Å; K35-N59 PolarHBondContact NZ-OD1 3.25Å
36	C	40.7	Very low	35.4	Very low	27 Å²	27	77.1 Å²	77.1	18%	0.182	42%	0.423	C	S	.	.			trans	-67.5	123.7	179.3	-48.2	0	0	0	0	107.9	K34 Q38 L60 C62	K34-C36 PolarHBondContact O-N 3.36Å; C36-Q38 PolarHBondContact O-N 3.17Å; C36-Q38 VanDerWaalsContact O-N 3.1Å; C36-L60 HydrophobicContact CB-CD2 3.8Å; C36-L60 HydrophobicContact CB-CG 4.27Å; C36-L60 PolarHBondContact N-O 2.72Å; C36-C62 HydrophobicContact CB-CB 4.48Å; C36-C62 WeakPolarHBondContact CB-SG 3.47Å; C36-C62 WeakPolarHBondContact SG-CB 3.43Å; C36-C62 PolarHBondContact SG-N 3.21Å; C36-C62 CovalentContact SG-SG 2.04Å; C36-C62 PolarHBondContact SG-SG 3.37Å
37	S	33.9	Very low	35.2	Very low	120 Å²	120	76.8 Å²	76.8	84%	0.839	41%	0.412	S	S	*	.	S	Bend	trans	-84.7	32.8	-169.4	53.1	0	0	0	0	114.1	K35	K35-S37 PolarHBondContact O-N 2.84Å
38	Q	31.9	Very low	35.2	Very low	106 Å²	106	79.7 Å²	79.7	50%	0.495	42%	0.416	S	S	.	.	S	Bend	trans	-147.3	144.4	-176.9	-66.9	-172.9	-16	0	0	110.5	C36 L40	C36-Q38 PolarHBondContact O-N 3.17Å; C36-Q38 VanDerWaalsContact O-N 3.1Å; Q38-L40 PolarHBondContact O-N 2.93Å
39	P	29.9	Very low	35	Very low	109 Å²	109	76.3 Å²	76.3	71%	0.708	40%	0.401	S	S	*	.			trans	-75.3	99.5	-162.5	30.3	-32.5	0	0	0	110.5	Y41	P39-Y41 HydrophobicContact CB-CD2 4.43Å; P39-Y41 HydrophobicContact CB-CE2 4.08Å
40	L	37	Very low	34.8	Very low	45 Å²	45	76.8 Å²	76.8	24%	0.236	41%	0.414	C	S	.	.			trans	-94.8	97.3	162.1	-90.3	152.5	0	0	0	107	Q38 I42 L60 C111	Q38-L40 PolarHBondContact O-N 2.93Å; L40-I42 VanDerWaalsContact C-N 3.28Å; L40-I42 HydrophobicContact CB-CG1 4.45Å; L40-I42 PolarHBondContact O-N 3.32Å; L40-L60 HydrophobicContact CB-CD2 3.81Å; L40-L60 HydrophobicContact CD1-CD2 3.11Å; L40-L60 HydrophobicContact CG-CD2 4.02Å; L40-C111 VanDerWaalsContact CD2-O 3.31Å; L40-C111 WeakPolarHBondContact CD2-O 3.43Å
41	Y	34.8	Very low	34.6	Very low	165 Å²	165	76 Å²	76	65%	0.647	41%	0.405	S	S	*	.			trans	-69.5	89.8	167	-70.3	-78.4	0	0	0	108	P39 H43	P39-Y41 HydrophobicContact CB-CD2 4.43Å; P39-Y41 HydrophobicContact CB-CE2 4.08Å; Y41-H43 PolarHBondContact O-N 3.29Å
42	I	36.4	Very low	34.2	Very low	46 Å²	46	79.7 Å²	79.7	24%	0.236	43%	0.428	C	S	.	.			trans	-82.1	106.2	172.5	-59.4	154.8	0	0	0	106.6	L40 L60 L87	L40-I42 VanDerWaalsContact C-N 3.28Å; L40-I42 HydrophobicContact CB-CG1 4.45Å; L40-I42 PolarHBondContact O-N 3.32Å; I42-L60 HydrophobicContact CD1-CB 4.12Å; I42-L60 HydrophobicContact CD1-CD1 4.3Å; I42-L87 HydrophobicContact CD1-CD2 3.21Å; I42-L87 HydrophobicContact CG1-CD2 3.79Å
43	H	36.1	Very low	34	Very low	91 Å²	91	79.7 Å²	79.7	42%	0.421	42%	0.419	S	S	.	.			trans	-107.5	108.7	168.5	-70.4	-75.8	0	0	0	108.8	Y41 F276	Y41-H43 PolarHBondContact O-N 3.29Å; H43-F276 AromaticContact CD2-CE1 3.24Å; H43-F276 WeakPolarHBondContact CD2-CE1 3.37Å; H43-F276 AromaticContact CD2-CZ 3.63Å; H43-F276 AromaticContact NE2-CE1 3.25Å; H43-F276 WeakPolarHBondContact NE2-CE1 3.08Å; H43-F276 AromaticContact NE2-CZ 3.68Å
44	G	34.8	Very low	33.4	Very low	10 Å²	10	80.7 Å²	80.7	10%	0.103	43%	0.432	C	S	.	.			trans	-79.2	134	167.4	0	0	0	0	0	109.7	T52 F53	G44-T52 WeakPolarHBondContact O-CA 3.26Å; G44-F53 PolarHBondContact O-N 3.41Å
45	F	30.4	Very low	33	Very low	102 Å²	102	84.4 Å²	84.4	45%	0.447	45%	0.451	S	S	.	.	B	Isolated β-bridge	trans	-116.8	119.8	177.3	-179.2	-107	0	0	0	109	Q47	F45-Q47 HydrophobicContact CD1-CB 4.04Å; F45-Q47 HydrophobicContact CE1-CB 3.74Å; F45-Q47 PolarHBondContact O-N 3.24Å
46	D	30.7	Very low	32.4	Very low	37 Å²	37	87.3 Å²	87.3	20%	0.198	46%	0.464	C	S	.	.			trans	-85.7	107.3	164.7	178.2	-7.6	0	0	0	108.2	F48 T49 G50 N51 F53	D46-F48 PolarHBondContact O-N 3.48Å; D46-F48 WeakPolarHBondContact OD1-CB 3.28Å; D46-F48 PolarHBondContact OD1-N 3.26Å; D46-T49 WeakPolarHBondContact CB-OG1 2.92Å; D46-T49 PolarHBondContact OD1-N 3.39Å; D46-T49 WeakPolarHBondContact OD2-CB 3.43Å; D46-T49 WeakPolarHBondContact OD2-CG2 3.32Å; D46-T49 PolarHBondContact OD2-OG1 2.93Å; D46-G50 WeakPolarHBondContact O-CA 3.28Å; D46-G50 PolarHBondContact O-N 3.27Å; D46-N51 WeakPolarHBondContact CB-O 3.21Å; D46-N51 PolarHBondContact N-O 2.76Å; D46-F53 HydrophobicContact CB-CD2 4.32Å; D46-F53 HydrophobicContact CB-CE2 3.95Å
47	Q	28.6	Very low	32.4	Very low	77 Å²	77	89.8 Å²	89.8	36%	0.36	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-19.2	-179.6	64.9	176.3	-23.6	0	0	114.7	F45 E116 S117	F45-Q47 HydrophobicContact CD1-CB 4.04Å; F45-Q47 HydrophobicContact CE1-CB 3.74Å; F45-Q47 PolarHBondContact O-N 3.24Å; Q47-E116 PolarHBondContact NE2-OE1 2.74Å; Q47-E116 PolarHBondContact OE1-OE1 3.46Å; Q47-E116 VanDerWaalsContact OE1-OE1 3.05Å; Q47-S117 PolarHBondContact NE2-O 2.79Å
48	F	26.8	Very low	32.7	Very low	128 Å²	128	91.1 Å²	91.1	56%	0.561	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-34.3	-177.7	-67.2	-76.3	0	0	0	112.4	D46 S117 N119	D46-F48 PolarHBondContact O-N 3.48Å; D46-F48 WeakPolarHBondContact OD1-CB 3.28Å; D46-F48 PolarHBondContact OD1-N 3.26Å; F48-S117 WeakPolarHBondContact CE2-O 3.48Å; F48-N119 HydrophobicContact CZ-CB 4.41Å
49	T	29.8	Very low	33.1	Very low	75 Å²	75	86.9 Å²	86.9	46%	0.46	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-14	179.6	62.6	0	0	0	0	113.1	D46 N51	D46-T49 WeakPolarHBondContact CB-OG1 2.92Å; D46-T49 PolarHBondContact OD1-N 3.39Å; D46-T49 WeakPolarHBondContact OD2-CB 3.43Å; D46-T49 WeakPolarHBondContact OD2-CG2 3.32Å; D46-T49 PolarHBondContact OD2-OG1 2.93Å; T49-N51 WeakPolarHBondContact CB-ND2 2.97Å; T49-N51 PolarHBondContact O-N 3.25Å; T49-N51 VanDerWaalsContact OG1-CB 3.26Å; T49-N51 WeakPolarHBondContact OG1-CB 2.93Å; T49-N51 PolarHBondContact OG1-N 3.28Å; T49-N51 PolarHBondContact OG1-ND2 3.26Å
50	G	27.6	Very low	33.8	Very low	50 Å²	50	83 Å²	83	52%	0.515	42%	0.416	S	S	.	.			trans	62.8	5.9	-168.8	0	0	0	0	0	112.6	D46	D46-G50 WeakPolarHBondContact O-CA 3.28Å; D46-G50 PolarHBondContact O-N 3.27Å
51	N	29.8	Very low	34.4	Very low	101 Å²	101	80.8 Å²	80.8	54%	0.54	41%	0.405	S	S	.	.			trans	-75.2	131.5	172.9	-66.4	-37.6	0	0	0	107.2	D46 T49 F53	D46-N51 WeakPolarHBondContact CB-O 3.21Å; D46-N51 PolarHBondContact N-O 2.76Å; T49-N51 WeakPolarHBondContact CB-ND2 2.97Å; T49-N51 PolarHBondContact O-N 3.25Å; T49-N51 VanDerWaalsContact OG1-CB 3.26Å; T49-N51 WeakPolarHBondContact OG1-CB 2.93Å; T49-N51 PolarHBondContact OG1-N 3.28Å; T49-N51 PolarHBondContact OG1-ND2 3.26Å; N51-F53 PolarHBondContact O-N 2.83Å
52	T	33.3	Very low	34.9	Very low	89 Å²	89	73.8 Å²	73.8	55%	0.546	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-55.9	135.2	152.6	40.5	0	0	0	0	106.6	G44 G54	G44-T52 WeakPolarHBondContact O-CA 3.26Å; T52-G54 PolarHBondContact O-N 2.9Å
53	F	35.8	Very low	35.4	Very low	75 Å²	75	71.9 Å²	71.9	33%	0.329	37%	0.37	S	S	.	.			trans	-55.2	101	158	-82.4	-88.9	0	0	0	104.4	G44 D46 N51 Q55 Y57	G44-F53 PolarHBondContact O-N 3.41Å; D46-F53 HydrophobicContact CB-CD2 4.32Å; D46-F53 HydrophobicContact CB-CE2 3.95Å; N51-F53 PolarHBondContact O-N 2.83Å; F53-Q55 PolarHBondContact O-N 3.37Å; F53-Y57 HydrophobicContact CB-CE2 4.04Å; F53-Y57 HydrophobicContact CD1-CE2 4.26Å; F53-Y57 HydrophobicContact CG-CE2 4.41Å
54	G	30.5	Very low	35.8	Very low	31 Å²	31	70 Å²	70	32%	0.32	37%	0.365	S	S	.	.			trans	-53.2	141.5	-167.6	0	0	0	0	0	109.2	T52 F56	T52-G54 PolarHBondContact O-N 2.9Å; G54-F56 WeakPolarHBondContact O-CB 3.23Å; G54-F56 WeakPolarHBondContact O-CD2 3.32Å; G54-F56 PolarHBondContact O-N 3.46Å
55	Q	31.4	Very low	36.1	Very low	190 Å²	190	70.7 Å²	70.7	89%	0.888	37%	0.372	S	S	*	.	S	Bend	trans	4	15.9	154.9	-70.8	175.4	-25.2	0	0	121.6	F53	F53-Q55 PolarHBondContact O-N 3.37Å
56	F	30.7	Very low	36.8	Very low	160 Å²	160	68 Å²	68	70%	0.702	36%	0.359	S	S	*	.			trans	-112.2	-2.4	-163.7	-74.8	-72.3	0	0	0	113	G54 E58	G54-F56 WeakPolarHBondContact O-CB 3.23Å; G54-F56 WeakPolarHBondContact O-CD2 3.32Å; G54-F56 PolarHBondContact O-N 3.46Å; F56-E58 PolarHBondContact O-N 2.76Å
57	Y	40.6	Very low	37.4	Very low	79 Å²	79	67.5 Å²	67.5	31%	0.31	36%	0.359	S	S	.	.			trans	-95.1	74.5	168.5	-58.5	-54.8	0	0	0	109.1	F53 N59 F89	F53-Y57 HydrophobicContact CB-CE2 4.04Å; F53-Y57 HydrophobicContact CD1-CE2 4.26Å; F53-Y57 HydrophobicContact CG-CE2 4.41Å; Y57-N59 PolarHBondContact O-N 2.99Å; Y57-F89 HydrophobicContact CD1-CB 3.95Å; Y57-F89 AromaticContact CD1-CD1 3.81Å; Y57-F89 HydrophobicContact CD1-CD1 3.81Å; Y57-F89 HydrophobicContact CD1-CG 4.38Å; Y57-F89 HydrophobicContact CD2-CD1 4.05Å; Y57-F89 HydrophobicContact CE1-CB 3.55Å; Y57-F89 AromaticContact CE1-CD1 3.77Å; Y57-F89 HydrophobicContact CE1-CD1 3.77Å; Y57-F89 HydrophobicContact CE1-CG 4.1Å; Y57-F89 AromaticContact CE2-CD1 3.99Å; Y57-F89 HydrophobicContact CE2-CD1 3.99Å; Y57-F89 AromaticContact CG-CD1 3.95Å; Y57-F89 HydrophobicContact CG-CD1 3.95Å; Y57-F89 AromaticContact CZ-CD1 3.84Å
58	E	39	Very low	38.1	Very low	148 Å²	148	64.7 Å²	64.7	69%	0.692	35%	0.346	S	S	*	.			trans	-71.4	-10.2	-169.9	-68.1	-177.7	157	0	0	114.5	F56	F56-E58 PolarHBondContact O-N 2.76Å
59	N	41.4	Very low	38.9	Very low	17 Å²	17	62 Å²	62	9%	0.091	34%	0.336	C	S	.	.			trans	-147	119	-169.7	-64.2	-64.6	0	0	0	113.9	K35 Y57 F61	K35-N59 VanDerWaalsContact CE-OD1 3.29Å; K35-N59 WeakPolarHBondContact CE-OD1 3.34Å; K35-N59 PolarHBondContact NZ-OD1 3.25Å; Y57-N59 PolarHBondContact O-N 2.99Å; N59-F61 HydrophobicContact CB-CD2 4.1Å; N59-F61 HydrophobicContact CB-CE1 3.91Å; N59-F61 HydrophobicContact CB-CE2 3.26Å; N59-F61 HydrophobicContact CB-CZ 3.14Å; N59-F61 WeakPolarHBondContact O-CD2 3.48Å; N59-F61 WeakPolarHBondContact O-CE2 3.16Å
60	L	45.1	Very low	39.2	Very low	26 Å²	26	62.5 Å²	62.5	14%	0.136	34%	0.338	C	S	.	.			trans	-84	129.4	158.4	177	75.6	0	0	0	109.3	C36 L40 I42 L87	C36-L60 HydrophobicContact CB-CD2 3.8Å; C36-L60 HydrophobicContact CB-CG 4.27Å; C36-L60 PolarHBondContact N-O 2.72Å; L40-L60 HydrophobicContact CB-CD2 3.81Å; L40-L60 HydrophobicContact CD1-CD2 3.11Å; L40-L60 HydrophobicContact CG-CD2 4.02Å; I42-L60 HydrophobicContact CD1-CB 4.12Å; I42-L60 HydrophobicContact CD1-CD1 4.3Å; L60-L87 HydrophobicContact CD1-CD2 3.35Å; L60-L87 HydrophobicContact CD1-CG 3.91Å
61	F	47.8	Very low	39.5	Very low	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.8	178.5	-58	-85.3	0	0	0	111.8	N18 I20 L33 N59 F88 L90	N18-F61 HydrophobicContact CB-CD1 4.45Å; N18-F61 HydrophobicContact CB-CE1 3.77Å; I20-F61 HydrophobicContact CD1-CD1 3.91Å; I20-F61 HydrophobicContact CD1-CD2 3.96Å; I20-F61 HydrophobicContact CD1-CE1 3.43Å; I20-F61 VanDerWaalsContact CD1-CE1 3.43Å; I20-F61 HydrophobicContact CD1-CE2 3.48Å; I20-F61 VanDerWaalsContact CD1-CE2 3.48Å; I20-F61 HydrophobicContact CD1-CG 4.15Å; I20-F61 HydrophobicContact CD1-CZ 3.18Å; I20-F61 HydrophobicContact CG1-CE1 4.02Å; I20-F61 HydrophobicContact CG1-CZ 4.14Å; L33-F61 HydrophobicContact CB-CB 4.29Å; L33-F61 HydrophobicContact CB-CD1 3.89Å; L33-F61 HydrophobicContact CB-CG 4.39Å; L33-F61 HydrophobicContact CD1-CB 4.12Å; L33-F61 HydrophobicContact CD1-CD1 4.13Å; L33-F61 HydrophobicContact CD1-CG 4.06Å; L33-F61 HydrophobicContact CD2-CB 4.46Å; N59-F61 HydrophobicContact CB-CD2 4.1Å; N59-F61 HydrophobicContact CB-CE1 3.91Å; N59-F61 HydrophobicContact CB-CE2 3.26Å; N59-F61 HydrophobicContact CB-CZ 3.14Å; N59-F61 WeakPolarHBondContact O-CD2 3.48Å; N59-F61 WeakPolarHBondContact O-CE2 3.16Å; F61-F88 HydrophobicContact CB-CD2 3.76Å; F61-F88 HydrophobicContact CB-CE2 4.01Å; F61-F88 HydrophobicContact CD2-CB 4.07Å; F61-F88 HydrophobicContact CD2-CD2 4.08Å; F61-F88 HydrophobicContact CD2-CG 4.37Å; F61-F88 HydrophobicContact CG-CD2 4.4Å; F61-L90 HydrophobicContact CE2-CD1 3.62Å; F61-L90 HydrophobicContact CZ-CD1 4.06Å
62	C	45.4	Very low	39.8	Very low	18 Å²	18	66.8 Å²	66.8	12%	0.122	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.5	174.2	-72.3	0	0	0	0	108.3	K34 C36	K34-C62 PolarHBondContact N-O 2.93Å; K34-C62 PolarHBondContact O-N 2.85Å; C36-C62 HydrophobicContact CB-CB 4.48Å; C36-C62 WeakPolarHBondContact CB-SG 3.47Å; C36-C62 WeakPolarHBondContact SG-CB 3.43Å; C36-C62 PolarHBondContact SG-N 3.21Å; C36-C62 CovalentContact SG-SG 2.04Å; C36-C62 PolarHBondContact SG-SG 3.37Å
63	V	48.4	Very low	40	Very low	5 Å²	5	65.4 Å²	65.4	3%	0.03	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	99.6	172.6	-164	0	0	0	0	108.9	L33 Y66 V84 F88	L33-V63 HydrophobicContact CD2-CB 4.38Å; L33-V63 HydrophobicContact CD2-CG1 4.42Å; L33-V63 HydrophobicContact CD2-CG2 3.53Å; V63-Y66 HydrophobicContact CG1-CD2 3.79Å; V63-Y66 HydrophobicContact CG1-CG 4.23Å; V63-V84 CarbonylContact C-O 3.48Å; V63-V84 PolarHBondContact N-O 3.22Å; V63-V84 VanDerWaalsContact N-O 3.07Å; V63-V84 CarbonylContact O-C 3.43Å; V63-V84 PolarHBondContact O-N 3.27Å; V63-F88 HydrophobicContact CG2-CE2 3.84Å; V63-F88 HydrophobicContact CG2-CZ 3.69Å
64	T	43.8	Very low	40.2	Very low	52 Å²	52	66.6 Å²	66.6	32%	0.319	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	133.6	179.3	60.3	0	0	0	0	110.5	N83	T64-N83 WeakPolarHBondContact CB-OD1 3.29Å; T64-N83 HydrophobicContact CG2-CB 4.21Å; T64-N83 VanDerWaalsContact CG2-OD1 3.23Å; T64-N83 WeakPolarHBondContact CG2-OD1 3.49Å
65	G	41.2	Very low	40.9	Very low	24 Å²	24	66.1 Å²	66.1	25%	0.247	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	19.6	172.9	0	0	0	0	0	116	S77 E78	G65-S77 WeakPolarHBondContact O-CA 3.18Å; G65-E78 PolarHBondContact O-N 2.78Å
66	Y	45.3	Very low	41.6	Very low	46 Å²	46	60.5 Å²	60.5	18%	0.18	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	144.7	176.1	-66.9	-96.1	0	0	0	110.1	V29 T31 V63 F75 I76 V84	V29-Y66 HydrophobicContact CG1-CE1 4.37Å; T31-Y66 WeakPolarHBondContact OG1-CE2 3.4Å; V63-Y66 HydrophobicContact CG1-CD2 3.79Å; V63-Y66 HydrophobicContact CG1-CG 4.23Å; Y66-F75 HydrophobicContact CD1-CB 4.07Å; Y66-F75 HydrophobicContact CG-CB 4.37Å; Y66-I76 CarbonylContact C-O 3.44Å; Y66-I76 WeakPolarHBondContact CA-O 3.33Å; Y66-V84 VanDerWaalsContact O-CB 3.28Å; Y66-V84 WeakPolarHBondContact O-CB 3.33Å; Y66-V84 WeakPolarHBondContact O-CG2 3.38Å
