G4LX29_SCHMA Loading...

PID domain-containing protein

AlphaFold DB , UniProt , Accession G4LX29, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 369 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	45.2	Very low	48.9	Very low	245 Å²	245	169.5 Å²	169.5	100%	1.207	88%	0.884	S	S	*	*				0	112.8	0	-78.4	172.3	146.1	0	0	109.6
2	K	58.2	Low	48.8	Very low	215 Å²	215	164.3 Å²	164.3	94%	0.935	87%	0.872	S	S	*	*			trans	-168.1	89.5	151.8	-104	174.6	-172.6	-176.6	0	106.9
3	R	46.4	Very low	49	Very low	255 Å²	255	158.2 Å²	158.2	96%	0.962	85%	0.851	S	S	*	*			trans	-74.7	115.1	172.9	-87.2	177.4	164.3	170.6	-4.7	108
4	G	55	Low	49.3	Very low	79 Å²	79	154.9 Å²	154.9	81%	0.814	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-70.6	125.8	166	0	0	0	0	0	110.1
5	K	55.6	Low	50	Low	211 Å²	211	151.9 Å²	151.9	92%	0.917	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-72	147.8	-177	-90.7	172.8	170.9	175	0	112.2
6	R	47	Very low	50.9	Low	246 Å²	246	152.9 Å²	152.9	93%	0.928	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-61.1	148	171.9	-66.9	164.1	155.1	164.2	-8	112.9
7	S	46.5	Very low	52.8	Low	122 Å²	122	147.7 Å²	147.7	85%	0.853	78%	0.78	S	S	*	*			trans	-147.2	103.4	149	57.1	0	0	0	0	109.7
8	S	41.2	Very low	55	Low	118 Å²	118	142.7 Å²	142.7	83%	0.825	75%	0.753	S	S	*	*			trans	-146	85.6	165.7	62.9	0	0	0	0	108
9	S	42.7	Very low	57	Low	114 Å²	114	138.1 Å²	138.1	80%	0.797	73%	0.726	S	S	*	*			trans	-149.1	67.6	170.8	68.9	0	0	0	0	109.6
10	V	51.7	Low	59	Low	132 Å²	132	132.8 Å²	132.8	80%	0.8	70%	0.697	S	S	*	*			trans	-137.1	99.3	168	-177.1	0	0	0	0	104.1
11	D	48.9	Very low	60.7	Low	128 Å²	128	131.6 Å²	131.6	68%	0.684	69%	0.687	S	S	*	*			trans	161.9	3.1	156.1	-83.4	-12.4	0	0	0	115	S13	D11-S13 VanDerWaalsContact C-N 3.27Å; D11-S13 PolarHBondContact O-N 3.19Å
12	S	47.8	Very low	63.1	Low	106 Å²	106	120.2 Å²	120.2	74%	0.741	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-5.3	177.9	58.2	0	0	0	0	115.2
13	S	50.4	Low	65	Low	86 Å²	86	118.2 Å²	118.2	60%	0.601	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-29.3	-177.3	-174.1	0	0	0	0	113.6	D11 E15	D11-S13 VanDerWaalsContact C-N 3.27Å; D11-S13 PolarHBondContact O-N 3.19Å; S13-E15 PolarHBondContact O-N 3.38Å
14	N	54.2	Low	67.3	Low	111 Å²	111	106.1 Å²	106.1	59%	0.594	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-87.4	-1.6	-169.1	-70.9	-4.3	0	0	0	114.2	K16	N14-K16 VanDerWaalsContact C-N 3.31Å
15	E	60	Low	69.2	Low	111 Å²	111	105.5 Å²	105.5	52%	0.519	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-81.7	-9.9	176.5	-66.2	-172.1	161.7	0	0	113.1	S13 D17 I18 K68	S13-E15 PolarHBondContact O-N 3.38Å; E15-D17 PolarHBondContact O-N 3.07Å; E15-I18 HydrophobicContact CB-CD1 4.2Å; E15-I18 WeakPolarHBondContact O-CD1 3.46Å; E15-I18 WeakPolarHBondContact O-CG1 3.49Å; E15-K68 IonicContact OE1-NZ 2.66Å
16	K	63.7	Low	71.1	Confident	168 Å²	168	97.2 Å²	97.2	73%	0.73	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-71.5	-10	-179.7	-67	-174	177.3	-178.2	0	114.3	N14 K147	N14-K16 VanDerWaalsContact C-N 3.31Å; K16-K147 PolarHBondContact O-NZ 3.23Å
17	D	83.8	Confident	73.4	Confident	64 Å²	64	86.2 Å²	86.2	34%	0.342	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-117.9	36.9	-179.1	-64.2	-44.5	0	0	0	113.1	E15 F19 L63 K147	E15-D17 PolarHBondContact O-N 3.07Å; D17-F19 WeakPolarHBondContact O-CD2 3.33Å; D17-F19 PolarHBondContact O-N 3.44Å; D17-L63 WeakPolarHBondContact O-CA 3.31Å; D17-K147 IonicContact OD1-NZ 2.8Å; D17-K147 PolarHBondContact OD1-NZ 3.27Å
18	I	91.9	Very high	75.7	Confident	58 Å²	58	81.1 Å²	81.1	30%	0.297	44%	0.438	S	S	.	.			trans	-76.2	114.6	167.8	-62.4	166.7	0	0	0	108.8	E15 F20 Q21 C62 L63	E15-I18 HydrophobicContact CB-CD1 4.2Å; E15-I18 WeakPolarHBondContact O-CD1 3.46Å; E15-I18 WeakPolarHBondContact O-CG1 3.49Å; I18-F20 WeakPolarHBondContact CG2-O 3.18Å; I18-Q21 HydrophobicContact CG2-CB 4.11Å; I18-C62 WeakPolarHBondContact CA-O 3.48Å; I18-L63 HydrophobicContact CB-CD2 4.37Å; I18-L63 HydrophobicContact CG1-CD2 3.53Å
19	F	93.6	Very high	78.3	Confident	55 Å²	55	78.6 Å²	78.6	24%	0.241	42%	0.418	C	S	.	.			trans	-80.3	-34.7	174.1	-76.8	-97.1	0	0	0	112.2	D17 C62 Q64 L145 K147	D17-F19 WeakPolarHBondContact O-CD2 3.33Å; D17-F19 PolarHBondContact O-N 3.44Å; F19-C62 HydrophobicContact CB-CB 4.25Å; F19-C62 PolarHBondContact N-O 3.26Å; F19-Q64 HydrophobicContact CE2-CB 4.16Å; F19-L145 HydrophobicContact CB-CD1 3.99Å; F19-L145 HydrophobicContact CD1-CB 4.04Å; F19-L145 HydrophobicContact CD1-CD1 4.28Å; F19-L145 HydrophobicContact CD2-CB 3.97Å; F19-L145 HydrophobicContact CD2-CD1 3.97Å; F19-L145 HydrophobicContact CE1-CB 3.79Å; F19-L145 HydrophobicContact CE2-CB 3.73Å; F19-L145 HydrophobicContact CG-CB 4.12Å; F19-L145 HydrophobicContact CG-CD1 3.81Å; F19-L145 HydrophobicContact CZ-CB 3.62Å; F19-L145 WeakPolarHBondContact CZ-O 3.28Å; F19-K147 HydrophobicContact CD1-CG 4.37Å; F19-K147 HydrophobicContact CE1-CB 4.27Å; F19-K147 HydrophobicContact CE1-CG 3.58Å; F19-K147 VanDerWaalsContact CE1-N 3.34Å; F19-K147 HydrophobicContact CZ-CG 3.7Å
20	F	95.5	Very high	80.9	Confident	32 Å²	32	75.2 Å²	75.2	14%	0.14	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	149	-177.3	177	-107.9	0	0	0	110	I18 C22 S61 C62 D126 K129 L130 L133	I18-F20 WeakPolarHBondContact CG2-O 3.18Å; F20-C22 HydrophobicContact CE1-CB 3.77Å; F20-C22 HydrophobicContact CZ-CB 3.82Å; F20-S61 CarbonylContact O-C 3.6Å; F20-S61 WeakPolarHBondContact O-CA 3.31Å; F20-C62 HydrophobicContact CB-CB 4.14Å; F20-C62 PolarHBondContact O-N 2.87Å; F20-D126 HydrophobicContact CE1-CB 4.35Å; F20-D126 HydrophobicContact CZ-CB 3.89Å; F20-D126 WeakPolarHBondContact CZ-OD1 3.28Å; F20-K129 HydrophobicContact CD2-CD 4.18Å; F20-K129 HydrophobicContact CE1-CB 4.23Å; F20-K129 HydrophobicContact CE2-CB 4.18Å; F20-K129 HydrophobicContact CE2-CD 3.5Å; F20-K129 VanDerWaalsContact CE2-CD 3.5Å; F20-K129 HydrophobicContact CZ-CB 4.01Å; F20-K129 HydrophobicContact CZ-CD 3.88Å; F20-L130 HydrophobicContact CD1-CD2 3.8Å; F20-L130 HydrophobicContact CD1-CG 4.29Å; F20-L130 HydrophobicContact CE1-CD2 3.89Å; F20-L130 HydrophobicContact CE1-CG 3.92Å; F20-L133 HydrophobicContact CB-CD1 3.32Å; F20-L133 HydrophobicContact CD1-CD1 4.2Å; F20-L133 HydrophobicContact CG-CD1 3.93Å
21	Q	95.3	Very high	83	Confident	107 Å²	107	74 Å²	74	50%	0.5	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	134.3	176.2	-176.4	172.3	-73.8	0	0	110.6	I18 T59 I60 S61	I18-Q21 HydrophobicContact CG2-CB 4.11Å; Q21-T59 VanDerWaalsContact CD-CG2 3.44Å; Q21-T59 HydrophobicContact CG-CG2 3.38Å; Q21-I60 CarbonylContact C-O 3.49Å; Q21-I60 VanDerWaalsContact CA-O 3.28Å; Q21-I60 WeakPolarHBondContact CA-O 3.33Å; Q21-S61 PolarHBondContact OE1-OG 2.77Å
22	C	96.4	Very high	85.3	Confident	7 Å²	7	68.5 Å²	68.5	5%	0.047	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	164.3	173.8	65	0	0	0	0	112.1	F20 T59 I60 D126	F20-C22 HydrophobicContact CE1-CB 3.77Å; F20-C22 HydrophobicContact CZ-CB 3.82Å; C22-T59 WeakPolarHBondContact O-CA 3.39Å; C22-I60 PolarHBondContact N-O 2.94Å; C22-I60 PolarHBondContact O-N 3.17Å; C22-D126 HydrophobicContact CB-CB 3.72Å; C22-D126 WeakPolarHBondContact CB-OD2 3.47Å
23	R	96.6	Very high	87.5	Confident	173 Å²	173	65.7 Å²	65.7	65%	0.653	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	151.5	172.4	-63.1	-172.9	-58.6	-174.8	-0.3	110.3	D122	R23-D122 VanDerWaalsContact CB-OD2 3.27Å; R23-D122 WeakPolarHBondContact CB-OD2 3.1Å; R23-D122 PolarHBondContact O-N 2.94Å
24	G	95.4	Very high	89.5	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.01	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.5	-159.2	175.5	0	0	0	0	0	113.4	N57 I58 C120	G24-N57 WeakPolarHBondContact O-CA 3.31Å; G24-I58 PolarHBondContact N-O 2.8Å; G24-I58 WeakPolarHBondContact O-CG1 3.48Å; G24-I58 PolarHBondContact O-N 3.4Å; G24-I58 VanDerWaalsContact O-O 3.08Å; G24-C120 CarbonylContact C-O 3.42Å; G24-C120 WeakPolarHBondContact CA-O 3.22Å
25	K	95.4	Very high	91.3	Very high	65 Å²	65	68.9 Å²	68.9	28%	0.283	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	130.6	-172	-66.1	167.1	-173.1	171.6	0	109.5	L27 H55 T56 Y119 C120	K25-L27 HydrophobicContact CB-CD2 4.37Å; K25-H55 HydrophobicContact CB-CB 4.15Å; K25-T56 CarbonylContact C-O 3.54Å; K25-T56 WeakPolarHBondContact CA-O 2.98Å; K25-Y119 CarbonylContact O-C 3.53Å; K25-Y119 VanDerWaalsContact O-CA 3.26Å; K25-Y119 WeakPolarHBondContact O-CA 3.29Å; K25-C120 HydrophobicContact CB-CB 4.39Å; K25-C120 PolarHBondContact N-O 3.28Å; K25-C120 PolarHBondContact O-N 3.35Å
26	K	95.6	Very high	92.9	Very high	38 Å²	38	67.8 Å²	67.8	17%	0.165	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	120.8	163.5	-176.5	161.5	179	149.3	0	108.4	V29 H55 T56 I58 E117 Y119	K26-V29 VanDerWaalsContact NZ-CG2 3.26Å; K26-H55 WeakPolarHBondContact O-CA 3.35Å; K26-T56 PolarHBondContact N-O 3.24Å; K26-T56 PolarHBondContact O-N 3.27Å; K26-I58 HydrophobicContact CB-CD1 4.2Å; K26-I58 HydrophobicContact CB-CG2 4.19Å; K26-E117 IonicContact NZ-OE2 3.55Å; K26-E117 PolarHBondContact NZ-OE2 3.42Å; K26-Y119 HydrophobicContact CB-CD1 4.18Å; K26-Y119 HydrophobicContact CB-CE1 4.14Å; K26-Y119 HydrophobicContact CD-CE1 4.05Å; K26-Y119 HydrophobicContact CG-CD1 4.32Å; K26-Y119 HydrophobicContact CG-CE1 3.99Å
27	L	95.7	Very high	94.4	Very high	15 Å²	15	64.1 Å²	64.1	8%	0.079	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-39.6	-176	-55.7	175.6	0	0	0	111.9	K25 I47 H50 L51 H55 V101 S118 C120	K25-L27 HydrophobicContact CB-CD2 4.37Å; L27-I47 HydrophobicContact CD1-CD1 3.86Å; L27-H50 HydrophobicContact CB-CB 4.06Å; L27-L51 HydrophobicContact CD1-CD2 3.63Å; L27-L51 HydrophobicContact CD1-CG 4.26Å; L27-L51 HydrophobicContact CD2-CD2 4.24Å; L27-H55 HydrophobicContact CD2-CB 4.12Å; L27-V101 HydrophobicContact CD1-CG1 4.27Å; L27-S118 WeakPolarHBondContact CB-O 3.29Å; L27-S118 PolarHBondContact N-O 3.35Å; L27-C120 HydrophobicContact CD1-CB 4.21Å; L27-C120 HydrophobicContact CD2-CB 4.25Å; L27-C120 HydrophobicContact CG-CB 4.38Å
28	G	94.7	Very high	95	Very high	14 Å²	14	62.7 Å²	62.7	14%	0.144	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.4	170.8	-178.7	0	0	0	0	0	113.9	S118	G28-S118 PolarHBondContact O-N 2.87Å
29	V	95.3	Very high	95.2	Very high	66 Å²	66	61.9 Å²	61.9	40%	0.4	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	135.4	171.5	-178	0	0	0	0	107.5	K26 T115 Y116 E117	K26-V29 VanDerWaalsContact NZ-CG2 3.26Å; V29-T115 HydrophobicContact CG1-CG2 4.21Å; V29-Y116 CarbonylContact C-O 3.59Å; V29-Y116 VanDerWaalsContact CA-O 3.31Å; V29-Y116 WeakPolarHBondContact CA-O 3.28Å; V29-E117 HydrophobicContact CB-CG 4.49Å; V29-E117 HydrophobicContact CG1-CG 4.06Å; V29-E117 HydrophobicContact CG2-CB 4.47Å; V29-E117 HydrophobicContact CG2-CG 3.94Å
30	T	96.5	Very high	95.3	Very high	42 Å²	42	61.9 Å²	61.9	26%	0.258	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	123.8	170	-65.4	0	0	0	0	108	I46 H50 T115 Y116	T30-I46 HydrophobicContact CG2-CD1 4.06Å; T30-I46 HydrophobicContact CG2-CG1 4.41Å; T30-H50 PolarHBondContact OG1-NE2 3.09Å; T30-T115 CarbonylContact O-C 3.53Å; T30-T115 VanDerWaalsContact O-CA 3.31Å; T30-T115 WeakPolarHBondContact O-CA 3.35Å; T30-Y116 PolarHBondContact N-O 3.42Å; T30-Y116 PolarHBondContact O-N 3.42Å
31	E	96.8	Very high	95.4	Very high	108 Å²	108	67.5 Å²	67.5	51%	0.505	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	140.9	171.4	-171.6	169.9	159.3	0	0	108.9	K113 K114 T115	E31-K113 IonicContact OE1-NZ 3.75Å; E31-K113 PolarHBondContact OE1-NZ 3.25Å; E31-K113 IonicContact OE2-NZ 3.38Å; E31-K113 PolarHBondContact OE2-NZ 2.94Å; E31-K114 WeakPolarHBondContact CA-O 3.45Å; E31-T115 HydrophobicContact CB-CG2 4.32Å; E31-T115 HydrophobicContact CG-CG2 4.42Å
32	I	96	Very high	95.4	Very high	12 Å²	12	64.3 Å²	64.3	6%	0.062	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	158.4	177.1	62.8	171.5	0	0	0	110.5	E36 F38 L42 K114 Y116	I32-E36 HydrophobicContact CB-CB 4.35Å; I32-E36 WeakPolarHBondContact CB-OE2 3.4Å; I32-E36 HydrophobicContact CD1-CB 4.17Å; I32-F38 HydrophobicContact CD1-CD1 3.78Å; I32-F38 HydrophobicContact CD1-CE1 3.59Å; I32-F38 HydrophobicContact CD1-CZ 4.3Å; I32-F38 HydrophobicContact CG1-CE1 4.34Å; I32-L42 HydrophobicContact CG2-CD2 4.21Å; I32-K114 HydrophobicContact CD1-CB 3.88Å; I32-K114 HydrophobicContact CD1-CD 4.24Å; I32-K114 HydrophobicContact CG1-CB 3.39Å; I32-K114 HydrophobicContact CG1-CD 4.33Å; I32-K114 PolarHBondContact N-O 2.75Å; I32-Y116 HydrophobicContact CD1-CE2 3.9Å; I32-Y116 HydrophobicContact CG2-CD2 3.73Å; I32-Y116 HydrophobicContact CG2-CE2 3.69Å
33	A	95.2	Very high	95.4	Very high	47 Å²	47	64 Å²	64	39%	0.388	33%	0.329	S	S	.	.			trans	-69	154.3	-179.5	0	0	0	0	0	111.7	N35 E36	A33-N35 WeakPolarHBondContact CB-OD1 3.15Å; A33-N35 PolarHBondContact O-N 3.03Å; A33-E36 HydrophobicContact CB-CG 4.19Å; A33-E36 WeakPolarHBondContact O-CB 3.42Å; A33-E36 PolarHBondContact O-N 3.2Å
34	D	91.1	Very high	95.4	Very high	116 Å²	116	58.1 Å²	58.1	62%	0.62	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-29.5	-175.9	-64.3	-21.8	0	0	0	112.9	E36 K114	D34-E36 VanDerWaalsContact C-N 3.32Å; D34-K114 PolarHBondContact O-NZ 2.79Å
35	N	92.7	Very high	95.4	Very high	147 Å²	147	61.9 Å²	61.9	79%	0.786	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-9	176.2	65	-20.7	0	0	0	113.8	A33	A33-N35 WeakPolarHBondContact CB-OD1 3.15Å; A33-N35 PolarHBondContact O-N 3.03Å
36	E	94.1	Very high	95.4	Very high	88 Å²	88	59.1 Å²	59.1	41%	0.411	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-86.4	140.8	177.5	-67.2	-176.6	160.7	0	0	111.3	I32 A33 D34 K114	I32-E36 HydrophobicContact CB-CB 4.35Å; I32-E36 WeakPolarHBondContact CB-OE2 3.4Å; I32-E36 HydrophobicContact CD1-CB 4.17Å; A33-E36 HydrophobicContact CB-CG 4.19Å; A33-E36 WeakPolarHBondContact O-CB 3.42Å; A33-E36 PolarHBondContact O-N 3.2Å; D34-E36 VanDerWaalsContact C-N 3.32Å; E36-K114 PolarHBondContact O-NZ 3.07Å
37	S	94.8	Very high	95.4	Very high	91 Å²	91	57.6 Å²	57.6	64%	0.636	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-97.5	148.3	173.7	58	0	0	0	0	111	S39	S37-S39 PolarHBondContact O-N 2.74Å
38	F	96.8	Very high	95.4	Very high	34 Å²	34	63.9 Å²	63.9	15%	0.149	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-64.2	134.2	170.7	-63.4	-62.1	0	0	0	110.5	I32 K90 C105 K106 H107 K114 Y116	I32-F38 HydrophobicContact CD1-CD1 3.78Å; I32-F38 HydrophobicContact CD1-CE1 3.59Å; I32-F38 HydrophobicContact CD1-CZ 4.3Å; I32-F38 HydrophobicContact CG1-CE1 4.34Å; F38-K90 HydrophobicContact CD2-CB 3.77Å; F38-K90 HydrophobicContact CD2-CG 4.17Å; F38-K90 HydrophobicContact CE2-CB 3.91Å; F38-K90 HydrophobicContact CE2-CG 3.87Å; F38-C105 HydrophobicContact CB-CB 4.24Å; F38-C105 HydrophobicContact CD1-CB 3.58Å; F38-C105 HydrophobicContact CD2-CB 4.08Å; F38-C105 HydrophobicContact CE1-CB 3.87Å; F38-C105 HydrophobicContact CE2-CB 4.34Å; F38-C105 HydrophobicContact CG-CB 3.7Å; F38-C105 HydrophobicContact CZ-CB 4.25Å; F38-K106 WeakPolarHBondContact CZ-O 3.19Å; F38-H107 HydrophobicContact CE2-CB 4.33Å; F38-K114 HydrophobicContact CE1-CB 4.25Å; F38-K114 HydrophobicContact CE2-CG 4.38Å; F38-K114 HydrophobicContact CZ-CB 3.75Å; F38-K114 HydrophobicContact CZ-CG 4.03Å; F38-Y116 VanDerWaalsContact CA-OH 3.28Å; F38-Y116 WeakPolarHBondContact CA-OH 3.34Å; F38-Y116 HydrophobicContact CD1-CD2 4.36Å; F38-Y116 HydrophobicContact CD1-CE1 4.01Å; F38-Y116 AromaticContact CD1-CE2 3.8Å; F38-Y116 HydrophobicContact CD1-CE2 3.8Å; F38-Y116 AromaticContact CD1-CZ 3.62Å; F38-Y116 HydrophobicContact CE1-CD2 4.39Å; F38-Y116 HydrophobicContact CE1-CE2 4.2Å
39	S	96.4	Very high	95.4	Very high	42 Å²	42	69.6 Å²	69.6	29%	0.294	36%	0.358	S	S	.	.			trans	-145.5	149.8	177.8	74.1	0	0	0	0	111	S37 F41 L42 A43 Y116	S37-S39 PolarHBondContact O-N 2.74Å; S39-F41 VanDerWaalsContact C-N 3.31Å; S39-F41 PolarHBondContact O-N 3.31Å; S39-L42 PolarHBondContact O-N 3.38Å; S39-L42 WeakPolarHBondContact OG-CB 3.33Å; S39-L42 PolarHBondContact OG-N 3.21Å; S39-A43 PolarHBondContact O-N 3.38Å; S39-A43 VanDerWaalsContact O-N 3.11Å; S39-Y116 PolarHBondContact N-OH 2.95Å; S39-Y116 PolarHBondContact O-OH 2.87Å
