G4LXE1_SCHMA Loading...

RNA polymerase II nuclear localization protein SLC7A6OS

AlphaFold DB , UniProt , Accession G4LXE1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 268 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	23	Very low	26.3	Very low	242 Å²	242	141.5 Å²	141.5	100%	1.192	73%	0.727	S	S	*	*				0	118.9	0	-79.8	171.7	170.4	0	0	107.5	M3	M1-M3 PolarHBondContact O-N 2.81Å
2	A	19.4	Very low	26.5	Very low	103 Å²	103	131.3 Å²	131.3	85%	0.851	68%	0.677	S	S	*	*			trans	-72.5	108.6	-178	0	0	0	0	0	109	S4	A2-S4 PolarHBondContact O-N 3.46Å; A2-S4 VanDerWaalsContact O-N 3.14Å
3	M	20.2	Very low	27.1	Very low	174 Å²	174	125.4 Å²	125.4	86%	0.857	65%	0.645	S	S	*	*			trans	-63.3	110.2	166.7	-79.2	-175.2	151.1	0	0	107.8	M1 K5	M1-M3 PolarHBondContact O-N 2.81Å; M3-K5 PolarHBondContact O-N 2.96Å
4	S	22.1	Very low	27.9	Very low	70 Å²	70	118.1 Å²	118.1	49%	0.49	61%	0.609	S	S	.	*			trans	-57.1	107.5	165.9	170.8	0	0	0	0	107.9	A2 F6	A2-S4 PolarHBondContact O-N 3.46Å; A2-S4 VanDerWaalsContact O-N 3.14Å; S4-F6 PolarHBondContact O-N 3.49Å; S4-F6 VanDerWaalsContact O-N 3.12Å
5	K	22.9	Very low	28.9	Very low	199 Å²	199	111.1 Å²	111.1	87%	0.865	57%	0.573	S	S	*	*			trans	-74.5	96.4	169.7	-79.9	-177.2	175.4	-179.3	0	106.7	M3 L7	M3-K5 PolarHBondContact O-N 2.96Å; K5-L7 PolarHBondContact O-N 3.01Å
6	F	26.6	Very low	29.9	Very low	127 Å²	127	105.9 Å²	105.9	56%	0.557	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-48.8	126.1	167.9	-68	-89.7	0	0	0	110.3	S4 I68	S4-F6 PolarHBondContact O-N 3.49Å; S4-F6 VanDerWaalsContact O-N 3.12Å; F6-I68 HydrophobicContact CD1-CD1 4.23Å; F6-I68 HydrophobicContact CE1-CD1 4.08Å
7	L	26.6	Very low	30.8	Very low	155 Å²	155	99.9 Å²	99.9	81%	0.812	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-77.9	120.8	161.5	-84	160.2	0	0	0	107.2	K5 I9	K5-L7 PolarHBondContact O-N 3.01Å; L7-I9 PolarHBondContact O-N 3.24Å
8	P	27.2	Very low	31.6	Very low	74 Å²	74	94.4 Å²	94.4	48%	0.481	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-62.7	133.6	174.2	25.6	-31.1	0	0	0	109.4	E10	P8-E10 PolarHBondContact O-N 2.9Å
9	I	34.1	Very low	32.2	Very low	78 Å²	78	90.2 Å²	90.2	40%	0.4	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-53.8	116.6	162.1	-62.7	173.8	0	0	0	106.4	L7 Q13 M53	L7-I9 PolarHBondContact O-N 3.24Å; I9-Q13 HydrophobicContact CG2-CB 4.14Å; I9-M53 HydrophobicContact CD1-CE 4.02Å
10	E	34	Very low	32.7	Very low	112 Å²	112	88.3 Å²	88.3	52%	0.523	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-70	147.6	178.2	-64.6	-172.3	167.9	0	0	108.9	P8 S12 Q13	P8-E10 PolarHBondContact O-N 2.9Å; E10-S12 PolarHBondContact O-N 3.35Å; E10-Q13 HydrophobicContact CB-CG 4.42Å; E10-Q13 PolarHBondContact O-N 3.11Å
11	K	33.2	Very low	33	Very low	222 Å²	222	88.5 Å²	88.5	97%	0.965	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-8.5	-176.8	-72.2	-176.8	176.3	-179.1	0	114.3
12	S	28.1	Very low	33.8	Very low	19 Å²	19	81.7 Å²	81.7	13%	0.133	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	35.2	-174.3	60.1	0	0	0	0	112.1	E10 R122 N123	E10-S12 PolarHBondContact O-N 3.35Å; S12-R122 VanDerWaalsContact C-CB 3.47Å; S12-R122 WeakPolarHBondContact O-CA 3.39Å; S12-R122 WeakPolarHBondContact O-CB 3.44Å; S12-R122 PolarHBondContact O-N 3.32Å; S12-N123 PolarHBondContact OG-ND2 3.28Å
13	Q	34.4	Very low	34.5	Very low	55 Å²	55	82.9 Å²	82.9	26%	0.257	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134.1	174.4	-69.8	178.5	-25.8	0	0	111.2	I9 E10 I120	I9-Q13 HydrophobicContact CG2-CB 4.14Å; E10-Q13 HydrophobicContact CB-CG 4.42Å; E10-Q13 PolarHBondContact O-N 3.11Å; Q13-I120 WeakPolarHBondContact CA-O 3.21Å
14	V	39.2	Very low	35.5	Very low	24 Å²	24	79.8 Å²	79.8	15%	0.145	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	133.9	172.6	177	0	0	0	0	107.7	T52 I120 R122 L125	V14-T52 HydrophobicContact CG2-CG2 4.47Å; V14-I120 PolarHBondContact N-O 2.76Å; V14-I120 PolarHBondContact O-N 3.16Å; V14-R122 HydrophobicContact CG2-CB 4.17Å; V14-R122 HydrophobicContact CG2-CG 4.24Å; V14-L125 HydrophobicContact CB-CD1 3.83Å; V14-L125 HydrophobicContact CG1-CD1 4.31Å; V14-L125 HydrophobicContact CG2-CD1 3.88Å
15	I	41.9	Very low	36.3	Very low	13 Å²	13	79.4 Å²	79.4	7%	0.067	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	119.9	174.4	-68.5	145.8	0	0	0	107.6	I17 M53 F92 L117	I15-I17 HydrophobicContact CG2-CG1 4.17Å; I15-M53 HydrophobicContact CD1-CE 3.12Å; I15-M53 HydrophobicContact CD1-CG 3.92Å; I15-M53 HydrophobicContact CD1-SD 3.99Å; I15-F92 HydrophobicContact CD1-CE1 3.6Å; I15-F92 HydrophobicContact CD1-CZ 3.98Å; I15-F92 HydrophobicContact CG1-CE1 4.18Å; I15-F92 HydrophobicContact CG2-CE1 3.97Å; I15-F92 HydrophobicContact CG2-CZ 3.98Å; I15-L117 HydrophobicContact CG2-CD1 3.35Å; I15-L117 HydrophobicContact CG2-CG 4.07Å
16	Q	45.2	Very low	36.9	Very low	28 Å²	28	75.4 Å²	75.4	13%	0.131	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130.9	172.3	174.5	179.3	-19.6	0	0	108.6	T18 Y47 L118 I120	Q16-T18 PolarHBondContact NE2-OG1 3.21Å; Q16-Y47 VanDerWaalsContact NE2-CE1 3.33Å; Q16-L118 HydrophobicContact CB-CB 4.12Å; Q16-L118 PolarHBondContact N-O 3.24Å; Q16-L118 PolarHBondContact O-N 3.3Å; Q16-I120 HydrophobicContact CB-CD1 4.02Å; Q16-I120 VanDerWaalsContact OE1-CD1 3.27Å
17	I	45.1	Very low	37.2	Very low	4 Å²	4	76.7 Å²	76.7	2%	0.021	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	118.4	172.2	-60.1	-166.5	0	0	0	108.8	I15 V19 L50 L88 L91 Y115 R116 L117	I15-I17 HydrophobicContact CG2-CG1 4.17Å; I17-V19 HydrophobicContact CG2-CG2 4.28Å; I17-L50 HydrophobicContact CB-CD1 4.28Å; I17-L50 HydrophobicContact CD1-CD1 3.24Å; I17-L50 HydrophobicContact CG1-CD1 3.78Å; I17-L88 HydrophobicContact CD1-CD2 3.09Å; I17-L91 HydrophobicContact CD1-CD1 4.42Å; I17-Y115 HydrophobicContact CG2-CD1 4.33Å; I17-R116 WeakPolarHBondContact CA-O 3.08Å; I17-L117 HydrophobicContact CD1-CD1 3.62Å; I17-L117 HydrophobicContact CG1-CD1 3.68Å
18	T	45.5	Very low	37.8	Very low	0 Å²	0	73.1 Å²	73.1	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	126.1	175.8	-47.8	0	0	0	0	108.5	Q16 Y20 Y115 R116	Q16-T18 PolarHBondContact NE2-OG1 3.21Å; T18-Y20 HydrophobicContact CG2-CD2 4.31Å; T18-Y20 HydrophobicContact CG2-CE1 4.1Å; T18-Y20 HydrophobicContact CG2-CE2 3.55Å; T18-Y20 VanDerWaalsContact CG2-CZ 3.45Å; T18-Y20 WeakPolarHBondContact CG2-OH 3.39Å; T18-Y115 CarbonylContact O-C 3.45Å; T18-Y115 WeakPolarHBondContact O-CA 3.24Å; T18-R116 PolarHBondContact N-O 3.26Å; T18-R116 PolarHBondContact O-N 3.07Å
19	V	42.3	Very low	38.1	Very low	14 Å²	14	79.2 Å²	79.2	9%	0.085	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129	179.7	-170.8	0	0	0	0	108.6	I17 Y48 W113 T114 Y115	I17-V19 HydrophobicContact CG2-CG2 4.28Å; V19-Y48 HydrophobicContact CG2-CD2 3.86Å; V19-Y48 HydrophobicContact CG2-CE2 4.39Å; V19-W113 HydrophobicContact CG1-CB 4.29Å; V19-W113 HydrophobicContact CG1-CD2 4.4Å; V19-W113 HydrophobicContact CG1-CE3 3.79Å; V19-T114 CarbonylContact C-O 3.48Å; V19-T114 WeakPolarHBondContact CA-O 2.86Å; V19-Y115 HydrophobicContact CB-CD1 4.47Å; V19-Y115 HydrophobicContact CG1-CD1 4.19Å; V19-Y115 HydrophobicContact CG1-CE1 3.96Å; V19-Y115 HydrophobicContact CG2-CD1 3.62Å; V19-Y115 HydrophobicContact CG2-CE1 3.76Å; V19-Y115 HydrophobicContact CG2-CG 4.5Å
20	Y	42.6	Very low	37.9	Very low	53 Å²	53	82.1 Å²	82.1	21%	0.208	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	141.5	-179.8	-59.1	-91.5	0	0	0	110.2	T18 F25 W113 T114 R116	T18-Y20 HydrophobicContact CG2-CD2 4.31Å; T18-Y20 HydrophobicContact CG2-CE1 4.1Å; T18-Y20 HydrophobicContact CG2-CE2 3.55Å; T18-Y20 VanDerWaalsContact CG2-CZ 3.45Å; T18-Y20 WeakPolarHBondContact CG2-OH 3.39Å; Y20-F25 HydrophobicContact CD2-CE2 4.04Å; Y20-F25 HydrophobicContact CE2-CE2 4.47Å; Y20-F25 HydrophobicContact CG-CD2 4.17Å; Y20-F25 HydrophobicContact CG-CE2 4.14Å; Y20-W113 CarbonylContact O-C 3.44Å; Y20-W113 VanDerWaalsContact O-CA 3.24Å; Y20-W113 WeakPolarHBondContact O-CA 3.34Å; Y20-T114 WeakPolarHBondContact CD2-O 3.49Å; Y20-T114 PolarHBondContact N-O 3.14Å; Y20-T114 PolarHBondContact O-N 3.2Å; Y20-R116 HydrophobicContact CD2-CG 4.39Å; Y20-R116 HydrophobicContact CE2-CB 4.05Å; Y20-R116 HydrophobicContact CE2-CG 3.85Å
21	E	39.8	Very low	38	Very low	93 Å²	93	77.4 Å²	77.4	44%	0.435	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	139.6	166.3	-163.4	170.9	-163.3	0	0	110.4	D23 N24 N112 W113	E21-D23 PolarHBondContact O-N 3.39Å; E21-D23 VanDerWaalsContact O-N 3.09Å; E21-N24 WeakPolarHBondContact O-CB 3.47Å; E21-N24 PolarHBondContact O-N 3.16Å; E21-N112 CarbonylContact C-O 3.58Å; E21-N112 WeakPolarHBondContact CA-O 3.11Å; E21-W113 HydrophobicContact CB-CE3 4.12Å; E21-W113 HydrophobicContact CB-CH2 4.35Å; E21-W113 HydrophobicContact CB-CZ3 3.81Å; E21-W113 HydrophobicContact CG-CH2 4.39Å; E21-W113 HydrophobicContact CG-CZ3 4.26Å
22	K	39	Very low	38.1	Very low	99 Å²	99	71.9 Å²	71.9	43%	0.43	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-59.5	-24.8	-166	-177.2	175.2	-179.4	179.9	0	114.3	N24 G111 N112	K22-N24 VanDerWaalsContact C-N 3.33Å; K22-G111 WeakPolarHBondContact CD-O 3.43Å; K22-G111 PolarHBondContact NZ-O 3.42Å; K22-N112 HydrophobicContact CB-CB 4.17Å; K22-N112 VanDerWaalsContact CB-O 3.27Å; K22-N112 WeakPolarHBondContact CB-O 3.26Å; K22-N112 PolarHBondContact N-O 3.11Å
23	D	35.5	Very low	38.4	Very low	128 Å²	128	76 Å²	76	68%	0.684	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-80.6	-14	178.6	-68.7	-20.9	0	0	0	113.4	E21 F25	E21-D23 PolarHBondContact O-N 3.39Å; E21-D23 VanDerWaalsContact O-N 3.09Å; D23-F25 VanDerWaalsContact C-N 3.34Å
24	N	40.8	Very low	38.2	Very low	109 Å²	109	77.7 Å²	77.7	58%	0.583	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-85.5	-6.5	174.8	-72.9	-29.1	0	0	0	113.3	E21 K22	E21-N24 WeakPolarHBondContact O-CB 3.47Å; E21-N24 PolarHBondContact O-N 3.16Å; K22-N24 VanDerWaalsContact C-N 3.33Å
25	F	38	Very low	38	Very low	61 Å²	61	81 Å²	81	27%	0.268	41%	0.408	S	S	.	.	S	Bend	trans	-98.7	-14.7	-166.7	-141.1	-93.8	0	0	0	114.6	Y20 D23 N27 T114	Y20-F25 HydrophobicContact CD2-CE2 4.04Å; Y20-F25 HydrophobicContact CE2-CE2 4.47Å; Y20-F25 HydrophobicContact CG-CD2 4.17Å; Y20-F25 HydrophobicContact CG-CE2 4.14Å; D23-F25 VanDerWaalsContact C-N 3.34Å; F25-N27 VanDerWaalsContact C-N 3.35Å; F25-N27 PolarHBondContact O-N 3.15Å; F25-T114 HydrophobicContact CD2-CG2 4.26Å; F25-T114 HydrophobicContact CE2-CG2 3.8Å; F25-T114 HydrophobicContact CZ-CG2 3.96Å
26	T	35.6	Very low	37.6	Very low	115 Å²	115	89.1 Å²	89.1	71%	0.706	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-8.6	-168.5	34.7	0	0	0	0	115.1
27	N	34.2	Very low	36.8	Very low	154 Å²	154	92.3 Å²	92.3	82%	0.824	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	-2.3	-176.6	-80.8	-24.1	0	0	0	115.7	F25 K29	F25-N27 VanDerWaalsContact C-N 3.35Å; F25-N27 PolarHBondContact O-N 3.15Å; N27-K29 PolarHBondContact O-N 2.81Å; N27-K29 VanDerWaalsContact O-N 3.08Å
