A0A3Q0KRL3_SCHMA Loading...

PID domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KRL3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 315 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	36.5	Very low	35.4	Very low	231 Å²	231	160.8 Å²	160.8	100%	1.138	85%	0.854	S	S	*	*				0	145	0	-68.8	168.4	69.5	0	0	107.9
2	S	41.3	Very low	34.9	Very low	110 Å²	110	157 Å²	157	77%	0.769	85%	0.845	S	S	*	*			trans	35.9	105.6	158.3	55	0	0	0	0	119
3	D	36	Very low	34.5	Very low	153 Å²	153	158.5 Å²	158.5	82%	0.818	84%	0.843	S	S	*	*			trans	-60	156.6	159.5	-54.8	-95.2	0	0	0	113
4	I	40.8	Very low	34	Very low	169 Å²	169	156.3 Å²	156.3	87%	0.867	83%	0.829	S	S	*	*				-174.9	137.3	105.6	-91.4	160.3	0	0	0	108.9
5	R	38.1	Very low	33.6	Very low	241 Å²	241	159.2 Å²	159.2	91%	0.909	83%	0.826	S	S	*	*			trans	-98.1	149.6	-179.1	-105.7	176.8	169.7	169.1	-3.8	112.4
6	S	34.9	Very low	33.3	Very low	112 Å²	112	160.3 Å²	160.3	78%	0.783	83%	0.826	S	S	*	*			trans	-55.6	150.3	172.5	-11.3	0	0	0	0	113.9
7	K	37.3	Very low	33	Very low	214 Å²	214	162.5 Å²	162.5	93%	0.93	83%	0.832	S	S	*	*				-173.1	154.9	121.5	-102.1	164.3	-175.5	-174.9	0	112.9
8	S	30.1	Very low	32.6	Very low	111 Å²	111	157.4 Å²	157.4	78%	0.776	83%	0.826	S	S	*	*			trans	-117.2	130.6	-174.5	52.8	0	0	0	0	112.4
9	L	33.1	Very low	32.3	Very low	164 Å²	164	153 Å²	153	86%	0.859	82%	0.822	S	S	*	*			trans	-146.1	114.9	165.1	-75.7	169.4	0	0	0	104.7
10	S	32.8	Very low	32.2	Very low	92 Å²	92	154.8 Å²	154.8	64%	0.643	82%	0.822	S	S	*	*			cis	108.9	121.9	43.9	62.2	0	0	0	0	110
11	L	29.1	Very low	32	Very low	172 Å²	172	150.9 Å²	150.9	90%	0.901	81%	0.808	S	S	*	*			trans	63.8	108.8	165.3	-71.3	156.6	0	0	0	118.8
12	P	28.7	Very low	31.6	Very low	115 Å²	115	144.9 Å²	144.9	75%	0.747	78%	0.784	S	S	*	*			trans	-105.7	116.8	160.8	34.4	-23.7	0	0	0	111.8
13	H	29.9	Very low	31	Very low	176 Å²	176	144.9 Å²	144.9	82%	0.815	77%	0.768	S	S	*	*			trans	-178.8	144.8	143.4	-112.3	-82.1	0	0	0	111.5
14	I	27.7	Very low	30.6	Very low	128 Å²	128	141.8 Å²	141.8	66%	0.656	76%	0.758	S	S	*	*			trans	53.4	103	158.9	-50.8	159.6	0	0	0	115.8
15	Y	28.4	Very low	30	Very low	200 Å²	200	137 Å²	137	78%	0.784	74%	0.735	S	S	*	*				-170.3	144.7	111.5	-103	-72	0	0	0	111.4	H17	Y15-H17 PolarHBondContact O-N 2.67Å