40	R	95.7	Very high	95.5	Very high	55 Å²	55	66.5 Å²	66.5	21%	0.208	34%	0.339	C	S	.	.	H	α-helix	trans	-60.8	-42.9	176.1	176.3	60.4	-177.4	-96	2.8	111.4	L42 A43 D44 F93 F329	R40-L42 VanDerWaalsContact C-N 3.33Å; R40-L42 PolarHBondContact O-N 3.41Å; R40-A43 WeakPolarHBondContact O-CA 3.31Å; R40-A43 WeakPolarHBondContact O-CB 3.43Å; R40-A43 PolarHBondContact O-N 3.03Å; R40-A43 VanDerWaalsContact O-N 3.11Å; R40-D44 IonicContact CZ-OD1 3.21Å; R40-D44 IonicContact NE-OD1 2.87Å; R40-D44 PolarHBondContact NE-OD1 2.7Å; R40-D44 IonicContact NE-OD2 2.77Å; R40-D44 IonicContact NH2-OD1 3.18Å; R40-D44 PolarHBondContact O-N 2.9Å; R40-F93 HydrophobicContact CB-CE1 4.28Å; R40-F93 HydrophobicContact CB-CZ 4.44Å; R40-F329 HydrophobicContact CB-CE1 4.11Å; R40-F329 HydrophobicContact CG-CE1 3.91Å
41	F	95.9	Very high	95.4	Very high	149 Å²	149	67.3 Å²	67.3	65%	0.654	34%	0.341	S	S	*	.	H	α-helix	trans	-56.8	-45	179.3	176.9	-107.3	0	0	0	112.4	S39 D44 Q45	S39-F41 VanDerWaalsContact C-N 3.31Å; S39-F41 PolarHBondContact O-N 3.31Å; F41-D44 PolarHBondContact O-N 3.43Å; F41-Q45 PolarHBondContact O-N 3.1Å
42	L	96.1	Very high	95.3	Very high	40 Å²	40	66.5 Å²	66.5	21%	0.209	35%	0.353	C	S	.	.	H	α-helix	trans	-69	-38	177.6	-173.2	59	0	0	0	111.4	I32 S39 R40 D44 Q45 I46 Y116	I32-L42 HydrophobicContact CG2-CD2 4.21Å; S39-L42 PolarHBondContact O-N 3.38Å; S39-L42 WeakPolarHBondContact OG-CB 3.33Å; S39-L42 PolarHBondContact OG-N 3.21Å; R40-L42 VanDerWaalsContact C-N 3.33Å; R40-L42 PolarHBondContact O-N 3.41Å; L42-D44 VanDerWaalsContact C-N 3.33Å; L42-D44 PolarHBondContact O-N 3.21Å; L42-Q45 PolarHBondContact O-N 2.95Å; L42-I46 HydrophobicContact CD1-CD1 4.28Å; L42-I46 HydrophobicContact CD1-CG1 4.47Å; L42-I46 HydrophobicContact CG-CD1 3.86Å; L42-I46 HydrophobicContact CG-CG1 4.46Å; L42-I46 WeakPolarHBondContact O-CB 3.39Å; L42-I46 VanDerWaalsContact O-CG1 3.32Å; L42-I46 WeakPolarHBondContact O-CG1 3.37Å; L42-I46 PolarHBondContact O-N 3.2Å; L42-Y116 HydrophobicContact CD2-CE2 3.64Å; L42-Y116 HydrophobicContact CG-CE2 3.99Å
43	A	96.8	Very high	95	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-59.5	-41.6	173.6	0	0	0	0	0	112.2	S39 R40 Q45 I46 I47 F93 F95 Y116	S39-A43 PolarHBondContact O-N 3.38Å; S39-A43 VanDerWaalsContact O-N 3.11Å; R40-A43 WeakPolarHBondContact O-CA 3.31Å; R40-A43 WeakPolarHBondContact O-CB 3.43Å; R40-A43 PolarHBondContact O-N 3.03Å; R40-A43 VanDerWaalsContact O-N 3.11Å; A43-Q45 VanDerWaalsContact C-N 3.31Å; A43-Q45 PolarHBondContact O-N 2.9Å; A43-I46 PolarHBondContact O-N 3.37Å; A43-I47 WeakPolarHBondContact O-CB 3.32Å; A43-I47 WeakPolarHBondContact O-CG2 3.49Å; A43-I47 PolarHBondContact O-N 3.05Å; A43-F93 HydrophobicContact CB-CD2 3.57Å; A43-F93 HydrophobicContact CB-CE2 4Å; A43-F93 HydrophobicContact CB-CG 4.38Å; A43-F95 HydrophobicContact CB-CZ 3.96Å; A43-Y116 HydrophobicContact CB-CD1 4.18Å; A43-Y116 HydrophobicContact CB-CE1 3.81Å
44	D	95.8	Very high	94.6	Very high	51 Å²	51	73.1 Å²	73.1	27%	0.273	39%	0.392	S	S	.	.	H	α-helix	trans	-62.9	-34.4	175.5	-65.6	-31	0	0	0	112.5	R40 F41 L42 I47 K48 F95	R40-D44 IonicContact CZ-OD1 3.21Å; R40-D44 IonicContact NE-OD1 2.87Å; R40-D44 PolarHBondContact NE-OD1 2.7Å; R40-D44 IonicContact NE-OD2 2.77Å; R40-D44 IonicContact NH2-OD1 3.18Å; R40-D44 PolarHBondContact O-N 2.9Å; F41-D44 PolarHBondContact O-N 3.43Å; L42-D44 VanDerWaalsContact C-N 3.33Å; L42-D44 PolarHBondContact O-N 3.21Å; D44-I47 WeakPolarHBondContact O-CG2 3.36Å; D44-K48 WeakPolarHBondContact O-CD 3.18Å; D44-K48 WeakPolarHBondContact O-CG 3.5Å; D44-F95 WeakPolarHBondContact OD1-CE1 3.26Å
45	Q	95.7	Very high	94.7	Very high	79 Å²	79	72.4 Å²	72.4	37%	0.369	39%	0.385	S	S	.	.	H	α-helix	trans	-73.2	-43.8	173.9	-65.7	-171.4	31.5	0	0	112.2	F41 L42 A43 K48 K49	F41-Q45 PolarHBondContact O-N 3.1Å; L42-Q45 PolarHBondContact O-N 2.95Å; A43-Q45 VanDerWaalsContact C-N 3.31Å; A43-Q45 PolarHBondContact O-N 2.9Å; Q45-K48 PolarHBondContact O-N 3.23Å; Q45-K49 PolarHBondContact O-N 3.3Å
46	I	95.8	Very high	94.6	Very high	7 Å²	7	68.4 Å²	68.4	4%	0.036	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-42.2	-178.3	-72.8	171	0	0	0	110.5	T30 L42 A43 K48 K49 H50 Y116	T30-I46 HydrophobicContact CG2-CD1 4.06Å; T30-I46 HydrophobicContact CG2-CG1 4.41Å; L42-I46 HydrophobicContact CD1-CD1 4.28Å; L42-I46 HydrophobicContact CD1-CG1 4.47Å; L42-I46 HydrophobicContact CG-CD1 3.86Å; L42-I46 HydrophobicContact CG-CG1 4.46Å; L42-I46 WeakPolarHBondContact O-CB 3.39Å; L42-I46 VanDerWaalsContact O-CG1 3.32Å; L42-I46 WeakPolarHBondContact O-CG1 3.37Å; L42-I46 PolarHBondContact O-N 3.2Å; A43-I46 PolarHBondContact O-N 3.37Å; I46-K48 VanDerWaalsContact C-N 3.29Å; I46-K48 PolarHBondContact O-N 3.4Å; I46-K49 WeakPolarHBondContact O-CB 3.25Å; I46-K49 PolarHBondContact O-N 2.94Å; I46-H50 WeakPolarHBondContact CG2-CE1 3.49Å; I46-H50 PolarHBondContact O-N 3.46Å; I46-Y116 HydrophobicContact CD1-CD1 4.21Å; I46-Y116 HydrophobicContact CD1-CD2 3.23Å; I46-Y116 HydrophobicContact CD1-CE2 3.7Å; I46-Y116 HydrophobicContact CD1-CG 3.5Å
47	I	95.5	Very high	94.6	Very high	7 Å²	7	68.4 Å²	68.4	4%	0.036	37%	0.369	C	S	.	.	H	α-helix	trans	-64.3	-35.6	-178.2	-166.4	59.3	0	0	0	112.1	L27 A43 D44 K49 H50 L51 F95 V101 V103	L27-I47 HydrophobicContact CD1-CD1 3.86Å; A43-I47 WeakPolarHBondContact O-CB 3.32Å; A43-I47 WeakPolarHBondContact O-CG2 3.49Å; A43-I47 PolarHBondContact O-N 3.05Å; D44-I47 WeakPolarHBondContact O-CG2 3.36Å; I47-K49 VanDerWaalsContact C-N 3.3Å; I47-K49 PolarHBondContact O-N 2.99Å; I47-H50 PolarHBondContact O-N 2.96Å; I47-L51 HydrophobicContact CD1-CD1 4.35Å; I47-L51 HydrophobicContact CD1-CG 4.2Å; I47-L51 HydrophobicContact CG1-CD1 3.85Å; I47-L51 HydrophobicContact CG1-CG 4.21Å; I47-L51 WeakPolarHBondContact O-CB 3.49Å; I47-L51 VanDerWaalsContact O-CG 3.29Å; I47-L51 WeakPolarHBondContact O-CG 3.32Å; I47-L51 PolarHBondContact O-N 2.91Å; I47-F95 HydrophobicContact CB-CE1 4.17Å; I47-F95 HydrophobicContact CB-CZ 4.27Å; I47-F95 HydrophobicContact CG2-CD1 3.97Å; I47-F95 HydrophobicContact CG2-CE1 3.56Å; I47-F95 HydrophobicContact CG2-CZ 4.14Å; I47-V101 HydrophobicContact CD1-CG1 3.48Å; I47-V101 VanDerWaalsContact CD1-CG1 3.48Å; I47-V101 HydrophobicContact CG1-CG1 3.74Å; I47-V103 HydrophobicContact CB-CG2 4.49Å; I47-V103 HydrophobicContact CD1-CG2 4.1Å
48	K	95.2	Very high	94.6	Very high	147 Å²	147	64.2 Å²	64.2	64%	0.639	34%	0.339	S	S	*	.	H	α-helix	trans	-59.4	-42.6	174	-69.8	170.8	-173	177.3	0	110.9	D44 Q45 I46	D44-K48 WeakPolarHBondContact O-CD 3.18Å; D44-K48 WeakPolarHBondContact O-CG 3.5Å; Q45-K48 PolarHBondContact O-N 3.23Å; I46-K48 VanDerWaalsContact C-N 3.29Å; I46-K48 PolarHBondContact O-N 3.4Å
49	K	96.1	Very high	94.5	Very high	134 Å²	134	63.8 Å²	63.8	58%	0.583	34%	0.339	S	S	*	.	H	α-helix	trans	-68.8	-41.7	176.2	-64.4	178.1	-178.5	174.8	0	112.1	Q45 I46 I47 A52	Q45-K49 PolarHBondContact O-N 3.3Å; I46-K49 WeakPolarHBondContact O-CB 3.25Å; I46-K49 PolarHBondContact O-N 2.94Å; I47-K49 VanDerWaalsContact C-N 3.3Å; I47-K49 PolarHBondContact O-N 2.99Å; K49-A52 PolarHBondContact O-N 3.43Å
50	H	96.4	Very high	94.5	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-68.2	-35.8	-178.9	-73.3	178.1	0	0	0	112.9	L27 T30 I46 I47 A52 K53 S118	L27-H50 HydrophobicContact CB-CB 4.06Å; T30-H50 PolarHBondContact OG1-NE2 3.09Å; I46-H50 WeakPolarHBondContact CG2-CE1 3.49Å; I46-H50 PolarHBondContact O-N 3.46Å; I47-H50 PolarHBondContact O-N 2.96Å; H50-A52 VanDerWaalsContact C-N 3.3Å; H50-A52 PolarHBondContact O-N 3.43Å; H50-K53 PolarHBondContact O-N 2.8Å; H50-S118 VanDerWaalsContact ND1-CB 3.25Å; H50-S118 WeakPolarHBondContact ND1-CB 3.45Å; H50-S118 PolarHBondContact ND1-OG 3.42Å
51	L	94.8	Very high	94.4	Very high	59 Å²	59	59.4 Å²	59.4	31%	0.309	32%	0.317	S	S	.	.	H	α-helix	trans	-71.4	-23.3	178.3	-72.9	167.8	0	0	0	114	L27 I47 K53 K98	L27-L51 HydrophobicContact CD1-CD2 3.63Å; L27-L51 HydrophobicContact CD1-CG 4.26Å; L27-L51 HydrophobicContact CD2-CD2 4.24Å; I47-L51 HydrophobicContact CD1-CD1 4.35Å; I47-L51 HydrophobicContact CD1-CG 4.2Å; I47-L51 HydrophobicContact CG1-CD1 3.85Å; I47-L51 HydrophobicContact CG1-CG 4.21Å; I47-L51 WeakPolarHBondContact O-CB 3.49Å; I47-L51 VanDerWaalsContact O-CG 3.29Å; I47-L51 WeakPolarHBondContact O-CG 3.32Å; I47-L51 PolarHBondContact O-N 2.91Å; L51-K53 VanDerWaalsContact C-N 3.3Å; L51-K98 HydrophobicContact CD1-CD 3.26Å
52	A	93.9	Very high	94.4	Very high	90 Å²	90	52.3 Å²	52.3	74%	0.744	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-15.6	174.2	0	0	0	0	0	112.9	K49 H50	K49-A52 PolarHBondContact O-N 3.43Å; H50-A52 VanDerWaalsContact C-N 3.3Å; H50-A52 PolarHBondContact O-N 3.43Å
53	K	90.6	Very high	94.3	Very high	130 Å²	130	51.1 Å²	51.1	57%	0.565	28%	0.28	S	S	*	.	S	Bend	trans	-89	163.1	179	-67.5	177.9	-178	-178.8	0	110.8	H50 L51	H50-K53 PolarHBondContact O-N 2.8Å; L51-K53 VanDerWaalsContact C-N 3.3Å
54	G	86.6	Confident	94.2	Very high	69 Å²	69	54.3 Å²	54.3	71%	0.711	30%	0.295	S	S	*	.			trans	-62.6	155.2	170.1	0	0	0	0	0	111.9
55	H	92.5	Very high	94.1	Very high	100 Å²	100	53.9 Å²	53.9	46%	0.463	29%	0.292	S	S	.	.			trans	-117	160.5	-179.4	55.4	-89.6	0	0	0	111.7	K25 K26 L27	K25-H55 HydrophobicContact CB-CB 4.15Å; K26-H55 WeakPolarHBondContact O-CA 3.35Å; L27-H55 HydrophobicContact CD2-CB 4.12Å
56	T	91.8	Very high	94.1	Very high	63 Å²	63	52.3 Å²	52.3	39%	0.387	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.6	172.6	-56.1	0	0	0	0	109.9	K25 K26 I58 K71	K25-T56 CarbonylContact C-O 3.54Å; K25-T56 WeakPolarHBondContact CA-O 2.98Å; K26-T56 PolarHBondContact N-O 3.24Å; K26-T56 PolarHBondContact O-N 3.27Å; T56-I58 HydrophobicContact CG2-CG2 4.47Å; T56-I58 PolarHBondContact O-N 3.44Å; T56-K71 HydrophobicContact CG2-CG 4.09Å
57	N	93.8	Very high	94.1	Very high	88 Å²	88	52.1 Å²	52.1	47%	0.471	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	131.2	174.5	-63.3	-21.8	0	0	0	110.5	G24 S72	G24-N57 WeakPolarHBondContact O-CA 3.31Å; N57-S72 PolarHBondContact O-N 3.05Å
58	I	94.3	Very high	94	Very high	3 Å²	3	55.4 Å²	55.4	2%	0.015	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	161.1	-176.4	60.1	162.1	0	0	0	111.3	G24 K26 T56 I60 F69 S70 Y119	G24-I58 PolarHBondContact N-O 2.8Å; G24-I58 WeakPolarHBondContact O-CG1 3.48Å; G24-I58 PolarHBondContact O-N 3.4Å; G24-I58 VanDerWaalsContact O-O 3.08Å; K26-I58 HydrophobicContact CB-CD1 4.2Å; K26-I58 HydrophobicContact CB-CG2 4.19Å; T56-I58 HydrophobicContact CG2-CG2 4.47Å; T56-I58 PolarHBondContact O-N 3.44Å; I58-I60 HydrophobicContact CD1-CD1 4.29Å; I58-I60 HydrophobicContact CD1-CG1 3.8Å; I58-I60 HydrophobicContact CG1-CG1 4.37Å; I58-F69 HydrophobicContact CD1-CB 4.46Å; I58-F69 HydrophobicContact CD1-CD1 3.91Å; I58-S70 CarbonylContact C-O 3.47Å; I58-S70 WeakPolarHBondContact CA-O 3.44Å; I58-S70 VanDerWaalsContact CB-O 3.26Å; I58-S70 WeakPolarHBondContact CB-O 3.47Å; I58-Y119 HydrophobicContact CD1-CD1 3.61Å; I58-Y119 HydrophobicContact CD1-CE1 3.77Å
59	T	94.4	Very high	93.9	Very high	25 Å²	25	48.9 Å²	48.9	15%	0.153	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.5	162.3	-59	0	0	0	0	108.1	Q21 C22 F69 S70	Q21-T59 VanDerWaalsContact CD-CG2 3.44Å; Q21-T59 HydrophobicContact CG-CG2 3.38Å; C22-T59 WeakPolarHBondContact O-CA 3.39Å; T59-F69 CarbonylContact O-C 3.59Å; T59-F69 WeakPolarHBondContact O-CA 3.44Å; T59-S70 WeakPolarHBondContact CB-OG 3.43Å; T59-S70 PolarHBondContact N-O 2.86Å; T59-S70 PolarHBondContact O-N 2.93Å
60	I	95.7	Very high	93.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.5	177.8	-51.9	168.7	0	0	0	106.7	Q21 C22 I58 K68 F69 F102 L130	Q21-I60 CarbonylContact C-O 3.49Å; Q21-I60 VanDerWaalsContact CA-O 3.28Å; Q21-I60 WeakPolarHBondContact CA-O 3.33Å; C22-I60 PolarHBondContact N-O 2.94Å; C22-I60 PolarHBondContact O-N 3.17Å; I58-I60 HydrophobicContact CD1-CD1 4.29Å; I58-I60 HydrophobicContact CD1-CG1 3.8Å; I58-I60 HydrophobicContact CG1-CG1 4.37Å; I60-K68 WeakPolarHBondContact CA-O 3.45Å; I60-F69 HydrophobicContact CB-CD1 4.5Å; I60-F69 HydrophobicContact CG1-CD1 3.99Å; I60-F69 HydrophobicContact CG1-CE1 4.24Å; I60-F69 HydrophobicContact CG2-CD1 4.19Å; I60-F69 HydrophobicContact CG2-CE1 3.94Å; I60-F102 HydrophobicContact CD1-CE1 4.29Å; I60-F102 HydrophobicContact CD1-CZ 3.97Å; I60-L130 HydrophobicContact CD1-CD1 4.23Å; I60-L130 HydrophobicContact CG2-CD1 4.46Å; I60-L130 HydrophobicContact CG2-CD2 4.09Å
61	S	95.1	Very high	93.3	Very high	6 Å²	6	49.3 Å²	49.3	4%	0.042	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	125.7	176.2	-47.6	0	0	0	0	109.6	F20 Q21 K68	F20-S61 CarbonylContact O-C 3.6Å; F20-S61 WeakPolarHBondContact O-CA 3.31Å; Q21-S61 PolarHBondContact OE1-OG 2.77Å; S61-K68 PolarHBondContact N-O 3.32Å; S61-K68 PolarHBondContact O-N 2.91Å
62	C	95.4	Very high	92.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	113.4	168.8	-65.2	0	0	0	0	108.8	I18 F19 F20 L67 L130 L133 L145	I18-C62 WeakPolarHBondContact CA-O 3.48Å; F19-C62 HydrophobicContact CB-CB 4.25Å; F19-C62 PolarHBondContact N-O 3.26Å; F20-C62 HydrophobicContact CB-CB 4.14Å; F20-C62 PolarHBondContact O-N 2.87Å; C62-L67 HydrophobicContact CB-CD2 4.34Å; C62-L67 WeakPolarHBondContact SG-CD2 3.24Å; C62-L130 WeakPolarHBondContact SG-CD2 3.31Å; C62-L133 HydrophobicContact CB-CD1 4.11Å; C62-L145 HydrophobicContact CB-CD1 4.25Å
63	L	94.5	Very high	91.2	Very high	15 Å²	15	50 Å²	50	8%	0.079	28%	0.28	C	S	.	.			trans	-102.2	178.1	173.2	-59.8	177.7	0	0	0	109.6	D17 I18 D65 R66 K68 Y86	D17-L63 WeakPolarHBondContact O-CA 3.31Å; I18-L63 HydrophobicContact CB-CD2 4.37Å; I18-L63 HydrophobicContact CG1-CD2 3.53Å; L63-D65 VanDerWaalsContact C-N 3.29Å; L63-D65 PolarHBondContact O-N 3.38Å; L63-R66 HydrophobicContact CB-CG 4.06Å; L63-R66 WeakPolarHBondContact CB-O 3.25Å; L63-R66 HydrophobicContact CD1-CG 3.93Å; L63-R66 HydrophobicContact CG-CG 4.46Å; L63-R66 PolarHBondContact N-O 3.46Å; L63-K68 HydrophobicContact CD1-CB 4Å; L63-K68 HydrophobicContact CD1-CD 4.15Å; L63-K68 HydrophobicContact CG-CB 4.48Å; L63-Y86 VanDerWaalsContact O-CE2 3.32Å; L63-Y86 WeakPolarHBondContact O-CE2 3.35Å; L63-Y86 PolarHBondContact O-OH 3.11Å
64	Q	94.8	Very high	89.4	Confident	66 Å²	66	48.7 Å²	48.7	31%	0.308	29%	0.287	S	S	.	.	S	Bend	trans	-53.7	-42.3	-179.8	-166.9	-178.6	-6	0	0	113.6	F19 R144 L145	F19-Q64 HydrophobicContact CE2-CB 4.16Å; Q64-R144 HydrophobicContact CG-CB 4.28Å; Q64-R144 CarbonylContact O-C 3.59Å; Q64-R144 WeakPolarHBondContact O-CA 3.43Å; Q64-R144 WeakPolarHBondContact O-CB 3.46Å; Q64-L145 VanDerWaalsContact CG-O 3.3Å; Q64-L145 WeakPolarHBondContact CG-O 3.33Å; Q64-L145 PolarHBondContact O-N 3.37Å
65	D	94	Very high	88.2	Confident	42 Å²	42	52.6 Å²	52.6	23%	0.225	29%	0.29	C	S	.	.	S	Bend	trans	-121.9	-3.1	-170.2	64.3	-15.8	0	0	0	114.1	L63 E85 Y86 R144	L63-D65 VanDerWaalsContact C-N 3.29Å; L63-D65 PolarHBondContact O-N 3.38Å; D65-E85 WeakPolarHBondContact O-CA 3.26Å; D65-Y86 WeakPolarHBondContact O-CD2 3.31Å; D65-Y86 PolarHBondContact O-N 2.89Å; D65-R144 HydrophobicContact CB-CG 4.26Å
66	R	94.8	Very high	86.5	Confident	47 Å²	47	54.1 Å²	54.1	18%	0.177	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	157.7	-169.8	68.9	-168.3	70.4	-135.8	-6.6	113.7	L63 Y83 A84 E85 Y86	L63-R66 HydrophobicContact CB-CG 4.06Å; L63-R66 WeakPolarHBondContact CB-O 3.25Å; L63-R66 HydrophobicContact CD1-CG 3.93Å; L63-R66 HydrophobicContact CG-CG 4.46Å; L63-R66 PolarHBondContact N-O 3.46Å; R66-Y83 VanDerWaalsContact NH1-CD2 3.33Å; R66-Y83 VanDerWaalsContact NH1-CZ 3.29Å; R66-A84 CarbonylContact C-O 3.56Å; R66-A84 VanDerWaalsContact CA-O 3.29Å; R66-A84 WeakPolarHBondContact CA-O 3.49Å; R66-A84 WeakPolarHBondContact CB-O 3.33Å; R66-E85 HydrophobicContact CB-CG 4.36Å; R66-E85 IonicContact CZ-OE1 3.04Å; R66-E85 IonicContact NH1-OE1 2.65Å; R66-E85 PolarHBondContact NH1-OE1 3.37Å; R66-E85 IonicContact NH2-OE1 2.66Å; R66-E85 PolarHBondContact NH2-OE1 2.9Å; R66-Y86 VanDerWaalsContact N-CE2 3.35Å
67	L	95.4	Very high	84.5	Confident	2 Å²	2	56 Å²	56	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	125	158.9	-62.6	177.7	0	0	0	109.4	C62 F69 Y83 A84 Y86 I89 I104 V134	C62-L67 HydrophobicContact CB-CD2 4.34Å; C62-L67 WeakPolarHBondContact SG-CD2 3.24Å; L67-F69 HydrophobicContact CB-CE1 4.44Å; L67-F69 HydrophobicContact CB-CE2 3.94Å; L67-F69 HydrophobicContact CB-CZ 3.73Å; L67-F69 HydrophobicContact CD1-CZ 4.1Å; L67-Y83 CarbonylContact O-C 3.54Å; L67-Y83 WeakPolarHBondContact O-CA 3.34Å; L67-Y83 WeakPolarHBondContact O-CB 3.47Å; L67-A84 PolarHBondContact N-O 3.11Å; L67-A84 PolarHBondContact O-N 3.3Å; L67-Y86 HydrophobicContact CD2-CE1 3.81Å; L67-Y86 HydrophobicContact CG-CE1 3.76Å; L67-I89 HydrophobicContact CD1-CD1 4.05Å; L67-I104 HydrophobicContact CD1-CD1 3.57Å; L67-V134 HydrophobicContact CD1-CG2 4.01Å; L67-V134 HydrophobicContact CD2-CG2 4.31Å