28	D	37.3	Very low	36	Very low	81 Å²	81	92.9 Å²	92.9	43%	0.433	47%	0.467	S	S	.	.			trans	-93.7	67.8	-172.7	-130.9	-13.1	0	0	0	112	M30 C31	D28-M30 PolarHBondContact O-N 3.43Å; D28-C31 HydrophobicContact CB-CB 3.99Å; D28-C31 PolarHBondContact O-N 3.15Å
29	K	33.7	Very low	35.2	Very low	201 Å²	201	96.3 Å²	96.3	87%	0.874	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-15	164.8	-88.9	-176.2	177.2	178.1	0	112.3	N27	N27-K29 PolarHBondContact O-N 2.81Å; N27-K29 VanDerWaalsContact O-N 3.08Å
30	M	31.5	Very low	34.6	Very low	139 Å²	139	100 Å²	100	69%	0.685	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-21.1	179.1	-73.2	-166.7	159.2	0	0	114.5	D28	D28-M30 PolarHBondContact O-N 3.43Å
31	C	36	Very low	34	Very low	14 Å²	14	101.8 Å²	101.8	10%	0.095	53%	0.531	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	13.8	-171.1	-112.6	0	0	0	0	115.2	D28 C38 R116	D28-C31 HydrophobicContact CB-CB 3.99Å; D28-C31 PolarHBondContact O-N 3.15Å; C31-C38 WeakPolarHBondContact CA-SG 3.17Å; C31-C38 WeakPolarHBondContact CB-SG 3.39Å; C31-C38 WeakPolarHBondContact SG-CA 3.31Å; C31-C38 WeakPolarHBondContact SG-CB 3.1Å; C31-C38 CovalentContact SG-SG 2.04Å; C31-C38 PolarHBondContact SG-SG 3Å; C31-R116 PolarHBondContact O-NH1 3.11Å; C31-R116 VanDerWaalsContact O-NH1 3.13Å; C31-R116 PolarHBondContact O-NH2 3.25Å
32	N	35.3	Very low	33.5	Very low	105 Å²	105	102.3 Å²	102.3	56%	0.561	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-15.3	-176.9	-83.7	-19.1	0	0	0	114.5
33	N	33.7	Very low	33	Very low	105 Å²	105	106.1 Å²	106.1	56%	0.561	56%	0.555	S	S	*	*	S	Bend	trans	-129.7	-19.2	-169	-70.9	-5.7	0	0	0	115.9
34	H	31.1	Very low	32.7	Very low	91 Å²	91	108.3 Å²	108.3	42%	0.421	56%	0.559	S	S	.	*			trans	-144.8	133.1	-177.2	-71.2	-60.7	0	0	0	113.5	E36 D37 C38	H34-E36 PolarHBondContact O-N 3.14Å; H34-D37 HydrophobicContact CB-CB 4.03Å; H34-D37 IonicContact CD2-OD2 3.52Å; H34-D37 IonicContact CG-OD2 3.92Å; H34-D37 PolarHBondContact O-N 3.14Å; H34-C38 PolarHBondContact O-N 3.4Å
35	I	34.1	Very low	32.1	Very low	95 Å²	95	104 Å²	104	49%	0.487	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-30.5	169.4	-69	169.1	0	0	0	110.8	I105 L118	I35-I105 HydrophobicContact CG1-CD1 4.28Å; I35-L118 HydrophobicContact CD1-CD2 4.35Å; I35-L118 HydrophobicContact CG1-CD2 4.23Å
36	E	33.1	Very low	31.7	Very low	183 Å²	183	106.3 Å²	106.3	86%	0.855	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-27.6	-177.9	-65.6	179.6	172.1	0	0	113.4	H34	H34-E36 PolarHBondContact O-N 3.14Å
37	D	29.1	Very low	31.4	Very low	95 Å²	95	104.3 Å²	104.3	51%	0.508	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-19	179.2	-75.7	-27.4	0	0	0	113.2	H34 G39	H34-D37 HydrophobicContact CB-CB 4.03Å; H34-D37 IonicContact CD2-OD2 3.52Å; H34-D37 IonicContact CG-OD2 3.92Å; H34-D37 PolarHBondContact O-N 3.14Å; D37-G39 VanDerWaalsContact C-N 3.25Å; D37-G39 PolarHBondContact O-N 3.18Å
38	C	29.1	Very low	31.3	Very low	16 Å²	16	104 Å²	104	11%	0.108	52%	0.521	C	S	.	.	S	Bend	trans	-72.1	85.5	170.3	-75.7	0	0	0	0	108.3	C31 H34 F40	C31-C38 WeakPolarHBondContact CA-SG 3.17Å; C31-C38 WeakPolarHBondContact CB-SG 3.39Å; C31-C38 WeakPolarHBondContact SG-CA 3.31Å; C31-C38 WeakPolarHBondContact SG-CB 3.1Å; C31-C38 CovalentContact SG-SG 2.04Å; C31-C38 PolarHBondContact SG-SG 3Å; H34-C38 PolarHBondContact O-N 3.4Å; C38-F40 WeakPolarHBondContact O-CD2 3.49Å; C38-F40 PolarHBondContact O-N 2.68Å
39	G	27	Very low	31	Very low	72 Å²	72	106.6 Å²	106.6	74%	0.742	53%	0.534	S	S	*	.			trans	-52	89.7	170.3	0	0	0	0	0	110.2	D37 N41	D37-G39 VanDerWaalsContact C-N 3.25Å; D37-G39 PolarHBondContact O-N 3.18Å; G39-N41 VanDerWaalsContact C-N 3.33Å; G39-N41 PolarHBondContact O-N 3.24Å
40	F	30.5	Very low	30.9	Very low	91 Å²	91	98.8 Å²	98.8	40%	0.399	50%	0.502	S	S	.	.			trans	-60.3	91.4	-172.7	-99.9	-90.6	0	0	0	109.2	C38 L42 L118	C38-F40 WeakPolarHBondContact O-CD2 3.49Å; C38-F40 PolarHBondContact O-N 2.68Å; F40-L42 VanDerWaalsContact C-N 3.34Å; F40-L42 PolarHBondContact O-N 3.47Å; F40-L42 VanDerWaalsContact O-N 3.17Å; F40-L118 HydrophobicContact CZ-CD1 4.05Å
41	N	29.3	Very low	30.8	Very low	90 Å²	90	99.3 Å²	99.3	48%	0.481	50%	0.5	S	S	.	.			trans	-88.7	82.2	171.6	-151.4	-13.8	0	0	0	108.5	G39 E43 K44	G39-N41 VanDerWaalsContact C-N 3.33Å; G39-N41 PolarHBondContact O-N 3.24Å; N41-E43 PolarHBondContact O-N 3.23Å; N41-K44 PolarHBondContact O-N 3.1Å; N41-K44 VanDerWaalsContact O-N 3.14Å
42	L	30.6	Very low	30.5	Very low	105 Å²	105	102.4 Å²	102.4	55%	0.55	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-53.4	-18.4	179.6	-80.1	137.7	0	0	0	113.8	F40 K44 Y47	F40-L42 VanDerWaalsContact C-N 3.34Å; F40-L42 PolarHBondContact O-N 3.47Å; F40-L42 VanDerWaalsContact O-N 3.17Å; L42-K44 VanDerWaalsContact C-N 3.26Å; L42-K44 PolarHBondContact O-N 3.19Å; L42-Y47 HydrophobicContact CB-CE2 4.14Å; L42-Y47 HydrophobicContact CD2-CD2 4.22Å; L42-Y47 HydrophobicContact CD2-CE1 4.02Å; L42-Y47 HydrophobicContact CD2-CE2 3.47Å; L42-Y47 VanDerWaalsContact CD2-CE2 3.47Å; L42-Y47 WeakPolarHBondContact CD2-OH 3.18Å; L42-Y47 HydrophobicContact CG-CE2 4.08Å; L42-Y47 WeakPolarHBondContact CG-OH 3.34Å
43	E	28.4	Very low	30.2	Very low	179 Å²	179	99.7 Å²	99.7	84%	0.836	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-73.2	-14.1	179.7	-64.3	-173.1	162.1	0	0	114	N41	N41-E43 PolarHBondContact O-N 3.23Å
44	K	28.5	Very low	29.9	Very low	173 Å²	173	103.7 Å²	103.7	75%	0.752	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-116.9	0.3	-174.5	-68.1	-170.6	178.9	-177.2	0	115.5	N41 L42	N41-K44 PolarHBondContact O-N 3.1Å; N41-K44 VanDerWaalsContact O-N 3.14Å; L42-K44 VanDerWaalsContact C-N 3.26Å; L42-K44 PolarHBondContact O-N 3.19Å
45	S	28.9	Very low	29.9	Very low	20 Å²	20	107.8 Å²	107.8	14%	0.14	52%	0.522	C	S	.	.			trans	-109.2	127.8	-179.8	15.5	0	0	0	0	110.7	Y47	S45-Y47 VanDerWaalsContact CB-CE2 3.47Å; S45-Y47 WeakPolarHBondContact O-CD2 3.28Å; S45-Y47 WeakPolarHBondContact O-CE2 2.94Å; S45-Y47 PolarHBondContact O-N 2.97Å; S45-Y47 VanDerWaalsContact O-N 3.11Å; S45-Y47 WeakPolarHBondContact OG-CE2 3.48Å; S45-Y47 PolarHBondContact OG-OH 2.87Å
46	D	29.9	Very low	29.7	Very low	108 Å²	108	109.9 Å²	109.9	58%	0.578	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	98.4	164.7	-74.8	-35.6	0	0	0	107.6	Y48	D46-Y48 PolarHBondContact O-N 3.17Å
47	Y	29.2	Very low	29.5	Very low	74 Å²	74	109.1 Å²	109.1	29%	0.29	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	113.4	177.9	-70.3	-89.3	0	0	0	110.1	Q16 L42 S45 L49	Q16-Y47 VanDerWaalsContact NE2-CE1 3.33Å; L42-Y47 HydrophobicContact CB-CE2 4.14Å; L42-Y47 HydrophobicContact CD2-CD2 4.22Å; L42-Y47 HydrophobicContact CD2-CE1 4.02Å; L42-Y47 HydrophobicContact CD2-CE2 3.47Å; L42-Y47 VanDerWaalsContact CD2-CE2 3.47Å; L42-Y47 WeakPolarHBondContact CD2-OH 3.18Å; L42-Y47 HydrophobicContact CG-CE2 4.08Å; L42-Y47 WeakPolarHBondContact CG-OH 3.34Å; S45-Y47 VanDerWaalsContact CB-CE2 3.47Å; S45-Y47 WeakPolarHBondContact O-CD2 3.28Å; S45-Y47 WeakPolarHBondContact O-CE2 2.94Å; S45-Y47 PolarHBondContact O-N 2.97Å; S45-Y47 VanDerWaalsContact O-N 3.11Å; S45-Y47 WeakPolarHBondContact OG-CE2 3.48Å; S45-Y47 PolarHBondContact OG-OH 2.87Å; Y47-L49 PolarHBondContact O-N 2.8Å
48	Y	30.8	Very low	29.4	Very low	147 Å²	147	114 Å²	114	58%	0.576	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	97.4	158.6	-70.4	-88.3	0	0	0	107.8	V19 D46 L50	V19-Y48 HydrophobicContact CG2-CD2 3.86Å; V19-Y48 HydrophobicContact CG2-CE2 4.39Å; D46-Y48 PolarHBondContact O-N 3.17Å; Y48-L50 PolarHBondContact O-N 3.19Å; Y48-L50 VanDerWaalsContact O-N 3.13Å
49	L	31.5	Very low	29.3	Very low	136 Å²	136	121.2 Å²	121.2	71%	0.712	57%	0.569	S	S	*	*			trans	-74.5	100	168.7	-165.8	86.3	0	0	0	108.1	Y47 K51	Y47-L49 PolarHBondContact O-N 2.8Å; L49-K51 PolarHBondContact O-N 3.5Å
50	L	30.4	Very low	29.3	Very low	37 Å²	37	127.3 Å²	127.3	19%	0.194	58%	0.575	C	S	.	*			trans	-73.8	118.3	168.6	-83	156.5	0	0	0	109.2	I17 Y48 I80 L88	I17-L50 HydrophobicContact CB-CD1 4.28Å; I17-L50 HydrophobicContact CD1-CD1 3.24Å; I17-L50 HydrophobicContact CG1-CD1 3.78Å; Y48-L50 PolarHBondContact O-N 3.19Å; Y48-L50 VanDerWaalsContact O-N 3.13Å; L50-I80 HydrophobicContact CD2-CD1 3.56Å; L50-L88 HydrophobicContact CD1-CD1 3.89Å; L50-L88 HydrophobicContact CD1-CD2 3.55Å; L50-L88 HydrophobicContact CD1-CG 4.39Å; L50-L88 HydrophobicContact CD2-CD1 4.16Å
51	K	30.9	Very low	29	Very low	149 Å²	149	128.2 Å²	128.2	65%	0.648	60%	0.6	S	S	*	*			trans	-58.9	139.8	-179.4	-163	176.2	171.8	-162.7	0	109.6	L49 M53 D76	L49-K51 PolarHBondContact O-N 3.5Å; K51-M53 PolarHBondContact O-N 3.46Å; K51-D76 IonicContact NZ-OD2 2.85Å; K51-D76 PolarHBondContact NZ-OD2 3.32Å
52	T	28.4	Very low	28.9	Very low	79 Å²	79	127.4 Å²	127.4	49%	0.485	61%	0.613	S	S	.	*			trans	-35.5	124.3	-177.2	33.9	0	0	0	0	115.6	V14	V14-T52 HydrophobicContact CG2-CG2 4.47Å
53	M	30.5	Very low	28.7	Very low	48 Å²	48	129.1 Å²	129.1	24%	0.236	63%	0.627	C	S	.	*			trans	-77.2	131.8	169.1	-57.8	-153.6	-62	0	0	111	I9 I15 K51 F73 F92	I9-M53 HydrophobicContact CD1-CE 4.02Å; I15-M53 HydrophobicContact CD1-CE 3.12Å; I15-M53 HydrophobicContact CD1-CG 3.92Å; I15-M53 HydrophobicContact CD1-SD 3.99Å; K51-M53 PolarHBondContact O-N 3.46Å; M53-F73 HydrophobicContact CB-CE1 4.39Å; M53-F73 HydrophobicContact CE-CD1 4.41Å; M53-F73 HydrophobicContact CE-CE1 3.67Å; M53-F73 HydrophobicContact CE-CZ 4.24Å; M53-F73 HydrophobicContact SD-CD1 3.61Å; M53-F73 HydrophobicContact SD-CE1 3.49Å; M53-F73 WeakPolarHBondContact SD-CE1 3.27Å; M53-F73 HydrophobicContact SD-CZ 4.41Å; M53-F92 HydrophobicContact CE-CD1 4.32Å; M53-F92 HydrophobicContact CE-CE1 3.75Å; M53-F92 HydrophobicContact CE-CZ 3.99Å; M53-F92 HydrophobicContact SD-CE1 4.39Å; M53-F92 HydrophobicContact SD-CE2 4.47Å; M53-F92 HydrophobicContact SD-CZ 4.02Å
54	R	27.6	Very low	28.5	Very low	189 Å²	189	125.9 Å²	125.9	71%	0.713	63%	0.625	S	S	*	*			trans	-112.4	127.8	170.3	-74.7	-176.4	177.7	178.2	1.7	109.6
55	R	30.8	Very low	28.4	Very low	178 Å²	178	124.7 Å²	124.7	67%	0.672	63%	0.627	S	S	*	*			trans	-84	114.9	173.9	-159.8	-179.9	-173.6	-171.8	3.4	109.8
56	Q	28.9	Very low	28.2	Very low	139 Å²	139	130.7 Å²	130.7	65%	0.65	66%	0.657	S	S	*	*			trans	-83.9	126.1	165	-75.8	-168.4	11	0	0	109.9	R58	Q56-R58 PolarHBondContact O-N 2.83Å
57	Q	29.4	Very low	28	Very low	166 Å²	166	132.2 Å²	132.2	78%	0.776	67%	0.665	S	S	*	*			trans	-78.9	98	165.7	-81	-179.2	-21.8	0	0	108.7	H59	Q57-H59 PolarHBondContact O-N 3.4Å; Q57-H59 VanDerWaalsContact O-N 3.11Å
58	R	27.6	Very low	28.2	Very low	197 Å²	197	133.1 Å²	133.1	74%	0.743	67%	0.674	S	S	*	*			trans	-76.3	93.2	160.8	-89.4	-176.4	171.1	174.9	-1.1	109.2	Q56 K60	Q56-R58 PolarHBondContact O-N 2.83Å; R58-K60 VanDerWaalsContact C-N 3.27Å; R58-K60 PolarHBondContact O-N 2.87Å
59	H	25.3	Very low	28.1	Very low	168 Å²	168	130.1 Å²	130.1	78%	0.778	67%	0.668	S	S	*	*			trans	-68.8	88.1	157.5	-84.7	-69.9	0	0	0	108.8	Q57	Q57-H59 PolarHBondContact O-N 3.4Å; Q57-H59 VanDerWaalsContact O-N 3.11Å