16	E	28.4	Very low	29.7	Very low	176 Å²	176	129.1 Å²	129.1	82%	0.822	71%	0.71	S	S	*	*			trans	-27.7	103.1	-179.4	-60.3	171.3	149.2	0	0	117.6
17	H	27.3	Very low	29.9	Very low	199 Å²	199	130.4 Å²	130.4	92%	0.921	70%	0.704	S	S	*	*			trans	-143.5	144.4	166.8	-92.4	-68.9	0	0	0	112.1	Y15	Y15-H17 PolarHBondContact O-N 2.67Å
18	G	26.7	Very low	30.6	Very low	71 Å²	71	122.3 Å²	122.3	73%	0.732	67%	0.671	S	S	*	*			trans	110.3	105.6	179.9	0	0	0	0	0	112.4
19	G	26.5	Very low	32.4	Very low	73 Å²	73	123 Å²	123	75%	0.753	66%	0.659	S	S	*	*			cis	113.5	36.5	10.2	0	0	0	0	0	113.9
20	F	31.1	Very low	34.7	Very low	188 Å²	188	120 Å²	120	83%	0.825	64%	0.644	S	S	*	*			trans	-121.5	93.2	178.9	-73.2	-73.4	0	0	0	112.7	T22	F20-T22 PolarHBondContact O-N 2.68Å
21	S	26.7	Very low	37	Very low	74 Å²	74	115.8 Å²	115.8	52%	0.517	61%	0.614	S	S	.	*			trans	-79.7	94.2	170.6	53.6	0	0	0	0	110.8	Y23 S222	S21-Y23 VanDerWaalsContact C-N 3.32Å; S21-Y23 PolarHBondContact O-N 2.76Å; S21-S222 PolarHBondContact OG-OG 3.49Å
22	T	28.4	Very low	39.6	Very low	105 Å²	105	116.3 Å²	116.3	64%	0.644	61%	0.609	S	S	*	*			trans	-79	57.2	-171.4	50.4	0	0	0	0	115.3	F20 S24	F20-T22 PolarHBondContact O-N 2.68Å; T22-S24 PolarHBondContact O-N 2.9Å; T22-S24 VanDerWaalsContact O-N 3.15Å
23	Y	29.1	Very low	42.2	Very low	109 Å²	109	117.2 Å²	117.2	43%	0.427	60%	0.601	S	S	.	*			trans	-71.6	-4.4	172.8	-72.8	-139.3	0	0	0	113.6	S21 L25 L221 S222	S21-Y23 VanDerWaalsContact C-N 3.32Å; S21-Y23 PolarHBondContact O-N 2.76Å; Y23-L25 VanDerWaalsContact C-N 3.35Å; Y23-L25 PolarHBondContact O-N 2.84Å; Y23-L25 VanDerWaalsContact O-N 3.08Å; Y23-L221 WeakPolarHBondContact CB-O 3.47Å; Y23-L221 HydrophobicContact CD1-CB 3.93Å; Y23-L221 HydrophobicContact CD1-CD2 3.28Å; Y23-L221 HydrophobicContact CD1-CG 4.16Å; Y23-L221 WeakPolarHBondContact CD1-O 3.29Å; Y23-L221 WeakPolarHBondContact CD2-O 3.34Å; Y23-L221 HydrophobicContact CE1-CB 2.82Å; Y23-L221 HydrophobicContact CE1-CD1 4.32Å; Y23-L221 HydrophobicContact CE1-CD2 3.26Å; Y23-L221 HydrophobicContact CE1-CG 3.51Å; Y23-L221 WeakPolarHBondContact CE1-O 3.42Å; Y23-L221 HydrophobicContact CE2-CB 4.35Å; Y23-L221 WeakPolarHBondContact CE2-O 3.27Å; Y23-L221 WeakPolarHBondContact OH-CA 3.21Å; Y23-L221 WeakPolarHBondContact OH-CB 3.29Å; Y23-L221 PolarHBondContact OH-N 2.92Å; Y23-S222 WeakPolarHBondContact CB-O 3.48Å; Y23-S222 VanDerWaalsContact CE2-CA 3.48Å; Y23-S222 WeakPolarHBondContact CE2-OG 3.17Å; Y23-S222 VanDerWaalsContact CG-O 3.23Å; Y23-S222 PolarHBondContact OH-N 2.89Å