68	K	94.2	Very high	82.1	Confident	76 Å²	76	59.6 Å²	59.6	33%	0.33	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	129.4	173.7	-177.9	-178.1	177.3	-173.6	0	109.3	E15 I60 S61 L63	E15-K68 IonicContact OE1-NZ 2.66Å; I60-K68 WeakPolarHBondContact CA-O 3.45Å; S61-K68 PolarHBondContact N-O 3.32Å; S61-K68 PolarHBondContact O-N 2.91Å; L63-K68 HydrophobicContact CD1-CB 4Å; L63-K68 HydrophobicContact CD1-CD 4.15Å; L63-K68 HydrophobicContact CG-CB 4.48Å
69	F	93.8	Very high	79.9	Confident	10 Å²	10	62 Å²	62	4%	0.044	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	101	178.8	-51.7	-83.7	0	0	0	110.4	I58 T59 I60 L67 K82 A84 I104 Y119	I58-F69 HydrophobicContact CD1-CB 4.46Å; I58-F69 HydrophobicContact CD1-CD1 3.91Å; T59-F69 CarbonylContact O-C 3.59Å; T59-F69 WeakPolarHBondContact O-CA 3.44Å; I60-F69 HydrophobicContact CB-CD1 4.5Å; I60-F69 HydrophobicContact CG1-CD1 3.99Å; I60-F69 HydrophobicContact CG1-CE1 4.24Å; I60-F69 HydrophobicContact CG2-CD1 4.19Å; I60-F69 HydrophobicContact CG2-CE1 3.94Å; L67-F69 HydrophobicContact CB-CE1 4.44Å; L67-F69 HydrophobicContact CB-CE2 3.94Å; L67-F69 HydrophobicContact CB-CZ 3.73Å; L67-F69 HydrophobicContact CD1-CZ 4.1Å; F69-K82 HydrophobicContact CB-CB 4.07Å; F69-K82 WeakPolarHBondContact CD2-O 3.44Å; F69-K82 PolarHBondContact N-O 3.18Å; F69-K82 VanDerWaalsContact O-CB 3.23Å; F69-K82 WeakPolarHBondContact O-CB 3.03Å; F69-A84 HydrophobicContact CE2-CB 3.96Å; F69-I104 HydrophobicContact CZ-CD1 3.96Å; F69-Y119 HydrophobicContact CD1-CD1 4.26Å; F69-Y119 AromaticContact CD1-CE1 3.55Å; F69-Y119 HydrophobicContact CD1-CE1 3.55Å; F69-Y119 AromaticContact CD1-CZ 3.91Å; F69-Y119 HydrophobicContact CE1-CD1 4.14Å; F69-Y119 AromaticContact CE1-CE1 3.55Å; F69-Y119 HydrophobicContact CE1-CE1 3.55Å; F69-Y119 HydrophobicContact CE1-CE2 4.13Å; F69-Y119 AromaticContact CE1-CZ 3.55Å; F69-Y119 WeakPolarHBondContact CE2-OH 3.37Å; F69-Y119 HydrophobicContact CG-CE1 4.18Å; F69-Y119 HydrophobicContact CZ-CE1 4.2Å; F69-Y119 HydrophobicContact CZ-CE2 4.14Å; F69-Y119 AromaticContact CZ-CZ 3.71Å; F69-Y119 WeakPolarHBondContact CZ-OH 3.21Å
70	S	90.3	Very high	77.7	Confident	48 Å²	48	67 Å²	67	34%	0.336	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	139.7	176.4	54.7	0	0	0	0	111	I58 T59	I58-S70 CarbonylContact C-O 3.47Å; I58-S70 WeakPolarHBondContact CA-O 3.44Å; I58-S70 VanDerWaalsContact CB-O 3.26Å; I58-S70 WeakPolarHBondContact CB-O 3.47Å; T59-S70 WeakPolarHBondContact CB-OG 3.43Å; T59-S70 PolarHBondContact N-O 2.86Å; T59-S70 PolarHBondContact O-N 2.93Å
71	K	88.5	Confident	75.8	Confident	96 Å²	96	76.6 Å²	76.6	42%	0.417	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	134.4	173	-79.2	169.9	158.1	164.3	0	108.9	T56 S73 S79 K82	T56-K71 HydrophobicContact CG2-CG 4.09Å; K71-S73 VanDerWaalsContact C-N 3.29Å; K71-S73 PolarHBondContact O-N 2.81Å; K71-S79 PolarHBondContact NZ-OG 3.31Å; K71-K82 VanDerWaalsContact CE-NZ 3.32Å
72	S	76.7	Confident	75.1	Confident	79 Å²	79	78.6 Å²	78.6	55%	0.552	42%	0.419	S	S	*	.	S	Bend	trans	-71.3	-21.4	-179.9	178.4	0	0	0	0	113.6	N57	N57-S72 PolarHBondContact O-N 3.05Å
73	S	67.2	Low	74.9	Confident	85 Å²	85	80.7 Å²	80.7	59%	0.594	43%	0.428	S	S	*	.			trans	-110.3	118.7	178.1	-177.4	0	0	0	0	110.3	K71	K71-S73 VanDerWaalsContact C-N 3.29Å; K71-S73 PolarHBondContact O-N 2.81Å
74	S	54.7	Low	74.9	Confident	103 Å²	103	80.1 Å²	80.1	72%	0.72	43%	0.425	S	S	*	.			trans	-103.6	16.2	-164.4	54.9	0	0	0	0	114.5	I76	S74-I76 PolarHBondContact O-N 2.84Å; S74-I76 VanDerWaalsContact O-N 3.12Å
75	I	61.4	Low	74.9	Confident	150 Å²	150	78 Å²	78	77%	0.769	42%	0.415	S	S	*	.	S	Bend	trans	-63.9	-23.7	-176.2	-56.2	174.3	0	0	0	111.6
76	I	56.2	Low	75	Confident	132 Å²	132	76 Å²	76	68%	0.677	40%	0.404	S	S	*	.			trans	-128.1	107.6	177.8	-52.2	176.4	0	0	0	110	S74 H78	S74-I76 PolarHBondContact O-N 2.84Å; S74-I76 VanDerWaalsContact O-N 3.12Å; I76-H78 HydrophobicContact CG2-CB 4.36Å; I76-H78 PolarHBondContact O-N 3.43Å
77	P	49.2	Very low	75.1	Confident	104 Å²	104	78.1 Å²	78.1	68%	0.675	42%	0.415	S	S	*	.			trans	-76.6	24.7	-174.3	28.3	-32.4	0	0	0	115.3
78	H	44.5	Very low	75.1	Confident	163 Å²	163	78.5 Å²	78.5	76%	0.755	42%	0.417	S	S	*	.			trans	-125.9	47.6	-166.2	-58.6	-48.9	0	0	0	114.9	I76	I76-H78 HydrophobicContact CG2-CB 4.36Å; I76-H78 PolarHBondContact O-N 3.43Å
79	S	47.8	Very low	75.2	Confident	54 Å²	54	75 Å²	75	38%	0.378	40%	0.402	S	S	.	.			trans	-103.5	109.1	165.8	-154.6	0	0	0	0	108.6	K71 K82	K71-S79 PolarHBondContact NZ-OG 3.31Å; S79-K82 WeakPolarHBondContact OG-CE 3.19Å
80	T	46.9	Very low	75.3	Confident	128 Å²	128	79 Å²	79	79%	0.785	42%	0.419	S	S	*	.			trans	-40.1	142.1	171.2	44	0	0	0	0	112.4	K82	T80-K82 PolarHBondContact O-N 3.43Å
81	R	56.3	Low	75.6	Confident	202 Å²	202	79.6 Å²	79.6	76%	0.762	42%	0.418	S	S	*	.			trans	-19.9	115.7	-178.1	-89.1	168.1	175	-149.7	8.6	113.9	Y83	R81-Y83 HydrophobicContact CB-CD1 4.09Å; R81-Y83 HydrophobicContact CB-CE1 3.8Å; R81-Y83 HydrophobicContact CG-CD1 4.05Å; R81-Y83 HydrophobicContact CG-CE1 3.53Å; R81-Y83 PolarHBondContact NH1-OH 2.92Å
82	K	81.1	Confident	76	Confident	49 Å²	49	76.8 Å²	76.8	21%	0.213	41%	0.406	C	S	.	.			trans	-112.8	70.7	173.9	-65	-172.6	175.5	-163.7	0	110.2	F69 K71 S79 T80	F69-K82 HydrophobicContact CB-CB 4.07Å; F69-K82 WeakPolarHBondContact CD2-O 3.44Å; F69-K82 PolarHBondContact N-O 3.18Å; F69-K82 VanDerWaalsContact O-CB 3.23Å; F69-K82 WeakPolarHBondContact O-CB 3.03Å; K71-K82 VanDerWaalsContact CE-NZ 3.32Å; S79-K82 WeakPolarHBondContact OG-CE 3.19Å; T80-K82 PolarHBondContact O-N 3.43Å
83	Y	91	Very high	77	Confident	44 Å²	44	73.9 Å²	73.9	17%	0.173	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	154.1	168.1	60.6	-106.9	0	0	0	110.9	R66 L67 R81 E85	R66-Y83 VanDerWaalsContact NH1-CD2 3.33Å; R66-Y83 VanDerWaalsContact NH1-CZ 3.29Å; L67-Y83 CarbonylContact O-C 3.54Å; L67-Y83 WeakPolarHBondContact O-CA 3.34Å; L67-Y83 WeakPolarHBondContact O-CB 3.47Å; R81-Y83 HydrophobicContact CB-CD1 4.09Å; R81-Y83 HydrophobicContact CB-CE1 3.8Å; R81-Y83 HydrophobicContact CG-CD1 4.05Å; R81-Y83 HydrophobicContact CG-CE1 3.53Å; R81-Y83 PolarHBondContact NH1-OH 2.92Å; Y83-E85 HydrophobicContact CD2-CG 3.86Å; Y83-E85 HydrophobicContact CE2-CG 3.87Å
84	A	93.9	Very high	78.3	Confident	3 Å²	3	72.2 Å²	72.2	3%	0.025	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	113.7	167.1	0	0	0	0	0	107.6	R66 L67 F69 I89 K106	R66-A84 CarbonylContact C-O 3.56Å; R66-A84 VanDerWaalsContact CA-O 3.29Å; R66-A84 WeakPolarHBondContact CA-O 3.49Å; R66-A84 WeakPolarHBondContact CB-O 3.33Å; L67-A84 PolarHBondContact N-O 3.11Å; L67-A84 PolarHBondContact O-N 3.3Å; F69-A84 HydrophobicContact CE2-CB 3.96Å; A84-I89 HydrophobicContact CB-CD1 4.27Å; A84-I89 HydrophobicContact CB-CG1 4.34Å; A84-K106 HydrophobicContact CB-CD 4.35Å
85	E	95	Very high	80.2	Confident	20 Å²	20	67.6 Å²	67.6	9%	0.093	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	141.7	174.4	-57	-164.2	163.7	0	0	109.2	D65 R66 Y83 K87 D88 I89	D65-E85 WeakPolarHBondContact O-CA 3.26Å; R66-E85 HydrophobicContact CB-CG 4.36Å; R66-E85 IonicContact CZ-OE1 3.04Å; R66-E85 IonicContact NH1-OE1 2.65Å; R66-E85 PolarHBondContact NH1-OE1 3.37Å; R66-E85 IonicContact NH2-OE1 2.66Å; R66-E85 PolarHBondContact NH2-OE1 2.9Å; Y83-E85 HydrophobicContact CD2-CG 3.86Å; Y83-E85 HydrophobicContact CE2-CG 3.87Å; E85-K87 HydrophobicContact CB-CD 4.5Å; E85-K87 HydrophobicContact CB-CG 4.09Å; E85-K87 PolarHBondContact O-N 3.22Å; E85-K87 WeakPolarHBondContact OE2-CE 3.44Å; E85-K87 IonicContact OE2-NZ 3.83Å; E85-K87 PolarHBondContact OE2-NZ 3.43Å; E85-D88 PolarHBondContact O-N 2.76Å; E85-I89 PolarHBondContact O-N 3.2Å
86	Y	96.4	Very high	81.5	Confident	1 Å²	1	64.4 Å²	64.4	0%	0.004	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-59.9	-33.7	-176	-66	-56	0	0	0	112.2	L63 D65 R66 L67 D88 I89 V134 A137 H143 L145	L63-Y86 VanDerWaalsContact O-CE2 3.32Å; L63-Y86 WeakPolarHBondContact O-CE2 3.35Å; L63-Y86 PolarHBondContact O-OH 3.11Å; D65-Y86 WeakPolarHBondContact O-CD2 3.31Å; D65-Y86 PolarHBondContact O-N 2.89Å; R66-Y86 VanDerWaalsContact N-CE2 3.35Å; L67-Y86 HydrophobicContact CD2-CE1 3.81Å; L67-Y86 HydrophobicContact CG-CE1 3.76Å; Y86-D88 VanDerWaalsContact C-N 3.25Å; Y86-D88 PolarHBondContact O-N 2.97Å; Y86-I89 HydrophobicContact CD1-CD1 4.15Å; Y86-I89 PolarHBondContact O-N 3.19Å; Y86-V134 HydrophobicContact CE1-CG2 4.07Å; Y86-A137 HydrophobicContact CD1-CB 3.95Å; Y86-A137 HydrophobicContact CD2-CB 3.48Å; Y86-A137 VanDerWaalsContact CD2-CB 3.48Å; Y86-A137 HydrophobicContact CE1-CB 4.25Å; Y86-A137 HydrophobicContact CE2-CB 3.8Å; Y86-A137 HydrophobicContact CG-CB 3.57Å; Y86-H143 WeakPolarHBondContact CB-O 3.48Å; Y86-H143 WeakPolarHBondContact CD2-O 3.33Å; Y86-L145 HydrophobicContact CE2-CD1 4.06Å; Y86-L145 HydrophobicContact CE2-CG 4.01Å; Y86-L145 WeakPolarHBondContact OH-CD1 3.45Å
87	K	96	Very high	83.2	Confident	92 Å²	92	61.4 Å²	61.4	40%	0.4	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-61.4	-29.3	176.3	78	-170.1	-162.8	-157.6	0	114	E85 K90 H143	E85-K87 HydrophobicContact CB-CD 4.5Å; E85-K87 HydrophobicContact CB-CG 4.09Å; E85-K87 PolarHBondContact O-N 3.22Å; E85-K87 WeakPolarHBondContact OE2-CE 3.44Å; E85-K87 IonicContact OE2-NZ 3.83Å; E85-K87 PolarHBondContact OE2-NZ 3.43Å; K87-K90 PolarHBondContact O-NZ 2.78Å; K87-H143 HydrophobicContact CB-CB 4Å
88	D	95.7	Very high	85.3	Confident	9 Å²	9	60.6 Å²	60.6	5%	0.048	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-85.7	-16.6	-178.7	-65.9	-20	0	0	0	111.6	E85 Y86 K90 K106 H107 S109	E85-D88 PolarHBondContact O-N 2.76Å; Y86-D88 VanDerWaalsContact C-N 3.25Å; Y86-D88 PolarHBondContact O-N 2.97Å; D88-K90 PolarHBondContact O-N 3.25Å; D88-K106 HydrophobicContact CB-CD 4.44Å; D88-K106 HydrophobicContact CB-CG 3.83Å; D88-K106 WeakPolarHBondContact O-CA 3.48Å; D88-H107 WeakPolarHBondContact CB-O 3.47Å; D88-H107 PolarHBondContact O-N 3.02Å; D88-S109 PolarHBondContact OD1-OG 2.79Å
89	I	96.7	Very high	87.6	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.015	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	101.6	179.7	-60.8	175.3	0	0	0	109.8	L67 A84 E85 Y86 I104 K138	L67-I89 HydrophobicContact CD1-CD1 4.05Å; A84-I89 HydrophobicContact CB-CD1 4.27Å; A84-I89 HydrophobicContact CB-CG1 4.34Å; E85-I89 PolarHBondContact O-N 3.2Å; Y86-I89 HydrophobicContact CD1-CD1 4.15Å; Y86-I89 PolarHBondContact O-N 3.19Å; I89-I104 HydrophobicContact CB-CG2 4.1Å; I89-I104 HydrophobicContact CD1-CD1 4.48Å; I89-I104 HydrophobicContact CD1-CG2 4.08Å; I89-I104 HydrophobicContact CG1-CG2 3.77Å; I89-I104 HydrophobicContact CG2-CG2 3.39Å; I89-K138 HydrophobicContact CG2-CD 4.46Å; I89-K138 VanDerWaalsContact O-CE 3.26Å; I89-K138 WeakPolarHBondContact O-CE 3.16Å; I89-K138 PolarHBondContact O-NZ 2.91Å
90	K	96.2	Very high	89.9	Confident	95 Å²	95	55 Å²	55	41%	0.413	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	-47.3	179	-58.1	-50	179.7	-166.8	0	111.6	F38 K87 D88 C105 H107 K138	F38-K90 HydrophobicContact CD2-CB 3.77Å; F38-K90 HydrophobicContact CD2-CG 4.17Å; F38-K90 HydrophobicContact CE2-CB 3.91Å; F38-K90 HydrophobicContact CE2-CG 3.87Å; K87-K90 PolarHBondContact O-NZ 2.78Å; D88-K90 PolarHBondContact O-N 3.25Å; K90-C105 PolarHBondContact N-O 3.21Å; K90-H107 HydrophobicContact CG-CB 3.96Å; K90-K138 PolarHBondContact O-NZ 3.14Å
91	N	96.5	Very high	92.3	Very high	59 Å²	59	49.1 Å²	49.1	32%	0.316	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	148.4	177.3	-60.3	72.5	0	0	0	111	F93 C105	N91-F93 HydrophobicContact CB-CD2 4.36Å; N91-F93 HydrophobicContact CB-CE1 4.03Å; N91-F93 HydrophobicContact CB-CE2 3.77Å; N91-F93 HydrophobicContact CB-CZ 3.58Å; N91-C105 HydrophobicContact CB-CB 3.75Å; N91-C105 PolarHBondContact N-O 3.45Å; N91-C105 WeakPolarHBondContact O-CB 3.47Å; N91-C105 PolarHBondContact O-N 3.47Å
92	F	96.6	Very high	94.3	Very high	37 Å²	37	39.6 Å²	39.6	16%	0.162	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	103.1	174.6	-170.6	-84.3	0	0	0	107.4	V94 F102 I104 L127 T131 V134	F92-V94 HydrophobicContact CD1-CG2 4.03Å; F92-V94 HydrophobicContact CE1-CG2 3.73Å; F92-F102 HydrophobicContact CD2-CD2 4.44Å; F92-F102 HydrophobicContact CE1-CB 4.19Å; F92-F102 HydrophobicContact CE1-CD2 4.21Å; F92-F102 HydrophobicContact CE1-CG 4.41Å; F92-F102 AromaticContact CE2-CD2 3.51Å; F92-F102 HydrophobicContact CE2-CD2 3.51Å; F92-F102 AromaticContact CE2-CE2 3.77Å; F92-F102 HydrophobicContact CE2-CE2 3.77Å; F92-F102 HydrophobicContact CE2-CG 4.44Å; F92-F102 HydrophobicContact CZ-CB 4.13Å; F92-F102 AromaticContact CZ-CD2 3.37Å; F92-F102 HydrophobicContact CZ-CD2 3.37Å; F92-F102 AromaticContact CZ-CE2 3.87Å; F92-F102 HydrophobicContact CZ-CE2 3.87Å; F92-F102 AromaticContact CZ-CG 3.86Å; F92-F102 HydrophobicContact CZ-CG 3.86Å; F92-I104 HydrophobicContact CD2-CD1 4.32Å; F92-I104 HydrophobicContact CD2-CG1 3.86Å; F92-I104 HydrophobicContact CD2-CG2 4.47Å; F92-I104 HydrophobicContact CE2-CD1 4.09Å; F92-I104 HydrophobicContact CE2-CG1 3.87Å; F92-L127 HydrophobicContact CE1-CD1 4.07Å; F92-L127 HydrophobicContact CZ-CD1 4.03Å; F92-T131 HydrophobicContact CD1-CG2 4.46Å; F92-T131 HydrophobicContact CE1-CG2 4.42Å; F92-T131 WeakPolarHBondContact CE1-OG1 2.91Å; F92-V134 HydrophobicContact CB-CG1 4.41Å; F92-V134 HydrophobicContact CD2-CB 4.45Å; F92-V134 HydrophobicContact CD2-CG1 4Å; F92-V134 HydrophobicContact CD2-CG2 4.29Å; F92-V134 HydrophobicContact CE2-CG2 4.11Å; F92-V134 HydrophobicContact CG-CG1 4.32Å
93	F	96.9	Very high	95.1	Very high	19 Å²	19	37.2 Å²	37.2	8%	0.083	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.4	-176	-62.7	-54.5	0	0	0	110.9	R40 A43 N91 F95 F102 V103 C105 Y116	R40-F93 HydrophobicContact CB-CE1 4.28Å; R40-F93 HydrophobicContact CB-CZ 4.44Å; A43-F93 HydrophobicContact CB-CD2 3.57Å; A43-F93 HydrophobicContact CB-CE2 4Å; A43-F93 HydrophobicContact CB-CG 4.38Å; N91-F93 HydrophobicContact CB-CD2 4.36Å; N91-F93 HydrophobicContact CB-CE1 4.03Å; N91-F93 HydrophobicContact CB-CE2 3.77Å; N91-F93 HydrophobicContact CB-CZ 3.58Å; F93-F95 HydrophobicContact CB-CE2 3.81Å; F93-F95 HydrophobicContact CB-CZ 4.2Å; F93-F95 WeakPolarHBondContact O-CE2 3.41Å; F93-F102 CarbonylContact O-C 3.55Å; F93-F102 WeakPolarHBondContact O-CA 3.44Å; F93-F102 WeakPolarHBondContact O-CB 3.14Å; F93-V103 HydrophobicContact CB-CB 4.39Å; F93-V103 PolarHBondContact N-O 3.45Å; F93-V103 PolarHBondContact O-N 3.33Å; F93-C105 VanDerWaalsContact CD2-SG 3.54Å; F93-C105 WeakPolarHBondContact CE2-SG 3.48Å; F93-Y116 HydrophobicContact CE2-CE1 4.37Å
94	V	96.3	Very high	95.4	Very high	50 Å²	50	35.3 Å²	35.3	30%	0.303	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	138.8	173.2	174.2	0	0	0	0	109.3	F92 L127	F92-V94 HydrophobicContact CD1-CG2 4.03Å; F92-V94 HydrophobicContact CE1-CG2 3.73Å; V94-L127 HydrophobicContact CG1-CD2 3.85Å; V94-L127 HydrophobicContact CG2-CD1 4.31Å; V94-L127 HydrophobicContact CG2-CD2 4.35Å; V94-L127 HydrophobicContact CG2-CG 4.41Å
95	F	94	Very high	95.6	Very high	5 Å²	5	35.1 Å²	35.1	2%	0.022	19%	0.188	C	C	.	.			trans	-112.1	99.5	-174.6	-66.6	-102.2	0	0	0	110.1	A43 D44 I47 F93 S97 K98 V101 V103	A43-F95 HydrophobicContact CB-CZ 3.96Å; D44-F95 WeakPolarHBondContact OD1-CE1 3.26Å; I47-F95 HydrophobicContact CB-CE1 4.17Å; I47-F95 HydrophobicContact CB-CZ 4.27Å; I47-F95 HydrophobicContact CG2-CD1 3.97Å; I47-F95 HydrophobicContact CG2-CE1 3.56Å; I47-F95 HydrophobicContact CG2-CZ 4.14Å; F93-F95 HydrophobicContact CB-CE2 3.81Å; F93-F95 HydrophobicContact CB-CZ 4.2Å; F93-F95 WeakPolarHBondContact O-CE2 3.41Å; F95-S97 PolarHBondContact O-N 3.49Å; F95-K98 CarbonylContact O-C 3.43Å; F95-K98 VanDerWaalsContact O-C 3.26Å; F95-K98 PolarHBondContact O-N 2.92Å; F95-V101 HydrophobicContact CD2-CG1 4.42Å; F95-V101 PolarHBondContact N-O 2.71Å; F95-V103 HydrophobicContact CD2-CG2 4.32Å; F95-V103 HydrophobicContact CE2-CB 3.83Å; F95-V103 HydrophobicContact CE2-CG2 3.37Å; F95-V103 HydrophobicContact CZ-CB 4.32Å; F95-V103 HydrophobicContact CZ-CG2 3.76Å
96	T	89.5	Confident	95.6	Very high	83 Å²	83	35 Å²	35	51%	0.509	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-28.7	-178.9	41.6	0	0	0	0	113.3	K98 E354	T96-K98 PolarHBondContact O-N 3.41Å; T96-E354 PolarHBondContact N-OE1 3.25Å; T96-E354 WeakPolarHBondContact OG1-CG 3.37Å; T96-E354 PolarHBondContact OG1-OE1 3.22Å