67	S	42.3	Very low	42.4	Very low	27 Å²	27	56.9 Å²	56.9	19%	0.189	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	147.3	163.7	54	0	0	0	0	112	F75 I76 E78	S67-F75 CarbonylContact O-C 3.43Å; S67-F75 VanDerWaalsContact O-CA 3.23Å; S67-F75 WeakPolarHBondContact O-CA 3.23Å; S67-I76 PolarHBondContact N-O 3.41Å; S67-I76 PolarHBondContact O-N 2.76Å; S67-E78 WeakPolarHBondContact CB-OE1 3.39Å; S67-E78 VanDerWaalsContact OG-CG 3.32Å; S67-E78 WeakPolarHBondContact OG-CG 3.43Å; S67-E78 PolarHBondContact OG-OE1 2.8Å
68	L	43.9	Very low	42.9	Very low	17 Å²	17	55.8 Å²	55.8	9%	0.089	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	118.9	175.6	-178.2	76.9	0	0	0	110.5	V70 F75 Y98 N100	L68-V70 PolarHBondContact O-N 3.26Å; L68-F75 HydrophobicContact CB-CD1 4.22Å; L68-F75 HydrophobicContact CB-CE1 4.05Å; L68-F75 HydrophobicContact CD1-CD1 4.23Å; L68-F75 HydrophobicContact CD1-CD2 3.98Å; L68-F75 HydrophobicContact CD1-CE1 4.04Å; L68-F75 HydrophobicContact CD1-CE2 3.76Å; L68-F75 HydrophobicContact CD1-CG 4.21Å; L68-F75 HydrophobicContact CD1-CZ 3.8Å; L68-Y98 HydrophobicContact CD2-CE2 3.58Å; L68-Y98 WeakPolarHBondContact CD2-OH 3.31Å; L68-N100 HydrophobicContact CD2-CB 3.76Å; L68-N100 WeakPolarHBondContact CD2-ND2 3.21Å
69	Q	43.1	Very low	43.3	Very low	73 Å²	73	56.1 Å²	56.1	34%	0.341	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	103.4	166.3	-165.6	175.8	23.7	0	0	109.1	D71 N72 L73 K74 I76	Q69-D71 VanDerWaalsContact C-N 3.28Å; Q69-D71 PolarHBondContact O-N 2.92Å; Q69-N72 PolarHBondContact O-N 3.02Å; Q69-L73 WeakPolarHBondContact O-CA 3.28Å; Q69-L73 PolarHBondContact O-N 3.46Å; Q69-K74 HydrophobicContact CB-CB 4.31Å; Q69-K74 VanDerWaalsContact CB-O 3.28Å; Q69-K74 WeakPolarHBondContact CB-O 2.98Å; Q69-K74 PolarHBondContact N-O 3.17Å; Q69-K74 PolarHBondContact O-N 3.5Å; Q69-I76 HydrophobicContact CB-CD1 3.81Å; Q69-I76 HydrophobicContact CB-CG1 4.21Å; Q69-I76 HydrophobicContact CG-CD1 4.17Å
70	V	35.7	Very low	43.5	Very low	85 Å²	85	58 Å²	58	52%	0.515	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-56.6	-40	-172.4	-177.1	0	0	0	0	112.3	L68 N72	L68-V70 PolarHBondContact O-N 3.26Å; V70-N72 VanDerWaalsContact C-N 3.27Å; V70-N72 PolarHBondContact O-N 3.43Å
71	D	34.7	Very low	43.6	Very low	141 Å²	141	66.4 Å²	66.4	75%	0.754	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-65.6	-28.9	-174.3	-55.9	-33.1	0	0	0	113.6	Q69	Q69-D71 VanDerWaalsContact C-N 3.28Å; Q69-D71 PolarHBondContact O-N 2.92Å
72	N	36.2	Very low	43.4	Very low	99 Å²	99	70.4 Å²	70.4	53%	0.529	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-124.7	6.8	-173.6	-69.1	-31	0	0	0	113.2	Q69 V70 K74	Q69-N72 PolarHBondContact O-N 3.02Å; V70-N72 VanDerWaalsContact C-N 3.27Å; V70-N72 PolarHBondContact O-N 3.43Å; N72-K74 HydrophobicContact CB-CB 4.26Å; N72-K74 PolarHBondContact O-N 2.7Å
73	L	38.1	Very low	43.4	Very low	61 Å²	61	72.7 Å²	72.7	32%	0.319	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	30.4	-172.7	-57.1	174.3	0	0	0	113.2	Q69 Y98 T153	Q69-L73 WeakPolarHBondContact O-CA 3.28Å; Q69-L73 PolarHBondContact O-N 3.46Å; L73-Y98 HydrophobicContact CD2-CE1 3.92Å; L73-Y98 WeakPolarHBondContact CD2-OH 3.34Å; L73-T153 HydrophobicContact CD2-CG2 4.46Å
74	K	40.1	Very low	43.3	Very low	100 Å²	100	73 Å²	73	44%	0.435	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	122	-173.6	-173.9	176.9	-179	178.6	0	110	Q69 N72 I76	Q69-K74 HydrophobicContact CB-CB 4.31Å; Q69-K74 VanDerWaalsContact CB-O 3.28Å; Q69-K74 WeakPolarHBondContact CB-O 2.98Å; Q69-K74 PolarHBondContact N-O 3.17Å; Q69-K74 PolarHBondContact O-N 3.5Å; N72-K74 HydrophobicContact CB-CB 4.26Å; N72-K74 PolarHBondContact O-N 2.7Å; K74-I76 PolarHBondContact O-N 2.92Å
75	F	44.9	Very low	43.6	Very low	20 Å²	20	72.8 Å²	72.8	9%	0.088	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	121.9	168.1	-69.9	-88.7	0	0	0	109.9	F25 Y66 S67 L68 V84 F88	F25-F75 HydrophobicContact CE1-CB 3.82Å; F25-F75 HydrophobicContact CZ-CB 4.2Å; F25-F75 HydrophobicContact CZ-CD2 4.46Å; Y66-F75 HydrophobicContact CD1-CB 4.07Å; Y66-F75 HydrophobicContact CG-CB 4.37Å; S67-F75 CarbonylContact O-C 3.43Å; S67-F75 VanDerWaalsContact O-CA 3.23Å; S67-F75 WeakPolarHBondContact O-CA 3.23Å; L68-F75 HydrophobicContact CB-CD1 4.22Å; L68-F75 HydrophobicContact CB-CE1 4.05Å; L68-F75 HydrophobicContact CD1-CD1 4.23Å; L68-F75 HydrophobicContact CD1-CD2 3.98Å; L68-F75 HydrophobicContact CD1-CE1 4.04Å; L68-F75 HydrophobicContact CD1-CE2 3.76Å; L68-F75 HydrophobicContact CD1-CG 4.21Å; L68-F75 HydrophobicContact CD1-CZ 3.8Å; F75-V84 HydrophobicContact CE1-CG1 4.16Å; F75-F88 HydrophobicContact CZ-CZ 4.32Å
76	I	46.5	Very low	43.9	Very low	73 Å²	73	71.8 Å²	71.8	37%	0.374	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.3	176	-57.3	177	0	0	0	107	Y66 S67 Q69 K74 E78	Y66-I76 CarbonylContact C-O 3.44Å; Y66-I76 WeakPolarHBondContact CA-O 3.33Å; S67-I76 PolarHBondContact N-O 3.41Å; S67-I76 PolarHBondContact O-N 2.76Å; Q69-I76 HydrophobicContact CB-CD1 3.81Å; Q69-I76 HydrophobicContact CB-CG1 4.21Å; Q69-I76 HydrophobicContact CG-CD1 4.17Å; K74-I76 PolarHBondContact O-N 2.92Å; I76-E78 PolarHBondContact O-N 3.07Å
77	S	46.2	Very low	44.2	Very low	84 Å²	84	69.8 Å²	69.8	59%	0.587	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.4	124.8	175.7	-179.9	0	0	0	0	109.8	G65	G65-S77 WeakPolarHBondContact O-CA 3.18Å
78	E	52.6	Low	44.6	Very low	56 Å²	56	69.2 Å²	69.2	26%	0.262	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-99.6	128.6	170.7	-77.9	-160.3	-179.5	0	0	109.5	G65 S67 I76 S80 N82	G65-E78 PolarHBondContact O-N 2.78Å; S67-E78 WeakPolarHBondContact CB-OE1 3.39Å; S67-E78 VanDerWaalsContact OG-CG 3.32Å; S67-E78 WeakPolarHBondContact OG-CG 3.43Å; S67-E78 PolarHBondContact OG-OE1 2.8Å; I76-E78 PolarHBondContact O-N 3.07Å; E78-S80 PolarHBondContact O-N 3.17Å; E78-S80 PolarHBondContact OE2-OG 2.04Å; E78-N82 PolarHBondContact OE2-ND2 3.37Å
79	T	46.5	Very low	44.8	Very low	155 Å²	155	69.4 Å²	69.4	95%	0.951	37%	0.366	S	S	*	.	S	Bend	trans	-71.6	-8.9	166.7	48	0	0	0	0	112.1
80	S	46.2	Very low	44.8	Very low	56 Å²	56	67.3 Å²	67.3	39%	0.392	36%	0.357	S	S	.	.	S	Bend	trans	-94.5	144.6	179.8	33.6	0	0	0	0	112.4	E78 N82	E78-S80 PolarHBondContact O-N 3.17Å; E78-S80 PolarHBondContact OE2-OG 2.04Å; S80-N82 PolarHBondContact O-N 3.36Å
81	K	46.7	Very low	45.1	Very low	203 Å²	203	65.6 Å²	65.6	88%	0.883	35%	0.349	S	S	*	.	S	Bend	trans	-61.5	20.5	-177.5	-67.1	178.8	175.4	177.6	0	115.8	N83	K81-N83 PolarHBondContact O-N 3.36Å; K81-N83 VanDerWaalsContact O-N 3.17Å
82	N	44.5	Very low	45.6	Very low	84 Å²	84	68.2 Å²	68.2	45%	0.449	35%	0.354	S	S	.	.			trans	-84.8	95.8	178.2	-63.3	-21.6	0	0	0	107.8	E78 S80 V84	E78-N82 PolarHBondContact OE2-ND2 3.37Å; S80-N82 PolarHBondContact O-N 3.36Å; N82-V84 PolarHBondContact O-N 3.1Å
83	N	44.8	Very low	45.9	Very low	66 Å²	66	68.8 Å²	68.8	35%	0.353	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-63.2	128.2	166.8	-65.6	-28.8	0	0	0	108	T64 K81 Y85	T64-N83 WeakPolarHBondContact CB-OD1 3.29Å; T64-N83 HydrophobicContact CG2-CB 4.21Å; T64-N83 VanDerWaalsContact CG2-OD1 3.23Å; T64-N83 WeakPolarHBondContact CG2-OD1 3.49Å; K81-N83 PolarHBondContact O-N 3.36Å; K81-N83 VanDerWaalsContact O-N 3.17Å; N83-Y85 HydrophobicContact CB-CE1 4.48Å; N83-Y85 HydrophobicContact CB-CE2 4.09Å
84	V	46.7	Very low	46.1	Very low	10 Å²	10	71.6 Å²	71.6	6%	0.061	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	118.3	166.4	165.9	0	0	0	0	108.1	V63 Y66 F75 N82 N100	V63-V84 CarbonylContact C-O 3.48Å; V63-V84 PolarHBondContact N-O 3.22Å; V63-V84 VanDerWaalsContact N-O 3.07Å; V63-V84 CarbonylContact O-C 3.43Å; V63-V84 PolarHBondContact O-N 3.27Å; Y66-V84 VanDerWaalsContact O-CB 3.28Å; Y66-V84 WeakPolarHBondContact O-CB 3.33Å; Y66-V84 WeakPolarHBondContact O-CG2 3.38Å; F75-V84 HydrophobicContact CE1-CG1 4.16Å; N82-V84 PolarHBondContact O-N 3.1Å; V84-N100 WeakPolarHBondContact CG1-OD1 3.15Å
85	Y	48.5	Very low	46.3	Very low	49 Å²	49	67.8 Å²	67.8	19%	0.192	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	133.2	171.3	-59.5	-80.2	0	0	0	107.3	N83 I101	N83-Y85 HydrophobicContact CB-CE1 4.48Å; N83-Y85 HydrophobicContact CB-CE2 4.09Å; Y85-I101 PolarHBondContact N-O 3.44Å; Y85-I101 CarbonylContact O-C 3.42Å; Y85-I101 WeakPolarHBondContact O-CA 3.49Å; Y85-I101 VanDerWaalsContact O-CB 3.23Å; Y85-I101 WeakPolarHBondContact O-CB 3.17Å; Y85-I101 PolarHBondContact O-N 2.93Å
86	G	49.4	Very low	46.3	Very low	3 Å²	3	70.1 Å²	70.1	3%	0.031	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	129.4	178.1	0	0	0	0	0	109.9	F88 V99	G86-F88 WeakPolarHBondContact O-CD2 3.15Å; G86-V99 CarbonylContact C-O 3.52Å; G86-V99 VanDerWaalsContact CA-O 3.28Å; G86-V99 WeakPolarHBondContact CA-O 3.27Å
87	L	49.7	Very low	46.2	Very low	4 Å²	4	66.7 Å²	66.7	2%	0.021	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	125.6	159.9	-70.5	156.6	0	0	0	106.6	I42 L60 F89 Y98 V99 I101 I113	I42-L87 HydrophobicContact CD1-CD2 3.21Å; I42-L87 HydrophobicContact CG1-CD2 3.79Å; L60-L87 HydrophobicContact CD1-CD2 3.35Å; L60-L87 HydrophobicContact CD1-CG 3.91Å; L87-F89 HydrophobicContact CB-CZ 4.18Å; L87-Y98 CarbonylContact O-C 3.6Å; L87-Y98 VanDerWaalsContact O-C 3.29Å; L87-Y98 WeakPolarHBondContact O-CA 3.15Å; L87-Y98 WeakPolarHBondContact O-CB 3.27Å; L87-V99 HydrophobicContact CB-CB 3.9Å; L87-V99 HydrophobicContact CB-CG2 4.06Å; L87-V99 HydrophobicContact CD1-CB 3.89Å; L87-V99 HydrophobicContact CD1-CG1 4.43Å; L87-V99 HydrophobicContact CD1-CG2 3.91Å; L87-V99 HydrophobicContact CG-CB 4.39Å; L87-V99 PolarHBondContact N-O 2.57Å; L87-V99 PolarHBondContact O-N 3.34Å; L87-I101 HydrophobicContact CD1-CD1 4.12Å; L87-I101 HydrophobicContact CG-CD1 4.12Å; L87-I113 HydrophobicContact CD1-CB 4.32Å; L87-I113 HydrophobicContact CD1-CD1 3.55Å; L87-I113 HydrophobicContact CD1-CG2 3.9Å; L87-I113 HydrophobicContact CG-CD1 4.35Å
88	F	51.6	Low	46.3	Very low	15 Å²	15	63.3 Å²	63.3	7%	0.066	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.4	173.3	-62.3	-98.5	0	0	0	107.8	F61 V63 F75 G86 L95	F61-F88 HydrophobicContact CB-CD2 3.76Å; F61-F88 HydrophobicContact CB-CE2 4.01Å; F61-F88 HydrophobicContact CD2-CB 4.07Å; F61-F88 HydrophobicContact CD2-CD2 4.08Å; F61-F88 HydrophobicContact CD2-CG 4.37Å; F61-F88 HydrophobicContact CG-CD2 4.4Å; V63-F88 HydrophobicContact CG2-CE2 3.84Å; V63-F88 HydrophobicContact CG2-CZ 3.69Å; F75-F88 HydrophobicContact CZ-CZ 4.32Å; G86-F88 WeakPolarHBondContact O-CD2 3.15Å; F88-L95 HydrophobicContact CB-CD1 3.94Å; F88-L95 HydrophobicContact CD1-CD1 3.85Å; F88-L95 HydrophobicContact CG-CD1 4.41Å
89	F	48	Very low	46	Very low	21 Å²	21	60.6 Å²	60.6	9%	0.092	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	112.4	175	-56.8	-70.5	0	0	0	107.7	Y57 L87 K96 G97 V99 I115	Y57-F89 HydrophobicContact CD1-CB 3.95Å; Y57-F89 AromaticContact CD1-CD1 3.81Å; Y57-F89 HydrophobicContact CD1-CD1 3.81Å; Y57-F89 HydrophobicContact CD1-CG 4.38Å; Y57-F89 HydrophobicContact CD2-CD1 4.05Å; Y57-F89 HydrophobicContact CE1-CB 3.55Å; Y57-F89 AromaticContact CE1-CD1 3.77Å; Y57-F89 HydrophobicContact CE1-CD1 3.77Å; Y57-F89 HydrophobicContact CE1-CG 4.1Å; Y57-F89 AromaticContact CE2-CD1 3.99Å; Y57-F89 HydrophobicContact CE2-CD1 3.99Å; Y57-F89 AromaticContact CG-CD1 3.95Å; Y57-F89 HydrophobicContact CG-CD1 3.95Å; Y57-F89 AromaticContact CZ-CD1 3.84Å; L87-F89 HydrophobicContact CB-CZ 4.18Å; F89-K96 HydrophobicContact CB-CB 4.33Å; F89-K96 PolarHBondContact O-N 3.24Å; F89-G97 PolarHBondContact N-O 2.98Å; F89-G97 PolarHBondContact O-N 2.97Å; F89-V99 HydrophobicContact CE2-CG2 3.62Å; F89-V99 HydrophobicContact CZ-CG2 3.79Å; F89-I115 HydrophobicContact CE1-CD1 3.93Å; F89-I115 HydrophobicContact CE2-CD1 4.36Å; F89-I115 HydrophobicContact CZ-CD1 3.35Å
90	L	44.1	Very low	46.1	Very low	29 Å²	29	53.6 Å²	53.6	15%	0.152	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	138.1	176	-64.3	164.6	0	0	0	109.1	L8 I20 F61 K94 L95	L8-L90 HydrophobicContact CD1-CD2 3.55Å; L8-L90 HydrophobicContact CD2-CD2 4.11Å; L8-L90 HydrophobicContact CG-CD2 4.49Å; I20-L90 HydrophobicContact CD1-CD1 4.21Å; F61-L90 HydrophobicContact CE2-CD1 3.62Å; F61-L90 HydrophobicContact CZ-CD1 4.06Å; L90-K94 CarbonylContact C-O 3.58Å; L90-K94 WeakPolarHBondContact CA-O 3.38Å; L90-L95 HydrophobicContact CD2-CB 4.34Å; L90-L95 HydrophobicContact CD2-CD1 4.19Å
91	S	41.9	Very low	46.1	Very low	49 Å²	49	51.2 Å²	51.2	34%	0.343	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	127.7	169.2	-177.5	0	0	0	0	109.3	N93 K94 K96	S91-N93 VanDerWaalsContact C-N 3.3Å; S91-N93 PolarHBondContact O-N 3.31Å; S91-K94 PolarHBondContact N-O 2.99Å; S91-K94 WeakPolarHBondContact O-CB 3.4Å; S91-K94 PolarHBondContact O-N 3.04Å; S91-K96 VanDerWaalsContact CB-CG 3.41Å
92	K	44.1	Very low	45.9	Very low	196 Å²	196	44.6 Å²	44.6	85%	0.852	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.9	48	-177.8	-59	179.8	178.4	177.9	0	112.6	K94	K92-K94 PolarHBondContact O-N 3.03Å
93	N	43.1	Very low	45.7	Very low	111 Å²	111	42.1 Å²	42.1	59%	0.594	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	22.2	-175.8	-59.2	-19.1	0	0	0	114.8	L8 S91	L8-N93 WeakPolarHBondContact CB-O 2.95Å; S91-N93 VanDerWaalsContact C-N 3.3Å; S91-N93 PolarHBondContact O-N 3.31Å