60	K	28.5	Very low	28.3	Very low	201 Å²	201	126 Å²	126	87%	0.874	65%	0.649	S	S	*	*			trans	-131.9	117.9	154.9	-102.3	-178.7	178.8	177.5	0	109.5	R58	R58-K60 VanDerWaalsContact C-N 3.27Å; R58-K60 PolarHBondContact O-N 2.87Å
61	A	24.4	Very low	28.2	Very low	110 Å²	110	130.3 Å²	130.3	91%	0.909	67%	0.672	S	S	*	*			trans	-55.9	140.8	-179.6	0	0	0	0	0	111.5
62	G	25.7	Very low	28.2	Very low	73 Å²	73	128.4 Å²	128.4	75%	0.753	67%	0.668	S	S	*	*			trans	147.2	-17.7	148.7	0	0	0	0	0	119.1
63	T	26.5	Very low	28.4	Very low	140 Å²	140	127.4 Å²	127.4	86%	0.859	66%	0.657	S	S	*	*			trans	-142	104.6	-174.5	45.7	0	0	0	0	112.7	N65	T63-N65 PolarHBondContact O-N 2.9Å; T63-N65 VanDerWaalsContact O-N 3.15Å
64	S	25.1	Very low	28.4	Very low	112 Å²	112	133.1 Å²	133.1	78%	0.783	68%	0.684	S	S	*	*			trans	-67.4	99	164.9	55.7	0	0	0	0	109.6
65	N	25.9	Very low	28.7	Very low	148 Å²	148	126 Å²	126	79%	0.791	66%	0.663	S	S	*	*			trans	-153.6	114.2	151.6	-97.1	-17.5	0	0	0	107.9	T63 N67	T63-N65 PolarHBondContact O-N 2.9Å; T63-N65 VanDerWaalsContact O-N 3.15Å; N65-N67 PolarHBondContact O-N 3.14Å
66	N	25.2	Very low	28.8	Very low	146 Å²	146	123 Å²	123	78%	0.781	66%	0.66	S	S	*	*			trans	-74.7	57.5	-175	-72.2	-30.8	0	0	0	112.3
67	N	26	Very low	29	Very low	140 Å²	140	118.6 Å²	118.6	75%	0.749	64%	0.638	S	S	*	*			trans	-101.4	113.2	159.9	-79	-5.5	0	0	0	106.5	N65 N69	N65-N67 PolarHBondContact O-N 3.14Å; N67-N69 PolarHBondContact O-N 3.42Å
68	I	33.1	Very low	29	Very low	92 Å²	92	118.9 Å²	118.9	47%	0.472	65%	0.645	S	S	.	*			trans	-63.2	100.1	160.2	-64.7	170.8	0	0	0	103.9	F6 V70 F73	F6-I68 HydrophobicContact CD1-CD1 4.23Å; F6-I68 HydrophobicContact CE1-CD1 4.08Å; I68-V70 PolarHBondContact O-N 2.76Å; I68-V70 VanDerWaalsContact O-N 3.14Å; I68-F73 HydrophobicContact CG2-CE2 4.39Å
69	N	29	Very low	29.1	Very low	85 Å²	85	113.7 Å²	113.7	46%	0.455	64%	0.638	S	S	.	*			trans	-66	113.4	171.6	-132.8	25.2	0	0	0	105.5	N67 D71 D72	N67-N69 PolarHBondContact O-N 3.42Å; N69-D71 HydrophobicContact CB-CB 4.31Å; N69-D71 VanDerWaalsContact CG-OD2 3.27Å; N69-D71 PolarHBondContact ND2-OD2 3.29Å; N69-D71 PolarHBondContact O-N 3.06Å; N69-D71 VanDerWaalsContact O-N 3.14Å; N69-D71 PolarHBondContact OD1-OD2 2.79Å; N69-D72 PolarHBondContact O-N 3.19Å; N69-D72 VanDerWaalsContact O-N 3.15Å
70	V	35	Very low	29.7	Very low	50 Å²	50	107.5 Å²	107.5	30%	0.303	61%	0.611	S	S	.	*	G	3₁₀ helix	trans	-61.4	-15.8	173.7	-177.7	0	0	0	0	110.2	I68 D72 F73 D89	I68-V70 PolarHBondContact O-N 2.76Å; I68-V70 VanDerWaalsContact O-N 3.14Å; V70-D72 PolarHBondContact O-N 2.86Å; V70-F73 HydrophobicContact CG1-CD2 4.1Å; V70-F73 WeakPolarHBondContact O-CD2 2.84Å; V70-F73 PolarHBondContact O-N 3.2Å; V70-F73 VanDerWaalsContact O-N 3.14Å; V70-D89 WeakPolarHBondContact CG1-OD1 3.34Å
71	D	28.9	Very low	29.9	Very low	127 Å²	127	102 Å²	102	68%	0.679	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-61.2	-17	171.9	-54.1	-19.7	0	0	0	114.6	N69	N69-D71 HydrophobicContact CB-CB 4.31Å; N69-D71 VanDerWaalsContact CG-OD2 3.27Å; N69-D71 PolarHBondContact ND2-OD2 3.29Å; N69-D71 PolarHBondContact O-N 3.06Å; N69-D71 VanDerWaalsContact O-N 3.14Å; N69-D71 PolarHBondContact OD1-OD2 2.79Å
72	D	30.2	Very low	30.5	Very low	108 Å²	108	101.5 Å²	101.5	58%	0.578	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-92.4	7.6	176.2	-82.8	-26.9	0	0	0	113.2	N69 V70 E74	N69-D72 PolarHBondContact O-N 3.19Å; N69-D72 VanDerWaalsContact O-N 3.15Å; V70-D72 PolarHBondContact O-N 2.86Å; D72-E74 PolarHBondContact O-N 2.69Å
73	F	32	Very low	31.1	Very low	58 Å²	58	101.2 Å²	101.2	25%	0.254	56%	0.562	S	S	.	*			trans	-85.3	98	166.5	-72.4	-87.1	0	0	0	109.4	M53 I68 V70 S75 Y77	M53-F73 HydrophobicContact CB-CE1 4.39Å; M53-F73 HydrophobicContact CE-CD1 4.41Å; M53-F73 HydrophobicContact CE-CE1 3.67Å; M53-F73 HydrophobicContact CE-CZ 4.24Å; M53-F73 HydrophobicContact SD-CD1 3.61Å; M53-F73 HydrophobicContact SD-CE1 3.49Å; M53-F73 WeakPolarHBondContact SD-CE1 3.27Å; M53-F73 HydrophobicContact SD-CZ 4.41Å; I68-F73 HydrophobicContact CG2-CE2 4.39Å; V70-F73 HydrophobicContact CG1-CD2 4.1Å; V70-F73 WeakPolarHBondContact O-CD2 2.84Å; V70-F73 PolarHBondContact O-N 3.2Å; V70-F73 VanDerWaalsContact O-N 3.14Å; F73-S75 PolarHBondContact O-N 3.21Å; F73-Y77 HydrophobicContact CB-CE2 3.99Å; F73-Y77 WeakPolarHBondContact O-CE2 3.24Å
74	E	32.1	Very low	31.8	Very low	169 Å²	169	96.8 Å²	96.8	79%	0.79	54%	0.535	S	S	*	.			trans	-67.9	91.3	151.9	-81	176.8	172.6	0	0	106.5	D72	D72-E74 PolarHBondContact O-N 2.69Å
75	S	33.4	Very low	32.6	Very low	38 Å²	38	93 Å²	93	27%	0.266	51%	0.506	S	S	.	.			trans	-89.1	157.7	145.4	107.3	0	0	0	0	108.1	F73 Y77	F73-S75 PolarHBondContact O-N 3.21Å; S75-Y77 VanDerWaalsContact CA-CD2 3.43Å; S75-Y77 WeakPolarHBondContact O-CD2 3.16Å; S75-Y77 PolarHBondContact O-N 3.41Å; S75-Y77 VanDerWaalsContact OG-CA 3.31Å; S75-Y77 WeakPolarHBondContact OG-CA 3.36Å; S75-Y77 WeakPolarHBondContact OG-CB 3.28Å; S75-Y77 WeakPolarHBondContact OG-CD1 3.37Å; S75-Y77 WeakPolarHBondContact OG-CD2 3.24Å; S75-Y77 WeakPolarHBondContact OG-CE1 3.46Å; S75-Y77 WeakPolarHBondContact OG-CE2 3.48Å; S75-Y77 PolarHBondContact OG-N 3.43Å
76	D	32	Very low	33.4	Very low	115 Å²	115	93.9 Å²	93.9	62%	0.615	50%	0.498	S	S	*	.			trans	-63.8	56.8	161.9	-63.1	-32	0	0	0	108.5	K51 D78	K51-D76 IonicContact NZ-OD2 2.85Å; K51-D76 PolarHBondContact NZ-OD2 3.32Å; D76-D78 PolarHBondContact O-N 3.05Å
77	Y	34	Very low	34.5	Very low	48 Å²	48	89.6 Å²	89.6	19%	0.188	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-72.4	-9.8	-164.5	-88.5	-65	0	0	0	112.9	F73 S75 S79 I80 N85	F73-Y77 HydrophobicContact CB-CE2 3.99Å; F73-Y77 WeakPolarHBondContact O-CE2 3.24Å; S75-Y77 VanDerWaalsContact CA-CD2 3.43Å; S75-Y77 WeakPolarHBondContact O-CD2 3.16Å; S75-Y77 PolarHBondContact O-N 3.41Å; S75-Y77 VanDerWaalsContact OG-CA 3.31Å; S75-Y77 WeakPolarHBondContact OG-CA 3.36Å; S75-Y77 WeakPolarHBondContact OG-CB 3.28Å; S75-Y77 WeakPolarHBondContact OG-CD1 3.37Å; S75-Y77 WeakPolarHBondContact OG-CD2 3.24Å; S75-Y77 WeakPolarHBondContact OG-CE1 3.46Å; S75-Y77 WeakPolarHBondContact OG-CE2 3.48Å; S75-Y77 PolarHBondContact OG-N 3.43Å; Y77-S79 PolarHBondContact O-N 3.08Å; Y77-S79 VanDerWaalsContact O-N 3.1Å; Y77-I80 PolarHBondContact O-N 2.84Å; Y77-N85 VanDerWaalsContact CD1-OD1 3.28Å; Y77-N85 WeakPolarHBondContact CD1-OD1 3.38Å
78	D	28.4	Very low	35.6	Very low	172 Å²	172	83.2 Å²	83.2	92%	0.92	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-69	-12.1	-171.4	-65.5	-21.9	0	0	0	113.9	D76	D76-D78 PolarHBondContact O-N 3.05Å
79	S	31.6	Very low	36.4	Very low	87 Å²	87	81.4 Å²	81.4	61%	0.608	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-100.7	-0.1	179.4	60.5	0	0	0	0	114.6	Y77	Y77-S79 PolarHBondContact O-N 3.08Å; Y77-S79 VanDerWaalsContact O-N 3.1Å
80	I	36.2	Very low	37.3	Very low	39 Å²	39	81.8 Å²	81.8	20%	0.2	43%	0.426	C	S	.	.	S	Bend	trans	-110.7	123.8	-175.1	-59.9	174.1	0	0	0	109.9	L50 Y77 T84 N85 L88	L50-I80 HydrophobicContact CD2-CD1 3.56Å; Y77-I80 PolarHBondContact O-N 2.84Å; I80-T84 HydrophobicContact CG2-CG2 3.57Å; I80-N85 VanDerWaalsContact CG2-OD1 3.28Å; I80-N85 WeakPolarHBondContact CG2-OD1 3.43Å; I80-N85 PolarHBondContact O-ND2 3.13Å; I80-L88 HydrophobicContact CD1-CD1 4.46Å; I80-L88 HydrophobicContact CG2-CD1 4.5Å
81	D	33.9	Very low	38.1	Very low	85 Å²	85	79.4 Å²	79.4	46%	0.455	41%	0.412	S	S	.	.			trans	-48.9	133.6	176.2	168.5	73.6	0	0	0	111.7	T83 T84 N85	D81-T83 PolarHBondContact O-N 3.34Å; D81-T83 WeakPolarHBondContact OD2-CA 3.5Å; D81-T83 WeakPolarHBondContact OD2-CB 3.46Å; D81-T83 PolarHBondContact OD2-N 3.41Å; D81-T83 VanDerWaalsContact OD2-N 3.09Å; D81-T83 PolarHBondContact OD2-OG1 2.86Å; D81-T84 WeakPolarHBondContact O-CA 3.44Å; D81-T84 VanDerWaalsContact O-CB 3.27Å; D81-T84 WeakPolarHBondContact O-CB 3.04Å; D81-T84 PolarHBondContact O-N 3.31Å; D81-T84 PolarHBondContact OD2-N 2.93Å; D81-N85 PolarHBondContact O-N 2.96Å; D81-N85 VanDerWaalsContact O-N 3.08Å
82	P	35.6	Very low	39.1	Very low	100 Å²	100	75 Å²	75	65%	0.649	39%	0.386	S	S	*	.	H	α-helix	trans	-54.8	-30.2	-176.2	-27.2	33.3	0	0	0	114.3	N85 R86	P82-N85 PolarHBondContact O-N 2.97Å; P82-R86 PolarHBondContact O-N 2.85Å
83	T	38.2	Very low	40	Very low	66 Å²	66	73.3 Å²	73.3	41%	0.405	38%	0.378	S	S	.	.	H	α-helix	trans	-66.7	-42.2	175.5	-15.8	0	0	0	0	110.6	D81 R86 Y87	D81-T83 PolarHBondContact O-N 3.34Å; D81-T83 WeakPolarHBondContact OD2-CA 3.5Å; D81-T83 WeakPolarHBondContact OD2-CB 3.46Å; D81-T83 PolarHBondContact OD2-N 3.41Å; D81-T83 VanDerWaalsContact OD2-N 3.09Å; D81-T83 PolarHBondContact OD2-OG1 2.86Å; T83-R86 WeakPolarHBondContact O-CB 3.31Å; T83-R86 PolarHBondContact O-N 2.99Å; T83-Y87 HydrophobicContact CG2-CE2 3.73Å; T83-Y87 WeakPolarHBondContact O-CD2 3Å; T83-Y87 WeakPolarHBondContact O-CE2 3.34Å; T83-Y87 VanDerWaalsContact O-CG 3.3Å; T83-Y87 PolarHBondContact O-N 3.26Å; T83-Y87 VanDerWaalsContact O-N 3.14Å
84	T	41.4	Very low	40.6	Very low	47 Å²	47	73.9 Å²	73.9	29%	0.288	38%	0.383	S	S	.	.	H	α-helix	trans	-62.5	-43	174.2	-55.5	0	0	0	0	111	I80 D81 R86 Y87 L88	I80-T84 HydrophobicContact CG2-CG2 3.57Å; D81-T84 WeakPolarHBondContact O-CA 3.44Å; D81-T84 VanDerWaalsContact O-CB 3.27Å; D81-T84 WeakPolarHBondContact O-CB 3.04Å; D81-T84 PolarHBondContact O-N 3.31Å; D81-T84 PolarHBondContact OD2-N 2.93Å; T84-R86 VanDerWaalsContact C-N 3.33Å; T84-R86 PolarHBondContact O-N 2.89Å; T84-Y87 CarbonylContact O-C 3.48Å; T84-Y87 WeakPolarHBondContact O-CA 3.49Å; T84-Y87 WeakPolarHBondContact O-CB 2.86Å; T84-Y87 PolarHBondContact O-N 2.89Å; T84-L88 HydrophobicContact CG2-CD1 4.44Å; T84-L88 HydrophobicContact CG2-CG 4.42Å; T84-L88 VanDerWaalsContact O-CG 3.31Å; T84-L88 WeakPolarHBondContact O-CG 3.46Å; T84-L88 PolarHBondContact O-N 3.44Å
85	N	43.2	Very low	41.2	Very low	33 Å²	33	66.9 Å²	66.9	18%	0.176	35%	0.352	C	S	.	.	H	α-helix	trans	-57.2	-44.5	173.8	-75.6	-21.4	0	0	0	112.4	Y77 I80 D81 P82 Y87 L88 D89	Y77-N85 VanDerWaalsContact CD1-OD1 3.28Å; Y77-N85 WeakPolarHBondContact CD1-OD1 3.38Å; I80-N85 VanDerWaalsContact CG2-OD1 3.28Å; I80-N85 WeakPolarHBondContact CG2-OD1 3.43Å; I80-N85 PolarHBondContact O-ND2 3.13Å; D81-N85 PolarHBondContact O-N 2.96Å; D81-N85 VanDerWaalsContact O-N 3.08Å; P82-N85 PolarHBondContact O-N 2.97Å; N85-Y87 PolarHBondContact O-N 2.95Å; N85-L88 WeakPolarHBondContact O-CB 3.39Å; N85-L88 PolarHBondContact O-N 2.58Å; N85-D89 PolarHBondContact O-N 3.43Å
86	R	42.4	Very low	41.6	Very low	166 Å²	166	69.6 Å²	69.6	63%	0.626	36%	0.363	S	S	*	.	H	α-helix	trans	-62.1	-29.3	175.5	-167.7	178.6	-177.4	-173.9	3	113.3	P82 T83 T84 K90	P82-R86 PolarHBondContact O-N 2.85Å; T83-R86 WeakPolarHBondContact O-CB 3.31Å; T83-R86 PolarHBondContact O-N 2.99Å; T84-R86 VanDerWaalsContact C-N 3.33Å; T84-R86 PolarHBondContact O-N 2.89Å; R86-K90 WeakPolarHBondContact O-CG 3.49Å; R86-K90 PolarHBondContact O-N 3.05Å