97	S	91.3	Very high	95.6	Very high	70 Å²	70	37.6 Å²	37.6	49%	0.49	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-16.1	171.9	46.9	0	0	0	0	113.8	F95 E354	F95-S97 PolarHBondContact O-N 3.49Å; S97-E354 WeakPolarHBondContact CB-OE1 3.42Å; S97-E354 WeakPolarHBondContact CB-OE2 3.27Å; S97-E354 PolarHBondContact N-OE1 2.79Å; S97-E354 PolarHBondContact OG-OE1 3.18Å; S97-E354 PolarHBondContact OG-OE2 3.23Å
98	K	92.5	Very high	95.4	Very high	87 Å²	87	34.6 Å²	34.6	38%	0.378	19%	0.187	S	C	.	.	S	Bend	trans	-140.7	93.4	-179.3	-64.9	-172.1	-179.3	176	0	111.1	L51 F95 T96 G100 V101	L51-K98 HydrophobicContact CD1-CD 3.26Å; F95-K98 CarbonylContact O-C 3.43Å; F95-K98 VanDerWaalsContact O-C 3.26Å; F95-K98 PolarHBondContact O-N 2.92Å; T96-K98 PolarHBondContact O-N 3.41Å; K98-G100 PolarHBondContact O-N 3.4Å; K98-V101 HydrophobicContact CB-CB 3.95Å; K98-V101 HydrophobicContact CB-CG2 3.72Å; K98-V101 VanDerWaalsContact O-CB 3.29Å; K98-V101 WeakPolarHBondContact O-CB 3.45Å; K98-V101 PolarHBondContact O-N 2.96Å
99	P	93.7	Very high	95.1	Very high	95 Å²	95	37.2 Å²	37.2	62%	0.617	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.7	135.8	-178.9	-27.8	34.8	0	0	0	112.9	V101 P124	P99-V101 PolarHBondContact O-N 2.66Å; P99-P124 HydrophobicContact CB-CB 4.09Å; P99-P124 HydrophobicContact CB-CG 3.91Å
100	G	96.1	Very high	94.7	Very high	3 Å²	3	44 Å²	44	3%	0.031	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	79	-8.6	-179.7	0	0	0	0	0	115.3	K98 C120 C121	K98-G100 PolarHBondContact O-N 3.4Å; G100-C120 CarbonylContact O-C 3.57Å; G100-C120 VanDerWaalsContact O-CA 3.29Å; G100-C120 WeakPolarHBondContact O-CA 3.45Å; G100-C121 PolarHBondContact O-N 3.22Å
101	V	97.4	Very high	94.5	Very high	6 Å²	6	43.1 Å²	43.1	4%	0.036	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	133	-179.2	-179.8	0	0	0	0	111.8	L27 I47 F95 K98 P99 Y119 C120	L27-V101 HydrophobicContact CD1-CG1 4.27Å; I47-V101 HydrophobicContact CD1-CG1 3.48Å; I47-V101 VanDerWaalsContact CD1-CG1 3.48Å; I47-V101 HydrophobicContact CG1-CG1 3.74Å; F95-V101 HydrophobicContact CD2-CG1 4.42Å; F95-V101 PolarHBondContact N-O 2.71Å; K98-V101 HydrophobicContact CB-CB 3.95Å; K98-V101 HydrophobicContact CB-CG2 3.72Å; K98-V101 VanDerWaalsContact O-CB 3.29Å; K98-V101 WeakPolarHBondContact O-CB 3.45Å; K98-V101 PolarHBondContact O-N 2.96Å; P99-V101 PolarHBondContact O-N 2.66Å; V101-Y119 WeakPolarHBondContact CA-O 3.29Å; V101-C120 HydrophobicContact CG2-CB 4.15Å
102	F	97.7	Very high	94.2	Very high	1 Å²	1	45.1 Å²	45.1	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	162.5	177.9	68.9	-82.4	0	0	0	113	I60 F92 F93 I104 Y119 L127 L130	I60-F102 HydrophobicContact CD1-CE1 4.29Å; I60-F102 HydrophobicContact CD1-CZ 3.97Å; F92-F102 HydrophobicContact CD2-CD2 4.44Å; F92-F102 HydrophobicContact CE1-CB 4.19Å; F92-F102 HydrophobicContact CE1-CD2 4.21Å; F92-F102 HydrophobicContact CE1-CG 4.41Å; F92-F102 AromaticContact CE2-CD2 3.51Å; F92-F102 HydrophobicContact CE2-CD2 3.51Å; F92-F102 AromaticContact CE2-CE2 3.77Å; F92-F102 HydrophobicContact CE2-CE2 3.77Å; F92-F102 HydrophobicContact CE2-CG 4.44Å; F92-F102 HydrophobicContact CZ-CB 4.13Å; F92-F102 AromaticContact CZ-CD2 3.37Å; F92-F102 HydrophobicContact CZ-CD2 3.37Å; F92-F102 AromaticContact CZ-CE2 3.87Å; F92-F102 HydrophobicContact CZ-CE2 3.87Å; F92-F102 AromaticContact CZ-CG 3.86Å; F92-F102 HydrophobicContact CZ-CG 3.86Å; F93-F102 CarbonylContact O-C 3.55Å; F93-F102 WeakPolarHBondContact O-CA 3.44Å; F93-F102 WeakPolarHBondContact O-CB 3.14Å; F102-I104 HydrophobicContact CD2-CG1 3.98Å; F102-I104 HydrophobicContact CE2-CD1 3.92Å; F102-I104 HydrophobicContact CE2-CG1 3.83Å; F102-Y119 HydrophobicContact CD2-CD2 4.34Å; F102-Y119 HydrophobicContact CE1-CG 4.38Å; F102-Y119 AromaticContact CE2-CD2 3.7Å; F102-Y119 HydrophobicContact CE2-CD2 3.7Å; F102-Y119 AromaticContact CE2-CG 3.97Å; F102-Y119 HydrophobicContact CE2-CG 3.97Å; F102-Y119 HydrophobicContact CZ-CD2 4.02Å; F102-Y119 AromaticContact CZ-CG 3.79Å; F102-Y119 HydrophobicContact CZ-CG 3.79Å; F102-Y119 PolarHBondContact N-O 3.46Å; F102-Y119 PolarHBondContact O-N 2.94Å; F102-L127 HydrophobicContact CB-CD1 3.69Å; F102-L127 HydrophobicContact CB-CD2 4.26Å; F102-L127 HydrophobicContact CD1-CD1 3.5Å; F102-L127 VanDerWaalsContact CD1-CD1 3.5Å; F102-L127 HydrophobicContact CD1-CD2 4.5Å; F102-L127 HydrophobicContact CE1-CD1 4.21Å; F102-L127 HydrophobicContact CG-CD1 3.68Å; F102-L130 HydrophobicContact CE1-CD1 4.19Å; F102-L130 HydrophobicContact CZ-CD1 4.11Å
103	V	97.5	Very high	94.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	121	-179.4	-179.4	0	0	0	0	112.8	I47 F93 F95 Y116 E117 S118	I47-V103 HydrophobicContact CB-CG2 4.49Å; I47-V103 HydrophobicContact CD1-CG2 4.1Å; F93-V103 HydrophobicContact CB-CB 4.39Å; F93-V103 PolarHBondContact N-O 3.45Å; F93-V103 PolarHBondContact O-N 3.33Å; F95-V103 HydrophobicContact CD2-CG2 4.32Å; F95-V103 HydrophobicContact CE2-CB 3.83Å; F95-V103 HydrophobicContact CE2-CG2 3.37Å; F95-V103 HydrophobicContact CZ-CB 4.32Å; F95-V103 HydrophobicContact CZ-CG2 3.76Å; V103-Y116 HydrophobicContact CG1-CD1 3.69Å; V103-Y116 HydrophobicContact CG1-CG 4.43Å; V103-E117 WeakPolarHBondContact CA-O 3.46Å; V103-S118 WeakPolarHBondContact CG2-OG 3.43Å
104	I	97.5	Very high	94.1	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.015	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	92.9	159	5.8	155.1	0	0	0	117.7	L67 F69 I89 F92 F102 Y116 E117 Y119	L67-I104 HydrophobicContact CD1-CD1 3.57Å; F69-I104 HydrophobicContact CZ-CD1 3.96Å; I89-I104 HydrophobicContact CB-CG2 4.1Å; I89-I104 HydrophobicContact CD1-CD1 4.48Å; I89-I104 HydrophobicContact CD1-CG2 4.08Å; I89-I104 HydrophobicContact CG1-CG2 3.77Å; I89-I104 HydrophobicContact CG2-CG2 3.39Å; F92-I104 HydrophobicContact CD2-CD1 4.32Å; F92-I104 HydrophobicContact CD2-CG1 3.86Å; F92-I104 HydrophobicContact CD2-CG2 4.47Å; F92-I104 HydrophobicContact CE2-CD1 4.09Å; F92-I104 HydrophobicContact CE2-CG1 3.87Å; F102-I104 HydrophobicContact CD2-CG1 3.98Å; F102-I104 HydrophobicContact CE2-CD1 3.92Å; F102-I104 HydrophobicContact CE2-CG1 3.83Å; I104-Y116 CarbonylContact O-C 3.26Å; I104-Y116 VanDerWaalsContact O-CA 3.31Å; I104-Y116 WeakPolarHBondContact O-CA 3.25Å; I104-E117 VanDerWaalsContact CA-O 3.31Å; I104-E117 WeakPolarHBondContact CA-O 3.46Å; I104-E117 PolarHBondContact N-O 3.19Å; I104-E117 PolarHBondContact O-N 3.33Å; I104-Y119 HydrophobicContact CD1-CD2 4.49Å; I104-Y119 HydrophobicContact CD1-CE2 4.18Å; I104-Y119 HydrophobicContact CG1-CD2 4.35Å; I104-Y119 HydrophobicContact CG1-CE2 4.26Å
105	C	97.4	Very high	94.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	103.8	167.3	-56.3	0	0	0	0	109.7	F38 K90 N91 F93 T115 Y116	F38-C105 HydrophobicContact CB-CB 4.24Å; F38-C105 HydrophobicContact CD1-CB 3.58Å; F38-C105 HydrophobicContact CD2-CB 4.08Å; F38-C105 HydrophobicContact CE1-CB 3.87Å; F38-C105 HydrophobicContact CE2-CB 4.34Å; F38-C105 HydrophobicContact CG-CB 3.7Å; F38-C105 HydrophobicContact CZ-CB 4.25Å; K90-C105 PolarHBondContact N-O 3.21Å; N91-C105 HydrophobicContact CB-CB 3.75Å; N91-C105 PolarHBondContact N-O 3.45Å; N91-C105 WeakPolarHBondContact O-CB 3.47Å; N91-C105 PolarHBondContact O-N 3.47Å; F93-C105 VanDerWaalsContact CD2-SG 3.54Å; F93-C105 WeakPolarHBondContact CE2-SG 3.48Å; C105-T115 WeakPolarHBondContact CA-O 3.47Å; C105-Y116 WeakPolarHBondContact SG-CD1 3.34Å; C105-Y116 WeakPolarHBondContact SG-CE1 3.28Å
106	K	95.6	Very high	94.3	Very high	17 Å²	17	46.4 Å²	46.4	7%	0.074	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.8	-174.8	-173.5	-171.8	168.7	-163.7	0	110.4	F38 A84 D88 D108 K114 T115	F38-K106 WeakPolarHBondContact CZ-O 3.19Å; A84-K106 HydrophobicContact CB-CD 4.35Å; D88-K106 HydrophobicContact CB-CD 4.44Å; D88-K106 HydrophobicContact CB-CG 3.83Å; D88-K106 WeakPolarHBondContact O-CA 3.48Å; K106-D108 WeakPolarHBondContact CE-OD2 3.43Å; K106-D108 IonicContact NZ-OD2 3.83Å; K106-D108 PolarHBondContact NZ-OD2 3.31Å; K106-K114 CarbonylContact O-C 3.59Å; K106-K114 WeakPolarHBondContact O-CA 3.4Å; K106-T115 PolarHBondContact N-O 3.18Å; K106-T115 PolarHBondContact O-N 3.2Å
107	H	96.3	Very high	94.7	Very high	55 Å²	55	43.9 Å²	43.9	26%	0.255	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	106.7	161.8	-179.2	-167.3	0	0	0	107.9	F38 D88 K90 S109 K114	F38-H107 HydrophobicContact CE2-CB 4.33Å; D88-H107 WeakPolarHBondContact CB-O 3.47Å; D88-H107 PolarHBondContact O-N 3.02Å; K90-H107 HydrophobicContact CG-CB 3.96Å; H107-S109 PolarHBondContact O-N 2.92Å; H107-K114 HydrophobicContact CB-CG 4.31Å
108	D	92.1	Very high	95	Very high	29 Å²	29	40.5 Å²	40.5	16%	0.155	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	111.6	-179.7	-172.1	-61.4	0	0	0	109.8	K106 E110 T111 N112 K113	K106-D108 WeakPolarHBondContact CE-OD2 3.43Å; K106-D108 IonicContact NZ-OD2 3.83Å; K106-D108 PolarHBondContact NZ-OD2 3.31Å; D108-E110 VanDerWaalsContact C-N 3.29Å; D108-E110 PolarHBondContact O-N 2.81Å; D108-E110 WeakPolarHBondContact OD1-CB 3.48Å; D108-E110 PolarHBondContact OD1-N 2.91Å; D108-T111 VanDerWaalsContact CB-OG1 3.32Å; D108-T111 WeakPolarHBondContact CB-OG1 3.32Å; D108-T111 PolarHBondContact OD1-N 2.91Å; D108-T111 PolarHBondContact OD1-OG1 2.8Å; D108-N112 WeakPolarHBondContact O-CA 3.49Å; D108-N112 PolarHBondContact O-N 3.15Å; D108-K113 PolarHBondContact N-O 3.24Å; D108-K113 PolarHBondContact O-N 3.4Å
109	S	88.5	Confident	95.2	Very high	65 Å²	65	36.4 Å²	36.4	46%	0.455	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-21.8	-175.9	47.2	0	0	0	0	114	D88 H107	D88-S109 PolarHBondContact OD1-OG 2.79Å; H107-S109 PolarHBondContact O-N 2.92Å
110	E	89.4	Confident	95.4	Very high	145 Å²	145	33.1 Å²	33.1	68%	0.678	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-38.6	178.7	-62.5	-179.8	179.1	0	0	111.2	D108	D108-E110 VanDerWaalsContact C-N 3.29Å; D108-E110 PolarHBondContact O-N 2.81Å; D108-E110 WeakPolarHBondContact OD1-CB 3.48Å; D108-E110 PolarHBondContact OD1-N 2.91Å
111	T	91.1	Very high	95.4	Very high	77 Å²	77	33.2 Å²	33.2	47%	0.472	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-7.2	-176.5	59.1	0	0	0	0	114	D108 K113	D108-T111 VanDerWaalsContact CB-OG1 3.32Å; D108-T111 WeakPolarHBondContact CB-OG1 3.32Å; D108-T111 PolarHBondContact OD1-N 2.91Å; D108-T111 PolarHBondContact OD1-OG1 2.8Å; T111-K113 PolarHBondContact O-N 3.04Å; T111-K113 VanDerWaalsContact O-N 3.17Å
112	N	91.8	Very high	95.4	Very high	101 Å²	101	36.7 Å²	36.7	54%	0.54	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	19.5	-169.2	-68.2	-59.3	0	0	0	114.5	D108	D108-N112 WeakPolarHBondContact O-CA 3.49Å; D108-N112 PolarHBondContact O-N 3.15Å
113	K	94.3	Very high	95.3	Very high	85 Å²	85	40.2 Å²	40.2	37%	0.37	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	134.7	-178.6	-70.3	177.3	170.3	-105.5	0	111.4	E31 D108 T111	E31-K113 IonicContact OE1-NZ 3.75Å; E31-K113 PolarHBondContact OE1-NZ 3.25Å; E31-K113 IonicContact OE2-NZ 3.38Å; E31-K113 PolarHBondContact OE2-NZ 2.94Å; D108-K113 PolarHBondContact N-O 3.24Å; D108-K113 PolarHBondContact O-N 3.4Å; T111-K113 PolarHBondContact O-N 3.04Å; T111-K113 VanDerWaalsContact O-N 3.17Å
114	K	96.7	Very high	95.2	Very high	37 Å²	37	43.4 Å²	43.4	16%	0.161	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.1	170.2	-69.5	175.9	179.1	174.1	0	110.2	E31 I32 D34 E36 F38 K106 H107	E31-K114 WeakPolarHBondContact CA-O 3.45Å; I32-K114 HydrophobicContact CD1-CB 3.88Å; I32-K114 HydrophobicContact CD1-CD 4.24Å; I32-K114 HydrophobicContact CG1-CB 3.39Å; I32-K114 HydrophobicContact CG1-CD 4.33Å; I32-K114 PolarHBondContact N-O 2.75Å; D34-K114 PolarHBondContact O-NZ 2.79Å; E36-K114 PolarHBondContact O-NZ 3.07Å; F38-K114 HydrophobicContact CE1-CB 4.25Å; F38-K114 HydrophobicContact CE2-CG 4.38Å; F38-K114 HydrophobicContact CZ-CB 3.75Å; F38-K114 HydrophobicContact CZ-CG 4.03Å; K106-K114 CarbonylContact O-C 3.59Å; K106-K114 WeakPolarHBondContact O-CA 3.4Å; H107-K114 HydrophobicContact CB-CG 4.31Å
115	T	97	Very high	95.1	Very high	15 Å²	15	46.4 Å²	46.4	9%	0.092	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	147	-177.5	62.6	0	0	0	0	112.9	V29 T30 E31 C105 K106	V29-T115 HydrophobicContact CG1-CG2 4.21Å; T30-T115 CarbonylContact O-C 3.53Å; T30-T115 VanDerWaalsContact O-CA 3.31Å; T30-T115 WeakPolarHBondContact O-CA 3.35Å; E31-T115 HydrophobicContact CB-CG2 4.32Å; E31-T115 HydrophobicContact CG-CG2 4.42Å; C105-T115 WeakPolarHBondContact CA-O 3.47Å; K106-T115 PolarHBondContact N-O 3.18Å; K106-T115 PolarHBondContact O-N 3.2Å
116	Y	97.7	Very high	95.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	116.9	160.7	-71.4	-90.4	0	0	0	109.3	V29 T30 I32 F38 S39 L42 A43 I46 F93 V103 I104 C105	V29-Y116 CarbonylContact C-O 3.59Å; V29-Y116 VanDerWaalsContact CA-O 3.31Å; V29-Y116 WeakPolarHBondContact CA-O 3.28Å; T30-Y116 PolarHBondContact N-O 3.42Å; T30-Y116 PolarHBondContact O-N 3.42Å; I32-Y116 HydrophobicContact CD1-CE2 3.9Å; I32-Y116 HydrophobicContact CG2-CD2 3.73Å; I32-Y116 HydrophobicContact CG2-CE2 3.69Å; F38-Y116 VanDerWaalsContact CA-OH 3.28Å; F38-Y116 WeakPolarHBondContact CA-OH 3.34Å; F38-Y116 HydrophobicContact CD1-CD2 4.36Å; F38-Y116 HydrophobicContact CD1-CE1 4.01Å; F38-Y116 AromaticContact CD1-CE2 3.8Å; F38-Y116 HydrophobicContact CD1-CE2 3.8Å; F38-Y116 AromaticContact CD1-CZ 3.62Å; F38-Y116 HydrophobicContact CE1-CD2 4.39Å; F38-Y116 HydrophobicContact CE1-CE2 4.2Å; S39-Y116 PolarHBondContact N-OH 2.95Å; S39-Y116 PolarHBondContact O-OH 2.87Å; L42-Y116 HydrophobicContact CD2-CE2 3.64Å; L42-Y116 HydrophobicContact CG-CE2 3.99Å; A43-Y116 HydrophobicContact CB-CD1 4.18Å; A43-Y116 HydrophobicContact CB-CE1 3.81Å; I46-Y116 HydrophobicContact CD1-CD1 4.21Å; I46-Y116 HydrophobicContact CD1-CD2 3.23Å; I46-Y116 HydrophobicContact CD1-CE2 3.7Å; I46-Y116 HydrophobicContact CD1-CG 3.5Å; F93-Y116 HydrophobicContact CE2-CE1 4.37Å; V103-Y116 HydrophobicContact CG1-CD1 3.69Å; V103-Y116 HydrophobicContact CG1-CG 4.43Å; I104-Y116 CarbonylContact O-C 3.26Å; I104-Y116 VanDerWaalsContact O-CA 3.31Å; I104-Y116 WeakPolarHBondContact O-CA 3.25Å; C105-Y116 WeakPolarHBondContact SG-CD1 3.34Å; C105-Y116 WeakPolarHBondContact SG-CE1 3.28Å
117	E	96.7	Very high	95.2	Very high	30 Å²	30	47.3 Å²	47.3	14%	0.14	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.3	176.4	-57.5	-155.8	-150	0	0	110.3	K26 V29 V103 I104 Y119	K26-E117 IonicContact NZ-OE2 3.55Å; K26-E117 PolarHBondContact NZ-OE2 3.42Å; V29-E117 HydrophobicContact CB-CG 4.49Å; V29-E117 HydrophobicContact CG1-CG 4.06Å; V29-E117 HydrophobicContact CG2-CB 4.47Å; V29-E117 HydrophobicContact CG2-CG 3.94Å; V103-E117 WeakPolarHBondContact CA-O 3.46Å; I104-E117 VanDerWaalsContact CA-O 3.31Å; I104-E117 WeakPolarHBondContact CA-O 3.46Å; I104-E117 PolarHBondContact N-O 3.19Å; I104-E117 PolarHBondContact O-N 3.33Å; E117-Y119 HydrophobicContact CB-CD2 4.44Å; E117-Y119 HydrophobicContact CB-CE2 3.5Å; E117-Y119 WeakPolarHBondContact O-CD2 3.43Å; E117-Y119 WeakPolarHBondContact O-CE2 3.45Å; E117-Y119 PolarHBondContact OE2-OH 3.36Å
118	S	97.4	Very high	95.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	140.5	-177.1	-57.2	0	0	0	0	112.3	L27 G28 H50 V103	L27-S118 WeakPolarHBondContact CB-O 3.29Å; L27-S118 PolarHBondContact N-O 3.35Å; G28-S118 PolarHBondContact O-N 2.87Å; H50-S118 VanDerWaalsContact ND1-CB 3.25Å; H50-S118 WeakPolarHBondContact ND1-CB 3.45Å; H50-S118 PolarHBondContact ND1-OG 3.42Å; V103-S118 WeakPolarHBondContact CG2-OG 3.43Å