94	K	41.3	Very low	45.3	Very low	120 Å²	120	44.2 Å²	44.2	52%	0.522	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.5	174.7	-63.4	-172.8	175.3	-168.8	0	110.5	L90 S91 K92 K96	L90-K94 CarbonylContact C-O 3.58Å; L90-K94 WeakPolarHBondContact CA-O 3.38Å; S91-K94 PolarHBondContact N-O 2.99Å; S91-K94 WeakPolarHBondContact O-CB 3.4Å; S91-K94 PolarHBondContact O-N 3.04Å; K92-K94 PolarHBondContact O-N 3.03Å; K94-K96 PolarHBondContact O-N 3.22Å
95	L	45.8	Very low	44.6	Very low	19 Å²	19	49.9 Å²	49.9	10%	0.099	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	116.6	171	-173.9	68.9	0	0	0	109.2	P6 L8 L24 F88 L90 G97	P6-L95 HydrophobicContact CG-CD2 4.38Å; L8-L95 HydrophobicContact CD1-CB 4.35Å; L24-L95 HydrophobicContact CD1-CD2 4.36Å; L24-L95 HydrophobicContact CD2-CD2 3.96Å; F88-L95 HydrophobicContact CB-CD1 3.94Å; F88-L95 HydrophobicContact CD1-CD1 3.85Å; F88-L95 HydrophobicContact CG-CD1 4.41Å; L90-L95 HydrophobicContact CD2-CB 4.34Å; L90-L95 HydrophobicContact CD2-CD1 4.19Å; L95-G97 WeakPolarHBondContact CD1-O 3.41Å
96	K	44.6	Very low	44.1	Very low	69 Å²	69	48.6 Å²	48.6	30%	0.3	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-37.9	177	-69.8	-57.8	-165.9	162.5	0	112.1	F89 S91 K94 L155	F89-K96 HydrophobicContact CB-CB 4.33Å; F89-K96 PolarHBondContact O-N 3.24Å; S91-K96 VanDerWaalsContact CB-CG 3.41Å; K94-K96 PolarHBondContact O-N 3.22Å; K96-L155 CarbonylContact O-C 3.53Å
97	G	44.8	Very low	43.3	Very low	2 Å²	2	57.4 Å²	57.4	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	176.9	174.9	0	0	0	0	0	111.5	F89 L95	F89-G97 PolarHBondContact N-O 2.98Å; F89-G97 PolarHBondContact O-N 2.97Å; L95-G97 WeakPolarHBondContact CD1-O 3.41Å
98	Y	47.2	Very low	42.4	Very low	12 Å²	12	59.2 Å²	59.2	5%	0.047	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	140	173.8	78.4	-78.6	0	0	0	111.7	L68 L73 L87 N100 T153 L155	L68-Y98 HydrophobicContact CD2-CE2 3.58Å; L68-Y98 WeakPolarHBondContact CD2-OH 3.31Å; L73-Y98 HydrophobicContact CD2-CE1 3.92Å; L73-Y98 WeakPolarHBondContact CD2-OH 3.34Å; L87-Y98 CarbonylContact O-C 3.6Å; L87-Y98 VanDerWaalsContact O-C 3.29Å; L87-Y98 WeakPolarHBondContact O-CA 3.15Å; L87-Y98 WeakPolarHBondContact O-CB 3.27Å; Y98-N100 HydrophobicContact CE2-CB 4.07Å; Y98-T153 HydrophobicContact CE1-CG2 4.34Å; Y98-L155 HydrophobicContact CD1-CD1 4.07Å; Y98-L155 HydrophobicContact CE1-CD1 3.99Å
99	V	47.1	Very low	41.4	Very low	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	120	170	-173.7	0	0	0	0	108.7	G86 L87 F89 I101 I115 V152	G86-V99 CarbonylContact C-O 3.52Å; G86-V99 VanDerWaalsContact CA-O 3.28Å; G86-V99 WeakPolarHBondContact CA-O 3.27Å; L87-V99 HydrophobicContact CB-CB 3.9Å; L87-V99 HydrophobicContact CB-CG2 4.06Å; L87-V99 HydrophobicContact CD1-CB 3.89Å; L87-V99 HydrophobicContact CD1-CG1 4.43Å; L87-V99 HydrophobicContact CD1-CG2 3.91Å; L87-V99 HydrophobicContact CG-CB 4.39Å; L87-V99 PolarHBondContact N-O 2.57Å; L87-V99 PolarHBondContact O-N 3.34Å; F89-V99 HydrophobicContact CE2-CG2 3.62Å; F89-V99 HydrophobicContact CZ-CG2 3.79Å; V99-I101 HydrophobicContact CG1-CG1 4.2Å; V99-I115 HydrophobicContact CG2-CD1 4.24Å; V99-V152 HydrophobicContact CG1-CB 4.39Å; V99-V152 HydrophobicContact CG1-CG1 4.04Å; V99-V152 HydrophobicContact CG1-CG2 4.18Å; V99-V152 HydrophobicContact CG2-CG1 4.04Å
100	N	47.1	Very low	40.5	Very low	7 Å²	7	63.1 Å²	63.1	4%	0.037	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	124.4	169	-171.9	13	0	0	0	110.1	L68 V84 Y98 S102	L68-N100 HydrophobicContact CD2-CB 3.76Å; L68-N100 WeakPolarHBondContact CD2-ND2 3.21Å; V84-N100 WeakPolarHBondContact CG1-OD1 3.15Å; Y98-N100 HydrophobicContact CE2-CB 4.07Å; N100-S102 PolarHBondContact OD1-N 2.72Å
101	I	47.8	Very low	40	Very low	7 Å²	7	62.7 Å²	62.7	4%	0.036	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	77.5	174.7	-58.8	169.9	0	0	0	106.1	Y85 L87 V99 S103 I106 I113 L150	Y85-I101 PolarHBondContact N-O 3.44Å; Y85-I101 CarbonylContact O-C 3.42Å; Y85-I101 WeakPolarHBondContact O-CA 3.49Å; Y85-I101 VanDerWaalsContact O-CB 3.23Å; Y85-I101 WeakPolarHBondContact O-CB 3.17Å; Y85-I101 PolarHBondContact O-N 2.93Å; L87-I101 HydrophobicContact CD1-CD1 4.12Å; L87-I101 HydrophobicContact CG-CD1 4.12Å; V99-I101 HydrophobicContact CG1-CG1 4.2Å; I101-S103 PolarHBondContact O-N 2.91Å; I101-I106 HydrophobicContact CB-CD1 4.47Å; I101-I106 HydrophobicContact CG2-CD1 2.98Å; I101-I106 HydrophobicContact CG2-CG1 4.29Å; I101-I113 HydrophobicContact CD1-CD1 3.43Å; I101-I113 VanDerWaalsContact CD1-CD1 3.43Å; I101-I113 HydrophobicContact CG1-CD1 4.45Å; I101-L150 HydrophobicContact CG1-CD2 4.45Å; I101-L150 HydrophobicContact CG2-CD2 4.12Å
102	S	41.3	Very low	39.8	Very low	63 Å²	63	64.5 Å²	64.5	44%	0.441	35%	0.346	S	S	.	.			trans	-87.2	78.2	175	64	0	0	0	0	109.3	N100	N100-S102 PolarHBondContact OD1-N 2.72Å
103	S	40.3	Very low	39.5	Very low	32 Å²	32	56 Å²	56	22%	0.224	31%	0.309	C	S	.	.			trans	-139.2	128.4	166.3	179.9	0	0	0	0	110.4	I101 E105	I101-S103 PolarHBondContact O-N 2.91Å; S103-E105 PolarHBondContact O-N 2.76Å; S103-E105 WeakPolarHBondContact OG-CB 3.31Å; S103-E105 PolarHBondContact OG-N 3.34Å
104	S	36.7	Very low	39.2	Very low	111 Å²	111	53.7 Å²	53.7	78%	0.776	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-10.7	167	47.6	0	0	0	0	112.9
105	E	31.5	Very low	39.1	Very low	129 Å²	129	48.7 Å²	48.7	60%	0.603	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	0.5	-172	-56.9	179.3	163.4	0	0	113.3	S103 Y107 F148	S103-E105 PolarHBondContact O-N 2.76Å; S103-E105 WeakPolarHBondContact OG-CB 3.31Å; S103-E105 PolarHBondContact OG-N 3.34Å; E105-Y107 PolarHBondContact O-N 3.49Å; E105-F148 WeakPolarHBondContact OE2-CE1 3.47Å
106	I	39.5	Very low	38.6	Very low	22 Å²	22	50.5 Å²	50.5	11%	0.113	28%	0.283	C	S	.	.			trans	-83.5	104.8	-180	-71.1	169	0	0	0	109.6	I101 P108 L138 L150	I101-I106 HydrophobicContact CB-CD1 4.47Å; I101-I106 HydrophobicContact CG2-CD1 2.98Å; I101-I106 HydrophobicContact CG2-CG1 4.29Å; I106-P108 VanDerWaalsContact O-CD 3.27Å; I106-P108 WeakPolarHBondContact O-CD 3.38Å; I106-L138 HydrophobicContact CD1-CD2 3.69Å; I106-L138 HydrophobicContact CG1-CD2 4.01Å; I106-L150 HydrophobicContact CD1-CD2 4.21Å
107	Y	31.5	Very low	38	Very low	188 Å²	188	48 Å²	48	74%	0.737	28%	0.275	S	S	*	.			trans	-75.9	110	158.6	-99.6	-95.3	0	0	0	108.3	E105 S109	E105-Y107 PolarHBondContact O-N 3.49Å; Y107-S109 PolarHBondContact O-N 3.02Å
108	P	31.7	Very low	37.4	Very low	41 Å²	41	50.2 Å²	50.2	27%	0.266	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-5.6	-175.4	25.5	-33.2	0	0	0	114	I106 G110	I106-P108 VanDerWaalsContact O-CD 3.27Å; I106-P108 WeakPolarHBondContact O-CD 3.38Å; P108-G110 VanDerWaalsContact C-N 3.3Å; P108-G110 PolarHBondContact O-N 3.25Å
109	S	29.5	Very low	36.6	Very low	90 Å²	90	53.5 Å²	53.5	63%	0.629	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	2.7	-174	54.9	0	0	0	0	115.3	Y107	Y107-S109 PolarHBondContact O-N 3.02Å
110	G	29.6	Very low	35.8	Very low	29 Å²	29	57.1 Å²	57.1	30%	0.299	32%	0.321	S	S	.	.	S	Bend	trans	-174.4	53.5	-177.8	0	0	0	0	0	113.8	P108 A141	P108-G110 VanDerWaalsContact C-N 3.3Å; P108-G110 PolarHBondContact O-N 3.25Å; G110-A141 WeakPolarHBondContact O-CA 3.25Å; G110-A141 WeakPolarHBondContact O-CB 3.4Å; G110-A141 PolarHBondContact O-N 2.84Å
111	C	34.6	Very low	34.8	Very low	19 Å²	19	64.2 Å²	64.2	13%	0.128	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.3	172.1	68.3	0	0	0	0	111.3	L40 L138 F139	L40-C111 VanDerWaalsContact CD2-O 3.31Å; L40-C111 WeakPolarHBondContact CD2-O 3.43Å; C111-L138 HydrophobicContact CB-CD1 3.76Å; C111-F139 CarbonylContact C-O 3.51Å; C111-F139 VanDerWaalsContact CA-O 3.29Å; C111-F139 WeakPolarHBondContact CA-O 3.43Å
112	T	35.9	Very low	33.9	Very low	88 Å²	88	68.5 Å²	68.5	54%	0.54	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.4	170.4	-57.1	0	0	0	0	107.7	F139	T112-F139 PolarHBondContact N-O 3.34Å; T112-F139 PolarHBondContact O-N 2.87Å
113	I	38.7	Very low	33.3	Very low	16 Å²	16	74 Å²	74	8%	0.082	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	112	174.5	-60.8	168.9	0	0	0	107.3	L87 I101 I115 C136 H137 L138 L150	L87-I113 HydrophobicContact CD1-CB 4.32Å; L87-I113 HydrophobicContact CD1-CD1 3.55Å; L87-I113 HydrophobicContact CD1-CG2 3.9Å; L87-I113 HydrophobicContact CG-CD1 4.35Å; I101-I113 HydrophobicContact CD1-CD1 3.43Å; I101-I113 VanDerWaalsContact CD1-CD1 3.43Å; I101-I113 HydrophobicContact CG1-CD1 4.45Å; I113-I115 HydrophobicContact CG2-CD1 4.4Å; I113-I115 HydrophobicContact CG2-CG1 4.03Å; I113-C136 HydrophobicContact CG2-CB 4.12Å; I113-H137 CarbonylContact C-O 3.56Å; I113-H137 VanDerWaalsContact CA-O 3.29Å; I113-H137 WeakPolarHBondContact CA-O 3.45Å; I113-L138 HydrophobicContact CD1-CD1 4.12Å; I113-L138 HydrophobicContact CG1-CD1 3.53Å; I113-L150 HydrophobicContact CG2-CD1 4.45Å
114	L	37.5	Very low	32.7	Very low	63 Å²	63	83.9 Å²	83.9	33%	0.33	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	132.7	171.7	178.3	72.9	0	0	0	108.3	C136 H137 F139	L114-C136 CarbonylContact O-C 3.51Å; L114-C136 WeakPolarHBondContact O-CA 3.21Å; L114-C136 WeakPolarHBondContact O-CB 3.46Å; L114-H137 HydrophobicContact CB-CB 4.19Å; L114-H137 PolarHBondContact N-O 3.09Å; L114-H137 PolarHBondContact O-N 3.1Å; L114-F139 HydrophobicContact CB-CD2 4.43Å; L114-F139 HydrophobicContact CB-CE2 3.78Å; L114-F139 HydrophobicContact CD2-CE2 4.2Å
115	I	38.2	Very low	32.3	Very low	16 Å²	16	84.2 Å²	84.2	8%	0.082	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	116.3	178.1	-50.8	-168.5	0	0	0	106.9	F89 V99 I113 T134 V135 C136 I154	F89-I115 HydrophobicContact CE1-CD1 3.93Å; F89-I115 HydrophobicContact CE2-CD1 4.36Å; F89-I115 HydrophobicContact CZ-CD1 3.35Å; V99-I115 HydrophobicContact CG2-CD1 4.24Å; I113-I115 HydrophobicContact CG2-CD1 4.4Å; I113-I115 HydrophobicContact CG2-CG1 4.03Å; I115-T134 HydrophobicContact CG2-CG2 3.34Å; I115-V135 CarbonylContact C-O 3.57Å; I115-V135 WeakPolarHBondContact CA-O 3.38Å; I115-C136 HydrophobicContact CG1-CB 4.12Å; I115-C136 WeakPolarHBondContact CG1-SG 3.45Å; I115-I154 HydrophobicContact CG2-CD1 3.83Å
116	E	36.1	Very low	32.5	Very low	56 Å²	56	87.8 Å²	87.8	26%	0.262	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	113.2	-179	-169.7	-172.6	159	0	0	109.2	Q47 I118 T134 V135 H137	Q47-E116 PolarHBondContact NE2-OE1 2.74Å; Q47-E116 PolarHBondContact OE1-OE1 3.46Å; Q47-E116 VanDerWaalsContact OE1-OE1 3.05Å; E116-I118 HydrophobicContact CG-CG1 3.96Å; E116-I118 PolarHBondContact O-N 3.14Å; E116-T134 CarbonylContact O-C 3.54Å; E116-T134 WeakPolarHBondContact O-CA 3.29Å; E116-V135 PolarHBondContact N-O 3.34Å; E116-V135 PolarHBondContact O-N 3.23Å; E116-H137 IonicContact OE2-NE2 3.95Å
117	S	32.4	Very low	32.4	Very low	18 Å²	18	93.9 Å²	93.9	13%	0.126	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	117.3	166.3	-64.7	0	0	0	0	108.7	Q47 F48 T134	Q47-S117 PolarHBondContact NE2-O 2.79Å; F48-S117 WeakPolarHBondContact CE2-O 3.48Å; S117-T134 WeakPolarHBondContact OG-CG2 3.26Å; S117-T134 PolarHBondContact OG-OG1 3.37Å
118	I	32	Very low	32.4	Very low	47 Å²	47	89.3 Å²	89.3	24%	0.241	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	115.7	177.3	-54	179.3	0	0	0	107.7	E116 Q120 T133 V135	E116-I118 HydrophobicContact CG-CG1 3.96Å; E116-I118 PolarHBondContact O-N 3.14Å; I118-Q120 HydrophobicContact CG2-CG 4.08Å; I118-Q120 PolarHBondContact O-N 2.75Å; I118-Q120 VanDerWaalsContact O-N 3.1Å; I118-T133 WeakPolarHBondContact CA-O 3.13Å; I118-T133 PolarHBondContact N-O 3.02Å; I118-T133 PolarHBondContact O-N 3.38Å; I118-T133 VanDerWaalsContact O-O 3.08Å; I118-V135 HydrophobicContact CD1-CB 4.38Å; I118-V135 HydrophobicContact CD1-CG2 3.67Å; I118-V135 HydrophobicContact CG1-CG2 4.31Å
119	N	28.9	Very low	32.2	Very low	81 Å²	81	90.9 Å²	90.9	43%	0.433	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	103.4	162.4	-77.4	-27	0	0	0	107.9	F48 E121 I130	F48-N119 HydrophobicContact CZ-CB 4.41Å; N119-E121 PolarHBondContact O-N 2.85Å; N119-I130 HydrophobicContact CB-CG2 4.23Å
120	Q	31.9	Very low	32.3	Very low	76 Å²	76	91.8 Å²	91.8	36%	0.355	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	105.7	171	-69.6	-167.6	8.8	0	0	108.6	I118 L122	I118-Q120 HydrophobicContact CG2-CG 4.08Å; I118-Q120 PolarHBondContact O-N 2.75Å; I118-Q120 VanDerWaalsContact O-N 3.1Å; Q120-L122 HydrophobicContact CB-CD1 4.42Å; Q120-L122 HydrophobicContact CB-CG 4.19Å; Q120-L122 PolarHBondContact O-N 2.75Å
121	E	26.2	Very low	32.3	Very low	157 Å²	157	96 Å²	96	73%	0.734	47%	0.466	S	S	*	.			trans	-67.6	80.6	158.9	-73.7	-170.7	173.5	0	0	108.6	N119 R123	N119-E121 PolarHBondContact O-N 2.85Å; E121-R123 PolarHBondContact O-N 3.18Å
122	L	28	Very low	32	Very low	96 Å²	96	97.5 Å²	97.5	50%	0.503	48%	0.475	S	S	.	.			trans	-71.7	81.5	172.9	-85.9	160.9	0	0	0	109.5	Q120 N128	Q120-L122 HydrophobicContact CB-CD1 4.42Å; Q120-L122 HydrophobicContact CB-CG 4.19Å; Q120-L122 PolarHBondContact O-N 2.75Å; L122-N128 PolarHBondContact O-ND2 3.27Å
123	R	29.4	Very low	31.9	Very low	179 Å²	179	95 Å²	95	68%	0.675	46%	0.46	S	S	*	.			trans	57.6	122.7	175.5	-68.9	-178.8	173.1	-173.6	-2.6	114	E121 N125	E121-R123 PolarHBondContact O-N 3.18Å; R123-N125 PolarHBondContact O-N 2.8Å
124	R	26.1	Very low	31.7	Very low	239 Å²	239	94.6 Å²	94.6	90%	0.902	46%	0.458	S	S	*	.			trans	-51.9	86.9	163	-80.1	-177	175	-173.5	-4.5	110.7
125	N	28.9	Very low	31.7	Very low	119 Å²	119	93.8 Å²	93.8	64%	0.636	46%	0.455	S	S	*	.			trans	-118.7	126.7	144.2	-89.3	-6.9	0	0	0	104	R123 N127 N128	R123-N125 PolarHBondContact O-N 2.8Å; N125-N127 PolarHBondContact O-N 2.9Å; N125-N128 PolarHBondContact O-N 3.02Å
126	E	35.4	Very low	31.6	Very low	204 Å²	204	93.5 Å²	93.5	95%	0.953	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-0.8	-172.6	-64.4	178.3	160	0	0	114.7