87	Y	47.7	Very low	41.7	Very low	56 Å²	56	71 Å²	71	22%	0.22	37%	0.366	C	S	.	.	H	α-helix	trans	-81.1	-34.5	176.9	-62.1	-50	0	0	0	112.5	T83 T84 N85 K90 L91 L108 I110	T83-Y87 HydrophobicContact CG2-CE2 3.73Å; T83-Y87 WeakPolarHBondContact O-CD2 3Å; T83-Y87 WeakPolarHBondContact O-CE2 3.34Å; T83-Y87 VanDerWaalsContact O-CG 3.3Å; T83-Y87 PolarHBondContact O-N 3.26Å; T83-Y87 VanDerWaalsContact O-N 3.14Å; T84-Y87 CarbonylContact O-C 3.48Å; T84-Y87 WeakPolarHBondContact O-CA 3.49Å; T84-Y87 WeakPolarHBondContact O-CB 2.86Å; T84-Y87 PolarHBondContact O-N 2.89Å; N85-Y87 PolarHBondContact O-N 2.95Å; Y87-K90 HydrophobicContact CD1-CD 4.47Å; Y87-K90 PolarHBondContact O-N 3.2Å; Y87-L91 WeakPolarHBondContact O-CB 3.35Å; Y87-L91 WeakPolarHBondContact O-CG 3.09Å; Y87-L91 PolarHBondContact O-N 3.32Å; Y87-L108 HydrophobicContact CD1-CD2 4.34Å; Y87-L108 WeakPolarHBondContact O-CD2 3.43Å; Y87-I110 HydrophobicContact CD1-CD1 3.08Å; Y87-I110 HydrophobicContact CD1-CG1 3.85Å; Y87-I110 HydrophobicContact CD2-CD1 3.76Å; Y87-I110 HydrophobicContact CE1-CD1 3.42Å; Y87-I110 VanDerWaalsContact CE1-CD1 3.42Å; Y87-I110 HydrophobicContact CE1-CG1 3.69Å; Y87-I110 HydrophobicContact CE1-CG2 4.03Å; Y87-I110 HydrophobicContact CE2-CD1 4.09Å; Y87-I110 HydrophobicContact CE2-CG2 4.24Å; Y87-I110 HydrophobicContact CG-CD1 3.28Å; Y87-I110 HydrophobicContact CG-CG1 4.43Å
88	L	49.8	Very low	41.7	Very low	7 Å²	7	71.1 Å²	71.1	4%	0.037	37%	0.374	C	S	.	.	H	α-helix	trans	-60.9	-46.9	169.3	-64.7	178.9	0	0	0	110.5	I17 L50 I80 T84 N85 K90 L91 F92	I17-L88 HydrophobicContact CD1-CD2 3.09Å; L50-L88 HydrophobicContact CD1-CD1 3.89Å; L50-L88 HydrophobicContact CD1-CD2 3.55Å; L50-L88 HydrophobicContact CD1-CG 4.39Å; L50-L88 HydrophobicContact CD2-CD1 4.16Å; I80-L88 HydrophobicContact CD1-CD1 4.46Å; I80-L88 HydrophobicContact CG2-CD1 4.5Å; T84-L88 HydrophobicContact CG2-CD1 4.44Å; T84-L88 HydrophobicContact CG2-CG 4.42Å; T84-L88 VanDerWaalsContact O-CG 3.31Å; T84-L88 WeakPolarHBondContact O-CG 3.46Å; T84-L88 PolarHBondContact O-N 3.44Å; N85-L88 WeakPolarHBondContact O-CB 3.39Å; N85-L88 PolarHBondContact O-N 2.58Å; L88-K90 VanDerWaalsContact C-N 3.27Å; L88-K90 PolarHBondContact O-N 3.31Å; L88-L91 CarbonylContact O-C 3.31Å; L88-L91 WeakPolarHBondContact O-CB 3.41Å; L88-L91 PolarHBondContact O-N 3.1Å; L88-L91 VanDerWaalsContact O-N 3.08Å; L88-F92 HydrophobicContact CB-CD2 4.25Å; L88-F92 HydrophobicContact CB-CE2 4.14Å; L88-F92 WeakPolarHBondContact O-CB 3.47Å; L88-F92 WeakPolarHBondContact O-CD2 3.22Å; L88-F92 WeakPolarHBondContact O-CG 3.38Å; L88-F92 PolarHBondContact O-N 2.99Å
89	D	49.6	Very low	41.7	Very low	53 Å²	53	71.1 Å²	71.1	28%	0.283	36%	0.362	S	S	.	.	H	α-helix	trans	-60.5	-38.5	176.5	-68.5	-15.1	0	0	0	112.2	V70 N85 N93	V70-D89 WeakPolarHBondContact CG1-OD1 3.34Å; N85-D89 PolarHBondContact O-N 3.43Å; D89-N93 VanDerWaalsContact O-CB 3.24Å; D89-N93 WeakPolarHBondContact O-CB 3.42Å; D89-N93 PolarHBondContact O-N 3.28Å; D89-N93 PolarHBondContact O-ND2 2.79Å
90	K	48.6	Very low	41.6	Very low	94 Å²	94	75 Å²	75	41%	0.409	37%	0.37	S	S	.	.	H	α-helix	trans	-66	-42.6	173.4	-78	178.1	179.6	-179.4	0	112	R86 Y87 L88 N93 L94 L108	R86-K90 WeakPolarHBondContact O-CG 3.49Å; R86-K90 PolarHBondContact O-N 3.05Å; Y87-K90 HydrophobicContact CD1-CD 4.47Å; Y87-K90 PolarHBondContact O-N 3.2Å; L88-K90 VanDerWaalsContact C-N 3.27Å; L88-K90 PolarHBondContact O-N 3.31Å; K90-N93 PolarHBondContact O-N 3.12Å; K90-L94 WeakPolarHBondContact O-CB 3.47Å; K90-L94 WeakPolarHBondContact O-CG 3.45Å; K90-L94 PolarHBondContact O-N 3.03Å; K90-L108 HydrophobicContact CB-CD2 3.96Å
91	L	50.6	Low	41.5	Very low	0 Å²	0	77.3 Å²	77.3	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-63.2	-43.4	175.8	-81.4	159.5	0	0	0	111.8	I17 Y87 L88 L94 T95 L108 Y115 L117	I17-L91 HydrophobicContact CD1-CD1 4.42Å; Y87-L91 WeakPolarHBondContact O-CB 3.35Å; Y87-L91 WeakPolarHBondContact O-CG 3.09Å; Y87-L91 PolarHBondContact O-N 3.32Å; L88-L91 CarbonylContact O-C 3.31Å; L88-L91 WeakPolarHBondContact O-CB 3.41Å; L88-L91 PolarHBondContact O-N 3.1Å; L88-L91 VanDerWaalsContact O-N 3.08Å; L91-L94 WeakPolarHBondContact O-CB 3.35Å; L91-L94 PolarHBondContact O-N 3.01Å; L91-T95 PolarHBondContact O-N 3.14Å; L91-T95 PolarHBondContact O-OG1 3.25Å; L91-L108 HydrophobicContact CD1-CB 4.4Å; L91-L108 HydrophobicContact CD1-CD2 4.26Å; L91-L108 HydrophobicContact CD2-CB 3.39Å; L91-L108 HydrophobicContact CD2-CD2 4.4Å; L91-L108 HydrophobicContact CG-CB 3.74Å; L91-L108 HydrophobicContact CG-CD2 3.77Å; L91-L108 HydrophobicContact CG-CG 4.41Å; L91-Y115 HydrophobicContact CD1-CD1 4.47Å; L91-Y115 HydrophobicContact CD1-CG 4.27Å; L91-L117 HydrophobicContact CD2-CB 4.33Å
92	F	51.1	Low	41.6	Very low	34 Å²	34	78 Å²	78	15%	0.149	40%	0.395	C	S	.	.	H	α-helix	trans	-66.7	-38	176.3	-74.8	-58.1	0	0	0	112.1	I15 M53 L88 L94 T95 N96 L117	I15-F92 HydrophobicContact CD1-CE1 3.6Å; I15-F92 HydrophobicContact CD1-CZ 3.98Å; I15-F92 HydrophobicContact CG1-CE1 4.18Å; I15-F92 HydrophobicContact CG2-CE1 3.97Å; I15-F92 HydrophobicContact CG2-CZ 3.98Å; M53-F92 HydrophobicContact CE-CD1 4.32Å; M53-F92 HydrophobicContact CE-CE1 3.75Å; M53-F92 HydrophobicContact CE-CZ 3.99Å; M53-F92 HydrophobicContact SD-CE1 4.39Å; M53-F92 HydrophobicContact SD-CE2 4.47Å; M53-F92 HydrophobicContact SD-CZ 4.02Å; L88-F92 HydrophobicContact CB-CD2 4.25Å; L88-F92 HydrophobicContact CB-CE2 4.14Å; L88-F92 WeakPolarHBondContact O-CB 3.47Å; L88-F92 WeakPolarHBondContact O-CD2 3.22Å; L88-F92 WeakPolarHBondContact O-CG 3.38Å; L88-F92 PolarHBondContact O-N 2.99Å; F92-L94 VanDerWaalsContact C-N 3.34Å; F92-T95 VanDerWaalsContact C-OG1 3.24Å; F92-T95 VanDerWaalsContact CA-OG1 3.24Å; F92-T95 WeakPolarHBondContact CA-OG1 3.48Å; F92-T95 PolarHBondContact O-N 2.87Å; F92-T95 PolarHBondContact O-OG1 3.06Å; F92-N96 VanDerWaalsContact O-CG 3.22Å; F92-N96 PolarHBondContact O-N 3.33Å; F92-N96 PolarHBondContact O-ND2 3.22Å; F92-L117 HydrophobicContact CD1-CD1 4.34Å; F92-L117 HydrophobicContact CD1-CD2 4.37Å; F92-L117 HydrophobicContact CE1-CD1 3.85Å; F92-L117 HydrophobicContact CE1-CD2 4.42Å; F92-L117 HydrophobicContact CZ-CD1 4.16Å
93	N	47.7	Very low	41.8	Very low	73 Å²	73	76.5 Å²	76.5	39%	0.39	38%	0.381	S	S	.	.	H	α-helix	trans	-67.3	-34.4	171.4	-76.5	-36.6	0	0	0	112.5	D89 K90 N96 H97	D89-N93 VanDerWaalsContact O-CB 3.24Å; D89-N93 WeakPolarHBondContact O-CB 3.42Å; D89-N93 PolarHBondContact O-N 3.28Å; D89-N93 PolarHBondContact O-ND2 2.79Å; K90-N93 PolarHBondContact O-N 3.12Å; N93-N96 WeakPolarHBondContact O-CB 3.48Å; N93-N96 PolarHBondContact O-N 2.64Å; N93-N96 VanDerWaalsContact O-N 3.16Å; N93-H97 PolarHBondContact O-CD2 3.42Å; N93-H97 PolarHBondContact O-N 3.07Å
94	L	44.4	Very low	42	Very low	70 Å²	70	79.1 Å²	79.1	37%	0.366	39%	0.388	S	S	.	.	H	α-helix	trans	-65.1	-38.5	172.9	-74.3	166.2	0	0	0	111.5	K90 L91 F92 N96 H97 S98 P106 L108	K90-L94 WeakPolarHBondContact O-CB 3.47Å; K90-L94 WeakPolarHBondContact O-CG 3.45Å; K90-L94 PolarHBondContact O-N 3.03Å; L91-L94 WeakPolarHBondContact O-CB 3.35Å; L91-L94 PolarHBondContact O-N 3.01Å; F92-L94 VanDerWaalsContact C-N 3.34Å; L94-N96 VanDerWaalsContact C-N 3.29Å; L94-N96 PolarHBondContact O-N 3Å; L94-H97 CarbonylContact O-C 3.58Å; L94-H97 PolarHBondContact O-N 3.28Å; L94-H97 VanDerWaalsContact O-N 3.11Å; L94-S98 PolarHBondContact O-N 2.91Å; L94-P106 HydrophobicContact CB-CB 4.44Å; L94-L108 HydrophobicContact CD1-CB 4.3Å; L94-L108 HydrophobicContact CD1-CD1 4.12Å
95	T	45.8	Very low	42.5	Very low	22 Å²	22	78.6 Å²	78.6	14%	0.135	38%	0.384	C	S	.	.	H	α-helix	trans	-64	-32.8	169.9	31.1	0	0	0	0	113.9	L91 F92 H97 S98 P106 L117 M119	L91-T95 PolarHBondContact O-N 3.14Å; L91-T95 PolarHBondContact O-OG1 3.25Å; F92-T95 VanDerWaalsContact C-OG1 3.24Å; F92-T95 VanDerWaalsContact CA-OG1 3.24Å; F92-T95 WeakPolarHBondContact CA-OG1 3.48Å; F92-T95 PolarHBondContact O-N 2.87Å; F92-T95 PolarHBondContact O-OG1 3.06Å; T95-H97 PolarHBondContact O-N 3.37Å; T95-S98 PolarHBondContact O-OG 3.18Å; T95-P106 HydrophobicContact CG2-CB 4.35Å; T95-P106 HydrophobicContact CG2-CG 3.38Å; T95-L117 HydrophobicContact CG2-CD2 3.15Å; T95-M119 HydrophobicContact CG2-CE 4.42Å; T95-M119 HydrophobicContact CG2-SD 4.18Å
96	N	41.2	Very low	42.6	Very low	95 Å²	95	78 Å²	78	51%	0.508	38%	0.382	S	S	.	.	H	α-helix	trans	-69.1	-14.3	175.9	-67.3	-27.5	0	0	0	112.4	F92 N93 L94	F92-N96 VanDerWaalsContact O-CG 3.22Å; F92-N96 PolarHBondContact O-N 3.33Å; F92-N96 PolarHBondContact O-ND2 3.22Å; N93-N96 WeakPolarHBondContact O-CB 3.48Å; N93-N96 PolarHBondContact O-N 2.64Å; N93-N96 VanDerWaalsContact O-N 3.16Å; L94-N96 VanDerWaalsContact C-N 3.29Å; L94-N96 PolarHBondContact O-N 3Å
97	H	35.2	Very low	43	Very low	143 Å²	143	73.3 Å²	73.3	66%	0.662	37%	0.371	S	S	*	.	H	α-helix	trans	-114.2	-14.5	-179.9	-65.8	-46.7	0	0	0	114.3	N93 L94 T95 Y99	N93-H97 PolarHBondContact O-CD2 3.42Å; N93-H97 PolarHBondContact O-N 3.07Å; L94-H97 CarbonylContact O-C 3.58Å; L94-H97 PolarHBondContact O-N 3.28Å; L94-H97 VanDerWaalsContact O-N 3.11Å; T95-H97 PolarHBondContact O-N 3.37Å; H97-Y99 VanDerWaalsContact C-N 3.29Å; H97-Y99 PolarHBondContact O-N 2.87Å
98	S	32.3	Very low	42.8	Very low	52 Å²	52	71.9 Å²	71.9	36%	0.364	37%	0.367	S	S	.	.			trans	-76.3	84.2	173.5	64.3	0	0	0	0	110	L94 T95 H100	L94-S98 PolarHBondContact O-N 2.91Å; T95-S98 PolarHBondContact O-OG 3.18Å; S98-H100 PolarHBondContact O-N 3.08Å
99	Y	28.3	Very low	42.6	Very low	171 Å²	171	75.3 Å²	75.3	67%	0.671	39%	0.389	S	S	*	.			trans	-48.9	122.9	167.5	-101.9	-108.1	0	0	0	111.2	H97 D101	H97-Y99 VanDerWaalsContact C-N 3.29Å; H97-Y99 PolarHBondContact O-N 2.87Å; Y99-D101 VanDerWaalsContact C-N 3.26Å; Y99-D101 PolarHBondContact O-N 2.81Å
100	H	30.9	Very low	42	Very low	169 Å²	169	74.6 Å²	74.6	78%	0.782	38%	0.384	S	S	*	.	S	Bend	trans	57.5	0.1	141.3	-81.2	-64	0	0	0	121.9	S98	S98-H100 PolarHBondContact O-N 3.08Å
101	D	32.8	Very low	41.8	Very low	87 Å²	87	72.8 Å²	72.8	47%	0.465	39%	0.393	S	S	.	.			trans	-98.9	110.3	170.6	-100	-30.7	0	0	0	110.7	Y99 D103 H104	Y99-D101 VanDerWaalsContact C-N 3.26Å; Y99-D101 PolarHBondContact O-N 2.81Å; D101-D103 PolarHBondContact O-N 2.56Å; D101-H104 HydrophobicContact CB-CB 3.86Å; D101-H104 WeakPolarHBondContact CB-ND1 3.5Å; D101-H104 PolarHBondContact O-N 3.34Å; D101-H104 IonicContact OD2-CE1 2.76Å; D101-H104 PolarHBondContact OD2-CE1 2.81Å; D101-H104 IonicContact OD2-ND1 3.01Å; D101-H104 PolarHBondContact OD2-ND1 3.09Å
102	S	37.2	Very low	41.5	Very low	101 Å²	101	76.9 Å²	76.9	71%	0.706	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-16	163.8	47.9	0	0	0	0	113
103	D	39.1	Very low	41.1	Very low	67 Å²	67	80.2 Å²	80.2	36%	0.358	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-11.2	-171.3	-57.3	-5.5	0	0	0	111.6	D101	D101-D103 PolarHBondContact O-N 2.56Å