119	Y	97.5	Very high	95.3	Very high	1 Å²	1	52.7 Å²	52.7	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	161.4	-175.5	-60.5	-87.6	0	0	0	111	K25 K26 I58 F69 V101 F102 I104 E117	K25-Y119 CarbonylContact O-C 3.53Å; K25-Y119 VanDerWaalsContact O-CA 3.26Å; K25-Y119 WeakPolarHBondContact O-CA 3.29Å; K26-Y119 HydrophobicContact CB-CD1 4.18Å; K26-Y119 HydrophobicContact CB-CE1 4.14Å; K26-Y119 HydrophobicContact CD-CE1 4.05Å; K26-Y119 HydrophobicContact CG-CD1 4.32Å; K26-Y119 HydrophobicContact CG-CE1 3.99Å; I58-Y119 HydrophobicContact CD1-CD1 3.61Å; I58-Y119 HydrophobicContact CD1-CE1 3.77Å; F69-Y119 HydrophobicContact CD1-CD1 4.26Å; F69-Y119 AromaticContact CD1-CE1 3.55Å; F69-Y119 HydrophobicContact CD1-CE1 3.55Å; F69-Y119 AromaticContact CD1-CZ 3.91Å; F69-Y119 HydrophobicContact CE1-CD1 4.14Å; F69-Y119 AromaticContact CE1-CE1 3.55Å; F69-Y119 HydrophobicContact CE1-CE1 3.55Å; F69-Y119 HydrophobicContact CE1-CE2 4.13Å; F69-Y119 AromaticContact CE1-CZ 3.55Å; F69-Y119 WeakPolarHBondContact CE2-OH 3.37Å; F69-Y119 HydrophobicContact CG-CE1 4.18Å; F69-Y119 HydrophobicContact CZ-CE1 4.2Å; F69-Y119 HydrophobicContact CZ-CE2 4.14Å; F69-Y119 AromaticContact CZ-CZ 3.71Å; F69-Y119 WeakPolarHBondContact CZ-OH 3.21Å; V101-Y119 WeakPolarHBondContact CA-O 3.29Å; F102-Y119 HydrophobicContact CD2-CD2 4.34Å; F102-Y119 HydrophobicContact CE1-CG 4.38Å; F102-Y119 AromaticContact CE2-CD2 3.7Å; F102-Y119 HydrophobicContact CE2-CD2 3.7Å; F102-Y119 AromaticContact CE2-CG 3.97Å; F102-Y119 HydrophobicContact CE2-CG 3.97Å; F102-Y119 HydrophobicContact CZ-CD2 4.02Å; F102-Y119 AromaticContact CZ-CG 3.79Å; F102-Y119 HydrophobicContact CZ-CG 3.79Å; F102-Y119 PolarHBondContact N-O 3.46Å; F102-Y119 PolarHBondContact O-N 2.94Å; I104-Y119 HydrophobicContact CD1-CD2 4.49Å; I104-Y119 HydrophobicContact CD1-CE2 4.18Å; I104-Y119 HydrophobicContact CG1-CD2 4.35Å; I104-Y119 HydrophobicContact CG1-CE2 4.26Å; E117-Y119 HydrophobicContact CB-CD2 4.44Å; E117-Y119 HydrophobicContact CB-CE2 3.5Å; E117-Y119 WeakPolarHBondContact O-CD2 3.43Å; E117-Y119 WeakPolarHBondContact O-CE2 3.45Å; E117-Y119 PolarHBondContact OE2-OH 3.36Å
120	C	97.1	Very high	95.6	Very high	25 Å²	25	49.7 Å²	49.7	17%	0.169	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	124.1	172.6	-174.7	0	0	0	0	109.2	G24 K25 L27 G100 V101	G24-C120 CarbonylContact C-O 3.42Å; G24-C120 WeakPolarHBondContact CA-O 3.22Å; K25-C120 HydrophobicContact CB-CB 4.39Å; K25-C120 PolarHBondContact N-O 3.28Å; K25-C120 PolarHBondContact O-N 3.35Å; L27-C120 HydrophobicContact CD1-CB 4.21Å; L27-C120 HydrophobicContact CD2-CB 4.25Å; L27-C120 HydrophobicContact CG-CB 4.38Å; G100-C120 CarbonylContact O-C 3.57Å; G100-C120 VanDerWaalsContact O-CA 3.29Å; G100-C120 WeakPolarHBondContact O-CA 3.45Å; V101-C120 HydrophobicContact CG2-CB 4.15Å
121	C	97.4	Very high	95.9	Very high	5 Å²	5	44.7 Å²	44.7	3%	0.034	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	146.3	170.9	-59.9	0	0	0	0	109.9	G100 D123 D126 L130	G100-C121 PolarHBondContact O-N 3.22Å; C121-D123 VanDerWaalsContact C-N 3.34Å; C121-D123 VanDerWaalsContact CB-O 3.3Å; C121-D123 WeakPolarHBondContact CB-O 3.33Å; C121-D126 HydrophobicContact CB-CB 4.35Å; C121-L130 VanDerWaalsContact SG-CD1 3.58Å
122	D	96.7	Very high	96.2	Very high	79 Å²	79	48.4 Å²	48.4	42%	0.422	25%	0.245	S	C	.	.	S	Bend	trans	-69.4	-36.4	174.2	-72	-23.4	0	0	0	111.3	R23	R23-D122 VanDerWaalsContact CB-OD2 3.27Å; R23-D122 WeakPolarHBondContact CB-OD2 3.1Å; R23-D122 PolarHBondContact O-N 2.94Å
123	D	96.5	Very high	96.4	Very high	75 Å²	75	45.4 Å²	45.4	40%	0.401	23%	0.229	S	C	.	.	S	Bend	trans	-105.9	121.3	171.5	-171.9	-18.1	0	0	0	110.1	C121 S125 D126	C121-D123 VanDerWaalsContact C-N 3.34Å; C121-D123 VanDerWaalsContact CB-O 3.3Å; C121-D123 WeakPolarHBondContact CB-O 3.33Å; D123-S125 PolarHBondContact O-N 3.48Å; D123-S125 WeakPolarHBondContact OD1-CB 3.42Å; D123-S125 PolarHBondContact OD1-N 3.45Å; D123-D126 HydrophobicContact CB-CB 4.46Å; D123-D126 WeakPolarHBondContact O-CB 3.23Å; D123-D126 PolarHBondContact O-N 2.97Å; D123-D126 VanDerWaalsContact O-N 3.1Å
124	P	94.8	Very high	96.4	Very high	68 Å²	68	41.4 Å²	41.4	44%	0.442	21%	0.212	S	C	.	.	H	α-helix	trans	-56.6	-30.6	174.6	-25.6	35.4	0	0	0	114.5	P99 D126 L127	P99-P124 HydrophobicContact CB-CB 4.09Å; P99-P124 HydrophobicContact CB-CG 3.91Å; P124-D126 PolarHBondContact O-N 3.46Å; P124-L127 WeakPolarHBondContact O-CB 3.3Å; P124-L127 PolarHBondContact O-N 2.81Å; P124-L127 VanDerWaalsContact O-N 3.16Å
125	S	95.7	Very high	96.3	Very high	65 Å²	65	41.9 Å²	41.9	46%	0.455	22%	0.22	S	C	.	.	H	α-helix	trans	-68.3	-24.5	177.5	-68	0	0	0	0	112.7	D123 L127 E128 K129	D123-S125 PolarHBondContact O-N 3.48Å; D123-S125 WeakPolarHBondContact OD1-CB 3.42Å; D123-S125 PolarHBondContact OD1-N 3.45Å; S125-L127 VanDerWaalsContact C-N 3.28Å; S125-L127 PolarHBondContact O-N 2.89Å; S125-E128 PolarHBondContact O-N 3.05Å; S125-K129 PolarHBondContact O-N 2.8Å
126	D	97.2	Very high	96.2	Very high	27 Å²	27	43.8 Å²	43.8	14%	0.144	23%	0.234	C	C	.	.	H	α-helix	trans	-68.5	-30.1	173.5	-71.9	-23.5	0	0	0	111.7	F20 C22 C121 D123 P124 E128 K129 L130	F20-D126 HydrophobicContact CE1-CB 4.35Å; F20-D126 HydrophobicContact CZ-CB 3.89Å; F20-D126 WeakPolarHBondContact CZ-OD1 3.28Å; C22-D126 HydrophobicContact CB-CB 3.72Å; C22-D126 WeakPolarHBondContact CB-OD2 3.47Å; C121-D126 HydrophobicContact CB-CB 4.35Å; D123-D126 HydrophobicContact CB-CB 4.46Å; D123-D126 WeakPolarHBondContact O-CB 3.23Å; D123-D126 PolarHBondContact O-N 2.97Å; D123-D126 VanDerWaalsContact O-N 3.1Å; P124-D126 PolarHBondContact O-N 3.46Å; D126-E128 VanDerWaalsContact C-N 3.32Å; D126-E128 PolarHBondContact O-N 3.49Å; D126-K129 PolarHBondContact O-N 2.95Å; D126-L130 WeakPolarHBondContact O-CG 3.45Å; D126-L130 PolarHBondContact O-N 2.79Å
127	L	96.9	Very high	96.1	Very high	9 Å²	9	43.8 Å²	43.8	5%	0.047	23%	0.234	C	C	.	.	H	α-helix	trans	-65.6	-37.1	176.4	178.5	55.4	0	0	0	111.8	F92 V94 F102 P124 S125 K129 L130 T131	F92-L127 HydrophobicContact CE1-CD1 4.07Å; F92-L127 HydrophobicContact CZ-CD1 4.03Å; V94-L127 HydrophobicContact CG1-CD2 3.85Å; V94-L127 HydrophobicContact CG2-CD1 4.31Å; V94-L127 HydrophobicContact CG2-CD2 4.35Å; V94-L127 HydrophobicContact CG2-CG 4.41Å; F102-L127 HydrophobicContact CB-CD1 3.69Å; F102-L127 HydrophobicContact CB-CD2 4.26Å; F102-L127 HydrophobicContact CD1-CD1 3.5Å; F102-L127 VanDerWaalsContact CD1-CD1 3.5Å; F102-L127 HydrophobicContact CD1-CD2 4.5Å; F102-L127 HydrophobicContact CE1-CD1 4.21Å; F102-L127 HydrophobicContact CG-CD1 3.68Å; P124-L127 WeakPolarHBondContact O-CB 3.3Å; P124-L127 PolarHBondContact O-N 2.81Å; P124-L127 VanDerWaalsContact O-N 3.16Å; S125-L127 VanDerWaalsContact C-N 3.28Å; S125-L127 PolarHBondContact O-N 2.89Å; L127-K129 VanDerWaalsContact C-N 3.34Å; L127-L130 PolarHBondContact O-N 3.5Å; L127-T131 WeakPolarHBondContact O-CB 3.33Å; L127-T131 PolarHBondContact O-N 3.48Å; L127-T131 PolarHBondContact O-OG1 2.99Å
128	E	94.7	Very high	96	Very high	98 Å²	98	45.8 Å²	45.8	46%	0.458	24%	0.242	S	C	.	.	H	α-helix	trans	-61.9	-44.6	176.1	-168.8	-173.4	154.3	0	0	110.9	S125 D126 T131 R132	S125-E128 PolarHBondContact O-N 3.05Å; D126-E128 VanDerWaalsContact C-N 3.32Å; D126-E128 PolarHBondContact O-N 3.49Å; E128-T131 PolarHBondContact O-N 3.18Å; E128-R132 WeakPolarHBondContact O-CG 3.5Å; E128-R132 PolarHBondContact O-N 3.18Å; E128-R132 IonicContact OE1-CZ 3.75Å; E128-R132 IonicContact OE1-NH1 3.77Å; E128-R132 PolarHBondContact OE1-NH1 3.02Å; E128-R132 IonicContact OE1-NH2 2.97Å; E128-R132 PolarHBondContact OE1-NH2 2.82Å
129	K	95.6	Very high	95.8	Very high	100 Å²	100	51.7 Å²	51.7	44%	0.435	27%	0.273	S	S	.	.	H	α-helix	trans	-63.9	-45.1	175.3	-66.1	175.7	-175.1	165.7	0	112.1	F20 S125 D126 L127 T131 R132 L133	F20-K129 HydrophobicContact CD2-CD 4.18Å; F20-K129 HydrophobicContact CE1-CB 4.23Å; F20-K129 HydrophobicContact CE2-CB 4.18Å; F20-K129 HydrophobicContact CE2-CD 3.5Å; F20-K129 VanDerWaalsContact CE2-CD 3.5Å; F20-K129 HydrophobicContact CZ-CB 4.01Å; F20-K129 HydrophobicContact CZ-CD 3.88Å; S125-K129 PolarHBondContact O-N 2.8Å; D126-K129 PolarHBondContact O-N 2.95Å; L127-K129 VanDerWaalsContact C-N 3.34Å; K129-T131 VanDerWaalsContact C-N 3.31Å; K129-T131 PolarHBondContact O-N 2.84Å; K129-R132 PolarHBondContact O-N 2.74Å; K129-L133 WeakPolarHBondContact O-CG 3.46Å; K129-L133 PolarHBondContact O-N 2.9Å
130	L	96.3	Very high	95.6	Very high	2 Å²	2	54 Å²	54	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-57.7	-46.1	175.2	-76.9	178.1	0	0	0	111.3	F20 I60 C62 F102 C121 D126 L127 R132 L133 V134	F20-L130 HydrophobicContact CD1-CD2 3.8Å; F20-L130 HydrophobicContact CD1-CG 4.29Å; F20-L130 HydrophobicContact CE1-CD2 3.89Å; F20-L130 HydrophobicContact CE1-CG 3.92Å; I60-L130 HydrophobicContact CD1-CD1 4.23Å; I60-L130 HydrophobicContact CG2-CD1 4.46Å; I60-L130 HydrophobicContact CG2-CD2 4.09Å; C62-L130 WeakPolarHBondContact SG-CD2 3.31Å; F102-L130 HydrophobicContact CE1-CD1 4.19Å; F102-L130 HydrophobicContact CZ-CD1 4.11Å; C121-L130 VanDerWaalsContact SG-CD1 3.58Å; D126-L130 WeakPolarHBondContact O-CG 3.45Å; D126-L130 PolarHBondContact O-N 2.79Å; L127-L130 PolarHBondContact O-N 3.5Å; L130-R132 PolarHBondContact O-N 3.05Å; L130-L133 PolarHBondContact O-N 2.93Å; L130-V134 WeakPolarHBondContact O-CB 3.46Å; L130-V134 VanDerWaalsContact O-CG2 3.28Å; L130-V134 WeakPolarHBondContact O-CG2 3.43Å; L130-V134 PolarHBondContact O-N 2.94Å
131	T	95.6	Very high	95.4	Very high	39 Å²	39	58.7 Å²	58.7	24%	0.239	32%	0.319	C	S	.	.	H	α-helix	trans	-60.5	-47.8	-179.8	-55.4	0	0	0	0	110.3	F92 L127 E128 K129 L133 V134 S135	F92-T131 HydrophobicContact CD1-CG2 4.46Å; F92-T131 HydrophobicContact CE1-CG2 4.42Å; F92-T131 WeakPolarHBondContact CE1-OG1 2.91Å; L127-T131 WeakPolarHBondContact O-CB 3.33Å; L127-T131 PolarHBondContact O-N 3.48Å; L127-T131 PolarHBondContact O-OG1 2.99Å; E128-T131 PolarHBondContact O-N 3.18Å; K129-T131 VanDerWaalsContact C-N 3.31Å; K129-T131 PolarHBondContact O-N 2.84Å; T131-L133 PolarHBondContact O-N 2.93Å; T131-V134 PolarHBondContact O-N 2.77Å; T131-S135 WeakPolarHBondContact O-CB 3.26Å; T131-S135 PolarHBondContact O-N 2.72Å; T131-S135 PolarHBondContact O-OG 2.86Å; T131-S135 VanDerWaalsContact O-OG 3.05Å
132	R	95.7	Very high	95.3	Very high	155 Å²	155	61.2 Å²	61.2	59%	0.585	33%	0.332	S	S	*	.	H	α-helix	trans	-57.3	-46.4	175.8	-74.8	-178.6	176.2	125.8	5.6	112.7	E128 K129 L130 S136	E128-R132 WeakPolarHBondContact O-CG 3.5Å; E128-R132 PolarHBondContact O-N 3.18Å; E128-R132 IonicContact OE1-CZ 3.75Å; E128-R132 IonicContact OE1-NH1 3.77Å; E128-R132 PolarHBondContact OE1-NH1 3.02Å; E128-R132 IonicContact OE1-NH2 2.97Å; E128-R132 PolarHBondContact OE1-NH2 2.82Å; K129-R132 PolarHBondContact O-N 2.74Å; L130-R132 PolarHBondContact O-N 3.05Å; R132-S136 VanDerWaalsContact O-CB 3.28Å; R132-S136 WeakPolarHBondContact O-CB 3.38Å; R132-S136 PolarHBondContact O-N 2.94Å
133	L	96.1	Very high	95.1	Very high	38 Å²	38	60.8 Å²	60.8	20%	0.199	33%	0.328	C	S	.	.	H	α-helix	trans	-68.1	-44.6	-179.1	-70.5	171	0	0	0	112.1	F20 C62 K129 L130 T131 S135 S136 A137 L145	F20-L133 HydrophobicContact CB-CD1 3.32Å; F20-L133 HydrophobicContact CD1-CD1 4.2Å; F20-L133 HydrophobicContact CG-CD1 3.93Å; C62-L133 HydrophobicContact CB-CD1 4.11Å; K129-L133 WeakPolarHBondContact O-CG 3.46Å; K129-L133 PolarHBondContact O-N 2.9Å; L130-L133 PolarHBondContact O-N 2.93Å; T131-L133 PolarHBondContact O-N 2.93Å; L133-S135 VanDerWaalsContact C-N 3.34Å; L133-S135 PolarHBondContact O-N 2.66Å; L133-S136 PolarHBondContact O-N 3.23Å; L133-A137 WeakPolarHBondContact O-CB 3.41Å; L133-A137 PolarHBondContact O-N 3.43Å; L133-L145 HydrophobicContact CB-CD1 4.31Å; L133-L145 HydrophobicContact CB-CD2 4.4Å; L133-L145 HydrophobicContact CD2-CD1 4.21Å; L133-L145 HydrophobicContact CD2-CD2 4.09Å; L133-L145 WeakPolarHBondContact O-CD2 3.36Å
134	V	95.9	Very high	95	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.006	33%	0.327	C	S	.	.	H	α-helix	trans	-61.5	-44.6	176.6	173.2	0	0	0	0	110.4	L67 Y86 F92 L130 T131 A137 K138	L67-V134 HydrophobicContact CD1-CG2 4.01Å; L67-V134 HydrophobicContact CD2-CG2 4.31Å; Y86-V134 HydrophobicContact CE1-CG2 4.07Å; F92-V134 HydrophobicContact CB-CG1 4.41Å; F92-V134 HydrophobicContact CD2-CB 4.45Å; F92-V134 HydrophobicContact CD2-CG1 4Å; F92-V134 HydrophobicContact CD2-CG2 4.29Å; F92-V134 HydrophobicContact CE2-CG2 4.11Å; F92-V134 HydrophobicContact CG-CG1 4.32Å; L130-V134 WeakPolarHBondContact O-CB 3.46Å; L130-V134 VanDerWaalsContact O-CG2 3.28Å; L130-V134 WeakPolarHBondContact O-CG2 3.43Å; L130-V134 PolarHBondContact O-N 2.94Å; T131-V134 PolarHBondContact O-N 2.77Å; V134-A137 PolarHBondContact O-N 3.28Å; V134-K138 HydrophobicContact CG1-CD 4.23Å; V134-K138 HydrophobicContact CG1-CG 4.49Å; V134-K138 WeakPolarHBondContact O-CB 3.29Å; V134-K138 WeakPolarHBondContact O-CG 3.36Å; V134-K138 PolarHBondContact O-N 3.4Å
135	S	94.9	Very high	94.9	Very high	48 Å²	48	59.1 Å²	59.1	34%	0.336	31%	0.307	S	S	.	.	H	α-helix	trans	-62.7	-44.5	175.9	-64.3	0	0	0	0	112	T131 L133 A137 K138 N139	T131-S135 WeakPolarHBondContact O-CB 3.26Å; T131-S135 PolarHBondContact O-N 2.72Å; T131-S135 PolarHBondContact O-OG 2.86Å; T131-S135 VanDerWaalsContact O-OG 3.05Å; L133-S135 VanDerWaalsContact C-N 3.34Å; L133-S135 PolarHBondContact O-N 2.66Å; S135-A137 PolarHBondContact O-N 2.95Å; S135-K138 PolarHBondContact O-N 2.89Å; S135-N139 WeakPolarHBondContact O-CB 3.4Å; S135-N139 PolarHBondContact O-N 2.86Å; S135-N139 PolarHBondContact O-ND2 2.76Å; S135-N139 PolarHBondContact O-OD1 2.92Å
136	S	94.9	Very high	94.7	Very high	55 Å²	55	62.1 Å²	62.1	39%	0.385	31%	0.31	S	S	.	.	H	α-helix	trans	-58.9	-46.1	176.1	178.2	0	0	0	0	111.9	R132 L133 K138 N139 N140	R132-S136 VanDerWaalsContact O-CB 3.28Å; R132-S136 WeakPolarHBondContact O-CB 3.38Å; R132-S136 PolarHBondContact O-N 2.94Å; L133-S136 PolarHBondContact O-N 3.23Å; S136-K138 PolarHBondContact O-N 3.3Å; S136-N139 PolarHBondContact O-N 3.46Å; S136-N140 PolarHBondContact O-N 2.87Å; S136-N140 PolarHBondContact O-ND2 3.42Å
137	A	95.3	Very high	93.9	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-61.9	-44.3	176.2	0	0	0	0	0	111.5	Y86 L133 V134 S135 N139 N140 H143 L145	Y86-A137 HydrophobicContact CD1-CB 3.95Å; Y86-A137 HydrophobicContact CD2-CB 3.48Å; Y86-A137 VanDerWaalsContact CD2-CB 3.48Å; Y86-A137 HydrophobicContact CE1-CB 4.25Å; Y86-A137 HydrophobicContact CE2-CB 3.8Å; Y86-A137 HydrophobicContact CG-CB 3.57Å; L133-A137 WeakPolarHBondContact O-CB 3.41Å; L133-A137 PolarHBondContact O-N 3.43Å; V134-A137 PolarHBondContact O-N 3.28Å; S135-A137 PolarHBondContact O-N 2.95Å; A137-N139 VanDerWaalsContact C-N 3.3Å; A137-N139 PolarHBondContact O-N 3.45Å; A137-N140 PolarHBondContact O-N 3.23Å; A137-H143 CarbonylContact O-C 3.51Å; A137-H143 VanDerWaalsContact O-CA 3.25Å; A137-H143 WeakPolarHBondContact O-CA 3.37Å; A137-L145 HydrophobicContact CB-CD2 3.88Å; A137-L145 HydrophobicContact CB-CG 3.99Å
138	K	93.3	Very high	92.6	Very high	71 Å²	71	69.4 Å²	69.4	31%	0.309	35%	0.349	S	S	.	.	H	α-helix	trans	-66.5	-29.3	-179.7	-76.1	-171.6	71.6	-177.3	0	113.8	I89 K90 V134 S135 S136 N140	I89-K138 HydrophobicContact CG2-CD 4.46Å; I89-K138 VanDerWaalsContact O-CE 3.26Å; I89-K138 WeakPolarHBondContact O-CE 3.16Å; I89-K138 PolarHBondContact O-NZ 2.91Å; K90-K138 PolarHBondContact O-NZ 3.14Å; V134-K138 HydrophobicContact CG1-CD 4.23Å; V134-K138 HydrophobicContact CG1-CG 4.49Å; V134-K138 WeakPolarHBondContact O-CB 3.29Å; V134-K138 WeakPolarHBondContact O-CG 3.36Å; V134-K138 PolarHBondContact O-N 3.4Å; S135-K138 PolarHBondContact O-N 2.89Å; S136-K138 PolarHBondContact O-N 3.3Å; K138-N140 VanDerWaalsContact C-N 3.31Å
139	N	93.3	Very high	90.4	Very high	124 Å²	124	73.2 Å²	73.2	66%	0.663	37%	0.367	S	S	*	.	H	α-helix	trans	-78	-17.7	177.9	-69.2	-9.4	0	0	0	112.8	S135 S136 A137	S135-N139 WeakPolarHBondContact O-CB 3.4Å; S135-N139 PolarHBondContact O-N 2.86Å; S135-N139 PolarHBondContact O-ND2 2.76Å; S135-N139 PolarHBondContact O-OD1 2.92Å; S136-N139 PolarHBondContact O-N 3.46Å; A137-N139 VanDerWaalsContact C-N 3.3Å; A137-N139 PolarHBondContact O-N 3.45Å
140	N	93.9	Very high	87.6	Confident	49 Å²	49	76 Å²	76	26%	0.262	39%	0.387	S	S	.	.	S	Bend	trans	-79.9	141.2	174.2	-66	-28.2	0	0	0	110.6	S136 A137 K138 D142 H143 R144 Y146	S136-N140 PolarHBondContact O-N 2.87Å; S136-N140 PolarHBondContact O-ND2 3.42Å; A137-N140 PolarHBondContact O-N 3.23Å; K138-N140 VanDerWaalsContact C-N 3.31Å; N140-D142 PolarHBondContact O-N 3.29Å; N140-D142 VanDerWaalsContact O-N 3.15Å; N140-H143 PolarHBondContact O-N 3.02Å; N140-R144 PolarHBondContact ND2-O 3.45Å; N140-Y146 HydrophobicContact CB-CE2 4.23Å
141	S	92.9	Very high	84.9	Confident	125 Å²	125	80.6 Å²	80.6	87%	0.874	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-27.3	-174.6	55.4	0	0	0	0	114.2
142	D	94.1	Very high	82.1	Confident	57 Å²	57	84.1 Å²	84.1	31%	0.305	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	6.9	-179.9	73.1	-37.7	0	0	0	113.5	N140 R144 Y146	N140-D142 PolarHBondContact O-N 3.29Å; N140-D142 VanDerWaalsContact O-N 3.15Å; D142-R144 PolarHBondContact O-N 3.49Å; D142-R144 WeakPolarHBondContact OD2-CB 3.45Å; D142-R144 WeakPolarHBondContact OD2-CD 3.08Å; D142-R144 VanDerWaalsContact OD2-CG 3.26Å; D142-R144 WeakPolarHBondContact OD2-CG 3.26Å; D142-R144 IonicContact OD2-NE 2.81Å; D142-Y146 PolarHBondContact OD1-OH 3Å; D142-Y146 PolarHBondContact OD2-OH 3.35Å