127	N	37.2	Very low	31.8	Very low	150 Å²	150	92.7 Å²	92.7	80%	0.802	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	3.3	-179.2	-63.6	-23.2	0	0	0	114.3	N125	N125-N127 PolarHBondContact O-N 2.9Å
128	N	31.9	Very low	32	Very low	91 Å²	91	92.2 Å²	92.2	49%	0.487	45%	0.447	S	S	.	.			trans	-89.4	125.4	178.9	-84.7	-2.5	0	0	0	111.2	L122 N125 I130	L122-N128 PolarHBondContact O-ND2 3.27Å; N125-N128 PolarHBondContact O-N 3.02Å; N128-I130 PolarHBondContact O-N 2.64Å
129	P	28	Very low	32.1	Very low	74 Å²	74	94.3 Å²	94.3	48%	0.481	45%	0.454	S	S	.	.			trans	-59.1	137.9	171.9	-20	32.3	0	0	0	110.5	Y131	P129-Y131 HydrophobicContact CB-CD2 4.48Å; P129-Y131 HydrophobicContact CB-CE1 4.11Å; P129-Y131 HydrophobicContact CB-CE2 3.93Å; P129-Y131 HydrophobicContact CG-CE2 4.2Å; P129-Y131 WeakPolarHBondContact CG-OH 3.42Å; P129-Y131 VanDerWaalsContact O-CD2 3.27Å; P129-Y131 WeakPolarHBondContact O-CD2 3.29Å; P129-Y131 WeakPolarHBondContact O-CE2 3.43Å; P129-Y131 PolarHBondContact O-N 3.23Å
130	I	31.3	Very low	32	Very low	110 Å²	110	91.7 Å²	91.7	56%	0.564	45%	0.446	S	S	*	.			trans	-71.7	112.2	167	-61.6	171.5	0	0	0	106.2	N119 N128	N119-I130 HydrophobicContact CB-CG2 4.23Å; N128-I130 PolarHBondContact O-N 2.64Å
131	Y	29.2	Very low	31.7	Very low	118 Å²	118	91.7 Å²	91.7	46%	0.463	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	117.3	174.5	-64.2	-75.7	0	0	0	109.1	P129 T133	P129-Y131 HydrophobicContact CB-CD2 4.48Å; P129-Y131 HydrophobicContact CB-CE1 4.11Å; P129-Y131 HydrophobicContact CB-CE2 3.93Å; P129-Y131 HydrophobicContact CG-CE2 4.2Å; P129-Y131 WeakPolarHBondContact CG-OH 3.42Å; P129-Y131 VanDerWaalsContact O-CD2 3.27Å; P129-Y131 WeakPolarHBondContact O-CD2 3.29Å; P129-Y131 WeakPolarHBondContact O-CE2 3.43Å; P129-Y131 PolarHBondContact O-N 3.23Å; Y131-T133 PolarHBondContact O-N 2.91Å
132	P	29.8	Very low	31.6	Very low	49 Å²	49	89 Å²	89	32%	0.318	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	127.9	167.3	26.9	-31	0	0	0	108.2	E156	P132-E156 WeakPolarHBondContact CB-OE2 3.46Å; P132-E156 WeakPolarHBondContact CG-OE2 3.47Å
133	T	33.4	Very low	31.4	Very low	37 Å²	37	94.6 Å²	94.6	23%	0.227	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.5	173.8	-60.2	0	0	0	0	108.2	I118 Y131	I118-T133 WeakPolarHBondContact CA-O 3.13Å; I118-T133 PolarHBondContact N-O 3.02Å; I118-T133 PolarHBondContact O-N 3.38Å; I118-T133 VanDerWaalsContact O-O 3.08Å; Y131-T133 PolarHBondContact O-N 2.91Å
134	T	34.3	Very low	31.3	Very low	6 Å²	6	94 Å²	94	4%	0.037	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	124.7	179.6	-43.3	0	0	0	0	110.6	I115 E116 S117 I154	I115-T134 HydrophobicContact CG2-CG2 3.34Å; E116-T134 CarbonylContact O-C 3.54Å; E116-T134 WeakPolarHBondContact O-CA 3.29Å; S117-T134 WeakPolarHBondContact OG-CG2 3.26Å; S117-T134 PolarHBondContact OG-OG1 3.37Å; T134-I154 HydrophobicContact CG2-CD1 3.12Å; T134-I154 HydrophobicContact CG2-CG1 4.29Å; T134-I154 HydrophobicContact CG2-CG2 4.37Å
135	V	37.2	Very low	31.3	Very low	46 Å²	46	85.6 Å²	85.6	28%	0.279	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.3	-178.5	-179.3	0	0	0	0	108.2	I115 E116 I118	I115-V135 CarbonylContact C-O 3.57Å; I115-V135 WeakPolarHBondContact CA-O 3.38Å; E116-V135 PolarHBondContact N-O 3.34Å; E116-V135 PolarHBondContact O-N 3.23Å; I118-V135 HydrophobicContact CD1-CB 4.38Å; I118-V135 HydrophobicContact CD1-CG2 3.67Å; I118-V135 HydrophobicContact CG1-CG2 4.31Å
136	C	35.9	Very low	31.2	Very low	10 Å²	10	82.4 Å²	82.4	7%	0.068	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142	166.4	-41.8	0	0	0	0	112.6	I113 L114 I115 V152	I113-C136 HydrophobicContact CG2-CB 4.12Å; L114-C136 CarbonylContact O-C 3.51Å; L114-C136 WeakPolarHBondContact O-CA 3.21Å; L114-C136 WeakPolarHBondContact O-CB 3.46Å; I115-C136 HydrophobicContact CG1-CB 4.12Å; I115-C136 WeakPolarHBondContact CG1-SG 3.45Å; C136-V152 HydrophobicContact CB-CB 4.32Å; C136-V152 HydrophobicContact CB-CG1 4.13Å; C136-V152 HydrophobicContact CB-CG2 3.3Å; C136-V152 WeakPolarHBondContact SG-CG1 3.48Å; C136-V152 VanDerWaalsContact SG-CG2 3.56Å
137	H	40.5	Very low	31.1	Very low	39 Å²	39	77.3 Å²	77.3	18%	0.181	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131.9	174.1	-52.5	-91.1	0	0	0	108.7	I113 L114 E116 F139	I113-H137 CarbonylContact C-O 3.56Å; I113-H137 VanDerWaalsContact CA-O 3.29Å; I113-H137 WeakPolarHBondContact CA-O 3.45Å; L114-H137 HydrophobicContact CB-CB 4.19Å; L114-H137 PolarHBondContact N-O 3.09Å; L114-H137 PolarHBondContact O-N 3.1Å; E116-H137 IonicContact OE2-NE2 3.95Å; H137-F139 HydrophobicContact CB-CD2 4.4Å; H137-F139 HydrophobicContact CB-CE2 3.68Å; H137-F139 HydrophobicContact CB-CZ 3.96Å
138	L	36	Very low	30.7	Very low	9 Å²	9	74 Å²	74	5%	0.047	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	124.2	168.4	-173.9	73.9	0	0	0	109	I106 C111 I113 F148 L150	I106-L138 HydrophobicContact CD1-CD2 3.69Å; I106-L138 HydrophobicContact CG1-CD2 4.01Å; C111-L138 HydrophobicContact CB-CD1 3.76Å; I113-L138 HydrophobicContact CD1-CD1 4.12Å; I113-L138 HydrophobicContact CG1-CD1 3.53Å; L138-F148 HydrophobicContact CD2-CB 4.45Å; L138-L150 HydrophobicContact CB-CD1 3.63Å; L138-L150 HydrophobicContact CB-CD2 4.4Å; L138-L150 HydrophobicContact CB-CG 3.73Å; L138-L150 HydrophobicContact CD1-CD1 4.14Å; L138-L150 HydrophobicContact CD2-CD2 4.1Å; L138-L150 HydrophobicContact CD2-CG 4.34Å; L138-L150 HydrophobicContact CG-CD1 4.33Å; L138-L150 HydrophobicContact CG-CG 4.49Å
139	F	33.9	Very low	30.8	Very low	90 Å²	90	72.3 Å²	72.3	40%	0.395	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	115.7	170	-59.5	-83.2	0	0	0	108.4	C111 T112 L114 H137	C111-F139 CarbonylContact C-O 3.51Å; C111-F139 VanDerWaalsContact CA-O 3.29Å; C111-F139 WeakPolarHBondContact CA-O 3.43Å; T112-F139 PolarHBondContact N-O 3.34Å; T112-F139 PolarHBondContact O-N 2.87Å; L114-F139 HydrophobicContact CB-CD2 4.43Å; L114-F139 HydrophobicContact CB-CE2 3.78Å; L114-F139 HydrophobicContact CD2-CE2 4.2Å; H137-F139 HydrophobicContact CB-CD2 4.4Å; H137-F139 HydrophobicContact CB-CE2 3.68Å; H137-F139 HydrophobicContact CB-CZ 3.96Å
140	G	28.3	Very low	31	Very low	26 Å²	26	69.9 Å²	69.9	27%	0.268	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	134.5	170.5	0	0	0	0	0	111.1	T142 S145	G140-T142 VanDerWaalsContact C-N 3.27Å; G140-T142 PolarHBondContact O-N 2.71Å; G140-S145 VanDerWaalsContact O-CB 3.25Å; G140-S145 WeakPolarHBondContact O-CB 3.3Å; G140-S145 PolarHBondContact O-OG 3.3Å
141	A	25.4	Very low	31.2	Very low	77 Å²	77	67.3 Å²	67.3	64%	0.636	36%	0.364	S	S	*	.	S	Bend	trans	-81.2	6.7	-178.1	0	0	0	0	0	114.7	G110	G110-A141 WeakPolarHBondContact O-CA 3.25Å; G110-A141 WeakPolarHBondContact O-CB 3.4Å; G110-A141 PolarHBondContact O-N 2.84Å
142	T	24.4	Very low	31.4	Very low	101 Å²	101	62.2 Å²	62.2	62%	0.62	35%	0.345	S	S	*	.	S	Bend	trans	-133.5	118.8	-172.9	48.7	0	0	0	0	111.7	G140	G140-T142 VanDerWaalsContact C-N 3.27Å; G140-T142 PolarHBondContact O-N 2.71Å
143	Y	23.5	Very low	31.5	Very low	212 Å²	212	61 Å²	61	83%	0.831	34%	0.337	S	S	*	.	S	Bend	trans	61.4	107.8	168.1	-66.8	-89.4	0	0	0	117.2	S145	Y143-S145 WeakPolarHBondContact O-CA 3.24Å; Y143-S145 PolarHBondContact O-N 2.85Å
144	N	25.8	Very low	31.4	Very low	167 Å²	167	59.8 Å²	59.8	89%	0.893	33%	0.329	S	S	*	.	S	Bend	trans	45.6	40.8	163.6	-75.6	-15	0	0	0	114.6	T146	N144-T146 PolarHBondContact O-N 3.1Å; N144-T146 VanDerWaalsContact O-N 3.08Å
145	S	26.8	Very low	31.2	Very low	62 Å²	62	61.1 Å²	61.1	43%	0.434	34%	0.336	S	S	.	.			trans	-66.6	113.9	-148.7	44.7	0	0	0	0	113.2	G140 Y143 I147	G140-S145 VanDerWaalsContact O-CB 3.25Å; G140-S145 WeakPolarHBondContact O-CB 3.3Å; G140-S145 PolarHBondContact O-OG 3.3Å; Y143-S145 WeakPolarHBondContact O-CA 3.24Å; Y143-S145 PolarHBondContact O-N 2.85Å; S145-I147 PolarHBondContact O-N 3.08Å
146	T	27	Very low	30.7	Very low	53 Å²	53	62.9 Å²	62.9	33%	0.325	34%	0.341	S	S	.	.			trans	-56.4	126.6	167.8	-12.4	0	0	0	0	107.9	N144 F148 P173	N144-T146 PolarHBondContact O-N 3.1Å; N144-T146 VanDerWaalsContact O-N 3.08Å; T146-F148 WeakPolarHBondContact O-CD2 3.43Å; T146-F148 PolarHBondContact O-N 2.91Å; T146-F148 VanDerWaalsContact O-N 3.08Å; T146-P173 HydrophobicContact CG2-CG 3.79Å
147	I	32.6	Very low	30.2	Very low	97 Å²	97	66 Å²	66	50%	0.497	36%	0.357	S	S	.	.			trans	-66.6	109.4	169.6	-62.3	169.8	0	0	0	106.4	S145 P149	S145-I147 PolarHBondContact O-N 3.08Å; I147-P149 WeakPolarHBondContact O-CD 3.22Å
148	F	29.9	Very low	29.6	Very low	80 Å²	80	71.5 Å²	71.5	35%	0.351	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	119.8	170.6	-66.8	-84	0	0	0	108.2	E105 L138 T146 L150	E105-F148 WeakPolarHBondContact OE2-CE1 3.47Å; L138-F148 HydrophobicContact CD2-CB 4.45Å; T146-F148 WeakPolarHBondContact O-CD2 3.43Å; T146-F148 PolarHBondContact O-N 2.91Å; T146-F148 VanDerWaalsContact O-N 3.08Å; F148-L150 PolarHBondContact O-N 2.89Å; F148-L150 VanDerWaalsContact O-N 3.14Å
149	P	32.9	Very low	29.2	Very low	55 Å²	55	75.4 Å²	75.4	36%	0.357	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	117.5	169.4	25.1	-29.7	0	0	0	108.4	I147 W168	I147-P149 WeakPolarHBondContact O-CD 3.22Å; P149-W168 HydrophobicContact CB-CB 3.66Å; P149-W168 VanDerWaalsContact CB-O 3.31Å; P149-W168 WeakPolarHBondContact CB-O 3.37Å; P149-W168 HydrophobicContact CG-CB 4.44Å; P149-W168 WeakPolarHBondContact CG-O 2.89Å
150	L	33.4	Very low	28.8	Very low	23 Å²	23	79.7 Å²	79.7	12%	0.12	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-79.2	143.1	170.1	-77.8	176.7	0	0	0	109.8	I101 I106 I113 L138 F148 V152	I101-L150 HydrophobicContact CG1-CD2 4.45Å; I101-L150 HydrophobicContact CG2-CD2 4.12Å; I106-L150 HydrophobicContact CD1-CD2 4.21Å; I113-L150 HydrophobicContact CG2-CD1 4.45Å; L138-L150 HydrophobicContact CB-CD1 3.63Å; L138-L150 HydrophobicContact CB-CD2 4.4Å; L138-L150 HydrophobicContact CB-CG 3.73Å; L138-L150 HydrophobicContact CD1-CD1 4.14Å; L138-L150 HydrophobicContact CD2-CD2 4.1Å; L138-L150 HydrophobicContact CD2-CG 4.34Å; L138-L150 HydrophobicContact CG-CD1 4.33Å; L138-L150 HydrophobicContact CG-CG 4.49Å; F148-L150 PolarHBondContact O-N 2.89Å; F148-L150 VanDerWaalsContact O-N 3.14Å; L150-V152 VanDerWaalsContact C-N 3.31Å; L150-V152 HydrophobicContact CB-CG2 3.88Å; L150-V152 PolarHBondContact O-N 3.05Å
151	N	34.4	Very low	28.7	Very low	57 Å²	57	82.9 Å²	82.9	31%	0.305	45%	0.448	S	S	.	.			trans	-74.2	91	163.2	-79.6	-20.1	0	0	0	108.6
152	V	33.2	Very low	28.8	Very low	10 Å²	10	86.1 Å²	86.1	6%	0.061	45%	0.448	C	S	.	.			trans	-93.1	121.9	175.9	-168.4	0	0	0	0	108.4	V99 C136 L150 I154 V165	V99-V152 HydrophobicContact CG1-CB 4.39Å; V99-V152 HydrophobicContact CG1-CG1 4.04Å; V99-V152 HydrophobicContact CG1-CG2 4.18Å; V99-V152 HydrophobicContact CG2-CG1 4.04Å; C136-V152 HydrophobicContact CB-CB 4.32Å; C136-V152 HydrophobicContact CB-CG1 4.13Å; C136-V152 HydrophobicContact CB-CG2 3.3Å; C136-V152 WeakPolarHBondContact SG-CG1 3.48Å; C136-V152 VanDerWaalsContact SG-CG2 3.56Å; L150-V152 VanDerWaalsContact C-N 3.31Å; L150-V152 HydrophobicContact CB-CG2 3.88Å; L150-V152 PolarHBondContact O-N 3.05Å; V152-I154 HydrophobicContact CG1-CD1 3.46Å; V152-I154 VanDerWaalsContact CG1-CD1 3.46Å; V152-I154 HydrophobicContact CG1-CG1 3.34Å; V152-V165 WeakPolarHBondContact O-CB 2.97Å; V152-V165 WeakPolarHBondContact O-CG1 3.41Å
153	T	32.5	Very low	28.9	Very low	23 Å²	23	83.8 Å²	83.8	14%	0.141	44%	0.435	C	S	.	.			trans	-104.2	124.1	161.5	-56.2	0	0	0	0	106	L73 Y98	L73-T153 HydrophobicContact CD2-CG2 4.46Å; Y98-T153 HydrophobicContact CE1-CG2 4.34Å
154	I	31.3	Very low	29.1	Very low	12 Å²	12	81.3 Å²	81.3	6%	0.062	44%	0.437	C	S	.	.			trans	-117	117.8	173.4	-58.1	-164.6	0	0	0	107.1	I115 T134 V152 E156	I115-I154 HydrophobicContact CG2-CD1 3.83Å; T134-I154 HydrophobicContact CG2-CD1 3.12Å; T134-I154 HydrophobicContact CG2-CG1 4.29Å; T134-I154 HydrophobicContact CG2-CG2 4.37Å; V152-I154 HydrophobicContact CG1-CD1 3.46Å; V152-I154 VanDerWaalsContact CG1-CD1 3.46Å; V152-I154 HydrophobicContact CG1-CG1 3.34Å; I154-E156 HydrophobicContact CG2-CG 4.23Å
155	L	30.2	Very low	29.2	Very low	35 Å²	35	76 Å²	76	18%	0.183	41%	0.41	C	S	.	.			trans	-92.8	115.5	168.9	-62.9	163.1	0	0	0	104.5	K96 Y98 F162	K96-L155 CarbonylContact O-C 3.53Å; Y98-L155 HydrophobicContact CD1-CD1 4.07Å; Y98-L155 HydrophobicContact CE1-CD1 3.99Å; L155-F162 HydrophobicContact CD2-CD1 3.88Å; L155-F162 HydrophobicContact CD2-CE1 4.47Å
156	E	27.9	Very low	29.3	Very low	82 Å²	82	79.4 Å²	79.4	38%	0.383	42%	0.419	S	S	.	.			trans	-107.1	94.8	164.6	-88.9	-177	179.9	0	0	106.8	P132 I154 D158	P132-E156 WeakPolarHBondContact CB-OE2 3.46Å; P132-E156 WeakPolarHBondContact CG-OE2 3.47Å; I154-E156 HydrophobicContact CG2-CG 4.23Å; E156-D158 VanDerWaalsContact C-N 3.34Å; E156-D158 PolarHBondContact O-N 2.84Å
157	N	25.2	Very low	29.3	Very low	76 Å²	76	85.8 Å²	85.8	41%	0.406	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	74.1	-179.3	-154.7	14.7	0	0	0	110.1	T159	N157-T159 PolarHBondContact OD1-O 3.27Å
158	D	26.9	Very low	29	Very low	154 Å²	154	87.6 Å²	87.6	82%	0.824	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	-8.3	158.3	-79.7	-11.4	0	0	0	111.7	E156	E156-D158 VanDerWaalsContact C-N 3.34Å; E156-D158 PolarHBondContact O-N 2.84Å
159	T	27.1	Very low	28.9	Very low	91 Å²	91	89.9 Å²	89.9	56%	0.558	45%	0.454	S	S	*	.	S	Bend	trans	-139.7	139.6	169.5	50.9	0	0	0	0	106.5	N157 T161	N157-T159 PolarHBondContact OD1-O 3.27Å; T159-T161 PolarHBondContact O-N 3.28Å; T159-T161 PolarHBondContact OG1-OG1 2.8Å
160	E	25.8	Very low	28.6	Very low	181 Å²	181	94.2 Å²	94.2	85%	0.846	47%	0.469	S	S	*	.	S	Bend	trans	-64.1	21.5	-175.8	-62.4	177.2	161.5	0	0	114.4