104	H	43.4	Very low	41	Very low	121 Å²	121	77 Å²	77	56%	0.56	41%	0.409	S	S	*	.			trans	-99.2	101.7	180	-77.8	78.1	0	0	0	111.1	D101 P106	D101-H104 HydrophobicContact CB-CB 3.86Å; D101-H104 WeakPolarHBondContact CB-ND1 3.5Å; D101-H104 PolarHBondContact O-N 3.34Å; D101-H104 IonicContact OD2-CE1 2.76Å; D101-H104 PolarHBondContact OD2-CE1 2.81Å; D101-H104 IonicContact OD2-ND1 3.01Å; D101-H104 PolarHBondContact OD2-ND1 3.09Å; H104-P106 WeakPolarHBondContact O-CD 3.22Å
105	I	50.7	Low	41.2	Very low	36 Å²	36	75.3 Å²	75.3	19%	0.185	40%	0.398	C	S	.	.			trans	-77.5	117.4	170.5	-60.4	167.6	0	0	0	108.3	I35 T107 R116 L118	I35-I105 HydrophobicContact CG1-CD1 4.28Å; I105-T107 PolarHBondContact O-N 3.5Å; I105-T107 VanDerWaalsContact O-N 3.16Å; I105-R116 HydrophobicContact CG2-CB 3.93Å; I105-R116 HydrophobicContact CG2-CG 3.99Å; I105-L118 HydrophobicContact CD1-CD2 3.85Å; I105-L118 HydrophobicContact CG1-CD2 4.05Å; I105-L118 HydrophobicContact CG2-CD2 4.27Å
106	P	46.9	Very low	41.4	Very low	22 Å²	22	74.8 Å²	74.8	14%	0.143	39%	0.394	C	S	.	.			trans	-60	121.6	175.4	1.4	0.8	0	0	0	110.1	L94 T95 H104 R116 L117	L94-P106 HydrophobicContact CB-CB 4.44Å; T95-P106 HydrophobicContact CG2-CB 4.35Å; T95-P106 HydrophobicContact CG2-CG 3.38Å; H104-P106 WeakPolarHBondContact O-CD 3.22Å; P106-R116 WeakPolarHBondContact O-CA 3.47Å; P106-L117 WeakPolarHBondContact CD-O 3.33Å; P106-L117 HydrophobicContact CG-CB 4.32Å; P106-L117 HydrophobicContact CG-CD2 4.45Å; P106-L117 PolarHBondContact O-N 2.85Å; P106-L117 VanDerWaalsContact O-N 3.07Å
107	T	49.2	Very low	42	Very low	66 Å²	66	70.3 Å²	70.3	41%	0.405	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	136.8	176.4	49.7	0	0	0	0	109.5	I105 T114 Y115 R116	I105-T107 PolarHBondContact O-N 3.5Å; I105-T107 VanDerWaalsContact O-N 3.16Å; T107-T114 HydrophobicContact CG2-CG2 4.43Å; T107-Y115 CarbonylContact C-O 3.57Å; T107-Y115 VanDerWaalsContact CA-O 3.26Å; T107-Y115 WeakPolarHBondContact CA-O 2.94Å; T107-R116 HydrophobicContact CG2-CG 3.57Å
108	L	45.1	Very low	42.7	Very low	26 Å²	26	64.2 Å²	64.2	14%	0.136	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	118.3	169.7	179.5	64.2	0	0	0	108.4	Y87 K90 L91 L94 I110 T114 Y115	Y87-L108 HydrophobicContact CD1-CD2 4.34Å; Y87-L108 WeakPolarHBondContact O-CD2 3.43Å; K90-L108 HydrophobicContact CB-CD2 3.96Å; L91-L108 HydrophobicContact CD1-CB 4.4Å; L91-L108 HydrophobicContact CD1-CD2 4.26Å; L91-L108 HydrophobicContact CD2-CB 3.39Å; L91-L108 HydrophobicContact CD2-CD2 4.4Å; L91-L108 HydrophobicContact CG-CB 3.74Å; L91-L108 HydrophobicContact CG-CD2 3.77Å; L91-L108 HydrophobicContact CG-CG 4.41Å; L94-L108 HydrophobicContact CD1-CB 4.3Å; L94-L108 HydrophobicContact CD1-CD1 4.12Å; L108-I110 HydrophobicContact CD2-CD1 3.66Å; L108-I110 HydrophobicContact CD2-CG1 4.42Å; L108-I110 HydrophobicContact CG-CD1 3.8Å; L108-I110 HydrophobicContact CG-CG1 4.14Å; L108-T114 CarbonylContact O-C 3.6Å; L108-Y115 PolarHBondContact N-O 3.39Å; L108-Y115 WeakPolarHBondContact O-CD2 3.27Å; L108-Y115 PolarHBondContact O-N 3.11Å
109	T	44.4	Very low	43.4	Very low	79 Å²	79	66.9 Å²	66.9	49%	0.485	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.7	176.2	-56.1	0	0	0	0	110.2	W113 T114	T109-W113 CarbonylContact C-O 3.59Å; T109-W113 VanDerWaalsContact CA-O 3.26Å; T109-W113 WeakPolarHBondContact CA-O 3.5Å; T109-W113 WeakPolarHBondContact CG2-O 3.26Å; T109-T114 PolarHBondContact OG1-OG1 3.44Å; T109-T114 VanDerWaalsContact OG1-OG1 3.12Å
110	I	37.3	Very low	44.2	Very low	38 Å²	38	60.7 Å²	60.7	20%	0.195	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	116	177.1	-62.1	141.7	0	0	0	108.2	Y87 L108 N112 W113 Y115	Y87-I110 HydrophobicContact CD1-CD1 3.08Å; Y87-I110 HydrophobicContact CD1-CG1 3.85Å; Y87-I110 HydrophobicContact CD2-CD1 3.76Å; Y87-I110 HydrophobicContact CE1-CD1 3.42Å; Y87-I110 VanDerWaalsContact CE1-CD1 3.42Å; Y87-I110 HydrophobicContact CE1-CG1 3.69Å; Y87-I110 HydrophobicContact CE1-CG2 4.03Å; Y87-I110 HydrophobicContact CE2-CD1 4.09Å; Y87-I110 HydrophobicContact CE2-CG2 4.24Å; Y87-I110 HydrophobicContact CG-CD1 3.28Å; Y87-I110 HydrophobicContact CG-CG1 4.43Å; L108-I110 HydrophobicContact CD2-CD1 3.66Å; L108-I110 HydrophobicContact CD2-CG1 4.42Å; L108-I110 HydrophobicContact CG-CD1 3.8Å; L108-I110 HydrophobicContact CG-CG1 4.14Å; I110-N112 PolarHBondContact O-N 2.73Å; I110-N112 VanDerWaalsContact O-N 3.16Å; I110-W113 PolarHBondContact N-O 3.4Å; I110-W113 PolarHBondContact O-N 3.23Å; I110-Y115 HydrophobicContact CB-CE2 4.24Å; I110-Y115 HydrophobicContact CD1-CD2 3.89Å; I110-Y115 HydrophobicContact CD1-CE2 3.64Å
111	G	45.1	Very low	44.5	Very low	56 Å²	56	54.6 Å²	54.6	58%	0.577	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	-116.6	-177.8	0	0	0	0	0	112	K22	K22-G111 WeakPolarHBondContact CD-O 3.43Å; K22-G111 PolarHBondContact NZ-O 3.42Å
112	N	42.8	Very low	44.6	Very low	87 Å²	87	56.1 Å²	56.1	47%	0.465	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	14.4	175.4	-74.5	-2.9	0	0	0	112.9	E21 K22 I110	E21-N112 CarbonylContact C-O 3.58Å; E21-N112 WeakPolarHBondContact CA-O 3.11Å; K22-N112 HydrophobicContact CB-CB 4.17Å; K22-N112 VanDerWaalsContact CB-O 3.27Å; K22-N112 WeakPolarHBondContact CB-O 3.26Å; K22-N112 PolarHBondContact N-O 3.11Å; I110-N112 PolarHBondContact O-N 2.73Å; I110-N112 VanDerWaalsContact O-N 3.16Å
113	W	43.3	Very low	44.4	Very low	104 Å²	104	56.1 Å²	56.1	39%	0.394	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.4	-177.5	-58.7	101.6	0	0	0	111	V19 Y20 E21 T109 I110 Y115	V19-W113 HydrophobicContact CG1-CB 4.29Å; V19-W113 HydrophobicContact CG1-CD2 4.4Å; V19-W113 HydrophobicContact CG1-CE3 3.79Å; Y20-W113 CarbonylContact O-C 3.44Å; Y20-W113 VanDerWaalsContact O-CA 3.24Å; Y20-W113 WeakPolarHBondContact O-CA 3.34Å; E21-W113 HydrophobicContact CB-CE3 4.12Å; E21-W113 HydrophobicContact CB-CH2 4.35Å; E21-W113 HydrophobicContact CB-CZ3 3.81Å; E21-W113 HydrophobicContact CG-CH2 4.39Å; E21-W113 HydrophobicContact CG-CZ3 4.26Å; T109-W113 CarbonylContact C-O 3.59Å; T109-W113 VanDerWaalsContact CA-O 3.26Å; T109-W113 WeakPolarHBondContact CA-O 3.5Å; T109-W113 WeakPolarHBondContact CG2-O 3.26Å; I110-W113 PolarHBondContact N-O 3.4Å; I110-W113 PolarHBondContact O-N 3.23Å; W113-Y115 HydrophobicContact CB-CD2 4.45Å; W113-Y115 HydrophobicContact CB-CE2 3.73Å
114	T	45.8	Very low	44.2	Very low	5 Å²	5	60.6 Å²	60.6	3%	0.031	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	119.2	172.5	-63.3	0	0	0	0	108.5	V19 Y20 F25 T107 L108 T109	V19-T114 CarbonylContact C-O 3.48Å; V19-T114 WeakPolarHBondContact CA-O 2.86Å; Y20-T114 WeakPolarHBondContact CD2-O 3.49Å; Y20-T114 PolarHBondContact N-O 3.14Å; Y20-T114 PolarHBondContact O-N 3.2Å; F25-T114 HydrophobicContact CD2-CG2 4.26Å; F25-T114 HydrophobicContact CE2-CG2 3.8Å; F25-T114 HydrophobicContact CZ-CG2 3.96Å; T107-T114 HydrophobicContact CG2-CG2 4.43Å; L108-T114 CarbonylContact O-C 3.6Å; T109-T114 PolarHBondContact OG1-OG1 3.44Å; T109-T114 VanDerWaalsContact OG1-OG1 3.12Å
115	Y	49	Very low	43.6	Very low	34 Å²	34	59 Å²	59	13%	0.133	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127.3	178.1	-59.8	-104.3	0	0	0	108.4	I17 T18 V19 L91 T107 L108 I110 W113	I17-Y115 HydrophobicContact CG2-CD1 4.33Å; T18-Y115 CarbonylContact O-C 3.45Å; T18-Y115 WeakPolarHBondContact O-CA 3.24Å; V19-Y115 HydrophobicContact CB-CD1 4.47Å; V19-Y115 HydrophobicContact CG1-CD1 4.19Å; V19-Y115 HydrophobicContact CG1-CE1 3.96Å; V19-Y115 HydrophobicContact CG2-CD1 3.62Å; V19-Y115 HydrophobicContact CG2-CE1 3.76Å; V19-Y115 HydrophobicContact CG2-CG 4.5Å; L91-Y115 HydrophobicContact CD1-CD1 4.47Å; L91-Y115 HydrophobicContact CD1-CG 4.27Å; T107-Y115 CarbonylContact C-O 3.57Å; T107-Y115 VanDerWaalsContact CA-O 3.26Å; T107-Y115 WeakPolarHBondContact CA-O 2.94Å; L108-Y115 PolarHBondContact N-O 3.39Å; L108-Y115 WeakPolarHBondContact O-CD2 3.27Å; L108-Y115 PolarHBondContact O-N 3.11Å; I110-Y115 HydrophobicContact CB-CE2 4.24Å; I110-Y115 HydrophobicContact CD1-CD2 3.89Å; I110-Y115 HydrophobicContact CD1-CE2 3.64Å; W113-Y115 HydrophobicContact CB-CD2 4.45Å; W113-Y115 HydrophobicContact CB-CE2 3.73Å
116	R	50.1	Low	42.6	Very low	11 Å²	11	63.7 Å²	63.7	4%	0.042	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.7	172	-80.5	-171.9	168.6	-168.3	-6.1	109.3	I17 T18 Y20 C31 I105 P106 T107	I17-R116 WeakPolarHBondContact CA-O 3.08Å; T18-R116 PolarHBondContact N-O 3.26Å; T18-R116 PolarHBondContact O-N 3.07Å; Y20-R116 HydrophobicContact CD2-CG 4.39Å; Y20-R116 HydrophobicContact CE2-CB 4.05Å; Y20-R116 HydrophobicContact CE2-CG 3.85Å; C31-R116 PolarHBondContact O-NH1 3.11Å; C31-R116 VanDerWaalsContact O-NH1 3.13Å; C31-R116 PolarHBondContact O-NH2 3.25Å; I105-R116 HydrophobicContact CG2-CB 3.93Å; I105-R116 HydrophobicContact CG2-CG 3.99Å; P106-R116 WeakPolarHBondContact O-CA 3.47Å; T107-R116 HydrophobicContact CG2-CG 3.57Å
117	L	52.5	Low	41.6	Very low	2 Å²	2	70.7 Å²	70.7	1%	0.01	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	116	173	-170.7	97.9	0	0	0	109.3	I15 I17 L91 F92 T95 P106 M119	I15-L117 HydrophobicContact CG2-CD1 3.35Å; I15-L117 HydrophobicContact CG2-CG 4.07Å; I17-L117 HydrophobicContact CD1-CD1 3.62Å; I17-L117 HydrophobicContact CG1-CD1 3.68Å; L91-L117 HydrophobicContact CD2-CB 4.33Å; F92-L117 HydrophobicContact CD1-CD1 4.34Å; F92-L117 HydrophobicContact CD1-CD2 4.37Å; F92-L117 HydrophobicContact CE1-CD1 3.85Å; F92-L117 HydrophobicContact CE1-CD2 4.42Å; F92-L117 HydrophobicContact CZ-CD1 4.16Å; T95-L117 HydrophobicContact CG2-CD2 3.15Å; P106-L117 WeakPolarHBondContact CD-O 3.33Å; P106-L117 HydrophobicContact CG-CB 4.32Å; P106-L117 HydrophobicContact CG-CD2 4.45Å; P106-L117 PolarHBondContact O-N 2.85Å; P106-L117 VanDerWaalsContact O-N 3.07Å; L117-M119 HydrophobicContact CD2-CG 4.25Å
118	L	49.6	Very low	40.7	Very low	14 Å²	14	76.4 Å²	76.4	7%	0.073	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	115.7	173.5	-74.4	161.1	0	0	0	108.4	Q16 I35 F40 I105 I120	Q16-L118 HydrophobicContact CB-CB 4.12Å; Q16-L118 PolarHBondContact N-O 3.24Å; Q16-L118 PolarHBondContact O-N 3.3Å; I35-L118 HydrophobicContact CD1-CD2 4.35Å; I35-L118 HydrophobicContact CG1-CD2 4.23Å; F40-L118 HydrophobicContact CZ-CD1 4.05Å; I105-L118 HydrophobicContact CD1-CD2 3.85Å; I105-L118 HydrophobicContact CG1-CD2 4.05Å; I105-L118 HydrophobicContact CG2-CD2 4.27Å; L118-I120 HydrophobicContact CB-CG1 4.28Å
119	M	48.9	Very low	39.8	Very low	108 Å²	108	80.5 Å²	80.5	53%	0.532	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	113.3	169	-63.6	-168.7	-54.8	0	0	108.4	T95 L117	T95-M119 HydrophobicContact CG2-CE 4.42Å; T95-M119 HydrophobicContact CG2-SD 4.18Å; L117-M119 HydrophobicContact CD2-CG 4.25Å
120	I	43.7	Very low	39.1	Very low	42 Å²	42	83.4 Å²	83.4	22%	0.215	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	126.9	-177	-47.7	174.4	0	0	0	108.5	Q13 V14 Q16 L118 R122 L125	Q13-I120 WeakPolarHBondContact CA-O 3.21Å; V14-I120 PolarHBondContact N-O 2.76Å; V14-I120 PolarHBondContact O-N 3.16Å; Q16-I120 HydrophobicContact CB-CD1 4.02Å; Q16-I120 VanDerWaalsContact OE1-CD1 3.27Å; L118-I120 HydrophobicContact CB-CG1 4.28Å; I120-R122 PolarHBondContact O-N 3.31Å; I120-L125 HydrophobicContact CB-CD1 3.71Å; I120-L125 HydrophobicContact CB-CG 4.35Å; I120-L125 HydrophobicContact CD1-CD1 4.39Å; I120-L125 HydrophobicContact CG2-CD1 3.37Å; I120-L125 HydrophobicContact CG2-CD2 4.36Å; I120-L125 HydrophobicContact CG2-CG 3.47Å; I120-L125 VanDerWaalsContact CG2-CG 3.47Å