143	H	93.5	Very high	79.2	Confident	71 Å²	71	88.5 Å²	88.5	33%	0.329	46%	0.458	S	S	.	.	S	Bend	trans	58.6	39.1	-178.2	-57.7	-63.9	0	0	0	114.4	Y86 K87 A137 N140	Y86-H143 WeakPolarHBondContact CB-O 3.48Å; Y86-H143 WeakPolarHBondContact CD2-O 3.33Å; K87-H143 HydrophobicContact CB-CB 4Å; A137-H143 CarbonylContact O-C 3.51Å; A137-H143 VanDerWaalsContact O-CA 3.25Å; A137-H143 WeakPolarHBondContact O-CA 3.37Å; N140-H143 PolarHBondContact O-N 3.02Å
144	R	94.6	Very high	76.3	Confident	103 Å²	103	91.2 Å²	91.2	39%	0.389	48%	0.48	S	S	.	.			trans	-122.8	154.2	-178.8	-63.6	-168.3	-179.5	175.5	-7	113.5	Q64 D65 N140 D142 Y146	Q64-R144 HydrophobicContact CG-CB 4.28Å; Q64-R144 CarbonylContact O-C 3.59Å; Q64-R144 WeakPolarHBondContact O-CA 3.43Å; Q64-R144 WeakPolarHBondContact O-CB 3.46Å; D65-R144 HydrophobicContact CB-CG 4.26Å; N140-R144 PolarHBondContact ND2-O 3.45Å; D142-R144 PolarHBondContact O-N 3.49Å; D142-R144 WeakPolarHBondContact OD2-CB 3.45Å; D142-R144 WeakPolarHBondContact OD2-CD 3.08Å; D142-R144 VanDerWaalsContact OD2-CG 3.26Å; D142-R144 WeakPolarHBondContact OD2-CG 3.26Å; D142-R144 IonicContact OD2-NE 2.81Å; R144-Y146 HydrophobicContact CB-CE2 4.36Å
145	L	93.4	Very high	73.5	Confident	4 Å²	4	97.4 Å²	97.4	2%	0.021	52%	0.518	C	S	.	.			trans	-85.3	144.9	166.3	-69.1	176.6	0	0	0	110.3	F19 C62 Q64 Y86 L133 A137	F19-L145 HydrophobicContact CB-CD1 3.99Å; F19-L145 HydrophobicContact CD1-CB 4.04Å; F19-L145 HydrophobicContact CD1-CD1 4.28Å; F19-L145 HydrophobicContact CD2-CB 3.97Å; F19-L145 HydrophobicContact CD2-CD1 3.97Å; F19-L145 HydrophobicContact CE1-CB 3.79Å; F19-L145 HydrophobicContact CE2-CB 3.73Å; F19-L145 HydrophobicContact CG-CB 4.12Å; F19-L145 HydrophobicContact CG-CD1 3.81Å; F19-L145 HydrophobicContact CZ-CB 3.62Å; F19-L145 WeakPolarHBondContact CZ-O 3.28Å; C62-L145 HydrophobicContact CB-CD1 4.25Å; Q64-L145 VanDerWaalsContact CG-O 3.3Å; Q64-L145 WeakPolarHBondContact CG-O 3.33Å; Q64-L145 PolarHBondContact O-N 3.37Å; Y86-L145 HydrophobicContact CE2-CD1 4.06Å; Y86-L145 HydrophobicContact CE2-CG 4.01Å; Y86-L145 WeakPolarHBondContact OH-CD1 3.45Å; L133-L145 HydrophobicContact CB-CD1 4.31Å; L133-L145 HydrophobicContact CB-CD2 4.4Å; L133-L145 HydrophobicContact CD2-CD1 4.21Å; L133-L145 HydrophobicContact CD2-CD2 4.09Å; L133-L145 WeakPolarHBondContact O-CD2 3.36Å; A137-L145 HydrophobicContact CB-CD2 3.88Å; A137-L145 HydrophobicContact CB-CG 3.99Å
146	Y	90.3	Very high	71	Confident	129 Å²	129	100.7 Å²	100.7	51%	0.506	53%	0.531	S	S	.	.			trans	-123	132	175.7	-63.7	-82.6	0	0	0	109.4	N140 D142 R144 S148	N140-Y146 HydrophobicContact CB-CE2 4.23Å; D142-Y146 PolarHBondContact OD1-OH 3Å; D142-Y146 PolarHBondContact OD2-OH 3.35Å; R144-Y146 HydrophobicContact CB-CE2 4.36Å; Y146-S148 PolarHBondContact O-N 2.87Å
147	K	81.3	Confident	68.3	Low	111 Å²	111	104 Å²	104	48%	0.483	54%	0.544	S	S	.	.			trans	-66.2	121.6	170.3	-72.6	175.7	177.4	159.8	0	105.5	K16 D17 F19 Q149	K16-K147 PolarHBondContact O-NZ 3.23Å; D17-K147 IonicContact OD1-NZ 2.8Å; D17-K147 PolarHBondContact OD1-NZ 3.27Å; F19-K147 HydrophobicContact CD1-CG 4.37Å; F19-K147 HydrophobicContact CE1-CB 4.27Å; F19-K147 HydrophobicContact CE1-CG 3.58Å; F19-K147 VanDerWaalsContact CE1-N 3.34Å; F19-K147 HydrophobicContact CZ-CG 3.7Å; K147-Q149 PolarHBondContact O-N 2.72Å; K147-Q149 VanDerWaalsContact O-N 3.07Å
148	S	69.1	Low	66	Low	78 Å²	78	113.1 Å²	113.1	55%	0.545	59%	0.589	S	S	.	*			trans	-57.2	120.1	171.3	49.3	0	0	0	0	107.1	Y146 N150 T151	Y146-S148 PolarHBondContact O-N 2.87Å; S148-N150 PolarHBondContact O-N 3.06Å; S148-T151 PolarHBondContact O-N 3.42Å; S148-T151 PolarHBondContact O-OG1 2.98Å
149	Q	48.8	Very low	63.7	Low	178 Å²	178	117 Å²	117	83%	0.832	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	2.7	-176.3	-69	-176.4	-8.6	0	0	113.1	K147	K147-Q149 PolarHBondContact O-N 2.72Å; K147-Q149 VanDerWaalsContact O-N 3.07Å
150	N	36	Very low	61.3	Low	159 Å²	159	117.2 Å²	117.2	85%	0.85	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	11.6	-178	-66.7	-7	0	0	0	114.4	S148	S148-N150 PolarHBondContact O-N 3.06Å
151	T	40.3	Very low	58.9	Low	98 Å²	98	124 Å²	124	60%	0.601	64%	0.644	S	S	*	*			trans	-115	33.3	172.9	58.6	0	0	0	0	113.5	S148 R153	S148-T151 PolarHBondContact O-N 3.42Å; S148-T151 PolarHBondContact O-OG1 2.98Å; T151-R153 PolarHBondContact O-N 3.22Å
152	S	36.3	Very low	57	Low	113 Å²	113	122 Å²	122	79%	0.79	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	22.5	174.2	-61.5	0	0	0	0	114.5
153	R	35.3	Very low	54.7	Low	246 Å²	246	123 Å²	123	93%	0.928	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.9	18.4	-177.6	-98.3	-170.4	165.3	169	-5.2	117.5	T151	T151-R153 PolarHBondContact O-N 3.22Å
154	S	34	Very low	53	Low	95 Å²	95	124 Å²	124	66%	0.664	66%	0.655	S	S	*	*			trans	-119	66.5	169.1	-170.7	0	0	0	0	111.5	I156	S154-I156 VanDerWaalsContact C-N 3.29Å
155	T	37.5	Very low	51.4	Low	132 Å²	132	122.4 Å²	122.4	81%	0.81	66%	0.664	S	S	*	*			trans	-90.7	75.7	146.7	50.7	0	0	0	0	106.4	D157	T155-D157 PolarHBondContact O-N 3.31Å
156	I	42.1	Very low	49.7	Very low	117 Å²	117	127.8 Å²	127.8	60%	0.6	69%	0.689	S	S	*	*			trans	-81.5	93.5	153.4	-61	178.1	0	0	0	104.2	S154 M158	S154-I156 VanDerWaalsContact C-N 3.29Å; I156-M158 PolarHBondContact O-N 3.33Å
157	D	38.7	Very low	48.2	Very low	124 Å²	124	127.9 Å²	127.9	66%	0.663	70%	0.697	S	S	*	*			trans	-40.2	121.9	158.7	-91	-48.1	0	0	0	108.7	T155 N159	T155-D157 PolarHBondContact O-N 3.31Å; D157-N159 PolarHBondContact O-N 2.98Å
158	M	46.8	Very low	47	Very low	192 Å²	192	130.5 Å²	130.5	95%	0.946	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	36.3	177.8	-75.6	-138.6	-92	0	0	113.3	I156	I156-M158 PolarHBondContact O-N 3.33Å
159	N	45.3	Very low	46.5	Very low	151 Å²	151	133.9 Å²	133.9	81%	0.807	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.7	14.8	-177.8	-70	-22.9	0	0	0	114	D157	D157-N159 PolarHBondContact O-N 2.98Å
160	N	43	Very low	46.5	Very low	129 Å²	129	130 Å²	130	69%	0.69	71%	0.709	S	S	*	*			trans	-127	118.6	173.8	-142	29.2	0	0	0	111.1	I162	N160-I162 PolarHBondContact O-N 2.84Å
161	E	43.8	Very low	47.2	Very low	192 Å²	192	126.4 Å²	126.4	90%	0.897	70%	0.696	S	S	*	*			trans	-62.9	79.2	172.4	-68.1	179.7	153.7	0	0	110	S163	E161-S163 PolarHBondContact O-N 3.25Å; E161-S163 VanDerWaalsContact O-N 3.16Å
162	I	52.6	Low	47.7	Very low	83 Å²	83	127 Å²	127	43%	0.426	70%	0.7	S	S	.	*			trans	-78.2	102.7	166.8	-63.9	171.5	0	0	0	106.2	N160 E166	N160-I162 PolarHBondContact O-N 2.84Å; I162-E166 HydrophobicContact CG2-CB 4.21Å
163	S	46.8	Very low	48.1	Very low	79 Å²	79	128.4 Å²	128.4	55%	0.552	70%	0.699	S	S	*	*			trans	-56	138.2	176.9	-76.7	0	0	0	0	110.3	E161 A165 E166	E161-S163 PolarHBondContact O-N 3.25Å; E161-S163 VanDerWaalsContact O-N 3.16Å; S163-A165 PolarHBondContact O-N 3.25Å; S163-E166 PolarHBondContact O-N 2.85Å
164	A	58.1	Low	48.7	Very low	92 Å²	92	124.3 Å²	124.3	76%	0.76	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	-11.5	178	0	0	0	0	0	114.7
165	A	60.4	Low	49.4	Very low	69 Å²	69	127.1 Å²	127.1	57%	0.57	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-35.5	172.8	0	0	0	0	0	113.6	S163 L167 F168	S163-A165 PolarHBondContact O-N 3.25Å; A165-L167 VanDerWaalsContact C-N 3.33Å; A165-L167 PolarHBondContact O-N 2.9Å; A165-F168 PolarHBondContact O-N 2.99Å
166	E	57.7	Low	49.6	Very low	116 Å²	116	129.1 Å²	129.1	54%	0.542	71%	0.707	S	S	.	*	H	α-helix	trans	-79.3	-19.3	-176.3	-64.6	-171.4	157	0	0	113	I162 S163 F168 S170	I162-E166 HydrophobicContact CG2-CB 4.21Å; S163-E166 PolarHBondContact O-N 2.85Å; E166-F168 VanDerWaalsContact C-N 3.32Å; E166-S170 PolarHBondContact O-OG 2.91Å
167	L	58.4	Low	49.7	Very low	131 Å²	131	132.7 Å²	132.7	69%	0.686	72%	0.722	S	S	*	*	H	α-helix	trans	-77.6	-18.4	177.7	-126.6	132	0	0	0	112.7	A165 S171	A165-L167 VanDerWaalsContact C-N 3.33Å; A165-L167 PolarHBondContact O-N 2.9Å; L167-S171 PolarHBondContact O-OG 3.22Å
168	F	56.6	Low	49.8	Very low	166 Å²	166	132.2 Å²	132.2	73%	0.728	73%	0.728	S	S	*	*	H	α-helix	trans	-89.2	-30.4	177.8	-146	-97.8	0	0	0	112.4	A165 E166 S171	A165-F168 PolarHBondContact O-N 2.99Å; E166-F168 VanDerWaalsContact C-N 3.32Å; F168-S171 PolarHBondContact O-OG 3Å
169	E	58.3	Low	49.5	Very low	149 Å²	149	131.1 Å²	131.1	70%	0.696	73%	0.725	S	S	*	*	H	α-helix	trans	-75.9	-23.9	176.4	-70.7	-175.3	165	0	0	113.1	S171 T172	E169-S171 VanDerWaalsContact C-N 3.31Å; E169-S171 PolarHBondContact O-N 3.07Å; E169-T172 PolarHBondContact O-OG1 3.31Å
170	S	48.3	Very low	49.2	Very low	96 Å²	96	129.7 Å²	129.7	67%	0.671	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-12	179	-58.7	0	0	0	0	113.8	E166	E166-S170 PolarHBondContact O-OG 2.91Å
171	S	51.9	Low	49.5	Very low	85 Å²	85	134.5 Å²	134.5	59%	0.594	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-0.3	-177.2	22.8	0	0	0	0	115.1	L167 F168 E169	L167-S171 PolarHBondContact O-OG 3.22Å; F168-S171 PolarHBondContact O-OG 3Å; E169-S171 VanDerWaalsContact C-N 3.31Å; E169-S171 PolarHBondContact O-N 3.07Å
172	T	50.2	Low	49.5	Very low	109 Å²	109	134.7 Å²	134.7	67%	0.669	74%	0.738	S	S	*	*	S	Bend	trans	-115.6	8.2	-173.3	53.5	0	0	0	0	115.5	E169	E169-T172 PolarHBondContact O-OG1 3.31Å
173	N	45	Very low	48.9	Very low	144 Å²	144	137.1 Å²	137.1	77%	0.77	76%	0.762	S	S	*	*			trans	-121.3	17.8	-172.5	-111.7	-36.3	0	0	0	116.6
174	L	48.3	Very low	48.8	Very low	160 Å²	160	136.2 Å²	136.2	84%	0.838	77%	0.765	S	S	*	*			trans	-103.3	69.5	172.8	-67.8	173.3	0	0	0	110.4
175	N	47.2	Very low	48.3	Very low	154 Å²	154	141.2 Å²	141.2	82%	0.824	77%	0.77	S	S	*	*	S	Bend	trans	-170.8	72.4	166.9	-89.7	-23.8	0	0	0	109.1
176	N	42.2	Very low	47.7	Very low	173 Å²	173	144 Å²	144	93%	0.925	78%	0.775	S	S	*	*			trans	-177.4	63.9	160.3	-96.2	-13.3	0	0	0	111.1
177	E	43.8	Very low	47.2	Very low	192 Å²	192	148.4 Å²	148.4	90%	0.897	79%	0.787	S	S	*	*			trans	-135.1	87.6	163.2	-102.6	-163.9	141.4	0	0	108.2
178	S	41.2	Very low	46.7	Very low	114 Å²	114	148.5 Å²	148.5	80%	0.797	79%	0.788	S	S	*	*	S	Bend	trans	164.4	140.3	149	37.1	0	0	0	0	108.8
179	L	41	Very low	46.2	Very low	170 Å²	170	147 Å²	147	89%	0.89	79%	0.792	S	S	*	*			trans	94.9	81.1	178.1	-50.2	166.6	0	0	0	115.9
180	S	38.8	Very low	45.4	Very low	120 Å²	120	143.4 Å²	143.4	84%	0.839	80%	0.795	S	S	*	*			trans	-178.6	69.1	134.4	42.3	0	0	0	0	111
181	Y	48.1	Very low	45.2	Very low	231 Å²	231	144.6 Å²	144.6	91%	0.906	80%	0.803	S	S	*	*			trans	-112.1	139.6	156.1	-85.7	-86.3	0	0	0	108
182	Q	44.8	Very low	45	Very low	196 Å²	196	146 Å²	146	92%	0.916	81%	0.811	S	S	*	*			trans	76.2	76.7	171.8	-67.4	178	-31.9	0	0	117.6
183	S	40.7	Very low	45	Very low	134 Å²	134	147 Å²	147	94%	0.937	82%	0.816	S	S	*	*			trans	-101.9	109.8	146	165.1	0	0	0	0	107.2
184	G	44.7	Very low	45.2	Very low	60 Å²	60	145.6 Å²	145.6	62%	0.619	81%	0.813	S	S	*	*			trans	-174.9	94.5	-177.1	0	0	0	0	0	113.5
185	F	47.2	Very low	45.3	Very low	196 Å²	196	146.6 Å²	146.6	86%	0.86	81%	0.814	S	S	*	*			trans	72.8	133.2	148	-76.2	-89.9	0	0	0	121.3
186	L	47.8	Very low	45.4	Very low	129 Å²	129	143.7 Å²	143.7	68%	0.675	81%	0.811	S	S	*	*			trans	91.7	100.5	147	-68	145.4	0	0	0	119.1
187	R	47.8	Very low	45.8	Very low	208 Å²	208	142.7 Å²	142.7	79%	0.785	81%	0.811	S	S	*	*				92.3	132	115.6	-81	-178.3	-172.6	-158.7	2.3	121.3
188	D	48.1	Very low	46.2	Very low	132 Å²	132	140.3 Å²	140.3	71%	0.706	80%	0.804	S	S	*	*			trans	80.2	102.3	136.6	-74	-32.3	0	0	0	120.2
189	T	44.7	Very low	46.9	Very low	135 Å²	135	146.9 Å²	146.9	83%	0.828	81%	0.812	S	S	*	*			trans	-40.9	141.2	145.6	50.6	0	0	0	0	114.2
190	G	42.8	Very low	47.2	Very low	73 Å²	73	142.6 Å²	142.6	75%	0.753	80%	0.801	S	S	*	*			trans	158.8	87.6	154.8	0	0	0	0	0	117.3
191	S	42.2	Very low	47.9	Very low	121 Å²	121	145.4 Å²	145.4	85%	0.846	80%	0.801	S	S	*	*			trans	59.8	135	144.9	-74.7	0	0	0	0	123.3
192	P	49.4	Very low	48	Very low	115 Å²	115	139 Å²	139	75%	0.747	79%	0.785	S	S	*	*			trans	-94	166.6	166.8	39.1	-31.5	0	0	0	111.7
193	V	49	Very low	48.2	Very low	129 Å²	129	137.5 Å²	137.5	78%	0.782	78%	0.776	S	S	*	*			trans	178.1	118.4	147.8	144.9	0	0	0	0	112.1
194	T	49.4	Very low	48.6	Very low	116 Å²	116	139.5 Å²	139.5	71%	0.712	77%	0.77	S	S	*	*			trans	75.3	146.3	137.1	61.6	0	0	0	0	126.7
195	E	51	Low	48.5	Very low	180 Å²	180	143.7 Å²	143.7	84%	0.841	78%	0.778	S	S	*	*			trans	86.9	101.4	155.6	-74.4	166	-158.1	0	0	117.2
196	A	48.7	Very low	48.6	Very low	93 Å²	93	141.1 Å²	141.1	77%	0.769	78%	0.779	S	S	*	*				71.7	100.7	61.1	0	0	0	0	0	114.3
197	V	51.8	Low	48.6	Very low	153 Å²	153	139.5 Å²	139.5	93%	0.927	78%	0.778	S	S	*	*			trans	-151.1	131.9	144.1	-179.7	0	0	0	0	110.2
198	D	50.9	Low	48.7	Very low	141 Å²	141	135 Å²	135	75%	0.754	78%	0.776	S	S	*	*			trans	-84.4	148.9	-177.5	-156.8	-3.5	0	0	0	112.3
199	R	56.1	Low	48.9	Very low	252 Å²	252	138.1 Å²	138.1	95%	0.951	78%	0.784	S	S	*	*			trans	-164.8	114.2	153.9	-116.5	176.7	179.6	151.2	2.1	112.2
200	A	47.3	Very low	48.8	Very low	80 Å²	80	137.2 Å²	137.2	66%	0.661	78%	0.783	S	S	*	*			trans	-89.1	-179	176.9	0	0	0	0	0	113.2
201	E	53.1	Low	49.7	Very low	180 Å²	180	139 Å²	139	84%	0.841	78%	0.781	S	S	*	*			trans	95.2	140.9	157.2	-60.3	-160.8	-177.9	0	0	117.1
202	V	50.1	Low	49.7	Very low	96 Å²	96	138.3 Å²	138.3	58%	0.582	78%	0.776	S	S	*	*			cis	-178.4	135.2	3.3	127.8	0	0	0	0	107.8
203	F	49.3	Very low	50	Low	165 Å²	165	140.9 Å²	140.9	72%	0.724	78%	0.778	S	S	*	*			trans	55.5	132.8	143.7	-64.7	-116.4	0	0	0	124.2
204	H	48.5	Very low	50	Low	176 Å²	176	140.7 Å²	140.7	82%	0.815	78%	0.777	S	S	*	*				173.6	146.8	91.2	-93.1	-61.6	0	0	0	115.1
205	N	42.3	Very low	49.6	Very low	147 Å²	147	145.5 Å²	145.5	79%	0.786	78%	0.784	S	S	*	*			trans	-79.8	-179.5	179.7	-86.9	-23.8	0	0	0	115.2
206	T	49.6	Very low	49.6	Very low	142 Å²	142	144.4 Å²	144.4	87%	0.871	78%	0.784	S	S	*	*			trans	102.2	139.6	159.3	71	0	0	0	0	114.5
207	S	47.9	Very low	49.3	Very low	95 Å²	95	147.6 Å²	147.6	66%	0.664	79%	0.788	S	S	*	*			cis	-171.3	155.4	-0.2	168.9	0	0	0	0	106.7
208	P	51.6	Low	49	Very low	114 Å²	114	147.6 Å²	147.6	74%	0.74	78%	0.781	S	S	*	*			trans	-88.2	155.9	177.5	35.6	-32.8	0	0	0	112.7
209	F	50.6	Low	48.8	Very low	197 Å²	197	146.2 Å²	146.2	86%	0.864	78%	0.778	S	S	*	*			trans	-139.9	124.7	168.5	-95.5	-83.3	0	0	0	111
210	S	42.4	Very low	48.3	Very low	116 Å²	116	139.4 Å²	139.4	81%	0.811	77%	0.769	S	S	*	*			trans	-105.2	148.6	157	-56.2	0	0	0	0	108.5
211	P	62.5	Low	48.4	Very low	110 Å²	110	141.5 Å²	141.5	71%	0.714	77%	0.773	S	S	*	*			trans	-123.3	134	155.9	18.2	1.7	0	0	0	112.7
212	S	43	Very low	48	Very low	107 Å²	107	138.4 Å²	138.4	75%	0.748	77%	0.772	S	S	*	*			trans	-80.7	141.5	165.5	41.7	0	0	0	0	111.5
213	H	53.9	Low	48.2	Very low	170 Å²	170	140.2 Å²	140.2	79%	0.787	78%	0.782	S	S	*	*			trans	-142.3	101.7	161.1	-70.6	-56.7	0	0	0	107.1
214	T	49.1	Very low	48.2	Very low	124 Å²	124	136.3 Å²	136.3	76%	0.761	78%	0.776	S	S	*	*				66.2	108.1	87.8	-39.9	0	0	0	0	114.2
215	Y	41.5	Very low	48.1	Very low	218 Å²	218	134.7 Å²	134.7	86%	0.855	77%	0.773	S	S	*	*			trans	-58.1	145.8	166.4	-88.4	-104.4	0	0	0	112.4
216	N	50.5	Low	48.6	Very low	157 Å²	157	135.3 Å²	135.3	84%	0.84	77%	0.773	S	S	*	*			trans	-145.8	122.3	150	-92.3	-30	0	0	0	111.4
217	N	43.2	Very low	48.6	Very low	159 Å²	159	134 Å²	134	85%	0.85	77%	0.767	S	S	*	*			trans	-59	135.1	165.9	-96	-36.8	0	0	0	111.5
218	I	46.4	Very low	48.6	Very low	154 Å²	154	135.9 Å²	135.9	79%	0.79	77%	0.77	S	S	*	*			trans	-135.1	101.5	153.9	-62	-176.8	0	0	0	109.4
219	T	45.9	Very low	48.5	Very low	111 Å²	111	138 Å²	138	68%	0.681	77%	0.77	S	S	*	*				52.8	102.9	124.8	-31.1	0	0	0	0	119.1
220	S	46.3	Very low	48.7	Very low	110 Å²	110	137.3 Å²	137.3	77%	0.769	77%	0.769	S	S	*	*			trans	-54.7	133.7	151.3	50.6	0	0	0	0	112.3
221	V	49.3	Very low	48.9	Very low	123 Å²	123	140 Å²	140	75%	0.745	77%	0.769	S	S	*	*			trans	-119.4	109.3	162.3	-164.8	0	0	0	0	107.7	V223	V221-V223 HydrophobicContact CG1-CG2 4.21Å
222	S	44.8	Very low	48.9	Very low	115 Å²	115	141.5 Å²	141.5	80%	0.804	78%	0.776	S	S	*	*			trans	-83.2	129.6	162.9	-59.6	0	0	0	0	108
223	V	53	Low	49.1	Very low	134 Å²	134	143.1 Å²	143.1	81%	0.812	78%	0.776	S	S	*	*			trans	-119.2	113	164.1	-177.9	0	0	0	0	106.9	V221	V221-V223 HydrophobicContact CG1-CG2 4.21Å
224	S	49.1	Very low	48.9	Very low	84 Å²	84	138.8 Å²	138.8	59%	0.587	78%	0.777	S	S	*	*			trans	-83.4	168.2	169.1	46.7	0	0	0	0	110.9
225	D	46.4	Very low	48.8	Very low	142 Å²	142	143.3 Å²	143.3	76%	0.759	78%	0.781	S	S	*	*			trans	96	93.1	155.1	-50.5	-43.6	0	0	0	118.3