161	T	26.2	Very low	28.2	Very low	92 Å²	92	96.5 Å²	96.5	56%	0.564	48%	0.481	S	S	*	.			trans	-99.7	111.9	-178.7	43.8	0	0	0	0	111.4	T159 S163	T159-T161 PolarHBondContact O-N 3.28Å; T159-T161 PolarHBondContact OG1-OG1 2.8Å; T161-S163 PolarHBondContact O-N 3.49Å
162	F	28.2	Very low	27.7	Very low	145 Å²	145	99.1 Å²	99.1	64%	0.636	49%	0.494	S	S	*	.			trans	-71.9	117.5	171.8	-59.4	-90	0	0	0	110.5	L155	L155-F162 HydrophobicContact CD2-CD1 3.88Å; L155-F162 HydrophobicContact CD2-CE1 4.47Å
163	S	26.4	Very low	27.3	Very low	52 Å²	52	103.6 Å²	103.6	36%	0.364	52%	0.523	S	S	.	.			trans	-94.8	113.6	169.1	51.2	0	0	0	0	110.7	T161	T161-S163 PolarHBondContact O-N 3.49Å
164	N	27.1	Very low	27	Very low	161 Å²	161	105.7 Å²	105.7	86%	0.861	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-72.9	124.9	170.4	-77.8	-26.6	0	0	0	110
165	V	28.3	Very low	26.7	Very low	54 Å²	54	109.3 Å²	109.3	33%	0.327	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-96.1	131.6	176.1	179.9	0	0	0	0	110.1	V152	V152-V165 WeakPolarHBondContact O-CB 2.97Å; V152-V165 WeakPolarHBondContact O-CG1 3.41Å
166	Q	28	Very low	26.4	Very low	134 Å²	134	116.1 Å²	116.1	63%	0.626	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-86.3	139.2	-168.5	-140.1	174	7.6	0	0	112.4
167	R	26.9	Very low	26.2	Very low	187 Å²	187	120.5 Å²	120.5	71%	0.706	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-61.8	129.2	-178.7	-157.6	176.8	-178	175.5	1.4	112.1
168	W	28	Very low	26.1	Very low	136 Å²	136	120.6 Å²	120.6	52%	0.515	64%	0.639	S	S	.	*	P	Polyproline II helix	trans	-99.4	117.4	165.1	-84.1	60.4	0	0	0	109.2	P149	P149-W168 HydrophobicContact CB-CB 3.66Å; P149-W168 VanDerWaalsContact CB-O 3.31Å; P149-W168 WeakPolarHBondContact CB-O 3.37Å; P149-W168 HydrophobicContact CG-CB 4.44Å; P149-W168 WeakPolarHBondContact CG-O 2.89Å
169	N	26.9	Very low	25.8	Very low	127 Å²	127	122 Å²	122	68%	0.679	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-87.9	137	172.9	-73.8	-20.5	0	0	0	110.2
170	Q	26.6	Very low	25.6	Very low	147 Å²	147	127 Å²	127	69%	0.687	65%	0.652	S	S	*	*			trans	-11.6	127.6	176.4	-82.5	172.9	-22.1	0	0	118.4	L172	Q170-L172 HydrophobicContact CB-CD1 4.43Å
171	I	25.1	Very low	25.4	Very low	70 Å²	70	126.4 Å²	126.4	36%	0.359	65%	0.649	S	S	.	*			trans	-100	102.6	154.4	-57.5	171.4	0	0	0	106.6	S200	I171-S200 VanDerWaalsContact CD1-OG 3.29Å; I171-S200 WeakPolarHBondContact CD1-OG 3.35Å
172	L	24.6	Very low	25.3	Very low	112 Å²	112	126.9 Å²	126.9	59%	0.586	66%	0.656	S	S	*	*			trans	-71.7	129.4	167.4	-100	96.5	0	0	0	109.1	Q170 S174	Q170-L172 HydrophobicContact CB-CD1 4.43Å; L172-S174 VanDerWaalsContact C-N 3.26Å; L172-S174 PolarHBondContact O-N 3.36Å
173	P	23.7	Very low	25.1	Very low	104 Å²	104	125 Å²	125	68%	0.675	66%	0.661	S	S	*	*			trans	-77.3	82.9	165.8	31.9	-29.3	0	0	0	108	T146	T146-P173 HydrophobicContact CG2-CG 3.79Å
174	S	26.3	Very low	24.8	Very low	67 Å²	67	130 Å²	130	47%	0.469	68%	0.683	S	S	.	*			trans	-97.2	115.7	165.5	77.1	0	0	0	0	108.8	L172 K176	L172-S174 VanDerWaalsContact C-N 3.26Å; L172-S174 PolarHBondContact O-N 3.36Å; S174-K176 PolarHBondContact O-N 2.95Å
175	G	24.9	Very low	24.7	Very low	89 Å²	89	129.9 Å²	129.9	92%	0.918	68%	0.682	S	S	*	*			trans	-69.1	36	179	0	0	0	0	0	114.4
176	K	25.1	Very low	24.3	Very low	178 Å²	178	132.2 Å²	132.2	77%	0.774	70%	0.701	S	S	*	*	S	Bend	trans	-138.4	121.3	177.7	-72.1	-172.5	178.9	179.1	0	111.2	S174 S178	S174-K176 PolarHBondContact O-N 2.95Å; K176-S178 PolarHBondContact O-N 3.05Å
177	I	22.7	Very low	24.1	Very low	173 Å²	173	133.3 Å²	133.3	89%	0.887	71%	0.71	S	S	*	*			trans	-34.3	114.5	170.9	-57.6	163	0	0	0	111.1
178	S	23.2	Very low	23.9	Very low	79 Å²	79	132.4 Å²	132.4	55%	0.552	72%	0.719	S	S	*	*			trans	-135.8	109.4	160.4	52.9	0	0	0	0	110	K176 F180	K176-S178 PolarHBondContact O-N 3.05Å; S178-F180 PolarHBondContact O-N 2.95Å
179	K	20.9	Very low	23.7	Very low	184 Å²	184	130.5 Å²	130.5	80%	0.8	73%	0.726	S	S	*	*			trans	-70.4	120.4	166.4	-76.3	176.4	174.5	177.5	0	107.4
180	F	24	Very low	23.5	Very low	195 Å²	195	131.8 Å²	131.8	86%	0.855	74%	0.739	S	S	*	*			trans	-108.2	109.9	162.4	-106.9	-86.8	0	0	0	109.8	S178	S178-F180 PolarHBondContact O-N 2.95Å
181	H	21.2	Very low	23.4	Very low	169 Å²	169	129.2 Å²	129.2	78%	0.782	74%	0.737	S	S	*	*			trans	-90.6	136.2	160.2	-76.8	-63.1	0	0	0	108.2
182	S	24.3	Very low	23.2	Very low	102 Å²	102	131.4 Å²	131.4	71%	0.713	76%	0.759	S	S	*	*			trans	175.1	93.8	157.7	159.3	0	0	0	0	108.3
183	S	23	Very low	23.2	Very low	106 Å²	106	131.6 Å²	131.6	74%	0.741	77%	0.765	S	S	*	*				76.7	119.1	83.9	65.1	0	0	0	0	114.2
184	N	21.2	Very low	23.1	Very low	155 Å²	155	133.7 Å²	133.7	83%	0.829	77%	0.77	S	S	*	*			trans	-38.7	130.8	167.9	-75.8	-21.4	0	0	0	112
185	N	23.1	Very low	23.1	Very low	159 Å²	159	134.3 Å²	134.3	85%	0.85	77%	0.771	S	S	*	*			trans	-159.5	134.5	141.2	-94.4	-23.5	0	0	0	111.7
186	S	21.1	Very low	22.9	Very low	103 Å²	103	135.3 Å²	135.3	72%	0.72	75%	0.752	S	S	*	*			trans	-58.5	136.1	-179.4	51	0	0	0	0	114.2
187	I	24.6	Very low	22.8	Very low	158 Å²	158	134.5 Å²	134.5	81%	0.81	76%	0.755	S	S	*	*			trans	-131.4	113.3	155.8	-61.3	-179.6	0	0	0	108.2	S189	I187-S189 PolarHBondContact O-N 3.15Å
188	N	21.4	Very low	22.9	Very low	168 Å²	168	131.6 Å²	131.6	90%	0.898	74%	0.736	S	S	*	*			trans	-65.1	109.9	169.9	-75.7	-25.7	0	0	0	109.5
189	S	24.6	Very low	23	Very low	95 Å²	95	134 Å²	134	66%	0.664	74%	0.743	S	S	*	*			trans	-142.3	124.5	153.9	60.4	0	0	0	0	109.7	I187 S191	I187-S189 PolarHBondContact O-N 3.15Å; S189-S191 VanDerWaalsContact C-N 3.29Å; S189-S191 PolarHBondContact O-N 2.65Å
190	T	22.7	Very low	23.3	Very low	154 Å²	154	126.6 Å²	126.6	95%	0.945	71%	0.714	S	S	*	*	S	Bend	trans	-74	74	-174.9	43.8	0	0	0	0	111.2
191	S	24.6	Very low	23.4	Very low	93 Å²	93	123.9 Å²	123.9	65%	0.65	70%	0.699	S	S	*	*	S	Bend	trans	-167.5	100	157	57.4	0	0	0	0	107.4	S189 T193	S189-S191 VanDerWaalsContact C-N 3.29Å; S189-S191 PolarHBondContact O-N 2.65Å; S191-T193 PolarHBondContact O-N 3.37Å
192	S	21	Very low	23.7	Very low	117 Å²	117	120.9 Å²	120.9	82%	0.818	69%	0.688	S	S	*	*			trans	-70.3	95.1	-170	52.9	0	0	0	0	112.6
193	T	23.6	Very low	23.8	Very low	116 Å²	116	121 Å²	121	71%	0.712	67%	0.673	S	S	*	*			trans	-116.8	107	151.5	37.8	0	0	0	0	108	S191 V195	S191-T193 PolarHBondContact O-N 3.37Å; T193-V195 PolarHBondContact O-N 3.31Å
194	N	22	Very low	24	Very low	147 Å²	147	118.7 Å²	118.7	79%	0.786	66%	0.657	S	S	*	*			trans	-64	94.7	175.6	-75.6	-45.4	0	0	0	109.3	Q196	N194-Q196 PolarHBondContact O-N 3.21Å; N194-Q196 VanDerWaalsContact O-N 3.1Å
195	V	25.1	Very low	24.3	Very low	81 Å²	81	116.1 Å²	116.1	49%	0.491	64%	0.643	S	S	.	*			trans	-74.9	97	171.7	-178.2	0	0	0	0	108.2	T193 I197	T193-V195 PolarHBondContact O-N 3.31Å; V195-I197 HydrophobicContact CG1-CG1 4.47Å; V195-I197 PolarHBondContact O-N 3.41Å
196	Q	22.1	Very low	24.4	Very low	110 Å²	110	110.5 Å²	110.5	51%	0.514	61%	0.613	S	S	.	*			trans	-75.3	108.4	163.6	-81.1	-172.8	-32.3	0	0	108.7	N194 F198	N194-Q196 PolarHBondContact O-N 3.21Å; N194-Q196 VanDerWaalsContact O-N 3.1Å; Q196-F198 HydrophobicContact CB-CD2 4.33Å; Q196-F198 HydrophobicContact CB-CE2 3.9Å; Q196-F198 HydrophobicContact CB-CZ 4.48Å; Q196-F198 VanDerWaalsContact O-CD2 3.3Å; Q196-F198 WeakPolarHBondContact O-CD2 3.38Å; Q196-F198 PolarHBondContact O-N 2.89Å; Q196-F198 VanDerWaalsContact O-N 3.09Å
197	I	23.2	Very low	24.6	Very low	161 Å²	161	111.3 Å²	111.3	83%	0.826	61%	0.608	S	S	*	*			trans	-68	103.9	171.6	-59.2	172.5	0	0	0	107.6	V195	V195-I197 HydrophobicContact CG1-CG1 4.47Å; V195-I197 PolarHBondContact O-N 3.41Å
198	F	24.9	Very low	24.6	Very low	111 Å²	111	107.8 Å²	107.8	49%	0.487	60%	0.602	S	S	.	*			trans	-81.3	117.4	174.8	-80	-85.3	0	0	0	110	Q196 S200	Q196-F198 HydrophobicContact CB-CD2 4.33Å; Q196-F198 HydrophobicContact CB-CE2 3.9Å; Q196-F198 HydrophobicContact CB-CZ 4.48Å; Q196-F198 VanDerWaalsContact O-CD2 3.3Å; Q196-F198 WeakPolarHBondContact O-CD2 3.38Å; Q196-F198 PolarHBondContact O-N 2.89Å; Q196-F198 VanDerWaalsContact O-N 3.09Å; F198-S200 PolarHBondContact O-N 3.38Å
199	N	23.8	Very low	24.7	Very low	131 Å²	131	106.6 Å²	106.6	70%	0.701	59%	0.586	S	S	*	*			trans	-58.6	106.2	173	-131.5	-6.2	0	0	0	109.3	Y201	N199-Y201 VanDerWaalsContact C-N 3.27Å; N199-Y201 PolarHBondContact O-N 3.15Å
200	S	28.1	Very low	24.7	Very low	28 Å²	28	111.3 Å²	111.3	20%	0.196	59%	0.589	C	S	.	*	T	Hydrogen-bonded Turn	trans	-77.9	-7	-171.9	59.2	0	0	0	0	114.2	I171 F198 D202 R203 S204	I171-S200 VanDerWaalsContact CD1-OG 3.29Å; I171-S200 WeakPolarHBondContact CD1-OG 3.35Å; F198-S200 PolarHBondContact O-N 3.38Å; S200-D202 VanDerWaalsContact C-N 3.26Å; S200-D202 PolarHBondContact O-N 3.42Å; S200-R203 PolarHBondContact O-N 3.14Å; S200-S204 PolarHBondContact O-N 3.02Å; S200-S204 PolarHBondContact O-OG 2.97Å; S200-S204 VanDerWaalsContact O-OG 3.08Å
201	Y	26	Very low	24.8	Very low	137 Å²	137	109.5 Å²	109.5	54%	0.537	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.6	-25	175.2	-97.5	-84.7	0	0	0	113.9	N199	N199-Y201 VanDerWaalsContact C-N 3.27Å; N199-Y201 PolarHBondContact O-N 3.15Å
202	D	27.2	Very low	24.8	Very low	106 Å²	106	110 Å²	110	57%	0.567	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-25	174.1	-84.3	-41	0	0	0	112.6	S200 N206	S200-D202 VanDerWaalsContact C-N 3.26Å; S200-D202 PolarHBondContact O-N 3.42Å; D202-N206 WeakPolarHBondContact O-CB 3.46Å; D202-N206 PolarHBondContact O-N 2.97Å; D202-N206 PolarHBondContact O-ND2 3.08Å
203	R	27.7	Very low	24.9	Very low	106 Å²	106	113.2 Å²	113.2	40%	0.4	56%	0.562	S	S	.	*	H	α-helix	trans	-82.8	-34.6	-173.8	-88.2	-168.7	-176.7	-172.1	4.1	114.7	S200 N205 N206 I207	S200-R203 PolarHBondContact O-N 3.14Å; R203-N205 VanDerWaalsContact C-N 3.33Å; R203-N206 CarbonylContact O-C 3.59Å; R203-N206 PolarHBondContact O-N 3.41Å; R203-N206 VanDerWaalsContact O-N 3.1Å; R203-I207 WeakPolarHBondContact O-CG1 3.3Å; R203-I207 PolarHBondContact O-N 2.93Å
204	S	27.1	Very low	25	Very low	57 Å²	57	110.2 Å²	110.2	40%	0.399	55%	0.546	S	S	.	.	H	α-helix	trans	-68.7	-33.5	173.9	35.9	0	0	0	0	112	S200	S200-S204 PolarHBondContact O-N 3.02Å; S200-S204 PolarHBondContact O-OG 2.97Å; S200-S204 VanDerWaalsContact O-OG 3.08Å
205	N	26.2	Very low	25.3	Very low	101 Å²	101	109.4 Å²	109.4	54%	0.54	55%	0.551	S	S	.	*	H	α-helix	trans	-72.3	-32.2	166	-85.2	-28.9	0	0	0	112.3	R203 R209	R203-N205 VanDerWaalsContact C-N 3.33Å; N205-R209 WeakPolarHBondContact O-CB 3.35Å; N205-R209 PolarHBondContact O-N 2.69Å
206	N	25.7	Very low	25.3	Very low	40 Å²	40	110.7 Å²	110.7	21%	0.214	55%	0.554	C	S	.	*	H	α-helix	trans	-79.5	-17.8	179.1	-72.2	-33.7	0	0	0	115	D202 R203 R209 R210	D202-N206 WeakPolarHBondContact O-CB 3.46Å; D202-N206 PolarHBondContact O-N 2.97Å; D202-N206 PolarHBondContact O-ND2 3.08Å; R203-N206 CarbonylContact O-C 3.59Å; R203-N206 PolarHBondContact O-N 3.41Å; R203-N206 VanDerWaalsContact O-N 3.1Å; N206-R209 CarbonylContact O-C 3.56Å; N206-R209 PolarHBondContact O-N 3.47Å; N206-R210 WeakPolarHBondContact O-CA 3.45Å; N206-R210 WeakPolarHBondContact O-CB 3.29Å; N206-R210 WeakPolarHBondContact O-CG 3.25Å; N206-R210 PolarHBondContact O-N 3.22Å
207	I	25.8	Very low	25.5	Very low	121 Å²	121	110 Å²	110	62%	0.621	56%	0.562	S	S	*	*	H	α-helix	trans	-74.5	-36	171	-67.5	165	0	0	0	110	R203	R203-I207 WeakPolarHBondContact O-CG1 3.3Å; R203-I207 PolarHBondContact O-N 2.93Å
208	A	23.6	Very low	25.9	Very low	83 Å²	83	106.5 Å²	106.5	69%	0.686	54%	0.543	S	S	*	.	H	α-helix	trans	-76	-20.4	168.8	0	0	0	0	0	113.7
209	R	24.3	Very low	26.3	Very low	144 Å²	144	107.5 Å²	107.5	54%	0.543	56%	0.558	S	S	.	*	S	Bend	trans	-111.5	9.4	-174.8	-158.6	-178.2	-167.1	177.6	7	114.1	N205 N206	N205-R209 WeakPolarHBondContact O-CB 3.35Å; N205-R209 PolarHBondContact O-N 2.69Å; N206-R209 CarbonylContact O-C 3.56Å; N206-R209 PolarHBondContact O-N 3.47Å
210	R	24.5	Very low	26.7	Very low	193 Å²	193	106 Å²	106	73%	0.728	55%	0.55	S	S	*	.			trans	-98.4	7	173.2	-89.7	177.3	178.6	-161.4	-1.5	113.8	N206 K212	N206-R210 WeakPolarHBondContact O-CA 3.45Å; N206-R210 WeakPolarHBondContact O-CB 3.29Å; N206-R210 WeakPolarHBondContact O-CG 3.25Å; N206-R210 PolarHBondContact O-N 3.22Å; R210-K212 VanDerWaalsContact C-N 3.28Å; R210-K212 PolarHBondContact O-N 2.93Å
211	V	25.2	Very low	27	Very low	116 Å²	116	109.4 Å²	109.4	70%	0.703	57%	0.57	S	S	*	*	S	Bend	trans	-58	106.3	139.5	-172.3	0	0	0	0	104.5	R213	V211-R213 PolarHBondContact O-N 3.05Å
212	K	24.7	Very low	27.4	Very low	103 Å²	103	106.2 Å²	106.2	45%	0.448	57%	0.568	S	S	.	*			trans	-11.9	119.9	-176.2	-127.6	160.3	176.1	175.7	0	114.3	R210 S214 D248 T250	R210-K212 VanDerWaalsContact C-N 3.28Å; R210-K212 PolarHBondContact O-N 2.93Å; K212-S214 PolarHBondContact O-N 2.85Å; K212-D248 HydrophobicContact CD-CB 3.87Å; K212-D248 WeakPolarHBondContact CD-OD2 3.35Å; K212-D248 IonicContact NZ-OD1 2.9Å; K212-D248 PolarHBondContact NZ-OD1 3.33Å; K212-D248 IonicContact NZ-OD2 2.79Å; K212-D248 PolarHBondContact NZ-OD2 2.91Å; K212-T250 PolarHBondContact NZ-OG1 3.31Å
213	R	23.1	Very low	27.7	Very low	186 Å²	186	106.1 Å²	106.1	70%	0.702	57%	0.566	S	S	*	*			trans	-60.1	92.7	155.8	-86.8	-176.1	176.8	177.1	-0.5	107	V211 S215	V211-R213 PolarHBondContact O-N 3.05Å; R213-S215 PolarHBondContact O-N 3.01Å
214	S	25.1	Very low	27.9	Very low	53 Å²	53	104.8 Å²	104.8	37%	0.371	57%	0.567	S	S	.	*			trans	-54.1	127.4	152.3	175.8	0	0	0	0	106.7	K212 I216	K212-S214 PolarHBondContact O-N 2.85Å; S214-I216 PolarHBondContact O-N 3.48Å; S214-I216 VanDerWaalsContact O-N 3.1Å; S214-I216 VanDerWaalsContact OG-CB 3.29Å; S214-I216 WeakPolarHBondContact OG-CB 3.38Å; S214-I216 VanDerWaalsContact OG-CG1 3.31Å; S214-I216 WeakPolarHBondContact OG-CG1 3.22Å; S214-I216 PolarHBondContact OG-N 3.26Å
215	S	27.6	Very low	28.2	Very low	129 Å²	129	107 Å²	107	90%	0.902	57%	0.574	S	S	*	*	S	Bend	trans	-71.8	11.7	172.4	47.6	0	0	0	0	112.4	R213	R213-S215 PolarHBondContact O-N 3.01Å