121	D	38	Very low	38.6	Very low	41 Å²	41	88.9 Å²	88.9	22%	0.219	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	119.5	168.5	-178	-1.2	0	0	0	108.5	N123 K124 L125	D121-N123 PolarHBondContact O-N 2.98Å; D121-N123 WeakPolarHBondContact OD1-CB 3.4Å; D121-N123 PolarHBondContact OD1-N 3.19Å; D121-N123 PolarHBondContact OD1-ND2 3.39Å; D121-K124 HydrophobicContact CB-CB 4.09Å; D121-K124 HydrophobicContact CB-CD 4.03Å; D121-K124 HydrophobicContact CB-CG 3.86Å; D121-K124 CarbonylContact O-C 3.6Å; D121-K124 WeakPolarHBondContact O-CA 3.43Å; D121-K124 WeakPolarHBondContact O-CB 3.13Å; D121-K124 PolarHBondContact O-N 2.85Å; D121-L125 PolarHBondContact O-N 3.29Å
122	R	34.2	Very low	37.9	Very low	119 Å²	119	92 Å²	92	45%	0.449	44%	0.435	S	S	.	.	H	α-helix	trans	-54.1	-34.8	175.1	-169.4	179.6	171.3	-171.5	-3.1	110.2	S12 V14 I120 K124 L125 F126	S12-R122 VanDerWaalsContact C-CB 3.47Å; S12-R122 WeakPolarHBondContact O-CA 3.39Å; S12-R122 WeakPolarHBondContact O-CB 3.44Å; S12-R122 PolarHBondContact O-N 3.32Å; V14-R122 HydrophobicContact CG2-CB 4.17Å; V14-R122 HydrophobicContact CG2-CG 4.24Å; I120-R122 PolarHBondContact O-N 3.31Å; R122-K124 VanDerWaalsContact C-N 3.27Å; R122-K124 PolarHBondContact O-N 3.25Å; R122-L125 PolarHBondContact O-N 3.33Å; R122-F126 HydrophobicContact CG-CD2 3.66Å; R122-F126 HydrophobicContact CG-CE2 3.6Å; R122-F126 WeakPolarHBondContact O-CD2 3.03Å; R122-F126 PolarHBondContact O-N 3.44Å
123	N	33	Very low	37.3	Very low	101 Å²	101	96 Å²	96	54%	0.54	45%	0.451	S	S	.	.	H	α-helix	trans	-70.6	-23.4	176.4	-57.7	-37.6	0	0	0	112.8	S12 D121 F126	S12-N123 PolarHBondContact OG-ND2 3.28Å; D121-N123 PolarHBondContact O-N 2.98Å; D121-N123 WeakPolarHBondContact OD1-CB 3.4Å; D121-N123 PolarHBondContact OD1-N 3.19Å; D121-N123 PolarHBondContact OD1-ND2 3.39Å; N123-F126 CarbonylContact O-C 3.55Å; N123-F126 VanDerWaalsContact O-C 3.31Å
124	K	35.6	Very low	36.9	Very low	161 Å²	161	98.3 Å²	98.3	70%	0.7	47%	0.47	S	S	*	.	H	α-helix	trans	-82.8	-33.9	171.5	-66.9	-175.7	-178.8	-175.4	0	112.4	D121 R122 F126	D121-K124 HydrophobicContact CB-CB 4.09Å; D121-K124 HydrophobicContact CB-CD 4.03Å; D121-K124 HydrophobicContact CB-CG 3.86Å; D121-K124 CarbonylContact O-C 3.6Å; D121-K124 WeakPolarHBondContact O-CA 3.43Å; D121-K124 WeakPolarHBondContact O-CB 3.13Å; D121-K124 PolarHBondContact O-N 2.85Å; R122-K124 VanDerWaalsContact C-N 3.27Å; R122-K124 PolarHBondContact O-N 3.25Å; K124-F126 VanDerWaalsContact C-N 3.28Å
125	L	31.1	Very low	36.3	Very low	88 Å²	88	104.6 Å²	104.6	46%	0.461	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-36.2	170.8	-89.6	152.5	0	0	0	112.2	V14 I120 D121 R122	V14-L125 HydrophobicContact CB-CD1 3.83Å; V14-L125 HydrophobicContact CG1-CD1 4.31Å; V14-L125 HydrophobicContact CG2-CD1 3.88Å; I120-L125 HydrophobicContact CB-CD1 3.71Å; I120-L125 HydrophobicContact CB-CG 4.35Å; I120-L125 HydrophobicContact CD1-CD1 4.39Å; I120-L125 HydrophobicContact CG2-CD1 3.37Å; I120-L125 HydrophobicContact CG2-CD2 4.36Å; I120-L125 HydrophobicContact CG2-CG 3.47Å; I120-L125 VanDerWaalsContact CG2-CG 3.47Å; D121-L125 PolarHBondContact O-N 3.29Å; R122-L125 PolarHBondContact O-N 3.33Å
126	F	28.6	Very low	35.4	Very low	134 Å²	134	106.8 Å²	106.8	59%	0.588	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	64	175.8	-55.7	-71.5	0	0	0	109	R122 N123 K124 K128	R122-F126 HydrophobicContact CG-CD2 3.66Å; R122-F126 HydrophobicContact CG-CE2 3.6Å; R122-F126 WeakPolarHBondContact O-CD2 3.03Å; R122-F126 PolarHBondContact O-N 3.44Å; N123-F126 CarbonylContact O-C 3.55Å; N123-F126 VanDerWaalsContact O-C 3.31Å; K124-F126 VanDerWaalsContact C-N 3.28Å; F126-K128 PolarHBondContact O-N 2.87Å
127	Q	27.1	Very low	34.7	Very low	168 Å²	168	114.9 Å²	114.9	79%	0.785	55%	0.553	S	S	*	*			trans	-53	114	157.4	-96.8	-177.2	-6.4	0	0	106.6	T129	Q127-T129 PolarHBondContact O-N 2.94Å
128	K	29.4	Very low	33.8	Very low	186 Å²	186	123.4 Å²	123.4	81%	0.809	59%	0.593	S	S	*	*			trans	-48.3	107.6	168.1	-103.6	-178	172	-176.6	0	106.2	F126 D130	F126-K128 PolarHBondContact O-N 2.87Å; K128-D130 PolarHBondContact O-N 2.8Å
129	T	26.1	Very low	32.9	Very low	113 Å²	113	131.5 Å²	131.5	69%	0.693	62%	0.622	S	S	*	*			trans	-65	102.1	156.7	7.3	0	0	0	0	103.7	Q127 Y131	Q127-T129 PolarHBondContact O-N 2.94Å; T129-Y131 VanDerWaalsContact C-N 3.26Å; T129-Y131 PolarHBondContact O-N 3.23Å
130	D	29.8	Very low	32	Very low	139 Å²	139	134 Å²	134	74%	0.743	63%	0.63	S	S	*	*			trans	-58.9	101.4	165.1	-79.8	-28.8	0	0	0	105.7	K128 N132	K128-D130 PolarHBondContact O-N 2.8Å; D130-N132 VanDerWaalsContact C-N 3.31Å; D130-N132 PolarHBondContact O-N 3.4Å
131	Y	27.3	Very low	31.3	Very low	154 Å²	154	136.5 Å²	136.5	60%	0.604	65%	0.652	S	S	*	*			trans	-63.1	98.5	172.9	-86.9	-88.7	0	0	0	106.9	T129 E133	T129-Y131 VanDerWaalsContact C-N 3.26Å; T129-Y131 PolarHBondContact O-N 3.23Å; Y131-E133 VanDerWaalsContact C-N 3.32Å; Y131-E133 PolarHBondContact O-N 2.88Å
132	N	30.1	Very low	30.9	Very low	122 Å²	122	141.2 Å²	141.2	65%	0.652	68%	0.677	S	S	*	*			trans	-61.6	102.9	155.4	-84.2	-23.5	0	0	0	106.2	D130 L134 D135	D130-N132 VanDerWaalsContact C-N 3.31Å; D130-N132 PolarHBondContact O-N 3.4Å; N132-L134 PolarHBondContact O-N 3.39Å; N132-D135 PolarHBondContact O-N 3.17Å
133	E	31	Very low	30.6	Very low	171 Å²	171	140.1 Å²	140.1	80%	0.799	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-0.4	176.4	-70.4	-175.2	149	0	0	114.1	Y131	Y131-E133 VanDerWaalsContact C-N 3.32Å; Y131-E133 PolarHBondContact O-N 2.88Å
134	L	33.7	Very low	30.4	Very low	152 Å²	152	141.3 Å²	141.3	80%	0.796	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-24.7	177.1	-77.6	154.8	0	0	0	113.9	N132 N136	N132-L134 PolarHBondContact O-N 3.39Å; L134-N136 PolarHBondContact O-N 3.14Å
135	D	32.5	Very low	30.3	Very low	137 Å²	137	144.8 Å²	144.8	73%	0.733	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-4.7	-174.4	-102.2	-3.1	0	0	0	114.9	N132	N132-D135 PolarHBondContact O-N 3.17Å
136	N	31.7	Very low	30.1	Very low	80 Å²	80	148.1 Å²	148.1	43%	0.428	73%	0.727	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.4	-1.8	-176.8	-79.5	-32.6	0	0	0	114.6	L134	L134-N136 PolarHBondContact O-N 3.14Å
137	K	34.4	Very low	30.2	Very low	181 Å²	181	147.2 Å²	147.2	79%	0.787	74%	0.738	S	S	*	*	S	Bend	trans	-84.7	-18.1	-179.7	-75.7	-173.1	179.2	176.9	0	114.6
138	E	33.6	Very low	30.3	Very low	180 Å²	180	144.5 Å²	144.5	84%	0.841	73%	0.734	S	S	*	*	S	Bend	trans	-104.9	-9.1	-177.4	-70	-169.7	162.1	0	0	114.5
139	R	31	Very low	30.3	Very low	184 Å²	184	143 Å²	143	69%	0.694	74%	0.735	S	S	*	*	S	Bend	trans	-101.7	-0.6	-172.2	-128.4	175.3	-175.3	165.6	6.5	115.9
140	F	30.6	Very low	30.5	Very low	160 Å²	160	146.6 Å²	146.6	70%	0.702	74%	0.744	S	S	*	*			trans	-128.7	20.1	-178.8	-68	-74.1	0	0	0	114	D142	F140-D142 VanDerWaalsContact C-N 3.25Å; F140-D142 PolarHBondContact O-N 3Å; F140-D142 VanDerWaalsContact O-N 3.16Å
141	S	28.6	Very low	30.4	Very low	95 Å²	95	149.9 Å²	149.9	66%	0.664	75%	0.752	S	S	*	*			trans	-85.8	65.5	168.8	60.1	0	0	0	0	110.2
142	D	28.7	Very low	30.4	Very low	141 Å²	141	151.1 Å²	151.1	75%	0.754	76%	0.763	S	S	*	*			trans	-148.8	93.5	155.4	-121.8	-21.4	0	0	0	112.3	F140	F140-D142 VanDerWaalsContact C-N 3.25Å; F140-D142 PolarHBondContact O-N 3Å; F140-D142 VanDerWaalsContact O-N 3.16Å
143	S	28.5	Very low	30.3	Very low	95 Å²	95	150 Å²	150	66%	0.664	77%	0.765	S	S	*	*			trans	15.9	105.2	137.6	68.4	0	0	0	0	117.1
144	T	30.1	Very low	30	Very low	126 Å²	126	149.4 Å²	149.4	77%	0.773	77%	0.767	S	S	*	*			trans	157.7	91.3	137.7	35.8	0	0	0	0	107.6
145	Y	31.4	Very low	29.6	Very low	234 Å²	234	147.4 Å²	147.4	92%	0.918	76%	0.761	S	S	*	*			trans	171.8	78.7	144.1	-99.6	-74.9	0	0	0	107.8	S147	Y145-S147 PolarHBondContact O-N 3.37Å
146	D	27.8	Very low	29.3	Very low	159 Å²	159	147.5 Å²	147.5	85%	0.85	76%	0.761	S	S	*	*			trans	-67.5	115.3	160.8	-76.9	-42.9	0	0	0	109.1
147	S	31.5	Very low	29	Very low	115 Å²	115	151.2 Å²	151.2	80%	0.804	78%	0.781	S	S	*	*			trans	-166.8	114.9	134.3	-91.4	0	0	0	0	110.7	Y145	Y145-S147 PolarHBondContact O-N 3.37Å
148	P	29	Very low	28.8	Very low	110 Å²	110	146.8 Å²	146.8	71%	0.714	77%	0.773	S	S	*	*			trans	-85.2	129	170.2	34	-26.5	0	0	0	108.3
149	D	29	Very low	28.5	Very low	155 Å²	155	147 Å²	147	83%	0.829	78%	0.78	S	S	*	*			trans	169.8	74.9	153.3	-85.7	-20.9	0	0	0	109.6
150	H	30.4	Very low	28.3	Very low	188 Å²	188	145.8 Å²	145.8	87%	0.87	78%	0.782	S	S	*	*			trans	-165.1	89.4	145.8	-97.8	-50.8	0	0	0	109.6
151	F	27.5	Very low	28	Very low	208 Å²	208	147.9 Å²	147.9	91%	0.912	79%	0.787	S	S	*	*			trans	-82.7	118.6	158.4	-119	-96	0	0	0	106.7
152	E	27.8	Very low	27.8	Very low	181 Å²	181	149 Å²	149	85%	0.846	79%	0.785	S	S	*	*			trans	-141.6	110.2	156.5	-121.2	171	-160.8	0	0	111
153	S	27.8	Very low	27.6	Very low	98 Å²	98	147.1 Å²	147.1	69%	0.685	79%	0.789	S	S	*	*			trans	-28.9	119.8	166.6	175.6	0	0	0	0	116.2
154	L	24.7	Very low	27.3	Very low	159 Å²	159	147.9 Å²	147.9	83%	0.832	79%	0.79	S	S	*	*			trans	-95.4	103.3	161.2	-89.4	150.8	0	0	0	109.1
155	T	25.5	Very low	27	Very low	110 Å²	110	147.9 Å²	147.9	68%	0.675	79%	0.789	S	S	*	*			trans	-136	139.5	162	46.5	0	0	0	0	109.5
156	D	25.4	Very low	26.6	Very low	139 Å²	139	146 Å²	146	74%	0.743	78%	0.782	S	S	*	*			trans	84.2	107.2	162.1	-68.6	-6.7	0	0	0	120.1
157	D	26.7	Very low	26.4	Very low	158 Å²	158	146.4 Å²	146.4	85%	0.845	78%	0.776	S	S	*	*				50.5	75	119.8	-64.2	-7.5	0	0	0	117.4
158	S	28.5	Very low	26	Very low	87 Å²	87	147.7 Å²	147.7	61%	0.608	77%	0.773	S	S	*	*			trans	-151.7	131.8	148.9	51.2	0	0	0	0	110.1	E160	S158-E160 PolarHBondContact O-N 3.17Å
159	D	27.5	Very low	25.6	Very low	186 Å²	186	147.3 Å²	147.3	100%	0.995	77%	0.769	S	S	*	*			trans	-68.8	38.3	174.9	-77.3	-44.4	0	0	0	112.5
160	E	27.8	Very low	25.3	Very low	158 Å²	158	149.1 Å²	149.1	74%	0.738	76%	0.764	S	S	*	*			trans	-100.5	99.6	174.5	-85	-174.8	159.5	0	0	110.2	S158 N162	S158-E160 PolarHBondContact O-N 3.17Å; E160-N162 PolarHBondContact O-N 3.34Å
161	Y	24.8	Very low	24.9	Very low	203 Å²	203	149.8 Å²	149.8	80%	0.796	76%	0.764	S	S	*	*			trans	26.6	69.5	139.9	-136.9	-95.1	0	0	0	116.4	A163	Y161-A163 PolarHBondContact O-N 2.92Å
162	N	23.6	Very low	24.7	Very low	120 Å²	120	147.3 Å²	147.3	64%	0.642	75%	0.753	S	S	*	*			trans	-82.7	118.9	178.8	-143.6	-16.4	0	0	0	110.6	E160 T164	E160-N162 PolarHBondContact O-N 3.34Å; N162-T164 PolarHBondContact O-N 2.87Å
163	A	24	Very low	24.5	Very low	101 Å²	101	147.8 Å²	147.8	84%	0.835	75%	0.752	S	S	*	*			trans	-77.6	41.8	-171.4	0	0	0	0	0	114.3	Y161	Y161-A163 PolarHBondContact O-N 2.92Å