226	M	52.7	Low	49.3	Very low	159 Å²	159	136.6 Å²	136.6	78%	0.783	78%	0.779	S	S	*	*				21.8	162.6	119.1	-76.4	-142.4	83.2	0	0	120.2	N228	M226-N228 HydrophobicContact CE-CB 4.31Å
227	P	51.5	Low	49.3	Very low	115 Å²	115	137.1 Å²	137.1	75%	0.747	78%	0.776	S	S	*	*			cis	-138.6	-178.3	15.9	25.3	1.6	0	0	0	116.9
228	N	47.7	Very low	49.9	Very low	134 Å²	134	137.6 Å²	137.6	72%	0.717	78%	0.779	S	S	*	*			trans	-61.2	174.7	173.5	-159.3	16.3	0	0	0	115.1	M226	M226-N228 HydrophobicContact CE-CB 4.31Å
229	E	49.3	Very low	49.9	Very low	158 Å²	158	138.7 Å²	138.7	74%	0.738	78%	0.781	S	S	*	*			trans	98.3	105.3	164.9	-53.8	-170.6	-174.7	0	0	117.4
230	H	53.5	Low	50.3	Low	184 Å²	184	138.1 Å²	138.1	85%	0.852	78%	0.781	S	S	*	*				-168.2	120.1	114	-108.8	-71.9	0	0	0	111.9
231	E	48.3	Very low	50.4	Low	173 Å²	173	139.1 Å²	139.1	81%	0.808	78%	0.778	S	S	*	*			trans	-64	137.9	163.3	-63.1	177.3	139.2	0	0	110.9
232	V	61.2	Low	50.4	Low	141 Å²	141	139.2 Å²	139.2	86%	0.855	77%	0.774	S	S	*	*			trans	-142.7	113.1	149.9	-178.4	0	0	0	0	109.4
233	N	47	Very low	50.4	Low	141 Å²	141	140.7 Å²	140.7	75%	0.754	77%	0.773	S	S	*	*			trans	-68.3	142.7	167.1	-75.1	-44.7	0	0	0	111.3
234	G	50.7	Low	50.2	Low	78 Å²	78	144.7 Å²	144.7	80%	0.804	77%	0.773	S	S	*	*			trans	-153.9	94.4	170.6	0	0	0	0	0	111.3
235	Y	46.4	Very low	50.3	Low	219 Å²	219	148.7 Å²	148.7	86%	0.859	79%	0.789	S	S	*	*			trans	-65.2	145	172.6	-80.3	-98.9	0	0	0	111.7
236	G	52	Low	50.4	Low	78 Å²	78	152.4 Å²	152.4	80%	0.804	79%	0.792	S	S	*	*			trans	-162.3	74.4	171.6	0	0	0	0	0	110.4
237	E	50.2	Low	50.2	Low	167 Å²	167	155 Å²	155	78%	0.78	80%	0.799	S	S	*	*			trans	-65.4	136.2	164.3	-68	178.5	156.9	0	0	109.6
238	N	55.4	Low	50	Low	169 Å²	169	157.4 Å²	157.4	90%	0.904	80%	0.797	S	S	*	*			trans	-154.9	106.5	144.4	-94.9	-37	0	0	0	109.1
239	E	48.3	Very low	50.3	Low	178 Å²	178	158.4 Å²	158.4	83%	0.832	80%	0.803	S	S	*	*			trans	-61.2	145.7	164.6	-59.2	-179.3	134.3	0	0	110.3
240	S	52.8	Low	50	Low	98 Å²	98	156 Å²	156	69%	0.685	80%	0.803	S	S	*	*				149.8	128.6	107.2	60.3	0	0	0	0	114.3
241	N	48.2	Very low	49.8	Very low	132 Å²	132	157.9 Å²	157.9	71%	0.706	80%	0.804	S	S	*	*			trans	81.5	106.9	137.2	-68.6	-25.2	0	0	0	122.2
242	N	49.2	Very low	49.6	Very low	124 Å²	124	155 Å²	155	66%	0.663	80%	0.804	S	S	*	*				67.2	112.6	118.5	-64	-28.2	0	0	0	118.4
243	N	46.8	Very low	48.9	Very low	147 Å²	147	153.8 Å²	153.8	79%	0.786	80%	0.801	S	S	*	*				-177.4	148.2	79.6	-106.1	-38.5	0	0	0	114.3
244	R	48.3	Very low	49	Very low	217 Å²	217	153.1 Å²	153.1	82%	0.819	81%	0.805	S	S	*	*			trans	-57.4	145.4	177.2	-65.2	156.4	177.7	169.9	0.4	112.4
245	N	51.3	Low	48.7	Very low	169 Å²	169	159.7 Å²	159.7	90%	0.904	81%	0.811	S	S	*	*				-160.4	118.8	119.8	-94.8	-31.6	0	0	0	112.8
246	R	47.1	Very low	48.4	Very low	220 Å²	220	152.6 Å²	152.6	83%	0.83	81%	0.805	S	S	*	*			trans	-76.5	141.4	174.2	-72.8	171.7	167.8	168.7	-3.1	110.1
247	K	49.2	Very low	47.7	Very low	213 Å²	213	157 Å²	157	93%	0.926	81%	0.806	S	S	*	*			trans	-142.6	107.8	138	-96.9	-176.8	-178.2	176.7	0	109.4
248	K	48.4	Very low	47.4	Very low	165 Å²	165	156 Å²	156	72%	0.717	81%	0.805	S	S	*	*			trans	-81.1	129.9	168.5	-72.4	178.3	172.8	-177	0	107.9
249	N	52.1	Low	46.4	Very low	156 Å²	156	153.3 Å²	153.3	83%	0.834	80%	0.799	S	S	*	*			trans	-121.8	109.8	155.4	-83	-6.7	0	0	0	108.1
250	S	44.3	Very low	46.3	Very low	106 Å²	106	150.4 Å²	150.4	74%	0.741	80%	0.796	S	S	*	*			trans	-85.3	125.4	176.8	-32.9	0	0	0	0	108.3
251	Y	48	Very low	45.6	Very low	224 Å²	224	151.8 Å²	151.8	88%	0.878	80%	0.802	S	S	*	*			trans	-116.5	117.7	158.5	-87.1	-81.7	0	0	0	108.5
252	S	44.8	Very low	45	Very low	114 Å²	114	150.2 Å²	150.2	80%	0.797	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-76.8	124.3	174.2	56	0	0	0	0	110.3
253	S	46.1	Very low	44.6	Very low	115 Å²	115	152 Å²	152	80%	0.804	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-90.6	137.9	160.3	-74.3	0	0	0	0	110
254	P	50.6	Low	44	Very low	127 Å²	127	151.9 Å²	151.9	83%	0.825	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-74.5	141.3	178.4	-9.2	25.8	0	0	0	112
255	K	43.6	Very low	43.3	Very low	216 Å²	216	148.5 Å²	148.5	94%	0.939	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-65.9	139.5	169.9	-74	173.1	172	178.3	0	111.5
256	G	40.4	Very low	42.3	Very low	70 Å²	70	150.7 Å²	150.7	72%	0.722	82%	0.817	S	S	*	*			trans	140.7	130.9	160.9	0	0	0	0	0	110.1
257	M	37.7	Very low	41.6	Very low	169 Å²	169	148.6 Å²	148.6	83%	0.833	82%	0.816	S	S	*	*			cis	-171.1	153.5	-1.6	-123	178.6	92.6	0	0	105.7
258	I	42.8	Very low	41	Very low	148 Å²	148	143.7 Å²	143.7	76%	0.759	81%	0.806	S	S	*	*			trans	82.6	102.7	160	-51.6	149	0	0	0	116.8
259	S	35.6	Very low	40.1	Very low	112 Å²	112	144.1 Å²	144.1	78%	0.783	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-75.5	138.4	159.4	-43.1	0	0	0	0	110
260	P	45.6	Very low	39.2	Very low	117 Å²	117	143.2 Å²	143.2	76%	0.76	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-87.8	153.9	164.3	21.8	-8	0	0	0	111.4
261	P	38.8	Very low	38.5	Very low	126 Å²	126	141.6 Å²	141.6	82%	0.818	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-78.7	154.7	-169	33.2	-34.2	0	0	0	112.5	N263	P261-N263 PolarHBondContact O-N 3.42Å
262	A	34.5	Very low	37.6	Very low	99 Å²	99	141.6 Å²	141.6	82%	0.818	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-64	121.9	166.6	0	0	0	0	0	109.8
263	N	41.1	Very low	36.9	Very low	162 Å²	162	144.5 Å²	144.5	87%	0.866	81%	0.809	S	S	*	*			trans	-155.9	133.6	149.6	-123.9	-2.3	0	0	0	111	P261	P261-N263 PolarHBondContact O-N 3.42Å
264	D	33.4	Very low	36.3	Very low	144 Å²	144	144.2 Å²	144.2	77%	0.77	81%	0.807	S	S	*	*			trans	-67.7	162.2	-177.7	-66.9	-52.5	0	0	0	112.6
265	N	33.6	Very low	35.6	Very low	146 Å²	146	146.8 Å²	146.8	78%	0.781	81%	0.806	S	S	*	*			trans	83.4	83.8	173.8	-56.7	-27.8	0	0	0	117
266	F	31.9	Very low	35.6	Very low	216 Å²	216	143.9 Å²	143.9	95%	0.947	80%	0.801	S	S	*	*			trans	-145.2	117.4	148.2	-100.8	-79.9	0	0	0	112.9
267	H	31.9	Very low	35.5	Very low	175 Å²	175	150.3 Å²	150.3	81%	0.81	81%	0.809	S	S	*	*			trans	-59.8	137.7	163.3	-90.2	-96.5	0	0	0	111.3	L269	H267-L269 PolarHBondContact O-N 2.87Å
268	P	36.8	Very low	35.6	Very low	111 Å²	111	151.5 Å²	151.5	72%	0.721	81%	0.814	S	S	*	*			trans	-92.3	93	166	32.9	-26.6	0	0	0	110.5	I270	P268-I270 HydrophobicContact CB-CG1 4.31Å; P268-I270 PolarHBondContact O-N 3.37Å
269	L	29.7	Very low	35.9	Very low	173 Å²	173	154.4 Å²	154.4	91%	0.906	82%	0.822	S	S	*	*			trans	-77.6	98.7	151.9	-88	164.4	0	0	0	107.5	H267 G271	H267-L269 PolarHBondContact O-N 2.87Å; L269-G271 PolarHBondContact O-N 2.9Å
270	I	32.3	Very low	36.1	Very low	138 Å²	138	156.5 Å²	156.5	71%	0.708	82%	0.818	S	S	*	*			trans	-90.7	102.2	173.5	-62.8	176.6	0	0	0	108.5	P268 Y272	P268-I270 HydrophobicContact CB-CG1 4.31Å; P268-I270 PolarHBondContact O-N 3.37Å; I270-Y272 HydrophobicContact CG2-CD2 4.26Å; I270-Y272 HydrophobicContact CG2-CE2 4.12Å
271	G	29	Very low	36.2	Very low	71 Å²	71	158.9 Å²	158.9	73%	0.732	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-97.2	126.7	162.5	0	0	0	0	0	110.4	L269	L269-G271 PolarHBondContact O-N 2.9Å
272	Y	30	Very low	36.4	Very low	225 Å²	225	160.9 Å²	160.9	88%	0.882	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-80	120	168.4	-85.7	-93.5	0	0	0	110.1	I270	I270-Y272 HydrophobicContact CG2-CD2 4.26Å; I270-Y272 HydrophobicContact CG2-CE2 4.12Å
273	Q	30.7	Very low	36.8	Very low	174 Å²	174	161.9 Å²	161.9	81%	0.813	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-100.2	120.7	161.1	-86	-170.4	-7.3	0	0	109.4
274	S	31.6	Very low	36.8	Very low	109 Å²	109	160.9 Å²	160.9	76%	0.762	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-73.6	124.5	167.2	178.8	0	0	0	0	109.8
275	K	36	Very low	37.5	Very low	182 Å²	182	161.7 Å²	161.7	79%	0.791	82%	0.818	S	S	*	*			trans	-101.8	91.2	172	-71.9	-175.3	179.7	177.2	0	109.3
276	N	44.3	Very low	38.2	Very low	155 Å²	155	161.7 Å²	161.7	83%	0.829	81%	0.813	S	S	*	*			trans	-88.7	110.5	158.3	-87.6	-15.4	0	0	0	109
277	K	37.7	Very low	38.6	Very low	205 Å²	205	157 Å²	157	89%	0.891	80%	0.798	S	S	*	*			trans	-81.5	108.6	166.6	-76.7	-178.4	174.2	-179.6	0	108.2
278	M	41.2	Very low	39.3	Very low	194 Å²	194	155.9 Å²	155.9	96%	0.956	80%	0.798	S	S	*	*			trans	-109.6	136.1	159.1	-107.2	-174.8	158.4	0	0	109.5
279	K	49.1	Very low	39.6	Very low	209 Å²	209	157.3 Å²	157.3	91%	0.909	80%	0.8	S	S	*	*			trans	-77	152.1	-173.3	-75.2	175.7	173.5	178	0	111.9
280	H	38.4	Very low	40.1	Very low	155 Å²	155	156.7 Å²	156.7	72%	0.718	80%	0.797	S	S	*	*			trans	-29	139.3	170	-83.4	-52.6	0	0	0	117.5
281	N	48.7	Very low	40.4	Very low	167 Å²	167	154.5 Å²	154.5	89%	0.893	80%	0.8	S	S	*	*				-152.7	136.5	111.6	-97.5	-17.3	0	0	0	111.4
282	Q	42.2	Very low	41	Very low	168 Å²	168	157.6 Å²	157.6	79%	0.785	80%	0.804	S	S	*	*			trans	-83.6	144.3	-177.3	-66.9	172.3	-8.6	0	0	111.1
283	S	44.3	Very low	41.3	Very low	121 Å²	121	152.3 Å²	152.3	85%	0.846	80%	0.798	S	S	*	*			trans	-165.6	133	145.1	177.8	0	0	0	0	110.3
284	N	40.1	Very low	41.6	Very low	140 Å²	140	150.9 Å²	150.9	75%	0.749	80%	0.801	S	S	*	*			trans	-67.4	146.1	-173.2	-61.7	-38.2	0	0	0	114.3
285	H	48.9	Very low	41.6	Very low	162 Å²	162	152.2 Å²	152.2	75%	0.75	80%	0.799	S	S	*	*				178.3	126.8	106.7	-106.3	-67.7	0	0	0	113.1
286	Q	46.5	Very low	41.6	Very low	145 Å²	145	149.8 Å²	149.8	68%	0.678	81%	0.805	S	S	*	*			trans	21.1	131.8	146.7	-77.6	167.1	-70.6	0	0	124.3
287	D	41.6	Very low	41.3	Very low	119 Å²	119	154.2 Å²	154.2	64%	0.636	81%	0.81	S	S	*	*			trans	58.9	109.4	130.1	-53.4	-25.4	0	0	0	119.3
288	N	47.4	Very low	41.3	Very low	150 Å²	150	155.5 Å²	155.5	80%	0.802	81%	0.809	S	S	*	*				175.6	152.8	98.9	-88.5	-54.5	0	0	0	112.8
289	N	41.6	Very low	41	Very low	142 Å²	142	154.2 Å²	154.2	76%	0.759	80%	0.801	S	S	*	*			trans	-43.7	137.1	178.4	-54.5	-57.4	0	0	0	114.4
290	D	41.2	Very low	40.6	Very low	159 Å²	159	149.8 Å²	149.8	85%	0.85	80%	0.796	S	S	*	*				-171.8	146.9	118.7	-110.4	-29.7	0	0	0	113.6
291	A	37.3	Very low	40.7	Very low	92 Å²	92	148.5 Å²	148.5	76%	0.76	79%	0.794	S	S	*	*			trans	-59.9	134.3	-175	0	0	0	0	0	113.6
292	T	42.9	Very low	40.2	Very low	136 Å²	136	149 Å²	149	83%	0.834	79%	0.789	S	S	*	*			trans	-146.6	149	159.5	31	0	0	0	0	112.4
293	P	35.1	Very low	40	Very low	115 Å²	115	147.8 Å²	147.8	75%	0.747	79%	0.787	S	S	*	*			trans	-95.4	156.1	-151.1	36.1	-32.5	0	0	0	114.5	N295	P293-N295 PolarHBondContact O-N 3.46Å
294	V	36.6	Very low	39.7	Very low	144 Å²	144	146.5 Å²	146.5	87%	0.873	77%	0.77	S	S	*	*	S	Bend	trans	-63.7	89	172.4	-179	0	0	0	0	110.1
295	N	33.3	Very low	40	Very low	137 Å²	137	147.4 Å²	147.4	73%	0.733	76%	0.764	S	S	*	*			trans	-164.8	86	168.5	-109.4	-22.2	0	0	0	113.2	P293	P293-N295 PolarHBondContact O-N 3.46Å
296	S	36.3	Very low	39.6	Very low	130 Å²	130	147.8 Å²	147.8	91%	0.909	76%	0.759	S	S	*	*			trans	-149.9	15.9	165	-86.2	0	0	0	0	114.8
297	R	36.9	Very low	39.6	Very low	249 Å²	249	142.6 Å²	142.6	94%	0.94	74%	0.736	S	S	*	*			trans	-103.7	12.6	-173.7	-132.2	179.8	-163	-178.4	4.4	115.9
298	R	36.9	Very low	39.8	Very low	231 Å²	231	140.1 Å²	140.1	87%	0.872	72%	0.723	S	S	*	*			trans	-112.2	21.5	-163.4	-105.8	-172.4	-179.1	-156.6	1.2	117.3
299	Q	36.4	Very low	39.6	Very low	168 Å²	168	136.4 Å²	136.4	79%	0.785	70%	0.703	S	S	*	*			trans	-105	7.8	-169.8	-74.6	-168.6	-6.6	0	0	118.4
300	S	40.6	Very low	39.9	Very low	115 Å²	115	138 Å²	138	80%	0.804	71%	0.706	S	S	*	*	S	Bend	trans	-102.8	10.5	-177.1	73	0	0	0	0	117
301	L	39.1	Very low	40.2	Very low	129 Å²	129	133.7 Å²	133.7	68%	0.675	68%	0.683	S	S	*	*			trans	-108.8	30.7	-177.6	-65.6	174.7	0	0	0	113.7	N303 L304	L301-N303 PolarHBondContact O-N 3.33Å; L301-L304 HydrophobicContact CB-CD1 4.28Å; L301-L304 HydrophobicContact CD2-CD1 3.95Å
302	K	38.8	Very low	40.6	Very low	178 Å²	178	131.7 Å²	131.7	77%	0.774	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-7.4	-174.8	-79.3	-173.6	175.1	-177.6	0	115.2
303	N	37.8	Very low	40.7	Very low	141 Å²	141	133.5 Å²	133.5	75%	0.754	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.8	51.4	-176.2	-60.6	-13.9	0	0	0	112.7	L301	L301-N303 PolarHBondContact O-N 3.33Å
304	L	37.6	Very low	41.3	Very low	94 Å²	94	131.7 Å²	131.7	49%	0.492	65%	0.646	S	S	.	*			trans	-81.8	115.6	168	-116.5	97.5	0	0	0	109.3	L301 Y346	L301-L304 HydrophobicContact CB-CD1 4.28Å; L301-L304 HydrophobicContact CD2-CD1 3.95Å; L304-Y346 HydrophobicContact CD2-CD1 4.17Å; L304-Y346 HydrophobicContact CD2-CE1 4.25Å
305	Y	47.5	Very low	42.1	Very low	159 Å²	159	128 Å²	128	62%	0.624	62%	0.619	S	S	*	*			trans	-93.4	123.3	165.8	-75.2	-84.9	0	0	0	109.2	M322	Y305-M322 HydrophobicContact CD2-CE 4.44Å; Y305-M322 HydrophobicContact CE2-CE 4.43Å; Y305-M322 HydrophobicContact CE2-SD 4.49Å
306	R	39.8	Very low	43.1	Very low	170 Å²	170	126.1 Å²	126.1	64%	0.642	61%	0.605	S	S	*	*			trans	-85.3	121.1	168.7	179.1	179.6	169.2	167.2	-0.5	107.7	D308	R306-D308 IonicContact CZ-OD1 2.71Å; R306-D308 IonicContact NE-OD1 3.39Å; R306-D308 PolarHBondContact NE-OD1 3.48Å; R306-D308 IonicContact NH2-OD1 2.99Å; R306-D308 PolarHBondContact NH2-OD1 3.38Å
307	L	46.9	Very low	44.1	Very low	36 Å²	36	126 Å²	126	19%	0.188	59%	0.594	C	S	.	*			trans	-114.1	117	169.9	-67.8	167.5	0	0	0	107.4	I312 L319 L347	L307-I312 HydrophobicContact CB-CG1 4.05Å; L307-L319 HydrophobicContact CD1-CD1 4.27Å; L307-L319 HydrophobicContact CD1-CD2 4.09Å; L307-L347 HydrophobicContact CD1-CD1 4.41Å
308	D	45.7	Very low	45.1	Very low	68 Å²	68	120.1 Å²	120.1	36%	0.364	58%	0.577	S	S	.	*			trans	-70.2	146	168.4	-61.1	-43.1	0	0	0	108.7	R306 E310 N311	R306-D308 IonicContact CZ-OD1 2.71Å; R306-D308 IonicContact NE-OD1 3.39Å; R306-D308 PolarHBondContact NE-OD1 3.48Å; R306-D308 IonicContact NH2-OD1 2.99Å; R306-D308 PolarHBondContact NH2-OD1 3.38Å; D308-E310 PolarHBondContact O-N 3.16Å; D308-N311 WeakPolarHBondContact O-CB 3.49Å; D308-N311 PolarHBondContact O-N 3.47Å
309	N	44	Very low	45.9	Very low	72 Å²	72	109.9 Å²	109.9	39%	0.385	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-30.1	-169.6	-73.5	-17.4	0	0	0	113.4	N311	N309-N311 VanDerWaalsContact C-N 3.33Å
310	E	48.2	Very low	46.9	Very low	176 Å²	176	104 Å²	104	82%	0.822	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-24.6	178	-60.4	-171.6	170.3	0	0	113.2	D308	D308-E310 PolarHBondContact O-N 3.16Å
311	N	47.2	Very low	47.7	Very low	67 Å²	67	102 Å²	102	36%	0.358	50%	0.503	S	S	.	.	H	α-helix	trans	-88.9	-15.7	-174.4	-72.7	-22.9	0	0	0	113.8	D308 N309 Y313 A314 H315	D308-N311 WeakPolarHBondContact O-CB 3.49Å; D308-N311 PolarHBondContact O-N 3.47Å; N309-N311 VanDerWaalsContact C-N 3.33Å; N311-Y313 VanDerWaalsContact C-N 3.28Å; N311-Y313 PolarHBondContact O-N 3.39Å; N311-A314 PolarHBondContact O-N 3.3Å; N311-H315 PolarHBondContact O-CD2 2.81Å; N311-H315 VanDerWaalsContact O-CD2 3.31Å; N311-H315 PolarHBondContact O-N 2.65Å; N311-H315 VanDerWaalsContact O-N 3.1Å
312	I	44.5	Very low	48.3	Very low	50 Å²	50	100.4 Å²	100.4	26%	0.256	49%	0.493	S	S	.	.	H	α-helix	trans	-63.5	-36.8	-177.8	-61	173.9	0	0	0	111.2	L307	L307-I312 HydrophobicContact CB-CG1 4.05Å
313	Y	45.1	Very low	49.1	Very low	175 Å²	175	95.3 Å²	95.3	69%	0.686	47%	0.471	S	S	*	.	H	α-helix	trans	-78.3	-34.6	178.1	-66.3	-76.1	0	0	0	112.6	N311	N311-Y313 VanDerWaalsContact C-N 3.28Å; N311-Y313 PolarHBondContact O-N 3.39Å
314	A	47.5	Very low	49.7	Very low	77 Å²	77	95.2 Å²	95.2	64%	0.636	47%	0.471	S	S	*	.	H	α-helix	trans	-70.8	-33.5	-178.3	0	0	0	0	0	112.9	N311	N311-A314 PolarHBondContact O-N 3.3Å
315	H	54.8	Low	50.4	Low	65 Å²	65	94.9 Å²	94.9	30%	0.301	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	20	-176.5	-67.8	-82.3	0	0	0	113.5	N311 D317 E318 L319	N311-H315 PolarHBondContact O-CD2 2.81Å; N311-H315 VanDerWaalsContact O-CD2 3.31Å; N311-H315 PolarHBondContact O-N 2.65Å; N311-H315 VanDerWaalsContact O-N 3.1Å; H315-D317 VanDerWaalsContact C-N 3.29Å; H315-D317 PolarHBondContact O-N 2.8Å; H315-E318 HydrophobicContact CB-CB 4.3Å; H315-E318 IonicContact CE1-OE2 3.51Å; H315-E318 IonicContact CG-OE2 3.72Å; H315-E318 IonicContact ND1-OE1 3.8Å; H315-E318 IonicContact ND1-OE2 2.7Å; H315-E318 PolarHBondContact ND1-OE2 2.98Å; H315-E318 CarbonylContact O-C 3.45Å; H315-E318 PolarHBondContact O-N 2.98Å; H315-E318 VanDerWaalsContact O-N 3.09Å; H315-L319 WeakPolarHBondContact O-CG 3.48Å; H315-L319 PolarHBondContact O-N 2.93Å