216	I	25.4	Very low	28.6	Very low	108 Å²	108	106.2 Å²	106.2	55%	0.554	57%	0.573	S	S	*	*	S	Bend	trans	-97	119.9	-176.9	-55.4	172.1	0	0	0	108.6	S214 M218	S214-I216 PolarHBondContact O-N 3.48Å; S214-I216 VanDerWaalsContact O-N 3.1Å; S214-I216 VanDerWaalsContact OG-CB 3.29Å; S214-I216 WeakPolarHBondContact OG-CB 3.38Å; S214-I216 VanDerWaalsContact OG-CG1 3.31Å; S214-I216 WeakPolarHBondContact OG-CG1 3.22Å; S214-I216 PolarHBondContact OG-N 3.26Å; I216-M218 PolarHBondContact O-N 3.24Å
217	S	25.9	Very low	29.1	Very low	96 Å²	96	108.1 Å²	108.1	67%	0.671	59%	0.586	S	S	*	*			trans	-61.2	97	163.7	136.5	0	0	0	0	108.1	T219	S217-T219 PolarHBondContact O-N 3.47Å; S217-T219 VanDerWaalsContact O-N 3.1Å
218	M	32	Very low	29.4	Very low	88 Å²	88	106.5 Å²	106.5	43%	0.433	58%	0.575	S	S	.	*			trans	-69.6	103.9	167.1	-76.8	178.9	91.6	0	0	108	I216 N220 L224	I216-M218 PolarHBondContact O-N 3.24Å; M218-N220 PolarHBondContact O-N 2.99Å; M218-N220 VanDerWaalsContact O-N 3.17Å; M218-L224 HydrophobicContact CE-CD1 3.84Å; M218-L224 HydrophobicContact CE-CG 4.24Å; M218-L224 HydrophobicContact SD-CD1 3.68Å
219	T	32.5	Very low	30	Very low	132 Å²	132	107.1 Å²	107.1	81%	0.81	57%	0.57	S	S	*	*	S	Bend	trans	-71.3	0.5	179.7	34.4	0	0	0	0	113.8	S217	S217-T219 PolarHBondContact O-N 3.47Å; S217-T219 VanDerWaalsContact O-N 3.1Å
220	N	32.1	Very low	30.5	Very low	98 Å²	98	105.3 Å²	105.3	52%	0.524	57%	0.567	S	S	.	*			trans	-137.8	69.4	-179.1	-118.3	-10.7	0	0	0	110.9	M218 S222 I223	M218-N220 PolarHBondContact O-N 2.99Å; M218-N220 VanDerWaalsContact O-N 3.17Å; N220-S222 PolarHBondContact O-N 3.44Å; N220-S222 PolarHBondContact OD1-OG 2.7Å; N220-I223 HydrophobicContact CB-CD1 4.25Å; N220-I223 PolarHBondContact O-N 2.84Å
221	T	35.2	Very low	31	Very low	100 Å²	100	104.8 Å²	104.8	61%	0.613	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-65.7	-12.2	175.7	51.8	0	0	0	0	113.5	I223 L224	T221-I223 PolarHBondContact O-N 2.89Å; T221-L224 PolarHBondContact O-N 3.34Å; T221-L224 VanDerWaalsContact O-N 3.08Å
222	S	34.5	Very low	31.5	Very low	71 Å²	71	103.5 Å²	103.5	50%	0.497	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-65.5	-19.2	174.5	54.7	0	0	0	0	113.9	N220 L224	N220-S222 PolarHBondContact O-N 3.44Å; N220-S222 PolarHBondContact OD1-OG 2.7Å; S222-L224 VanDerWaalsContact C-N 3.3Å
223	I	34.3	Very low	31.9	Very low	104 Å²	104	101.7 Å²	101.7	53%	0.533	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-78.6	-20.8	174.5	-64.5	171.8	0	0	0	111.2	N220 T221 L289	N220-I223 HydrophobicContact CB-CD1 4.25Å; N220-I223 PolarHBondContact O-N 2.84Å; T221-I223 PolarHBondContact O-N 2.89Å; I223-L289 HydrophobicContact CG2-CD1 4.44Å
224	L	31.8	Very low	32.6	Very low	78 Å²	78	98.8 Å²	98.8	41%	0.408	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-99.3	9.9	-179.3	-65.9	172.8	0	0	0	112.5	M218 T221 S222 T226 V246	M218-L224 HydrophobicContact CE-CD1 3.84Å; M218-L224 HydrophobicContact CE-CG 4.24Å; M218-L224 HydrophobicContact SD-CD1 3.68Å; T221-L224 PolarHBondContact O-N 3.34Å; T221-L224 VanDerWaalsContact O-N 3.08Å; S222-L224 VanDerWaalsContact C-N 3.3Å; L224-T226 VanDerWaalsContact C-N 3.29Å; L224-T226 PolarHBondContact O-N 3.22Å; L224-V246 HydrophobicContact CD2-CG2 3.97Å
225	D	32	Very low	33.4	Very low	102 Å²	102	103.9 Å²	103.9	55%	0.545	57%	0.57	S	S	.	*			trans	-61.7	96.6	175.6	-88.6	-27.1	0	0	0	109.5
226	T	35.7	Very low	34.4	Very low	86 Å²	86	102.9 Å²	102.9	53%	0.528	56%	0.563	S	S	.	*			trans	62	124.9	145.8	49.7	0	0	0	0	117.2	L224 H228	L224-T226 VanDerWaalsContact C-N 3.29Å; L224-T226 PolarHBondContact O-N 3.22Å; T226-H228 PolarHBondContact O-CD2 3.36Å; T226-H228 VanDerWaalsContact O-CD2 3.28Å; T226-H228 PolarHBondContact O-N 2.81Å
227	V	35.5	Very low	35.3	Very low	79 Å²	79	102.2 Å²	102.2	48%	0.479	56%	0.558	S	S	.	*			trans	-38.5	106	151.4	174.4	0	0	0	0	108.3	V229 V241 L243	V227-V229 HydrophobicContact CG1-CG2 4.26Å; V227-V229 PolarHBondContact O-N 3.35Å; V227-V241 HydrophobicContact CG1-CG1 3.56Å; V227-L243 HydrophobicContact CB-CD2 4.44Å; V227-L243 HydrophobicContact CG1-CD2 3.94Å; V227-L243 HydrophobicContact CG2-CD2 3.68Å
228	H	33.1	Very low	36.3	Very low	87 Å²	87	101.3 Å²	101.3	40%	0.403	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	103.1	177.4	-79.5	-73.8	0	0	0	106.7	T226 F230 E242	T226-H228 PolarHBondContact O-CD2 3.36Å; T226-H228 VanDerWaalsContact O-CD2 3.28Å; T226-H228 PolarHBondContact O-N 2.81Å; H228-F230 HydrophobicContact CB-CD2 4.05Å; H228-F230 HydrophobicContact CB-CE2 3.57Å; H228-F230 HydrophobicContact CB-CZ 4.27Å; H228-F230 PolarHBondContact O-N 3.5Å; H228-E242 PolarHBondContact O-N 3.42Å
229	V	35.6	Very low	37.2	Very low	96 Å²	96	100.9 Å²	100.9	58%	0.582	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	102.8	167.5	-178.1	0	0	0	0	106.3	V227	V227-V229 HydrophobicContact CG1-CG2 4.26Å; V227-V229 PolarHBondContact O-N 3.35Å
230	F	34.5	Very low	38	Very low	107 Å²	107	97.3 Å²	97.3	47%	0.469	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	135.5	176.4	-80.1	-90	0	0	0	110.1	H228 V240 E242	H228-F230 HydrophobicContact CB-CD2 4.05Å; H228-F230 HydrophobicContact CB-CE2 3.57Å; H228-F230 HydrophobicContact CB-CZ 4.27Å; H228-F230 PolarHBondContact O-N 3.5Å; F230-V240 PolarHBondContact N-O 2.8Å; F230-E242 HydrophobicContact CD2-CG 3.97Å; F230-E242 HydrophobicContact CE2-CB 4.49Å; F230-E242 HydrophobicContact CE2-CG 3.95Å; F230-E242 VanDerWaalsContact CE2-OE2 3.27Å; F230-E242 WeakPolarHBondContact CE2-OE2 3.28Å
231	H	34.1	Very low	39	Very low	182 Å²	182	93.8 Å²	93.8	84%	0.843	50%	0.502	S	S	*	.			trans	-48.7	140.5	-174	-137.8	7.3	0	0	0	113	P233	H231-P233 VanDerWaalsContact O-CD 3.22Å; H231-P233 WeakPolarHBondContact O-CD 3.45Å
232	R	35.7	Very low	39.6	Very low	88 Å²	88	91.5 Å²	91.5	33%	0.332	48%	0.484	S	S	.	.			trans	-71.1	113.7	173.4	-169.1	-172.5	-160.5	-176.7	-3.4	110	D234 E235 Y239	R232-D234 WeakPolarHBondContact CG-O 3.29Å; R232-D234 PolarHBondContact O-N 3.41Å; R232-E235 PolarHBondContact NH2-O 3.08Å; R232-Y239 HydrophobicContact CB-CD1 4.41Å; R232-Y239 HydrophobicContact CB-CE1 3.9Å; R232-Y239 WeakPolarHBondContact CD-OH 3.24Å; R232-Y239 HydrophobicContact CG-CE1 4.17Å; R232-Y239 PolarHBondContact NE-OH 2.91Å; R232-Y239 PolarHBondContact NH1-OH 2.87Å
233	P	33.8	Very low	40.5	Very low	65 Å²	65	90.1 Å²	90.1	42%	0.422	47%	0.471	S	S	.	.			trans	-86.6	95.2	167	2.4	20.6	0	0	0	106.3	H231 Q237	H231-P233 VanDerWaalsContact O-CD 3.22Å; H231-P233 WeakPolarHBondContact O-CD 3.45Å; P233-Q237 VanDerWaalsContact CG-OE1 3.23Å; P233-Q237 WeakPolarHBondContact O-CB 3.22Å; P233-Q237 WeakPolarHBondContact O-CG 3.3Å
234	D	37.6	Very low	41.2	Very low	125 Å²	125	89 Å²	89	67%	0.668	46%	0.463	S	S	*	.	S	Bend	trans	66.3	154.5	176.9	-52.8	-33.4	0	0	0	116.9	R232 S236 Q237	R232-D234 WeakPolarHBondContact CG-O 3.29Å; R232-D234 PolarHBondContact O-N 3.41Å; D234-S236 PolarHBondContact O-N 3.1Å; D234-Q237 PolarHBondContact O-N 3.25Å
235	E	43.4	Very low	42.4	Very low	161 Å²	161	87.9 Å²	87.9	75%	0.752	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-11.3	-167.8	-69.5	-173	151	0	0	115.4	R232	R232-E235 PolarHBondContact NH2-O 3.08Å
236	S	47.4	Very low	43.5	Very low	108 Å²	108	85.3 Å²	85.3	76%	0.755	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-6.9	-175.4	56.1	0	0	0	0	115.5	D234	D234-S236 PolarHBondContact O-N 3.1Å
237	Q	44.5	Very low	44.5	Very low	94 Å²	94	81.4 Å²	81.4	44%	0.439	42%	0.42	S	S	.	.	S	Bend	trans	-102.2	147.6	-177	-62	-171	16.5	0	0	113.3	P233 D234	P233-Q237 VanDerWaalsContact CG-OE1 3.23Å; P233-Q237 WeakPolarHBondContact O-CB 3.22Å; P233-Q237 WeakPolarHBondContact O-CG 3.3Å; D234-Q237 PolarHBondContact O-N 3.25Å
238	T	47.8	Very low	45.4	Very low	76 Å²	76	79.6 Å²	79.6	47%	0.466	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-67.2	128.2	177.1	-15.7	0	0	0	0	110.4	H280	T238-H280 CarbonylContact C-O 3.29Å; T238-H280 VanDerWaalsContact CG2-C 3.45Å
239	Y	49.9	Very low	46.7	Very low	79 Å²	79	81.5 Å²	81.5	31%	0.31	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	135.9	168.5	-68	-87.5	0	0	0	109.8	R232 H280 V281 T282	R232-Y239 HydrophobicContact CB-CD1 4.41Å; R232-Y239 HydrophobicContact CB-CE1 3.9Å; R232-Y239 WeakPolarHBondContact CD-OH 3.24Å; R232-Y239 HydrophobicContact CG-CE1 4.17Å; R232-Y239 PolarHBondContact NE-OH 2.91Å; R232-Y239 PolarHBondContact NH1-OH 2.87Å; Y239-H280 WeakPolarHBondContact CA-O 3.33Å; Y239-H280 VanDerWaalsContact CB-O 3.28Å; Y239-H280 WeakPolarHBondContact CB-O 3.43Å; Y239-H280 HydrophobicContact CD2-CB 4.15Å; Y239-H280 VanDerWaalsContact CD2-O 3.24Å; Y239-H280 WeakPolarHBondContact CD2-O 3.19Å; Y239-H280 PolarHBondContact N-O 3.3Å; Y239-V281 HydrophobicContact CD2-CG2 4.36Å; Y239-V281 CarbonylContact O-C 3.55Å; Y239-V281 VanDerWaalsContact O-CA 3.3Å; Y239-V281 WeakPolarHBondContact O-CA 3.19Å; Y239-T282 PolarHBondContact O-N 3.08Å
240	V	49.4	Very low	48	Very low	58 Å²	58	80.7 Å²	80.7	35%	0.352	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	124.1	172.8	-177.4	0	0	0	0	108.7	F230 T282	F230-V240 PolarHBondContact N-O 2.8Å; V240-T282 CarbonylContact C-O 3.54Å; V240-T282 WeakPolarHBondContact CA-O 3.33Å
241	V	52.4	Low	49.1	Very low	24 Å²	24	78.5 Å²	78.5	15%	0.145	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	112.1	177.9	177.3	0	0	0	0	107.9	V227 L243 V281 T282 I283 L284	V227-V241 HydrophobicContact CG1-CG1 3.56Å; V241-L243 HydrophobicContact CG1-CD2 3.89Å; V241-L243 HydrophobicContact CG1-CG 4.11Å; V241-V281 HydrophobicContact CB-CG1 4.32Å; V241-V281 HydrophobicContact CG2-CG1 3.51Å; V241-T282 PolarHBondContact N-O 2.96Å; V241-I283 HydrophobicContact CB-CG1 4.11Å; V241-I283 HydrophobicContact CG1-CG1 4.39Å; V241-I283 CarbonylContact O-C 3.53Å; V241-I283 VanDerWaalsContact O-CA 3.31Å; V241-I283 WeakPolarHBondContact O-CA 3.27Å; V241-L284 PolarHBondContact O-N 2.86Å
242	E	48	Very low	50.4	Low	51 Å²	51	70.2 Å²	70.2	24%	0.238	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	118.9	171.9	-67.5	-168.8	169.4	0	0	109.7	H228 F230 T286	H228-E242 PolarHBondContact O-N 3.42Å; F230-E242 HydrophobicContact CD2-CG 3.97Å; F230-E242 HydrophobicContact CE2-CB 4.49Å; F230-E242 HydrophobicContact CE2-CG 3.95Å; F230-E242 VanDerWaalsContact CE2-OE2 3.27Å; F230-E242 WeakPolarHBondContact CE2-OE2 3.28Å; E242-T286 HydrophobicContact CB-CG2 3.9Å; E242-T286 HydrophobicContact CG-CG2 3.89Å
243	L	54.4	Low	51.9	Low	42 Å²	42	69.1 Å²	69.1	22%	0.22	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	131.9	177.3	-69.9	-174.1	0	0	0	111.3	V227 V241 I270 I283 L284 T286	V227-L243 HydrophobicContact CB-CD2 4.44Å; V227-L243 HydrophobicContact CG1-CD2 3.94Å; V227-L243 HydrophobicContact CG2-CD2 3.68Å; V241-L243 HydrophobicContact CG1-CD2 3.89Å; V241-L243 HydrophobicContact CG1-CG 4.11Å; L243-I270 HydrophobicContact CD1-CD1 4.41Å; L243-I283 HydrophobicContact CB-CG2 4.18Å; L243-I283 HydrophobicContact CD1-CB 4.43Å; L243-I283 HydrophobicContact CD1-CD1 3.94Å; L243-I283 HydrophobicContact CD1-CG1 4.22Å; L243-I283 HydrophobicContact CD1-CG2 3.37Å; L243-I283 HydrophobicContact CG-CG2 3.71Å; L243-L284 PolarHBondContact N-O 2.8Å; L243-T286 PolarHBondContact O-N 2.75Å; L243-T286 VanDerWaalsContact O-N 3.16Å; L243-T286 PolarHBondContact O-OG1 3.26Å
244	F	48.5	Very low	53.7	Low	81 Å²	81	72.8 Å²	72.8	36%	0.355	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	122.6	164.5	-64.6	-86.2	0	0	0	108.5	T286 R287	F244-T286 WeakPolarHBondContact CE1-OG1 3.29Å; F244-R287 HydrophobicContact CD1-CB 4.08Å; F244-R287 HydrophobicContact CD1-CG 4.49Å; F244-R287 HydrophobicContact CE1-CB 4.38Å; F244-R287 HydrophobicContact CE1-CG 4.31Å
245	M	56.9	Low	55.3	Low	55 Å²	55	68.9 Å²	68.9	27%	0.271	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.8	175.9	-168.3	172.8	-70.2	0	0	109.9	V247 I266 I270 L285 R287 V288 L289	M245-V247 HydrophobicContact CG-CG2 4.49Å; M245-I266 HydrophobicContact CE-CG2 3.86Å; M245-I266 HydrophobicContact SD-CB 4.18Å; M245-I266 HydrophobicContact SD-CD1 3.79Å; M245-I266 HydrophobicContact SD-CG1 3.72Å; M245-I266 HydrophobicContact SD-CG2 3.4Å; M245-I266 WeakPolarHBondContact SD-CG2 3.33Å; M245-I270 HydrophobicContact CE-CD1 4.12Å; M245-L285 HydrophobicContact CB-CD1 3.71Å; M245-R287 PolarHBondContact N-O 3.33Å; M245-V288 WeakPolarHBondContact O-CA 3.47Å; M245-L289 PolarHBondContact O-N 3.35Å; M245-L289 VanDerWaalsContact O-N 3.07Å
246	V	55.2	Low	56.9	Low	47 Å²	47	71.9 Å²	71.9	29%	0.285	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.4	171.3	-177.8	0	0	0	0	107.7	L224 D291	L224-V246 HydrophobicContact CD2-CG2 3.97Å; V246-D291 WeakPolarHBondContact CG1-OD1 3.42Å
247	V	57.2	Low	57.8	Low	4 Å²	4	68.7 Å²	68.7	2%	0.024	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.4	178.8	-177.9	0	0	0	0	109.2	M245 M251 L262 I266 V288 L289 D291	M245-V247 HydrophobicContact CG-CG2 4.49Å; V247-M251 HydrophobicContact CG1-CB 3.68Å; V247-M251 HydrophobicContact CG1-CG 3.75Å; V247-M251 HydrophobicContact CG1-SD 3.69Å; V247-L262 HydrophobicContact CB-CD2 4.25Å; V247-L262 HydrophobicContact CG1-CD1 4.04Å; V247-L262 HydrophobicContact CG1-CD2 3.74Å; V247-L262 HydrophobicContact CG1-CG 4.44Å; V247-L262 HydrophobicContact CG2-CD1 4.5Å; V247-L262 HydrophobicContact CG2-CD2 4.25Å; V247-I266 HydrophobicContact CG2-CD1 3.57Å; V247-V288 HydrophobicContact CG2-CG1 3.82Å; V247-L289 PolarHBondContact N-O 3.21Å; V247-D291 PolarHBondContact O-N 3.34Å