164	T	21.9	Very low	24.2	Very low	110 Å²	110	150.5 Å²	150.5	68%	0.675	75%	0.754	S	S	*	*			trans	-107.3	72.3	179.1	18.1	0	0	0	0	110.1	N162	N162-T164 PolarHBondContact O-N 2.87Å
165	V	24.1	Very low	24.2	Very low	126 Å²	126	148.3 Å²	148.3	76%	0.764	75%	0.747	S	S	*	*			trans	-120.3	97.6	167.5	180	0	0	0	0	110.1
166	Y	24.4	Very low	24	Very low	194 Å²	194	150.1 Å²	150.1	76%	0.761	74%	0.742	S	S	*	*			trans	53.2	115.6	138.4	-73.7	-88.9	0	0	0	120.8	I168	Y166-I168 PolarHBondContact O-N 2.79Å
167	K	22	Very low	23.9	Very low	169 Å²	169	149.6 Å²	149.6	74%	0.735	74%	0.743	S	S	*	*			trans	-63.4	100.4	170	-158	176.8	-171	177.3	0	110.9	T169	K167-T169 HydrophobicContact CG-CG2 4.09Å; K167-T169 PolarHBondContact O-N 3.24Å; K167-T169 VanDerWaalsContact O-N 3.17Å
168	I	24.1	Very low	23.7	Very low	141 Å²	141	147.9 Å²	147.9	72%	0.723	73%	0.725	S	S	*	*			trans	-79.1	88.4	165.4	-62.4	173.2	0	0	0	107.8	Y166	Y166-I168 PolarHBondContact O-N 2.79Å
169	T	21.2	Very low	23.5	Very low	103 Å²	103	151.1 Å²	151.1	63%	0.632	73%	0.731	S	S	*	*			trans	-98.3	89	174.8	19.7	0	0	0	0	110.9	K167	K167-T169 HydrophobicContact CG-CG2 4.09Å; K167-T169 PolarHBondContact O-N 3.24Å; K167-T169 VanDerWaalsContact O-N 3.17Å
170	R	21.2	Very low	23.3	Very low	193 Å²	193	148.8 Å²	148.8	73%	0.728	71%	0.712	S	S	*	*	S	Bend	trans	158.9	123	134.8	-87.6	170.9	174.9	-176.9	-2.1	111.4
171	K	22.3	Very low	23.1	Very low	202 Å²	202	148 Å²	148	88%	0.878	71%	0.712	S	S	*	*	S	Bend	trans	81.9	23.4	165.2	-65.9	-169.1	177.9	-178	0	121.6
172	F	23.8	Very low	23	Very low	156 Å²	156	144.4 Å²	144.4	68%	0.684	71%	0.711	S	S	*	*			trans	-113.3	73.1	158.9	-66.8	-77.3	0	0	0	110.7	V175	F172-V175 HydrophobicContact CB-CG2 4.21Å; F172-V175 HydrophobicContact CD1-CG2 3.81Å; F172-V175 HydrophobicContact CG-CG2 4.37Å
173	K	22.6	Very low	23	Very low	190 Å²	190	145.2 Å²	145.2	83%	0.826	72%	0.715	S	S	*	*	S	Bend	trans	-86.2	-4.2	179.1	-143.8	178.1	-177.7	-177.7	0	113.7
174	H	22.2	Very low	23.1	Very low	156 Å²	156	146.4 Å²	146.4	72%	0.722	71%	0.707	S	S	*	*			trans	-152.8	70.8	175.5	-70.8	-70.2	0	0	0	111.5	R176	H174-R176 VanDerWaalsContact C-N 3.26Å; H174-R176 PolarHBondContact O-N 3.06Å
175	V	24.8	Very low	23.2	Very low	113 Å²	113	148.4 Å²	148.4	69%	0.685	71%	0.714	S	S	*	*			trans	-93.1	75.4	153.4	-175.7	0	0	0	0	105.8	F172	F172-V175 HydrophobicContact CB-CG2 4.21Å; F172-V175 HydrophobicContact CD1-CG2 3.81Å; F172-V175 HydrophobicContact CG-CG2 4.37Å
176	R	22	Very low	23.1	Very low	148 Å²	148	146.5 Å²	146.5	56%	0.558	70%	0.704	S	S	*	*			trans	-76.7	121.1	159.9	-89.3	178.7	174.9	-172.9	-3.9	105.3	H174 Y178	H174-R176 VanDerWaalsContact C-N 3.26Å; H174-R176 PolarHBondContact O-N 3.06Å; R176-Y178 VanDerWaalsContact C-N 3.33Å; R176-Y178 HydrophobicContact CB-CD2 3.94Å; R176-Y178 HydrophobicContact CB-CE2 3.38Å; R176-Y178 WeakPolarHBondContact CD-OH 3.49Å; R176-Y178 HydrophobicContact CG-CE2 4.47Å; R176-Y178 WeakPolarHBondContact O-CD2 3.42Å; R176-Y178 PolarHBondContact O-N 2.8Å
177	V	22.6	Very low	23.1	Very low	127 Å²	127	145.7 Å²	145.7	77%	0.77	71%	0.705	S	S	*	*			trans	-58.2	101.3	164.1	177.4	0	0	0	0	105.9
178	Y	23.3	Very low	23.2	Very low	122 Å²	122	143.7 Å²	143.7	48%	0.478	71%	0.711	S	S	.	*			trans	-88.9	105	170.8	-77.2	-82.1	0	0	0	107	R176 K180 Y245	R176-Y178 VanDerWaalsContact C-N 3.33Å; R176-Y178 HydrophobicContact CB-CD2 3.94Å; R176-Y178 HydrophobicContact CB-CE2 3.38Å; R176-Y178 WeakPolarHBondContact CD-OH 3.49Å; R176-Y178 HydrophobicContact CG-CE2 4.47Å; R176-Y178 WeakPolarHBondContact O-CD2 3.42Å; R176-Y178 PolarHBondContact O-N 2.8Å; Y178-K180 PolarHBondContact O-N 3.16Å; Y178-Y245 VanDerWaalsContact CZ-OH 3.28Å; Y178-Y245 PolarHBondContact OH-OH 3.09Å
179	H	23.4	Very low	23.1	Very low	156 Å²	156	143.8 Å²	143.8	72%	0.722	71%	0.711	S	S	*	*			trans	-59.8	90.6	145.1	-70.7	116	0	0	0	106	L181	H179-L181 VanDerWaalsContact C-N 3.31Å; H179-L181 PolarHBondContact O-N 3.07Å
180	K	23.9	Very low	23.1	Very low	136 Å²	136	147 Å²	147	59%	0.591	72%	0.719	S	S	*	*			trans	-88.7	84.7	169	-159	175.3	-177.8	-174.2	0	106.6	Y178 V182	Y178-K180 PolarHBondContact O-N 3.16Å; K180-V182 PolarHBondContact O-N 2.79Å
181	L	22.7	Very low	23.2	Very low	141 Å²	141	144 Å²	144	74%	0.738	72%	0.717	S	S	*	*			trans	-43.6	124	143	-93.5	151.8	0	0	0	106.3	H179 D183	H179-L181 VanDerWaalsContact C-N 3.31Å; H179-L181 PolarHBondContact O-N 3.07Å; L181-D183 PolarHBondContact O-N 3.13Å
182	V	23.4	Very low	23.2	Very low	128 Å²	128	142.4 Å²	142.4	78%	0.776	71%	0.713	S	S	*	*			trans	-68.1	71.5	178	-178.1	0	0	0	0	107.9	K180 N184	K180-V182 PolarHBondContact O-N 2.79Å; V182-N184 VanDerWaalsContact C-N 3.3Å; V182-N184 PolarHBondContact O-N 2.75Å
183	D	23.1	Very low	23.2	Very low	137 Å²	137	140.6 Å²	140.6	73%	0.733	72%	0.715	S	S	*	*			trans	-98.8	66.8	166.4	-80.4	-20.7	0	0	0	107.9	L181	L181-D183 PolarHBondContact O-N 3.13Å
184	N	25.8	Very low	23.3	Very low	126 Å²	126	139 Å²	139	67%	0.674	72%	0.715	S	S	*	*			trans	-127.8	64.5	156.5	-98.8	-3.1	0	0	0	107	V182	V182-N184 VanDerWaalsContact C-N 3.3Å; V182-N184 PolarHBondContact O-N 2.75Å
185	N	24	Very low	23.3	Very low	153 Å²	153	139.6 Å²	139.6	82%	0.818	72%	0.718	S	S	*	*			trans	-135.5	98.5	143.5	-141.8	4.6	0	0	0	108.3
186	P	23.3	Very low	23.4	Very low	85 Å²	85	142 Å²	142	55%	0.552	72%	0.722	S	S	*	*			trans	-69.6	159.1	168.3	31.4	-27.3	0	0	0	107.7
187	F	23.9	Very low	23.5	Very low	178 Å²	178	142.9 Å²	142.9	78%	0.781	74%	0.737	S	S	*	*			trans	88.1	96	176.2	-52.2	-79.4	0	0	0	116.7	I189	F187-I189 HydrophobicContact CD1-CD1 4.42Å; F187-I189 PolarHBondContact O-N 3.3Å
188	C	23	Very low	23.7	Very low	127 Å²	127	144.1 Å²	144.1	86%	0.858	74%	0.738	S	S	*	*				-39.5	123.7	129.8	-62.4	0	0	0	0	109.6
189	I	22.2	Very low	23.9	Very low	143 Å²	143	144.5 Å²	144.5	73%	0.733	75%	0.754	S	S	*	*			trans	-173.5	118.5	153.4	-93.6	144.3	0	0	0	107.6	F187	F187-I189 HydrophobicContact CD1-CD1 4.42Å; F187-I189 PolarHBondContact O-N 3.3Å
190	H	22	Very low	24	Very low	171 Å²	171	144.2 Å²	144.2	79%	0.792	76%	0.757	S	S	*	*			trans	-52.2	153.1	155.3	-69.9	-49.5	0	0	0	111.3
191	N	22.5	Very low	24.1	Very low	129 Å²	129	144.6 Å²	144.6	69%	0.69	77%	0.766	S	S	*	*			trans	108.6	106.9	167.9	-58	-20.2	0	0	0	112.6
192	Q	22.6	Very low	24.3	Very low	169 Å²	169	148.3 Å²	148.3	79%	0.79	77%	0.771	S	S	*	*				56.7	105.3	97.6	-63.6	176.2	-13.9	0	0	109.7
193	T	23.8	Very low	24.5	Very low	118 Å²	118	149.1 Å²	149.1	72%	0.724	77%	0.771	S	S	*	*				-159	109.7	71.4	34	0	0	0	0	111.4	Q195	T193-Q195 PolarHBondContact O-N 3.4Å
194	N	23.8	Very low	24.6	Very low	157 Å²	157	151.1 Å²	151.1	84%	0.84	77%	0.77	S	S	*	*			trans	-62.1	97.3	140.3	-86.7	-21.3	0	0	0	105.9	H196	N194-H196 PolarHBondContact O-N 3.32Å; N194-H196 VanDerWaalsContact O-N 3.09Å
195	Q	23.6	Very low	24.6	Very low	167 Å²	167	153.7 Å²	153.7	78%	0.78	78%	0.775	S	S	*	*			trans	-78	71	154	-96.2	-174.9	-22.3	0	0	107.8	T193	T193-Q195 PolarHBondContact O-N 3.4Å
196	H	26.4	Very low	24.8	Very low	164 Å²	164	154.6 Å²	154.6	76%	0.759	78%	0.775	S	S	*	*	S	Bend	trans	-146.4	110.3	143.4	-84.9	-52.6	0	0	0	104.7	N194 I198	N194-H196 PolarHBondContact O-N 3.32Å; N194-H196 VanDerWaalsContact O-N 3.09Å; H196-I198 PolarHBondContact O-N 3.23Å
197	D	24.8	Very low	25	Very low	166 Å²	166	158.7 Å²	158.7	89%	0.888	78%	0.784	S	S	*	*			trans	-48.5	105.1	-168.7	-61.3	-48.7	0	0	0	111.9
198	I	26.4	Very low	25.2	Very low	154 Å²	154	162.2 Å²	162.2	79%	0.79	79%	0.792	S	S	*	*			trans	-127.7	102.3	169	-59.3	175.5	0	0	0	106.6	H196	H196-I198 PolarHBondContact O-N 3.23Å
199	T	27.5	Very low	25.3	Very low	130 Å²	130	166.3 Å²	166.3	80%	0.798	79%	0.791	S	S	*	*			trans	-52.4	150.7	176.3	13.8	0	0	0	0	112.5
200	D	24.5	Very low	25.6	Very low	149 Å²	149	168.7 Å²	168.7	80%	0.797	80%	0.799	S	S	*	*	S	Bend	trans	-40.5	157.3	178.2	-64.1	-53.3	0	0	0	115.2
201	D	26.3	Very low	25.8	Very low	144 Å²	144	171.2 Å²	171.2	77%	0.77	80%	0.803	S	S	*	*			trans	81.3	91.1	175	-58.1	-25.3	0	0	0	115.2
202	Y	26.7	Very low	25.9	Very low	219 Å²	219	168.2 Å²	168.2	86%	0.859	80%	0.802	S	S	*	*			trans	-160.5	108.6	133	-99.3	-70.6	0	0	0	110.9	Y204	Y202-Y204 PolarHBondContact O-N 3.16Å
203	D	27.6	Very low	26	Very low	145 Å²	145	165.5 Å²	165.5	78%	0.775	80%	0.802	S	S	*	*			trans	-71.5	96.6	177.2	-159.3	0.6	0	0	0	109.8	K205	D203-K205 PolarHBondContact O-N 2.93Å
204	Y	26.8	Very low	26.2	Very low	179 Å²	179	167.2 Å²	167.2	70%	0.702	81%	0.807	S	S	*	*			trans	-89.2	56	172.9	-92.8	-92.7	0	0	0	110.7	Y202 K207	Y202-Y204 PolarHBondContact O-N 3.16Å; Y204-K207 HydrophobicContact CE1-CD 4.31Å
205	K	26	Very low	26.5	Very low	180 Å²	180	171.7 Å²	171.7	78%	0.783	81%	0.812	S	S	*	*			trans	-105	72.4	156.4	-90.1	-172.9	175.8	178.2	0	108.4	D203	D203-K205 PolarHBondContact O-N 2.93Å
206	E	27	Very low	26.8	Very low	173 Å²	173	170.8 Å²	170.8	81%	0.808	81%	0.812	S	S	*	*			trans	162.9	104.3	159.9	-101.4	172.3	174.6	0	0	107.8
207	K	28	Very low	26.8	Very low	171 Å²	171	170 Å²	170	74%	0.743	81%	0.813	S	S	*	*			trans	-167.1	72.7	149.7	-106.8	167.7	-171	-177.7	0	107.5	Y204	Y204-K207 HydrophobicContact CE1-CD 4.31Å
208	W	27.2	Very low	27.2	Very low	251 Å²	251	167.5 Å²	167.5	95%	0.951	81%	0.809	S	S	*	*			trans	-67.2	137.1	156	-83.4	65.1	0	0	0	107.8	E210	W208-E210 PolarHBondContact O-N 2.7Å
209	Y	26.4	Very low	27.2	Very low	214 Å²	214	167.7 Å²	167.7	84%	0.839	81%	0.811	S	S	*	*			trans	-60.9	99.8	-179.6	-86.6	-101.2	0	0	0	110.9	Y211	Y209-Y211 VanDerWaalsContact C-N 3.25Å; Y209-Y211 HydrophobicContact CD1-CD2 4.22Å; Y209-Y211 PolarHBondContact O-N 2.75Å
210	E	28.1	Very low	27.3	Very low	193 Å²	193	169.1 Å²	169.1	90%	0.902	81%	0.814	S	S	*	*			trans	-79.1	81.1	147	-88.7	-178.2	157.7	0	0	107.6	W208	W208-E210 PolarHBondContact O-N 2.7Å
211	Y	26.8	Very low	27.5	Very low	223 Å²	223	170.8 Å²	170.8	88%	0.875	82%	0.817	S	S	*	*			trans	-122.9	73.2	158.4	-105.7	-84.4	0	0	0	106.4	Y209	Y209-Y211 VanDerWaalsContact C-N 3.25Å; Y209-Y211 HydrophobicContact CD1-CD2 4.22Å; Y209-Y211 PolarHBondContact O-N 2.75Å
212	G	24	Very low	27.4	Very low	66 Å²	66	171.5 Å²	171.5	68%	0.68	82%	0.819	S	S	*	*			trans	-174.6	61.4	-173.3	0	0	0	0	0	110.3
213	S	25.1	Very low	27.5	Very low	112 Å²	112	167.7 Å²	167.7	78%	0.783	81%	0.813	S	S	*	*	S	Bend	trans	-174.8	138.9	161.8	-76.3	0	0	0	0	107.1
214	D	28.1	Very low	27.3	Very low	154 Å²	154	169.4 Å²	169.4	82%	0.824	82%	0.816	S	S	*	*			trans	98.4	24.7	171.3	-56.2	-14	0	0	0	120.2
215	R	30.3	Very low	27.4	Very low	251 Å²	251	169.3 Å²	169.3	95%	0.947	82%	0.822	S	S	*	*			trans	-122.8	83.5	152	-89.4	-172.7	164	174.6	-5.7	112.2
216	L	28.5	Very low	27.5	Very low	149 Å²	149	167 Å²	167	78%	0.78	82%	0.818	S	S	*	*			trans	-52.9	144.4	156.9	-72.7	152.5	0	0	0	111
217	D	27.5	Very low	27.4	Very low	147 Å²	147	167 Å²	167	79%	0.786	82%	0.821	S	S	*	*			trans	71.5	85.3	156.6	-53.8	-19.5	0	0	0	118.2
218	S	32.6	Very low	27.4	Very low	113 Å²	113	168.7 Å²	168.7	79%	0.79	83%	0.825	S	S	*	*				-179.2	127.2	121.2	55.6	0	0	0	0	111	D220	S218-D220 PolarHBondContact O-N 2.78Å