316	K	53.7	Low	50.4	Low	99 Å²	99	93 Å²	93	43%	0.43	47%	0.471	S	S	.	.	H	α-helix	trans	-51.3	-47.3	-177.7	179.7	-177.6	173.3	-176.2	0	112.4	L319 I320 T331	K316-L319 PolarHBondContact O-N 2.87Å; K316-I320 HydrophobicContact CG-CD1 3.92Å; K316-I320 WeakPolarHBondContact O-CD1 3.3Å; K316-I320 WeakPolarHBondContact O-CG1 3.18Å; K316-I320 PolarHBondContact O-N 2.82Å; K316-T331 HydrophobicContact CG-CG2 4.38Å
317	D	56.1	Low	50.6	Low	127 Å²	127	86 Å²	86	68%	0.679	45%	0.446	S	S	*	.	H	α-helix	trans	-71.9	-34	-177.9	-63.3	-28.5	0	0	0	111.8	H315 I320 A321	H315-D317 VanDerWaalsContact C-N 3.29Å; H315-D317 PolarHBondContact O-N 2.8Å; D317-I320 PolarHBondContact O-N 3Å; D317-A321 VanDerWaalsContact O-CB 3.31Å; D317-A321 WeakPolarHBondContact O-CB 3.1Å; D317-A321 PolarHBondContact O-N 3.22Å
318	E	58.2	Low	50.3	Low	126 Å²	126	87.6 Å²	87.6	59%	0.589	46%	0.457	S	S	*	.	H	α-helix	trans	-68.9	-38.5	173.3	-72.9	-177.3	-174.1	0	0	112.3	H315 A321 M322	H315-E318 HydrophobicContact CB-CB 4.3Å; H315-E318 IonicContact CE1-OE2 3.51Å; H315-E318 IonicContact CG-OE2 3.72Å; H315-E318 IonicContact ND1-OE1 3.8Å; H315-E318 IonicContact ND1-OE2 2.7Å; H315-E318 PolarHBondContact ND1-OE2 2.98Å; H315-E318 CarbonylContact O-C 3.45Å; H315-E318 PolarHBondContact O-N 2.98Å; H315-E318 VanDerWaalsContact O-N 3.09Å; E318-A321 PolarHBondContact O-N 3.48Å; E318-M322 WeakPolarHBondContact O-CB 3.45Å; E318-M322 PolarHBondContact O-N 3.39Å
319	L	54.3	Low	50.1	Low	16 Å²	16	89.5 Å²	89.5	8%	0.084	46%	0.462	C	S	.	.	H	α-helix	trans	-67	-39.8	174	-68.6	172.3	0	0	0	110.9	L307 H315 K316 A321 M322 F323 L327	L307-L319 HydrophobicContact CD1-CD1 4.27Å; L307-L319 HydrophobicContact CD1-CD2 4.09Å; H315-L319 WeakPolarHBondContact O-CG 3.48Å; H315-L319 PolarHBondContact O-N 2.93Å; K316-L319 PolarHBondContact O-N 2.87Å; L319-A321 VanDerWaalsContact C-N 3.32Å; L319-A321 PolarHBondContact O-N 2.94Å; L319-M322 HydrophobicContact CD2-CE 4.19Å; L319-M322 PolarHBondContact O-N 2.8Å; L319-F323 HydrophobicContact CD2-CE2 4.09Å; L319-F323 WeakPolarHBondContact O-CB 3.38Å; L319-F323 VanDerWaalsContact O-CD2 3.25Å; L319-F323 WeakPolarHBondContact O-CD2 3.44Å; L319-F323 PolarHBondContact O-N 2.95Å; L319-L327 HydrophobicContact CB-CD2 4.23Å
320	I	57	Low	49.7	Very low	45 Å²	45	89.4 Å²	89.4	23%	0.231	46%	0.461	C	S	.	.	H	α-helix	trans	-63.9	-40.6	174.3	-69.5	165.5	0	0	0	110.8	K316 D317 D324	K316-I320 HydrophobicContact CG-CD1 3.92Å; K316-I320 WeakPolarHBondContact O-CD1 3.3Å; K316-I320 WeakPolarHBondContact O-CG1 3.18Å; K316-I320 PolarHBondContact O-N 2.82Å; D317-I320 PolarHBondContact O-N 3Å; I320-D324 PolarHBondContact O-N 2.84Å
321	A	57.2	Low	49.2	Very low	72 Å²	72	84.1 Å²	84.1	60%	0.595	44%	0.441	S	S	*	.	H	α-helix	trans	-69.4	-38.7	177.3	0	0	0	0	0	112.9	D317 E318 L319 F323	D317-A321 VanDerWaalsContact O-CB 3.31Å; D317-A321 WeakPolarHBondContact O-CB 3.1Å; D317-A321 PolarHBondContact O-N 3.22Å; E318-A321 PolarHBondContact O-N 3.48Å; L319-A321 VanDerWaalsContact C-N 3.32Å; L319-A321 PolarHBondContact O-N 2.94Å; A321-F323 VanDerWaalsContact C-N 3.3Å; A321-F323 PolarHBondContact O-N 2.83Å
322	M	52.2	Low	48.7	Very low	95 Å²	95	85.1 Å²	85.1	47%	0.468	45%	0.453	S	S	.	.	H	α-helix	trans	-73.8	-22.6	-177.6	-162.6	173.3	69	0	0	112.6	Y305 E318 L319	Y305-M322 HydrophobicContact CD2-CE 4.44Å; Y305-M322 HydrophobicContact CE2-CE 4.43Å; Y305-M322 HydrophobicContact CE2-SD 4.49Å; E318-M322 WeakPolarHBondContact O-CB 3.45Å; E318-M322 PolarHBondContact O-N 3.39Å; L319-M322 HydrophobicContact CD2-CE 4.19Å; L319-M322 PolarHBondContact O-N 2.8Å
323	F	56.1	Low	48.4	Very low	72 Å²	72	89 Å²	89	32%	0.316	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118	20	-177.1	-67.4	-84.1	0	0	0	114	L319 A321 N325 D326 L327 C349	L319-F323 HydrophobicContact CD2-CE2 4.09Å; L319-F323 WeakPolarHBondContact O-CB 3.38Å; L319-F323 VanDerWaalsContact O-CD2 3.25Å; L319-F323 WeakPolarHBondContact O-CD2 3.44Å; L319-F323 PolarHBondContact O-N 2.95Å; A321-F323 VanDerWaalsContact C-N 3.3Å; A321-F323 PolarHBondContact O-N 2.83Å; F323-N325 PolarHBondContact O-N 2.85Å; F323-N325 VanDerWaalsContact O-N 3.14Å; F323-D326 WeakPolarHBondContact O-CB 3.45Å; F323-D326 PolarHBondContact O-N 2.81Å; F323-L327 HydrophobicContact CB-CD1 3.3Å; F323-L327 HydrophobicContact CD1-CD1 4.03Å; F323-L327 HydrophobicContact CD2-CD1 3.1Å; F323-L327 HydrophobicContact CE2-CD1 3.79Å; F323-L327 HydrophobicContact CG-CD1 3.21Å; F323-C349 HydrophobicContact CE1-CB 4.12Å
324	D	50.2	Low	47.9	Very low	139 Å²	139	85.5 Å²	85.5	74%	0.743	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.9	58.9	166.3	-98.1	-16.9	0	0	0	114.6	I320 D326	I320-D324 PolarHBondContact O-N 2.84Å; D324-D326 VanDerWaalsContact C-N 3.26Å; D324-D326 PolarHBondContact O-N 2.76Å
325	N	51.5	Low	47.2	Very low	86 Å²	86	85.3 Å²	85.3	46%	0.46	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	-6.6	-178.8	-59.9	-65.3	0	0	0	118	F323 L327 T328	F323-N325 PolarHBondContact O-N 2.85Å; F323-N325 VanDerWaalsContact O-N 3.14Å; N325-L327 PolarHBondContact O-N 3.41Å; N325-T328 PolarHBondContact O-N 2.91Å; N325-T328 PolarHBondContact O-OG1 3.36Å
326	D	48.2	Very low	46	Very low	121 Å²	121	88.9 Å²	88.9	65%	0.647	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-67.6	-16	176.9	-88.9	-18.3	0	0	0	112.8	F323 D324	F323-D326 WeakPolarHBondContact O-CB 3.45Å; F323-D326 PolarHBondContact O-N 2.81Å; D324-D326 VanDerWaalsContact C-N 3.26Å; D324-D326 PolarHBondContact O-N 2.76Å
327	L	44.5	Very low	45.1	Very low	23 Å²	23	88.3 Å²	88.3	12%	0.12	51%	0.511	C	S	.	.	G	3₁₀ helix	trans	-88.3	-0.4	175.7	-107.7	112.3	0	0	0	115.7	L319 F323 N325 F329 L330	L319-L327 HydrophobicContact CB-CD2 4.23Å; F323-L327 HydrophobicContact CB-CD1 3.3Å; F323-L327 HydrophobicContact CD1-CD1 4.03Å; F323-L327 HydrophobicContact CD2-CD1 3.1Å; F323-L327 HydrophobicContact CE2-CD1 3.79Å; F323-L327 HydrophobicContact CG-CD1 3.21Å; N325-L327 PolarHBondContact O-N 3.41Å; L327-F329 PolarHBondContact O-N 2.86Å; L327-L330 HydrophobicContact CD2-CB 4.19Å; L327-L330 HydrophobicContact CD2-CD1 3.51Å; L327-L330 HydrophobicContact CD2-CG 4.43Å; L327-L330 HydrophobicContact CG-CD1 3.92Å; L327-L330 PolarHBondContact O-N 3.02Å
328	T	41	Very low	43.9	Very low	69 Å²	69	87.7 Å²	87.7	42%	0.423	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-59.8	-15.5	175.2	46.8	0	0	0	0	113.1	N325 S332	N325-T328 PolarHBondContact O-N 2.91Å; N325-T328 PolarHBondContact O-OG1 3.36Å; T328-S332 PolarHBondContact O-OG 3.1Å
329	F	39.9	Very low	42.7	Very low	107 Å²	107	90.4 Å²	90.4	47%	0.469	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-74.2	-20.8	172.5	-69.9	-79.5	0	0	0	115.1	R40 L327	R40-F329 HydrophobicContact CB-CE1 4.11Å; R40-F329 HydrophobicContact CG-CE1 3.91Å; L327-F329 PolarHBondContact O-N 2.86Å
330	L	36.3	Very low	41.9	Very low	71 Å²	71	91.7 Å²	91.7	37%	0.372	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-17.1	-176.1	-84.4	172.3	0	0	0	113.9	L327 L347 L356	L327-L330 HydrophobicContact CD2-CB 4.19Å; L327-L330 HydrophobicContact CD2-CD1 3.51Å; L327-L330 HydrophobicContact CD2-CG 4.43Å; L327-L330 HydrophobicContact CG-CD1 3.92Å; L327-L330 PolarHBondContact O-N 3.02Å; L330-L347 HydrophobicContact CD1-CD2 4.44Å; L330-L356 HydrophobicContact CD1-CD1 3.9Å; L330-L356 HydrophobicContact CD1-CD2 4.14Å; L330-L356 HydrophobicContact CD2-CD1 3.56Å; L330-L356 HydrophobicContact CD2-CD2 4.38Å; L330-L356 HydrophobicContact CG-CD1 3.69Å
331	T	37.2	Very low	41.3	Very low	65 Å²	65	98 Å²	98	40%	0.399	56%	0.563	S	S	.	*	S	Bend	trans	-115.2	-3.3	-163.7	58.8	0	0	0	0	115.3	K316	K316-T331 HydrophobicContact CG-CG2 4.38Å
332	S	38.1	Very low	40.5	Very low	87 Å²	87	104 Å²	104	61%	0.608	57%	0.572	S	S	*	*	S	Bend	trans	-106.7	-18.1	-168.4	55.5	0	0	0	0	116.9	T328	T328-S332 PolarHBondContact O-OG 3.1Å
333	T	36.3	Very low	39.9	Very low	133 Å²	133	101.6 Å²	101.6	82%	0.816	57%	0.571	S	S	*	*	S	Bend	trans	-152.8	7.5	-178	54.9	0	0	0	0	117.4	G335	T333-G335 PolarHBondContact O-N 2.89Å
334	C	36	Very low	38.9	Very low	100 Å²	100	100.3 Å²	100.3	68%	0.676	57%	0.571	S	S	*	*			trans	-96.5	89.5	-178.5	-135.4	0	0	0	0	111.2	D336	C334-D336 PolarHBondContact O-N 3.26Å
335	G	31.5	Very low	38.8	Very low	74 Å²	74	96.3 Å²	96.3	76%	0.763	55%	0.547	S	S	*	.			trans	-78	4.2	173	0	0	0	0	0	114.7	T333	T333-G335 PolarHBondContact O-N 2.89Å
336	D	30	Very low	38.2	Very low	140 Å²	140	96 Å²	96	75%	0.749	54%	0.54	S	S	*	.			trans	-120.4	66.5	-175.4	-62.7	-36.3	0	0	0	111	C334 V338	C334-D336 PolarHBondContact O-N 3.26Å; D336-V338 PolarHBondContact O-N 3.45Å
337	V	34.4	Very low	38.1	Very low	87 Å²	87	93.8 Å²	93.8	53%	0.527	53%	0.527	S	S	.	.			trans	-82.9	91.4	159.2	-177.5	0	0	0	0	106.5	E339	V337-E339 PolarHBondContact O-N 3.12Å
338	V	31.6	Very low	37.9	Very low	113 Å²	113	96.9 Å²	96.9	69%	0.685	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-61.5	117.8	171	-179.1	0	0	0	0	108.2	D336 S340 K345	D336-V338 PolarHBondContact O-N 3.45Å; V338-S340 PolarHBondContact O-N 3.32Å; V338-K345 PolarHBondContact O-NZ 2.92Å
339	E	34.3	Very low	37.7	Very low	184 Å²	184	98 Å²	98	86%	0.86	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-62	122.4	169.1	-72.4	-179.4	162.2	0	0	108.3	V337	V337-E339 PolarHBondContact O-N 3.12Å
340	S	37.6	Very low	37.5	Very low	43 Å²	43	99.3 Å²	99.3	30%	0.301	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-100.2	126.5	167	160.8	0	0	0	0	106.4	V338 Y342	V338-S340 PolarHBondContact O-N 3.32Å; S340-Y342 PolarHBondContact O-N 3.4Å; S340-Y342 PolarHBondContact OG-N 2.98Å
341	E	44.2	Very low	37.3	Very low	178 Å²	178	101.5 Å²	101.5	83%	0.832	58%	0.578	S	S	*	*	S	Bend	trans	-64.2	-4.8	175.8	-70.9	-178	157.1	0	0	112.9
342	Y	39.9	Very low	37.4	Very low	198 Å²	198	101.5 Å²	101.5	78%	0.776	59%	0.592	S	S	*	*	S	Bend	trans	-132.2	76.5	-171.4	-58.6	-84.2	0	0	0	112.5	S340	S340-Y342 PolarHBondContact O-N 3.4Å; S340-Y342 PolarHBondContact OG-N 2.98Å
343	G	38.5	Very low	37.3	Very low	43 Å²	43	101.9 Å²	101.9	44%	0.443	59%	0.586	S	S	.	*			trans	104.9	165.2	151.3	0	0	0	0	0	118.8
344	S	36.6	Very low	37.8	Very low	46 Å²	46	100.8 Å²	100.8	32%	0.322	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-63.6	138.3	-174.3	-47.3	0	0	0	0	113.2
345	K	46.9	Very low	38	Very low	54 Å²	54	103.1 Å²	103.1	24%	0.235	57%	0.57	C	S	.	*	P	Polyproline II helix	trans	-91.8	123.6	175.7	-67.5	-178.6	-178.1	177.6	0	111.1	V338	V338-K345 PolarHBondContact O-NZ 2.92Å
346	Y	39.7	Very low	38.5	Very low	80 Å²	80	103.6 Å²	103.6	31%	0.314	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.7	127.6	173.7	-62.7	-90.3	0	0	0	110.4	L304	L304-Y346 HydrophobicContact CD2-CD1 4.17Å; L304-Y346 HydrophobicContact CD2-CE1 4.25Å
347	L	45.1	Very low	39.2	Very low	74 Å²	74	103.3 Å²	103.3	39%	0.387	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	113.4	170.3	-69.7	169.4	0	0	0	109.1	L307 L330 L356	L307-L347 HydrophobicContact CD1-CD1 4.41Å; L330-L347 HydrophobicContact CD1-CD2 4.44Å; L347-L356 HydrophobicContact CD2-CD2 3.39Å
348	F	40.9	Very low	39.8	Very low	89 Å²	89	103.8 Å²	103.8	39%	0.39	55%	0.552	S	S	.	*			trans	-95.5	116.7	169.3	-61.1	-88.5	0	0	0	108.9
349	C	37.7	Very low	40.3	Very low	91 Å²	91	105.2 Å²	105.2	62%	0.615	55%	0.546	S	S	*	.			trans	-104.7	100.2	160.6	-172.6	0	0	0	0	107.5	F323	F323-C349 HydrophobicContact CE1-CB 4.12Å
350	Q	34.2	Very low	41	Very low	135 Å²	135	103.7 Å²	103.7	63%	0.631	54%	0.539	S	S	*	.			trans	-94.2	112.1	166.3	-167.5	160.1	7.6	0	0	107	G352 I353	Q350-G352 PolarHBondContact O-N 3.23Å; Q350-I353 HydrophobicContact CB-CD1 4.09Å; Q350-I353 HydrophobicContact CB-CG1 4.33Å; Q350-I353 HydrophobicContact CG-CD1 4.19Å; Q350-I353 HydrophobicContact CG-CG1 4.49Å; Q350-I353 PolarHBondContact O-N 3.47Å
351	S	33.5	Very low	41.9	Very low	117 Å²	117	103.1 Å²	103.1	82%	0.818	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	110.7	173	59.3	0	0	0	0	108.9
352	G	39.3	Very low	41.8	Very low	66 Å²	66	100.3 Å²	100.3	68%	0.68	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.2	3.6	-178.3	0	0	0	0	0	117.1	Q350	Q350-G352 PolarHBondContact O-N 3.23Å
353	I	36.2	Very low	42.1	Very low	95 Å²	95	98.1 Å²	98.1	49%	0.487	54%	0.539	S	S	.	.			trans	-118.6	117.5	173	-55.9	-178.5	0	0	0	110.2	Q350 K355	Q350-I353 HydrophobicContact CB-CD1 4.09Å; Q350-I353 HydrophobicContact CB-CG1 4.33Å; Q350-I353 HydrophobicContact CG-CD1 4.19Å; Q350-I353 HydrophobicContact CG-CG1 4.49Å; Q350-I353 PolarHBondContact O-N 3.47Å; I353-K355 HydrophobicContact CG2-CB 4.46Å; I353-K355 PolarHBondContact O-N 3.04Å
354	E	44.9	Very low	42.4	Very low	109 Å²	109	107 Å²	107	51%	0.509	56%	0.56	S	S	.	*	S	Bend	trans	-64.9	8.9	-178.8	-76.5	-178.4	164.9	0	0	115.3	T96 S97	T96-E354 PolarHBondContact N-OE1 3.25Å; T96-E354 WeakPolarHBondContact OG1-CG 3.37Å; T96-E354 PolarHBondContact OG1-OE1 3.22Å; S97-E354 WeakPolarHBondContact CB-OE1 3.42Å; S97-E354 WeakPolarHBondContact CB-OE2 3.27Å; S97-E354 PolarHBondContact N-OE1 2.79Å; S97-E354 PolarHBondContact OG-OE1 3.18Å; S97-E354 PolarHBondContact OG-OE2 3.23Å
355	K	41.1	Very low	42.8	Very low	150 Å²	150	113.2 Å²	113.2	65%	0.652	58%	0.584	S	S	*	*			trans	-138.9	115.5	-170.4	-156.5	174.5	-176.5	-177.6	0	110.4	I353 Q357	I353-K355 HydrophobicContact CG2-CB 4.46Å; I353-K355 PolarHBondContact O-N 3.04Å; K355-Q357 PolarHBondContact O-N 3.42Å
356	L	41.2	Very low	42.9	Very low	84 Å²	84	115.3 Å²	115.3	44%	0.44	61%	0.606	S	S	.	*			trans	-59.8	117.5	158	-88.9	134.5	0	0	0	107.9	L330 L347	L330-L356 HydrophobicContact CD1-CD1 3.9Å; L330-L356 HydrophobicContact CD1-CD2 4.14Å; L330-L356 HydrophobicContact CD2-CD1 3.56Å; L330-L356 HydrophobicContact CD2-CD2 4.38Å; L330-L356 HydrophobicContact CG-CD1 3.69Å; L347-L356 HydrophobicContact CD2-CD2 3.39Å
357	Q	45.1	Very low	43.5	Very low	133 Å²	133	117.3 Å²	117.3	62%	0.621	63%	0.629	S	S	*	*			trans	-101.9	115.3	167.4	-73.3	-176.9	-11.1	0	0	107.4	K355	K355-Q357 PolarHBondContact O-N 3.42Å
358	T	48.5	Very low	43.4	Very low	98 Å²	98	121.5 Å²	121.5	60%	0.601	65%	0.651	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.6	122.6	159.3	39.3	0	0	0	0	107.5
359	Y	41.4	Very low	43.7	Very low	142 Å²	142	130.1 Å²	130.1	56%	0.557	69%	0.693	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.7	115.1	172.2	-178.6	-104.7	0	0	0	108.8	G361	Y359-G361 VanDerWaalsContact CE1-CA 3.49Å
360	E	48.8	Very low	44	Very low	152 Å²	152	132.1 Å²	132.1	71%	0.71	70%	0.697	S	S	*	*			trans	-101	107.3	162	-72.6	-178.3	168.3	0	0	106.8
361	G	55.4	Low	44.5	Very low	32 Å²	32	131.9 Å²	131.9	33%	0.33	70%	0.7	S	S	.	*			trans	-134.7	154.3	176.7	0	0	0	0	0	110.8	Y359 L363	Y359-G361 VanDerWaalsContact CE1-CA 3.49Å; G361-L363 PolarHBondContact O-N 3.48Å
362	P	42.9	Very low	45.1	Very low	119 Å²	119	132.8 Å²	132.8	77%	0.773	69%	0.694	S	S	*	*			trans	-59.3	136.1	-178.9	24.5	-32.2	0	0	0	109.9	Y364	P362-Y364 PolarHBondContact O-N 2.81Å
363	L	46.3	Very low	45.4	Very low	152 Å²	152	136.7 Å²	136.7	80%	0.796	70%	0.695	S	S	*	*			trans	-54.9	123	170.5	-72.9	163.9	0	0	0	107.9	G361 E365	G361-L363 PolarHBondContact O-N 3.48Å; L363-E365 VanDerWaalsContact C-N 3.29Å; L363-E365 PolarHBondContact O-N 3.47Å
364	Y	45.8	Very low	46	Very low	229 Å²	229	139.3 Å²	139.3	90%	0.898	71%	0.707	S	S	*	*			trans	-64.6	101.3	159.9	-103.4	-87.6	0	0	0	105.9	P362 S366	P362-Y364 PolarHBondContact O-N 2.81Å; Y364-S366 PolarHBondContact O-N 3.16Å
365	E	44.9	Very low	46.1	Very low	177 Å²	177	141.3 Å²	141.3	83%	0.827	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-57.7	120.5	163.6	-70.7	-175.8	170.1	0	0	107.1	L363	L363-E365 VanDerWaalsContact C-N 3.29Å; L363-E365 PolarHBondContact O-N 3.47Å
366	S	47.9	Very low	46.4	Very low	97 Å²	97	140.7 Å²	140.7	68%	0.678	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-49.8	135.6	167.4	-19.2	0	0	0	0	107.9	Y364 N368	Y364-S366 PolarHBondContact O-N 3.16Å; S366-N368 PolarHBondContact O-N 2.97Å
367	P	51.8	Low	46.8	Very low	123 Å²	123	145.1 Å²	145.1	80%	0.799	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-61.6	119.1	170.7	24.5	-25.4	0	0	0	106.9	E369	P367-E369 PolarHBondContact O-N 2.82Å
368	N	42.9	Very low	47	Very low	162 Å²	162	146.1 Å²	146.1	87%	0.866	76%	0.758	S	S	*	*			trans	-63.2	103.5	166	-78	-33.6	0	0	0	107.3	S366	S366-N368 PolarHBondContact O-N 2.97Å
369	E	47.3	Very low	46.8	Very low	270 Å²	270	150.5 Å²	150.5	100%	1.262	77%	0.772	S	S	*	*			trans	-163.1	0	150.9	-110.2	174.7	-171.2	0	0	111.1	P367	P367-E369 PolarHBondContact O-N 2.82Å

Retrieved 369 of 369 residues in 65.7 ms (Link to these results)

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