248	D	54.9	Low	59.3	Low	41 Å²	41	70.7 Å²	70.7	22%	0.219	36%	0.358	C	S	.	.			trans	-69.5	156.7	178.3	78.3	56	0	0	0	112.4	K212 T250 M251 A252	K212-D248 HydrophobicContact CD-CB 3.87Å; K212-D248 WeakPolarHBondContact CD-OD2 3.35Å; K212-D248 IonicContact NZ-OD1 2.9Å; K212-D248 PolarHBondContact NZ-OD1 3.33Å; K212-D248 IonicContact NZ-OD2 2.79Å; K212-D248 PolarHBondContact NZ-OD2 2.91Å; D248-T250 PolarHBondContact O-N 3.38Å; D248-T250 VanDerWaalsContact OD1-CA 3.28Å; D248-T250 WeakPolarHBondContact OD1-CA 3.49Å; D248-T250 WeakPolarHBondContact OD1-CB 3.43Å; D248-T250 PolarHBondContact OD1-N 2.95Å; D248-M251 PolarHBondContact O-N 2.9Å; D248-M251 PolarHBondContact OD1-N 2.85Å; D248-A252 PolarHBondContact O-N 2.85Å
249	E	59.7	Low	60.4	Low	127 Å²	127	72.1 Å²	72.1	59%	0.593	36%	0.355	S	S	*	.	H	α-helix	trans	-59.3	-28.9	-178.6	-69.3	-169.5	144.3	0	0	114.2	A252 A253	E249-A252 PolarHBondContact O-N 3.4Å; E249-A253 WeakPolarHBondContact O-CB 3.14Å; E249-A253 PolarHBondContact O-N 3.46Å
250	T	63.6	Low	61.5	Low	80 Å²	80	74.6 Å²	74.6	49%	0.491	37%	0.37	S	S	.	.	H	α-helix	trans	-71.1	-44.9	178.1	-50.5	0	0	0	0	110.5	K212 D248 A252 A253 E254	K212-T250 PolarHBondContact NZ-OG1 3.31Å; D248-T250 PolarHBondContact O-N 3.38Å; D248-T250 VanDerWaalsContact OD1-CA 3.28Å; D248-T250 WeakPolarHBondContact OD1-CA 3.49Å; D248-T250 WeakPolarHBondContact OD1-CB 3.43Å; D248-T250 PolarHBondContact OD1-N 2.95Å; T250-A252 VanDerWaalsContact C-N 3.32Å; T250-A252 PolarHBondContact O-N 2.87Å; T250-A253 WeakPolarHBondContact O-CB 3.45Å; T250-A253 PolarHBondContact O-N 2.84Å; T250-A253 VanDerWaalsContact O-N 3.14Å; T250-E254 WeakPolarHBondContact O-CG 3.08Å; T250-E254 PolarHBondContact O-N 2.94Å
251	M	57.2	Low	62.5	Low	60 Å²	60	75.4 Å²	75.4	30%	0.296	37%	0.369	S	S	.	.	H	α-helix	trans	-63.1	-41.5	173.8	-171.7	178.9	-164.1	0	0	109.9	V247 D248 A253 E254 F255 L262	V247-M251 HydrophobicContact CG1-CB 3.68Å; V247-M251 HydrophobicContact CG1-CG 3.75Å; V247-M251 HydrophobicContact CG1-SD 3.69Å; D248-M251 PolarHBondContact O-N 2.9Å; D248-M251 PolarHBondContact OD1-N 2.85Å; M251-A253 VanDerWaalsContact C-N 3.3Å; M251-A253 PolarHBondContact O-N 3.39Å; M251-E254 PolarHBondContact O-N 3.03Å; M251-F255 VanDerWaalsContact O-CD2 3.3Å; M251-F255 WeakPolarHBondContact O-CD2 3.39Å; M251-L262 HydrophobicContact CE-CD1 4.15Å; M251-L262 HydrophobicContact CG-CD1 4.08Å; M251-L262 HydrophobicContact SD-CD1 4.31Å
252	A	61.7	Low	63.3	Low	8 Å²	8	74.5 Å²	74.5	7%	0.066	36%	0.364	C	S	.	.	H	α-helix	trans	-62.6	-35.6	173	0	0	0	0	0	113	D248 E249 T250 F255 Y259	D248-A252 PolarHBondContact O-N 2.85Å; E249-A252 PolarHBondContact O-N 3.4Å; T250-A252 VanDerWaalsContact C-N 3.32Å; T250-A252 PolarHBondContact O-N 2.87Å; A252-F255 PolarHBondContact O-N 2.71Å; A252-Y259 HydrophobicContact CB-CE1 4.45Å
253	A	67.4	Low	64.2	Low	65 Å²	65	74.5 Å²	74.5	54%	0.537	37%	0.367	S	S	.	.	H	α-helix	trans	-70	-34	177.7	0	0	0	0	0	112.9	E249 T250 M251 F255 R256	E249-A253 WeakPolarHBondContact O-CB 3.14Å; E249-A253 PolarHBondContact O-N 3.46Å; T250-A253 WeakPolarHBondContact O-CB 3.45Å; T250-A253 PolarHBondContact O-N 2.84Å; T250-A253 VanDerWaalsContact O-N 3.14Å; M251-A253 VanDerWaalsContact C-N 3.3Å; M251-A253 PolarHBondContact O-N 3.39Å; A253-F255 PolarHBondContact O-N 3.24Å; A253-R256 WeakPolarHBondContact O-CA 3.4Å; A253-R256 PolarHBondContact O-N 2.82Å
254	E	70.5	Confident	64.8	Low	142 Å²	142	75.5 Å²	75.5	66%	0.664	38%	0.377	S	S	*	.	H	α-helix	trans	-57.7	-34.5	173.3	-75	178.2	-179.9	0	0	112	T250 M251 R256	T250-E254 WeakPolarHBondContact O-CG 3.08Å; T250-E254 PolarHBondContact O-N 2.94Å; M251-E254 PolarHBondContact O-N 3.03Å; E254-R256 VanDerWaalsContact C-N 3.25Å; E254-R256 PolarHBondContact O-N 2.81Å
255	F	70.8	Confident	65.6	Low	43 Å²	43	78.1 Å²	78.1	19%	0.189	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	6.9	175.4	-71.2	-92.2	0	0	0	113.6	M251 A252 A253 G257 R258 Q261 L262 R265	M251-F255 VanDerWaalsContact O-CD2 3.3Å; M251-F255 WeakPolarHBondContact O-CD2 3.39Å; A252-F255 PolarHBondContact O-N 2.71Å; A253-F255 PolarHBondContact O-N 3.24Å; F255-G257 PolarHBondContact O-N 2.79Å; F255-R258 WeakPolarHBondContact O-CB 3.02Å; F255-R258 WeakPolarHBondContact O-CG 3.48Å; F255-R258 PolarHBondContact O-N 2.8Å; F255-Q261 HydrophobicContact CD1-CB 3.73Å; F255-Q261 HydrophobicContact CE1-CB 4.2Å; F255-L262 HydrophobicContact CB-CB 4.28Å; F255-L262 HydrophobicContact CD1-CB 4.19Å; F255-L262 HydrophobicContact CD2-CB 3.98Å; F255-L262 HydrophobicContact CD2-CD1 3.76Å; F255-L262 HydrophobicContact CD2-CG 4.43Å; F255-L262 HydrophobicContact CE2-CB 4.4Å; F255-L262 HydrophobicContact CE2-CD1 3.68Å; F255-L262 HydrophobicContact CG-CB 3.87Å; F255-L262 HydrophobicContact CZ-CD1 4.35Å; F255-R265 HydrophobicContact CE1-CB 4.21Å; F255-R265 HydrophobicContact CZ-CB 3.94Å; F255-R265 HydrophobicContact CZ-CG 4.04Å
256	R	77.3	Confident	66	Low	224 Å²	224	75.5 Å²	75.5	85%	0.845	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	41	176.8	-56.5	-176.5	-178.5	-175.3	0.1	113.2	A253 E254 R258	A253-R256 WeakPolarHBondContact O-CA 3.4Å; A253-R256 PolarHBondContact O-N 2.82Å; E254-R256 VanDerWaalsContact C-N 3.25Å; E254-R256 PolarHBondContact O-N 2.81Å; R256-R258 PolarHBondContact O-N 2.9Å
257	G	66.5	Low	66.3	Low	42 Å²	42	77.1 Å²	77.1	43%	0.433	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	6.7	-177.5	0	0	0	0	0	115	F255 Y259	F255-G257 PolarHBondContact O-N 2.79Å; G257-Y259 VanDerWaalsContact C-N 3.26Å; G257-Y259 WeakPolarHBondContact O-CD2 3.3Å; G257-Y259 WeakPolarHBondContact O-CE2 3.38Å; G257-Y259 PolarHBondContact O-N 3.21Å
258	R	75.3	Confident	66.4	Low	135 Å²	135	81.4 Å²	81.4	51%	0.509	40%	0.4	S	S	.	.			trans	-82.4	70.4	174.2	-58.9	179.8	175.6	-178.8	-3.7	110.5	F255 R256 H260 Q261 L262	F255-R258 WeakPolarHBondContact O-CB 3.02Å; F255-R258 WeakPolarHBondContact O-CG 3.48Å; F255-R258 PolarHBondContact O-N 2.8Å; R256-R258 PolarHBondContact O-N 2.9Å; R258-H260 PolarHBondContact O-N 2.88Å; R258-H260 VanDerWaalsContact O-N 3.12Å; R258-Q261 HydrophobicContact CB-CB 4.21Å; R258-Q261 HydrophobicContact CB-CG 3.92Å; R258-Q261 VanDerWaalsContact CD-CD 3.47Å; R258-Q261 WeakPolarHBondContact O-CB 3.5Å; R258-Q261 PolarHBondContact O-N 3.26Å; R258-L262 PolarHBondContact O-N 2.95Å
259	Y	72.3	Confident	66.8	Low	106 Å²	106	82.6 Å²	82.6	42%	0.416	41%	0.406	S	S	.	.	H	α-helix	trans	-54.5	-33.9	-176.9	-64.7	-80.4	0	0	0	113.8	A252 G257 Q261 L262 V263 K290	A252-Y259 HydrophobicContact CB-CE1 4.45Å; G257-Y259 VanDerWaalsContact C-N 3.26Å; G257-Y259 WeakPolarHBondContact O-CD2 3.3Å; G257-Y259 WeakPolarHBondContact O-CE2 3.38Å; G257-Y259 PolarHBondContact O-N 3.21Å; Y259-Q261 VanDerWaalsContact C-N 3.29Å; Y259-Q261 PolarHBondContact O-N 2.94Å; Y259-L262 WeakPolarHBondContact O-CB 3.31Å; Y259-L262 PolarHBondContact O-N 3.39Å; Y259-V263 WeakPolarHBondContact O-CG2 3.22Å; Y259-V263 PolarHBondContact O-N 3.2Å; Y259-K290 HydrophobicContact CE1-CD 3.79Å; Y259-K290 HydrophobicContact CE1-CG 4.11Å; Y259-K290 WeakPolarHBondContact OH-CD 3.26Å; Y259-K290 VanDerWaalsContact OH-CE 3.26Å; Y259-K290 WeakPolarHBondContact OH-CE 3.47Å; Y259-K290 PolarHBondContact OH-NZ 3.41Å
260	H	71.8	Confident	66.8	Low	132 Å²	132	77.3 Å²	77.3	61%	0.611	38%	0.381	S	S	*	.	H	α-helix	trans	-62.4	-33.5	175.6	70.5	-84.3	0	0	0	113.2	R258 S264	R258-H260 PolarHBondContact O-N 2.88Å; R258-H260 VanDerWaalsContact O-N 3.12Å; H260-S264 VanDerWaalsContact O-CB 3.28Å; H260-S264 WeakPolarHBondContact O-CB 3.48Å; H260-S264 PolarHBondContact O-N 3.34Å
261	Q	70.9	Confident	66.5	Low	75 Å²	75	75.7 Å²	75.7	35%	0.35	38%	0.376	S	S	.	.	H	α-helix	trans	-73.9	-39.2	177.5	-61.2	-170.6	-22.1	0	0	111.1	F255 R258 Y259 S264 R265	F255-Q261 HydrophobicContact CD1-CB 3.73Å; F255-Q261 HydrophobicContact CE1-CB 4.2Å; R258-Q261 HydrophobicContact CB-CB 4.21Å; R258-Q261 HydrophobicContact CB-CG 3.92Å; R258-Q261 VanDerWaalsContact CD-CD 3.47Å; R258-Q261 WeakPolarHBondContact O-CB 3.5Å; R258-Q261 PolarHBondContact O-N 3.26Å; Y259-Q261 VanDerWaalsContact C-N 3.29Å; Y259-Q261 PolarHBondContact O-N 2.94Å; Q261-S264 PolarHBondContact O-N 3.49Å; Q261-R265 WeakPolarHBondContact O-CB 3.42Å; Q261-R265 PolarHBondContact O-N 3.48Å
262	L	68.9	Low	66.4	Low	4 Å²	4	77 Å²	77	2%	0.021	38%	0.384	C	S	.	.	H	α-helix	trans	-60.6	-50.6	172.8	171.3	66.3	0	0	0	111	V247 M251 F255 R258 Y259 S264 R265 I266	V247-L262 HydrophobicContact CB-CD2 4.25Å; V247-L262 HydrophobicContact CG1-CD1 4.04Å; V247-L262 HydrophobicContact CG1-CD2 3.74Å; V247-L262 HydrophobicContact CG1-CG 4.44Å; V247-L262 HydrophobicContact CG2-CD1 4.5Å; V247-L262 HydrophobicContact CG2-CD2 4.25Å; M251-L262 HydrophobicContact CE-CD1 4.15Å; M251-L262 HydrophobicContact CG-CD1 4.08Å; M251-L262 HydrophobicContact SD-CD1 4.31Å; F255-L262 HydrophobicContact CB-CB 4.28Å; F255-L262 HydrophobicContact CD1-CB 4.19Å; F255-L262 HydrophobicContact CD2-CB 3.98Å; F255-L262 HydrophobicContact CD2-CD1 3.76Å; F255-L262 HydrophobicContact CD2-CG 4.43Å; F255-L262 HydrophobicContact CE2-CB 4.4Å; F255-L262 HydrophobicContact CE2-CD1 3.68Å; F255-L262 HydrophobicContact CG-CB 3.87Å; F255-L262 HydrophobicContact CZ-CD1 4.35Å; R258-L262 PolarHBondContact O-N 2.95Å; Y259-L262 WeakPolarHBondContact O-CB 3.31Å; Y259-L262 PolarHBondContact O-N 3.39Å; L262-S264 VanDerWaalsContact C-N 3.32Å; L262-S264 PolarHBondContact O-N 3.2Å; L262-R265 WeakPolarHBondContact O-CB 3.43Å; L262-R265 PolarHBondContact O-N 3.14Å; L262-R265 VanDerWaalsContact O-N 3.13Å; L262-I266 HydrophobicContact CD1-CD1 3.98Å; L262-I266 HydrophobicContact CD1-CG1 4.4Å; L262-I266 HydrophobicContact CG-CD1 3.99Å; L262-I266 WeakPolarHBondContact O-CG1 3.35Å; L262-I266 PolarHBondContact O-N 3.16Å
263	V	67.3	Low	66.2	Low	52 Å²	52	78.9 Å²	78.9	32%	0.315	40%	0.395	S	S	.	.	H	α-helix	trans	-61.2	-41.6	177.2	172.4	0	0	0	0	111	Y259 R265 I266 N267 V288	Y259-V263 WeakPolarHBondContact O-CG2 3.22Å; Y259-V263 PolarHBondContact O-N 3.2Å; V263-R265 VanDerWaalsContact C-N 3.34Å; V263-R265 PolarHBondContact O-N 3.27Å; V263-I266 PolarHBondContact O-N 2.89Å; V263-N267 WeakPolarHBondContact O-CB 3.32Å; V263-N267 VanDerWaalsContact O-CG 3.28Å; V263-N267 PolarHBondContact O-N 2.88Å; V263-V288 HydrophobicContact CG2-CB 4.46Å; V263-V288 HydrophobicContact CG2-CG1 4.44Å; V263-V288 HydrophobicContact CG2-CG2 4.36Å
264	S	67.5	Low	65.5	Low	62 Å²	62	77.9 Å²	77.9	43%	0.434	38%	0.38	S	S	.	.	H	α-helix	trans	-61	-41.7	174	179.3	0	0	0	0	112	H260 Q261 L262 N267 M268	H260-S264 VanDerWaalsContact O-CB 3.28Å; H260-S264 WeakPolarHBondContact O-CB 3.48Å; H260-S264 PolarHBondContact O-N 3.34Å; Q261-S264 PolarHBondContact O-N 3.49Å; L262-S264 VanDerWaalsContact C-N 3.32Å; L262-S264 PolarHBondContact O-N 3.2Å; S264-N267 PolarHBondContact O-N 3.26Å; S264-M268 WeakPolarHBondContact O-CG 3.4Å; S264-M268 PolarHBondContact O-N 3.24Å
265	R	64.7	Low	64.7	Low	136 Å²	136	77.3 Å²	77.3	51%	0.513	38%	0.377	S	S	.	.	H	α-helix	trans	-62.3	-44.9	175.4	-175.6	63.4	168.5	176.7	-0.4	111.9	F255 Q261 L262 V263 M268 I269	F255-R265 HydrophobicContact CE1-CB 4.21Å; F255-R265 HydrophobicContact CZ-CB 3.94Å; F255-R265 HydrophobicContact CZ-CG 4.04Å; Q261-R265 WeakPolarHBondContact O-CB 3.42Å; Q261-R265 PolarHBondContact O-N 3.48Å; L262-R265 WeakPolarHBondContact O-CB 3.43Å; L262-R265 PolarHBondContact O-N 3.14Å; L262-R265 VanDerWaalsContact O-N 3.13Å; V263-R265 VanDerWaalsContact C-N 3.34Å; V263-R265 PolarHBondContact O-N 3.27Å; R265-M268 HydrophobicContact CB-CE 4.45Å; R265-M268 PolarHBondContact O-N 3.39Å; R265-I269 HydrophobicContact CG-CD1 4.23Å; R265-I269 WeakPolarHBondContact O-CG1 2.91Å; R265-I269 PolarHBondContact O-N 2.85Å
266	I	65	Low	63.5	Low	0 Å²	0	80 Å²	80	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-62.6	-46.6	176.7	-67.2	166.4	0	0	0	110.3	M245 V247 L262 V263 M268 I269 I270 L285 V288	M245-I266 HydrophobicContact CE-CG2 3.86Å; M245-I266 HydrophobicContact SD-CB 4.18Å; M245-I266 HydrophobicContact SD-CD1 3.79Å; M245-I266 HydrophobicContact SD-CG1 3.72Å; M245-I266 HydrophobicContact SD-CG2 3.4Å; M245-I266 WeakPolarHBondContact SD-CG2 3.33Å; V247-I266 HydrophobicContact CG2-CD1 3.57Å; L262-I266 HydrophobicContact CD1-CD1 3.98Å; L262-I266 HydrophobicContact CD1-CG1 4.4Å; L262-I266 HydrophobicContact CG-CD1 3.99Å; L262-I266 WeakPolarHBondContact O-CG1 3.35Å; L262-I266 PolarHBondContact O-N 3.16Å; V263-I266 PolarHBondContact O-N 2.89Å; I266-M268 VanDerWaalsContact C-N 3.29Å; I266-M268 PolarHBondContact O-N 3.17Å; I266-I269 CarbonylContact O-C 3.58Å; I266-I269 WeakPolarHBondContact O-CA 3.28Å; I266-I269 WeakPolarHBondContact O-CB 3.41Å; I266-I269 PolarHBondContact O-N 3.38Å; I266-I270 HydrophobicContact CG2-CG1 4.25Å; I266-I270 WeakPolarHBondContact O-CG1 3.38Å; I266-I270 PolarHBondContact O-N 3.27Å; I266-L285 HydrophobicContact CG2-CD1 4.15Å; I266-L285 HydrophobicContact CG2-CD2 3.55Å; I266-V288 HydrophobicContact CD1-CG1 4.01Å; I266-V288 HydrophobicContact CD1-CG2 4.23Å
267	N	60.9	Low	62.3	Low	82 Å²	82	72.2 Å²	72.2	44%	0.439	36%	0.364	S	S	.	.	H	α-helix	trans	-60.2	-38.6	177.4	-74.1	-16.3	0	0	0	112.2	V263 S264 I270 A271 L285	V263-N267 WeakPolarHBondContact O-CB 3.32Å; V263-N267 VanDerWaalsContact O-CG 3.28Å; V263-N267 PolarHBondContact O-N 2.88Å; S264-N267 PolarHBondContact O-N 3.26Å; N267-I270 PolarHBondContact O-N 2.92Å; N267-A271 WeakPolarHBondContact O-CB 3.2Å; N267-A271 PolarHBondContact O-N 3.42Å; N267-L285 WeakPolarHBondContact OD1-CD2 3.31Å
268	M	61.3	Low	61.2	Low	94 Å²	94	75 Å²	75	46%	0.463	38%	0.375	S	S	.	.	H	α-helix	trans	-63.6	-41.5	173	-74.3	-174.4	-70.3	0	0	112	S264 R265 I266 A271 L272	S264-M268 WeakPolarHBondContact O-CG 3.4Å; S264-M268 PolarHBondContact O-N 3.24Å; R265-M268 HydrophobicContact CB-CE 4.45Å; R265-M268 PolarHBondContact O-N 3.39Å; I266-M268 VanDerWaalsContact C-N 3.29Å; I266-M268 PolarHBondContact O-N 3.17Å; M268-A271 PolarHBondContact O-N 3.13Å; M268-L272 VanDerWaalsContact O-CG 3.3Å; M268-L272 WeakPolarHBondContact O-CG 3.28Å; M268-L272 PolarHBondContact O-N 3.34Å