219	D	26	Very low	27.5	Very low	158 Å²	158	166 Å²	166	85%	0.845	82%	0.823	S	S	*	*			trans	-45.6	118.2	175.7	-53.1	-56.2	0	0	0	112.4
220	D	29.1	Very low	27.7	Very low	160 Å²	160	165.2 Å²	165.2	86%	0.856	83%	0.827	S	S	*	*			trans	-163.4	134.6	150.4	-88.2	-32.6	0	0	0	109.9	S218	S218-D220 PolarHBondContact O-N 2.78Å
221	E	29.4	Very low	27.7	Very low	184 Å²	184	162.5 Å²	162.5	86%	0.86	82%	0.819	S	S	*	*			trans	-59	133.9	-164.1	-67.5	169.4	138.1	0	0	114.9
222	I	24.3	Very low	27.8	Very low	159 Å²	159	156.9 Å²	156.9	82%	0.815	81%	0.811	S	S	*	*			trans	-91.7	122.3	167.1	-63.1	172.1	0	0	0	108
223	I	27.9	Very low	28.4	Very low	140 Å²	140	161.7 Å²	161.7	72%	0.718	82%	0.815	S	S	*	*			trans	-104.5	119.4	167	-61.8	175.5	0	0	0	107.6	E225	I223-E225 HydrophobicContact CG2-CG 4.36Å
224	E	25	Very low	29.2	Very low	181 Å²	181	163.4 Å²	163.4	85%	0.846	81%	0.811	S	S	*	*			trans	-75.5	128.3	168.6	-67.6	175.5	144.8	0	0	109.7
225	E	28.5	Very low	29.6	Very low	176 Å²	176	165.1 Å²	165.1	82%	0.822	81%	0.811	S	S	*	*			trans	-139.6	103.2	161	-76.1	-168.1	165.6	0	0	111.8	I223	I223-E225 HydrophobicContact CG2-CG 4.36Å
226	D	28.2	Very low	30	Very low	132 Å²	132	161.5 Å²	161.5	71%	0.706	81%	0.805	S	S	*	*			trans	42.8	115.8	139.2	-63	-17.8	0	0	0	122.9	Y228	D226-Y228 HydrophobicContact CB-CD2 4.21Å; D226-Y228 HydrophobicContact CB-CE2 4.05Å
227	I	24	Very low	30.3	Very low	172 Å²	172	161.5 Å²	161.5	88%	0.882	80%	0.801	S	S	*	*			trans	-88.6	126	162.4	-59.6	167.7	0	0	0	108.3
228	Y	29.2	Very low	30.6	Very low	207 Å²	207	162.6 Å²	162.6	81%	0.812	80%	0.795	S	S	*	*			trans	-123.7	135.6	167	-85	-80.7	0	0	0	112	D226	D226-Y228 HydrophobicContact CB-CD2 4.21Å; D226-Y228 HydrophobicContact CB-CE2 4.05Å
229	E	28	Very low	30.9	Very low	194 Å²	194	164.8 Å²	164.8	91%	0.907	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-70.2	145.5	-175.3	-69.6	175.2	141.3	0	0	114.2
230	E	31.5	Very low	31.3	Very low	199 Å²	199	164.3 Å²	164.3	93%	0.93	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-80.1	124.5	-178.7	-131.6	175.3	-169	0	0	112
231	D	27.4	Very low	31.5	Very low	136 Å²	136	161.3 Å²	161.3	73%	0.727	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-92.2	142.6	-178.6	-149.5	-4.6	0	0	0	112.6	H233	D231-H233 PolarHBondContact O-N 2.04Å
232	C	28.9	Very low	31.7	Very low	105 Å²	105	160.8 Å²	160.8	71%	0.709	76%	0.758	S	S	*	*	S	Bend	trans	-95.5	28.2	-149.5	46.7	0	0	0	0	116.2
233	H	37.5	Very low	32.2	Very low	167 Å²	167	158 Å²	158	77%	0.773	75%	0.745	S	S	*	*			trans	-100.1	1.7	-168.9	-84.7	-66.2	0	0	0	117.3	D231	D231-H233 PolarHBondContact O-N 2.04Å
234	E	40.3	Very low	32.5	Very low	147 Å²	147	155.4 Å²	155.4	69%	0.687	74%	0.736	S	S	*	*			trans	-89.4	-7.6	-177.5	-67.7	-169.2	152.6	0	0	115.4	E236 Y238	E234-E236 PolarHBondContact O-N 2.68Å; E234-Y238 WeakPolarHBondContact O-CD2 3.47Å
235	K	38	Very low	32.7	Very low	190 Å²	190	151.7 Å²	151.7	83%	0.826	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-18.4	-169.8	-79.6	-178.8	177.6	171.2	0	116.7
236	E	37.7	Very low	32.9	Very low	175 Å²	175	146.5 Å²	146.5	82%	0.818	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-23.5	-178	-75.1	-169.7	152.2	0	0	114.2	E234	E234-E236 PolarHBondContact O-N 2.68Å
237	Q	35.9	Very low	33.2	Very low	149 Å²	149	148.2 Å²	148.2	70%	0.696	70%	0.699	S	S	*	*	H	α-helix	trans	-73.3	-33.5	-179	-151.9	125	2.7	0	0	112	K239 Q240	Q237-K239 VanDerWaalsContact C-N 3.25Å; Q237-K239 PolarHBondContact O-N 2.78Å; Q237-Q240 PolarHBondContact O-N 3.46Å
238	Y	32.3	Very low	33.6	Very low	170 Å²	170	145.6 Å²	145.6	67%	0.667	69%	0.686	S	S	*	*	H	α-helix	trans	-61	-26.7	178.8	-88	-87.4	0	0	0	114.6	E234 Y242	E234-Y238 WeakPolarHBondContact O-CD2 3.47Å; Y238-Y242 PolarHBondContact O-N 3.42Å
239	K	39.2	Very low	33.7	Very low	159 Å²	159	143.3 Å²	143.3	69%	0.691	68%	0.683	S	S	*	*	H	α-helix	trans	-75.7	-32	-176.1	-159.5	174.3	-177.1	178.8	0	112.9	Q237	Q237-K239 VanDerWaalsContact C-N 3.25Å; Q237-K239 PolarHBondContact O-N 2.78Å
240	Q	34.3	Very low	33.8	Very low	149 Å²	149	141 Å²	141	70%	0.696	68%	0.677	S	S	*	*	H	α-helix	trans	-77	-33.9	179.3	-75	-175.9	-10.9	0	0	112.8	Q237 T244	Q237-Q240 PolarHBondContact O-N 3.46Å; Q240-T244 PolarHBondContact O-N 3.01Å; Q240-T244 PolarHBondContact O-OG1 3.39Å
241	D	34	Very low	33.8	Very low	96 Å²	96	139.6 Å²	139.6	51%	0.513	67%	0.668	S	S	.	*	H	α-helix	trans	-71.6	-33.8	179.2	-77.5	-22.6	0	0	0	112.1	T244 Y245	D241-T244 PolarHBondContact O-N 2.85Å; D241-Y245 PolarHBondContact O-N 3.12Å; D241-Y245 VanDerWaalsContact O-N 3.1Å
242	Y	32.6	Very low	33.6	Very low	173 Å²	173	141.8 Å²	141.8	68%	0.678	67%	0.673	S	S	*	*	H	α-helix	trans	-66.9	-45.6	177.7	-169.1	-93.7	0	0	0	113.2	Y238 T244 Y245 S246	Y238-Y242 PolarHBondContact O-N 3.42Å; Y242-T244 PolarHBondContact O-N 2.88Å; Y242-Y245 PolarHBondContact O-N 3.17Å; Y242-S246 PolarHBondContact O-N 2.97Å
243	D	35.7	Very low	33.5	Very low	101 Å²	101	142.5 Å²	142.5	54%	0.54	67%	0.669	S	S	.	*	H	α-helix	trans	-64.5	-29.2	177.9	-83	-11.3	0	0	0	112.5
244	T	33.5	Very low	32.8	Very low	86 Å²	86	139.9 Å²	139.9	53%	0.528	66%	0.664	S	S	.	*	H	α-helix	trans	-75.6	-37.2	177.2	-51	0	0	0	0	111.1	Q240 D241 Y242	Q240-T244 PolarHBondContact O-N 3.01Å; Q240-T244 PolarHBondContact O-OG1 3.39Å; D241-T244 PolarHBondContact O-N 2.85Å; Y242-T244 PolarHBondContact O-N 2.88Å
245	Y	30.9	Very low	32.2	Very low	103 Å²	103	142.7 Å²	142.7	40%	0.404	67%	0.67	S	S	.	*	H	α-helix	trans	-71.6	-39.5	178.8	-118.3	-84.9	0	0	0	113.4	Y178 D241 Y242 K247 L248	Y178-Y245 VanDerWaalsContact CZ-OH 3.28Å; Y178-Y245 PolarHBondContact OH-OH 3.09Å; D241-Y245 PolarHBondContact O-N 3.12Å; D241-Y245 VanDerWaalsContact O-N 3.1Å; Y242-Y245 PolarHBondContact O-N 3.17Å; Y245-K247 VanDerWaalsContact C-N 3.25Å; Y245-K247 PolarHBondContact O-N 3.18Å; Y245-L248 PolarHBondContact O-N 2.88Å; Y245-L248 VanDerWaalsContact O-N 3.11Å
246	S	31.1	Very low	31.5	Very low	67 Å²	67	139.5 Å²	139.5	47%	0.469	67%	0.667	S	S	.	*	H	α-helix	trans	-61.7	-31.5	178.9	-179.3	0	0	0	0	112.9	Y242 L248	Y242-S246 PolarHBondContact O-N 2.97Å; S246-L248 VanDerWaalsContact C-N 3.31Å; S246-L248 PolarHBondContact O-N 3.21Å
247	K	34.7	Very low	31	Very low	168 Å²	168	136.1 Å²	136.1	73%	0.73	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-18.1	177.4	-72.9	176.8	-177.4	169.3	0	114.1	Y245	Y245-K247 VanDerWaalsContact C-N 3.25Å; Y245-K247 PolarHBondContact O-N 3.18Å
248	L	33.1	Very low	30.4	Very low	117 Å²	117	136.2 Å²	136.2	61%	0.613	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-24.3	-177	-78.4	161.9	0	0	0	113.4	Y245 S246 N250	Y245-L248 PolarHBondContact O-N 2.88Å; Y245-L248 VanDerWaalsContact O-N 3.11Å; S246-L248 VanDerWaalsContact C-N 3.31Å; S246-L248 PolarHBondContact O-N 3.21Å; L248-N250 VanDerWaalsContact C-N 3.32Å; L248-N250 PolarHBondContact O-N 3.31Å
249	Q	31.6	Very low	30.3	Very low	159 Å²	159	136.9 Å²	136.9	74%	0.743	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-11.3	-177.3	-76.2	-170.9	-21.8	0	0	114.9
250	N	30.4	Very low	29.9	Very low	146 Å²	146	139.2 Å²	139.2	78%	0.781	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	19.8	-178.2	-75.7	-22	0	0	0	114.6	L248	L248-N250 VanDerWaalsContact C-N 3.32Å; L248-N250 PolarHBondContact O-N 3.31Å
251	K	29.8	Very low	29.7	Very low	168 Å²	168	139.5 Å²	139.5	73%	0.73	69%	0.694	S	S	*	*			trans	-105	91.4	170.6	-74.6	-171	177.6	-177.5	0	110.3	I253	K251-I253 PolarHBondContact O-N 3.37Å
252	E	24.9	Very low	29.5	Very low	182 Å²	182	140.5 Å²	140.5	85%	0.85	70%	0.703	S	S	*	*			trans	-51.3	111.4	159.8	-167	175.7	-151.6	0	0	108.7
253	I	27.1	Very low	29.6	Very low	121 Å²	121	138.6 Å²	138.6	62%	0.621	71%	0.714	S	S	*	*			trans	-94	99.6	173.1	-57.6	179.1	0	0	0	107.2	K251 Y255	K251-I253 PolarHBondContact O-N 3.37Å; I253-Y255 HydrophobicContact CB-CE2 4.28Å; I253-Y255 HydrophobicContact CG2-CD2 3.76Å; I253-Y255 HydrophobicContact CG2-CE2 3.43Å; I253-Y255 VanDerWaalsContact CG2-CE2 3.43Å; I253-Y255 PolarHBondContact O-N 3.08Å
254	V	22.9	Very low	29.6	Very low	111 Å²	111	141.7 Å²	141.7	67%	0.673	73%	0.725	S	S	*	*			trans	-70.9	114	166.1	178	0	0	0	0	107.8
255	Y	26.5	Very low	29.8	Very low	207 Å²	207	144.9 Å²	144.9	81%	0.812	74%	0.739	S	S	*	*			trans	-91.9	108.4	167.2	-81.9	-86	0	0	0	109	I253	I253-Y255 HydrophobicContact CB-CE2 4.28Å; I253-Y255 HydrophobicContact CG2-CD2 3.76Å; I253-Y255 HydrophobicContact CG2-CE2 3.43Å; I253-Y255 VanDerWaalsContact CG2-CE2 3.43Å; I253-Y255 PolarHBondContact O-N 3.08Å
256	T	23.1	Very low	30.3	Very low	123 Å²	123	147.5 Å²	147.5	76%	0.755	76%	0.76	S	S	*	*			trans	-77.4	128.4	164.1	40.9	0	0	0	0	109.4
257	S	26.6	Very low	30.6	Very low	103 Å²	103	151.3 Å²	151.3	72%	0.72	78%	0.775	S	S	*	*			trans	-79.3	124.6	176.8	64	0	0	0	0	111.2
258	D	24.6	Very low	30.7	Very low	152 Å²	152	156 Å²	156	81%	0.813	80%	0.8	S	S	*	*			trans	-145	140.6	153.5	-79.1	-42.1	0	0	0	105.4
259	E	30	Very low	30.5	Very low	183 Å²	183	158 Å²	158	86%	0.855	81%	0.809	S	S	*	*			trans	87.4	63.8	177.9	-51.4	176.3	-178.2	0	0	116.8
260	F	29.6	Very low	30.5	Very low	209 Å²	209	157.9 Å²	157.9	92%	0.917	81%	0.813	S	S	*	*			trans	-91.8	96.2	139.1	-90.1	-92.2	0	0	0	107	T262	F260-T262 PolarHBondContact O-N 3.05Å
261	D	30.3	Very low	30.5	Very low	155 Å²	155	158.6 Å²	158.6	83%	0.829	82%	0.815	S	S	*	*			trans	-76.7	109.4	165.3	-98	-18.4	0	0	0	108.3	C263	D261-C263 PolarHBondContact O-N 3.04Å
262	T	31.3	Very low	30.5	Very low	116 Å²	116	158.1 Å²	158.1	71%	0.712	82%	0.819	S	S	*	*			trans	-57.8	121.9	168.8	37	0	0	0	0	110.3	F260 E264	F260-T262 PolarHBondContact O-N 3.05Å; T262-E264 PolarHBondContact O-N 3.09Å
263	C	34.2	Very low	30.9	Very low	133 Å²	133	156.6 Å²	156.6	90%	0.899	82%	0.818	S	S	*	*			trans	-67	109.5	159.3	-68.2	0	0	0	0	107.9	D261	D261-C263 PolarHBondContact O-N 3.04Å
264	E	36.3	Very low	31.1	Very low	167 Å²	167	158.9 Å²	158.9	78%	0.78	83%	0.831	S	S	*	*			trans	-68.2	127.4	168.3	-69.7	-175.1	151.4	0	0	109.1	T262 D266	T262-E264 PolarHBondContact O-N 3.09Å; E264-D266 PolarHBondContact O-N 3.01Å
265	D	37.7	Very low	31.7	Very low	152 Å²	152	162.4 Å²	162.4	81%	0.813	84%	0.842	S	S	*	*			trans	-64.8	104.9	164.6	-92.3	-34.1	0	0	0	108.7	N267	D265-N267 PolarHBondContact O-N 3.09Å; D265-N267 VanDerWaalsContact O-N 3.09Å
266	D	40	Very low	32.1	Very low	158 Å²	158	158.9 Å²	158.9	85%	0.845	84%	0.844	S	S	*	*			trans	-73.7	90.6	162.7	-81.6	-27.7	0	0	0	109.1	E264	E264-D266 PolarHBondContact O-N 3.01Å
267	N	38.6	Very low	32.9	Very low	147 Å²	147	161.9 Å²	161.9	79%	0.786	85%	0.852	S	S	*	*			trans	-91.5	106.2	157.4	-81.8	-56.4	0	0	0	109	D265	D265-N267 PolarHBondContact O-N 3.09Å; D265-N267 VanDerWaalsContact O-N 3.09Å
268	E	35	Very low	33.4	Very low	268 Å²	268	167.3 Å²	167.3	100%	1.252	86%	0.864	S	S	*	*			trans	-94.1	0	149.9	-83.2	-168.1	156.2	0	0	110.8

Retrieved 268 of 268 residues in 127.3 ms (Link to these results)

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