269	I	61.7	Low	60	Low	66 Å²	66	73.9 Å²	73.9	34%	0.338	38%	0.384	S	S	.	.	H	α-helix	trans	-62.2	-47.2	175	-67.1	163	0	0	0	110	R265 I266 A271 L272 V273	R265-I269 HydrophobicContact CG-CD1 4.23Å; R265-I269 WeakPolarHBondContact O-CG1 2.91Å; R265-I269 PolarHBondContact O-N 2.85Å; I266-I269 CarbonylContact O-C 3.58Å; I266-I269 WeakPolarHBondContact O-CA 3.28Å; I266-I269 WeakPolarHBondContact O-CB 3.41Å; I266-I269 PolarHBondContact O-N 3.38Å; I269-A271 PolarHBondContact O-N 3.3Å; I269-L272 WeakPolarHBondContact O-CB 3.02Å; I269-L272 PolarHBondContact O-N 3.33Å; I269-V273 HydrophobicContact CG2-CG2 4.28Å; I269-V273 WeakPolarHBondContact O-CG2 3.3Å; I269-V273 PolarHBondContact O-N 2.95Å
270	I	61	Low	59	Low	15 Å²	15	73.5 Å²	73.5	8%	0.077	39%	0.386	C	S	.	.	H	α-helix	trans	-65.6	-37.6	179.5	-62.4	-61.4	0	0	0	111.8	L243 M245 I266 N267 V273 N274 I283 L285	L243-I270 HydrophobicContact CD1-CD1 4.41Å; M245-I270 HydrophobicContact CE-CD1 4.12Å; I266-I270 HydrophobicContact CG2-CG1 4.25Å; I266-I270 WeakPolarHBondContact O-CG1 3.38Å; I266-I270 PolarHBondContact O-N 3.27Å; N267-I270 PolarHBondContact O-N 2.92Å; I270-V273 PolarHBondContact O-N 3.36Å; I270-N274 WeakPolarHBondContact O-CB 3.44Å; I270-N274 PolarHBondContact O-N 2.76Å; I270-I283 HydrophobicContact CD1-CG2 4.08Å; I270-I283 HydrophobicContact CG2-CB 4.42Å; I270-I283 HydrophobicContact CG2-CG2 3.82Å; I270-L285 HydrophobicContact CG1-CB 4.31Å
271	A	57	Low	57.7	Low	47 Å²	47	69 Å²	69	39%	0.388	37%	0.367	S	S	.	.	H	α-helix	trans	-60.8	-45.8	173.1	0	0	0	0	0	111.2	N267 M268 I269 V273 N274 E275	N267-A271 WeakPolarHBondContact O-CB 3.2Å; N267-A271 PolarHBondContact O-N 3.42Å; M268-A271 PolarHBondContact O-N 3.13Å; I269-A271 PolarHBondContact O-N 3.3Å; A271-V273 PolarHBondContact O-N 3.41Å; A271-N274 PolarHBondContact O-N 3.19Å; A271-E275 WeakPolarHBondContact O-CG 3.4Å; A271-E275 PolarHBondContact O-N 2.83Å
272	L	54.7	Low	56.3	Low	87 Å²	87	68.2 Å²	68.2	46%	0.455	37%	0.367	S	S	.	.	H	α-helix	trans	-60	-44.9	173.3	-72.2	165	0	0	0	111.3	M268 I269 N274 E275 F276	M268-L272 VanDerWaalsContact O-CG 3.3Å; M268-L272 WeakPolarHBondContact O-CG 3.28Å; M268-L272 PolarHBondContact O-N 3.34Å; I269-L272 WeakPolarHBondContact O-CB 3.02Å; I269-L272 PolarHBondContact O-N 3.33Å; L272-N274 VanDerWaalsContact C-N 3.31Å; L272-N274 PolarHBondContact O-N 3.12Å; L272-E275 WeakPolarHBondContact O-CB 3.19Å; L272-E275 PolarHBondContact O-N 2.91Å; L272-F276 VanDerWaalsContact C-CD2 3.48Å; L272-F276 HydrophobicContact CB-CD2 4.49Å; L272-F276 HydrophobicContact CB-CE2 4.17Å; L272-F276 WeakPolarHBondContact O-CD2 3.49Å; L272-F276 WeakPolarHBondContact O-CG 3.34Å; L272-F276 PolarHBondContact O-N 3.36Å
273	V	56.5	Low	55.3	Low	48 Å²	48	68.8 Å²	68.8	29%	0.291	37%	0.37	S	S	.	.	H	α-helix	trans	-63	-36.9	176.8	-176	0	0	0	0	111.7	I269 I270 A271 F276 L277 I283	I269-V273 HydrophobicContact CG2-CG2 4.28Å; I269-V273 WeakPolarHBondContact O-CG2 3.3Å; I269-V273 PolarHBondContact O-N 2.95Å; I270-V273 PolarHBondContact O-N 3.36Å; A271-V273 PolarHBondContact O-N 3.41Å; V273-F276 WeakPolarHBondContact O-CB 3.18Å; V273-F276 PolarHBondContact O-N 2.77Å; V273-L277 HydrophobicContact CG1-CD1 3.87Å; V273-L277 HydrophobicContact CG1-CG 4.34Å; V273-L277 WeakPolarHBondContact O-CB 3.47Å; V273-L277 VanDerWaalsContact O-CG 3.29Å; V273-L277 WeakPolarHBondContact O-CG 3.34Å; V273-L277 PolarHBondContact O-N 3.07Å; V273-I283 HydrophobicContact CB-CD1 4.43Å; V273-I283 HydrophobicContact CG1-CD1 3.44Å; V273-I283 VanDerWaalsContact CG1-CD1 3.44Å
274	N	52.9	Low	54.2	Low	43 Å²	43	70.5 Å²	70.5	23%	0.23	38%	0.377	C	S	.	.	H	α-helix	trans	-67.4	-40.5	173.5	-79	-22.6	0	0	0	112.5	I270 A271 L272 F276 L277 C278 I283	I270-N274 WeakPolarHBondContact O-CB 3.44Å; I270-N274 PolarHBondContact O-N 2.76Å; A271-N274 PolarHBondContact O-N 3.19Å; L272-N274 VanDerWaalsContact C-N 3.31Å; L272-N274 PolarHBondContact O-N 3.12Å; N274-F276 PolarHBondContact O-N 3.02Å; N274-L277 PolarHBondContact O-N 3.28Å; N274-L277 VanDerWaalsContact O-N 3.15Å; N274-C278 PolarHBondContact O-N 2.94Å; N274-C278 VanDerWaalsContact O-N 3.14Å; N274-I283 PolarHBondContact ND2-O 3.1Å; N274-I283 WeakPolarHBondContact OD1-CA 3.49Å; N274-I283 VanDerWaalsContact OD1-CB 3.3Å; N274-I283 WeakPolarHBondContact OD1-CB 3.12Å; N274-I283 PolarHBondContact OD1-N 3.28Å; N274-I283 PolarHBondContact OD1-O 2.84Å
275	E	54.8	Low	53.5	Low	130 Å²	130	69.1 Å²	69.1	61%	0.607	37%	0.365	S	S	*	.	H	α-helix	trans	-60.3	-35.5	171.1	-72.5	179.2	178.2	0	0	111.3	A271 L272 C278	A271-E275 WeakPolarHBondContact O-CG 3.4Å; A271-E275 PolarHBondContact O-N 2.83Å; L272-E275 WeakPolarHBondContact O-CB 3.19Å; L272-E275 PolarHBondContact O-N 2.91Å; E275-C278 WeakPolarHBondContact O-CB 3.4Å; E275-C278 PolarHBondContact O-SG 3.41Å
276	F	45.3	Very low	52.6	Low	101 Å²	101	64.8 Å²	64.8	44%	0.443	35%	0.354	S	S	.	.	H	α-helix	trans	-69	-32.6	173.8	-73.2	-56.3	0	0	0	113.9	H43 L272 V273 N274	H43-F276 AromaticContact CD2-CE1 3.24Å; H43-F276 WeakPolarHBondContact CD2-CE1 3.37Å; H43-F276 AromaticContact CD2-CZ 3.63Å; H43-F276 AromaticContact NE2-CE1 3.25Å; H43-F276 WeakPolarHBondContact NE2-CE1 3.08Å; H43-F276 AromaticContact NE2-CZ 3.68Å; L272-F276 VanDerWaalsContact C-CD2 3.48Å; L272-F276 HydrophobicContact CB-CD2 4.49Å; L272-F276 HydrophobicContact CB-CE2 4.17Å; L272-F276 WeakPolarHBondContact O-CD2 3.49Å; L272-F276 WeakPolarHBondContact O-CG 3.34Å; L272-F276 PolarHBondContact O-N 3.36Å; V273-F276 WeakPolarHBondContact O-CB 3.18Å; V273-F276 PolarHBondContact O-N 2.77Å; N274-F276 PolarHBondContact O-N 3.02Å
277	L	51.9	Low	51.7	Low	60 Å²	60	72.8 Å²	72.8	31%	0.314	38%	0.384	S	S	.	.	H	α-helix	trans	-94.1	1	-175.2	-70.3	172.9	0	0	0	114.6	V273 N274 V279 H280 V281 I283	V273-L277 HydrophobicContact CG1-CD1 3.87Å; V273-L277 HydrophobicContact CG1-CG 4.34Å; V273-L277 WeakPolarHBondContact O-CB 3.47Å; V273-L277 VanDerWaalsContact O-CG 3.29Å; V273-L277 WeakPolarHBondContact O-CG 3.34Å; V273-L277 PolarHBondContact O-N 3.07Å; N274-L277 PolarHBondContact O-N 3.28Å; N274-L277 VanDerWaalsContact O-N 3.15Å; L277-V279 PolarHBondContact O-N 3.29Å; L277-H280 PolarHBondContact O-N 3.02Å; L277-V281 HydrophobicContact CB-CB 4.17Å; L277-V281 WeakPolarHBondContact CB-O 3.44Å; L277-V281 HydrophobicContact CD1-CB 4.28Å; L277-V281 HydrophobicContact CD1-CG1 4.16Å; L277-V281 HydrophobicContact CD2-CB 4.47Å; L277-V281 PolarHBondContact O-N 3.1Å; L277-I283 HydrophobicContact CD1-CD1 3.3Å; L277-I283 HydrophobicContact CD1-CG1 3.73Å
278	C	43.7	Very low	51.2	Low	99 Å²	99	71.1 Å²	71.1	67%	0.669	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-33.4	-9.4	-174	-99.5	0	0	0	0	120.2	N274 E275	N274-C278 PolarHBondContact O-N 2.94Å; N274-C278 VanDerWaalsContact O-N 3.14Å; E275-C278 WeakPolarHBondContact O-CB 3.4Å; E275-C278 PolarHBondContact O-SG 3.41Å
279	V	50	Low	50.6	Low	113 Å²	113	69.6 Å²	69.6	69%	0.685	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-35.7	-174.2	-152.8	0	0	0	0	112	L277	L277-V279 PolarHBondContact O-N 3.29Å
280	H	50.3	Low	50.1	Low	98 Å²	98	72.1 Å²	72.1	45%	0.454	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.8	0.9	-178.1	-65.4	95.9	0	0	0	114.9	T238 Y239 L277	T238-H280 CarbonylContact C-O 3.29Å; T238-H280 VanDerWaalsContact CG2-C 3.45Å; Y239-H280 WeakPolarHBondContact CA-O 3.33Å; Y239-H280 VanDerWaalsContact CB-O 3.28Å; Y239-H280 WeakPolarHBondContact CB-O 3.43Å; Y239-H280 HydrophobicContact CD2-CB 4.15Å; Y239-H280 VanDerWaalsContact CD2-O 3.24Å; Y239-H280 WeakPolarHBondContact CD2-O 3.19Å; Y239-H280 PolarHBondContact N-O 3.3Å; L277-H280 PolarHBondContact O-N 3.02Å
281	V	44.5	Very low	49.4	Very low	38 Å²	38	75.5 Å²	75.5	23%	0.23	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	129.7	-175.9	-171.8	0	0	0	0	111.1	Y239 V241 L277	Y239-V281 HydrophobicContact CD2-CG2 4.36Å; Y239-V281 CarbonylContact O-C 3.55Å; Y239-V281 VanDerWaalsContact O-CA 3.3Å; Y239-V281 WeakPolarHBondContact O-CA 3.19Å; V241-V281 HydrophobicContact CB-CG1 4.32Å; V241-V281 HydrophobicContact CG2-CG1 3.51Å; L277-V281 HydrophobicContact CB-CB 4.17Å; L277-V281 WeakPolarHBondContact CB-O 3.44Å; L277-V281 HydrophobicContact CD1-CB 4.28Å; L277-V281 HydrophobicContact CD1-CG1 4.16Å; L277-V281 HydrophobicContact CD2-CB 4.47Å; L277-V281 PolarHBondContact O-N 3.1Å
282	T	42.6	Very low	49	Very low	57 Å²	57	76.9 Å²	76.9	35%	0.35	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121.8	171.9	-57.3	0	0	0	0	108.7	Y239 V240 V241	Y239-T282 PolarHBondContact O-N 3.08Å; V240-T282 CarbonylContact C-O 3.54Å; V240-T282 WeakPolarHBondContact CA-O 3.33Å; V241-T282 PolarHBondContact N-O 2.96Å
283	I	48.1	Very low	48.7	Very low	16 Å²	16	76.4 Å²	76.4	8%	0.082	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	126.8	170.6	-70.9	169.5	0	0	0	109.9	V241 L243 I270 V273 N274 L277	V241-I283 HydrophobicContact CB-CG1 4.11Å; V241-I283 HydrophobicContact CG1-CG1 4.39Å; V241-I283 CarbonylContact O-C 3.53Å; V241-I283 VanDerWaalsContact O-CA 3.31Å; V241-I283 WeakPolarHBondContact O-CA 3.27Å; L243-I283 HydrophobicContact CB-CG2 4.18Å; L243-I283 HydrophobicContact CD1-CB 4.43Å; L243-I283 HydrophobicContact CD1-CD1 3.94Å; L243-I283 HydrophobicContact CD1-CG1 4.22Å; L243-I283 HydrophobicContact CD1-CG2 3.37Å; L243-I283 HydrophobicContact CG-CG2 3.71Å; I270-I283 HydrophobicContact CD1-CG2 4.08Å; I270-I283 HydrophobicContact CG2-CB 4.42Å; I270-I283 HydrophobicContact CG2-CG2 3.82Å; V273-I283 HydrophobicContact CB-CD1 4.43Å; V273-I283 HydrophobicContact CG1-CD1 3.44Å; V273-I283 VanDerWaalsContact CG1-CD1 3.44Å; N274-I283 PolarHBondContact ND2-O 3.1Å; N274-I283 WeakPolarHBondContact OD1-CA 3.49Å; N274-I283 VanDerWaalsContact OD1-CB 3.3Å; N274-I283 WeakPolarHBondContact OD1-CB 3.12Å; N274-I283 PolarHBondContact OD1-N 3.28Å; N274-I283 PolarHBondContact OD1-O 2.84Å; L277-I283 HydrophobicContact CD1-CD1 3.3Å; L277-I283 HydrophobicContact CD1-CG1 3.73Å
284	L	43.3	Very low	48.3	Very low	88 Å²	88	77.9 Å²	77.9	46%	0.461	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	120.5	171.1	-165.4	82.3	0	0	0	109.2	V241 L243 T286	V241-L284 PolarHBondContact O-N 2.86Å; L243-L284 PolarHBondContact N-O 2.8Å; L284-T286 HydrophobicContact CD2-CG2 3.91Å; L284-T286 HydrophobicContact CG-CG2 4.44Å; L284-T286 PolarHBondContact O-N 3.17Å
285	L	52.6	Low	48	Very low	34 Å²	34	80 Å²	80	18%	0.178	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	108.8	168.6	-175	74.9	0	0	0	108.7	M245 I266 N267 I270 V288	M245-L285 HydrophobicContact CB-CD1 3.71Å; I266-L285 HydrophobicContact CG2-CD1 4.15Å; I266-L285 HydrophobicContact CG2-CD2 3.55Å; N267-L285 WeakPolarHBondContact OD1-CD2 3.31Å; I270-L285 HydrophobicContact CG1-CB 4.31Å; L285-V288 HydrophobicContact CD1-CG2 4.46Å; L285-V288 HydrophobicContact CD2-CG2 3.7Å; L285-V288 HydrophobicContact CG-CG2 4.32Å
286	T	46.1	Very low	47.6	Very low	45 Å²	45	76.9 Å²	76.9	28%	0.276	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-36	-175.8	50.3	0	0	0	0	112.3	E242 L243 F244 L284	E242-T286 HydrophobicContact CB-CG2 3.9Å; E242-T286 HydrophobicContact CG-CG2 3.89Å; L243-T286 PolarHBondContact O-N 2.75Å; L243-T286 VanDerWaalsContact O-N 3.16Å; L243-T286 PolarHBondContact O-OG1 3.26Å; F244-T286 WeakPolarHBondContact CE1-OG1 3.29Å; L284-T286 HydrophobicContact CD2-CG2 3.91Å; L284-T286 HydrophobicContact CG-CG2 4.44Å; L284-T286 PolarHBondContact O-N 3.17Å
287	R	47.4	Very low	47.8	Very low	168 Å²	168	75.3 Å²	75.3	63%	0.634	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.6	145	177.6	-66.4	-175.5	175.5	157.7	-2.1	112.2	F244 M245	F244-R287 HydrophobicContact CD1-CB 4.08Å; F244-R287 HydrophobicContact CD1-CG 4.49Å; F244-R287 HydrophobicContact CE1-CB 4.38Å; F244-R287 HydrophobicContact CE1-CG 4.31Å; M245-R287 PolarHBondContact N-O 3.33Å
288	V	50.2	Low	47.5	Very low	47 Å²	47	76.4 Å²	76.4	29%	0.285	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	114.7	164.7	-179.4	0	0	0	0	107.2	M245 V247 V263 I266 L285	M245-V288 WeakPolarHBondContact O-CA 3.47Å; V247-V288 HydrophobicContact CG2-CG1 3.82Å; V263-V288 HydrophobicContact CG2-CB 4.46Å; V263-V288 HydrophobicContact CG2-CG1 4.44Å; V263-V288 HydrophobicContact CG2-CG2 4.36Å; I266-V288 HydrophobicContact CD1-CG1 4.01Å; I266-V288 HydrophobicContact CD1-CG2 4.23Å; L285-V288 HydrophobicContact CD1-CG2 4.46Å; L285-V288 HydrophobicContact CD2-CG2 3.7Å; L285-V288 HydrophobicContact CG-CG2 4.32Å
289	L	48.4	Very low	47.8	Very low	61 Å²	61	74.6 Å²	74.6	32%	0.319	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	134.8	176.2	-64.1	173.6	0	0	0	109.2	I223 M245 V247	I223-L289 HydrophobicContact CG2-CD1 4.44Å; M245-L289 PolarHBondContact O-N 3.35Å; M245-L289 VanDerWaalsContact O-N 3.07Å; V247-L289 PolarHBondContact N-O 3.21Å
290	K	50.3	Low	47.6	Very low	120 Å²	120	71.4 Å²	71.4	52%	0.522	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	124.9	165.9	-169.5	-159.3	168.1	-178.2	0	107	Y259	Y259-K290 HydrophobicContact CE1-CD 3.79Å; Y259-K290 HydrophobicContact CE1-CG 4.11Å; Y259-K290 WeakPolarHBondContact OH-CD 3.26Å; Y259-K290 VanDerWaalsContact OH-CE 3.26Å; Y259-K290 WeakPolarHBondContact OH-CE 3.47Å; Y259-K290 PolarHBondContact OH-NZ 3.41Å
291	D	47	Very low	47.3	Very low	85 Å²	85	69 Å²	69	46%	0.455	35%	0.345	S	S	.	.			trans	-61.6	0	165.9	-85.1	-20	0	0	0	111.7	V246 V247	V246-D291 WeakPolarHBondContact CG1-OD1 3.42Å; V247-D291 PolarHBondContact O-N 3.34Å

Retrieved 291 of 291 residues in 567.3 ms (Link to these results)

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