24	S	26.8	Very low	44.8	Very low	88 Å²	88	111.2 Å²	111.2	62%	0.615	58%	0.577	S	S	*	*	S	Bend	trans	-90.9	56.9	-160.3	-170.3	0	0	0	0	113	T22	T22-S24 PolarHBondContact O-N 2.9Å; T22-S24 VanDerWaalsContact O-N 3.15Å
25	L	29.8	Very low	47.5	Very low	70 Å²	70	112 Å²	112	37%	0.366	58%	0.576	S	S	.	*	S	Bend	trans	-158.1	-47.6	156.6	-141.9	60.4	0	0	0	118	Y23 Q27 E240	Y23-L25 VanDerWaalsContact C-N 3.35Å; Y23-L25 PolarHBondContact O-N 2.84Å; Y23-L25 VanDerWaalsContact O-N 3.08Å; L25-Q27 PolarHBondContact O-N 3.21Å; L25-E240 HydrophobicContact CD2-CB 3.84Å; L25-E240 HydrophobicContact CD2-CG 3.9Å
26	N	30.7	Very low	50.2	Low	75 Å²	75	104.1 Å²	104.1	40%	0.401	55%	0.546	S	S	.	.			trans	-81.9	46.5	-174.2	-70.2	-72.3	0	0	0	113	L28	N26-L28 PolarHBondContact O-N 2.91Å
27	Q	38.9	Very low	52.9	Low	139 Å²	139	96.5 Å²	96.5	65%	0.65	51%	0.512	S	S	*	.			trans	-68.1	98.1	162.1	-75.3	-158.6	-31	0	0	108.5	L25 K29	L25-Q27 PolarHBondContact O-N 3.21Å; Q27-K29 PolarHBondContact O-N 3.21Å
28	L	51.7	Low	55.7	Low	43 Å²	43	87.4 Å²	87.4	23%	0.225	47%	0.471	C	S	.	.			trans	-44.8	117	162.9	-71	133.7	0	0	0	107.5	N26 L30 E167 P172	N26-L28 PolarHBondContact O-N 2.91Å; L28-L30 VanDerWaalsContact C-N 3.26Å; L28-L30 PolarHBondContact O-N 3.14Å; L28-E167 WeakPolarHBondContact CD1-OE1 3.48Å; L28-E167 HydrophobicContact CD2-CG 4.35Å; L28-P172 HydrophobicContact CD2-CB 4.22Å; L28-P172 HydrophobicContact CD2-CG 4.43Å
29	K	68.9	Low	58.6	Low	125 Å²	125	84.6 Å²	84.6	54%	0.543	44%	0.438	S	S	.	.			trans	-69.5	85.7	-168.9	-178.1	177.1	-177.6	170.1	0	109	Q27 D31 V38	Q27-K29 PolarHBondContact O-N 3.21Å; K29-D31 PolarHBondContact O-N 2.79Å; K29-V38 VanDerWaalsContact O-CB 3.27Å; K29-V38 WeakPolarHBondContact O-CB 3.41Å; K29-V38 WeakPolarHBondContact O-CG2 3.35Å
30	L	80.7	Confident	61.6	Low	102 Å²	102	81.6 Å²	81.6	53%	0.534	40%	0.404	S	S	.	.			trans	-52.9	131.5	-170.7	-63.9	-175.3	0	0	0	110.4	L28 K32 Q36	L28-L30 VanDerWaalsContact C-N 3.26Å; L28-L30 PolarHBondContact O-N 3.14Å; L30-K32 PolarHBondContact O-N 3.45Å; L30-K32 VanDerWaalsContact O-N 3.16Å; L30-Q36 WeakPolarHBondContact CA-O 3Å
31	D	82.2	Confident	64.4	Low	3 Å²	3	73.2 Å²	73.2	2%	0.016	37%	0.368	C	S	.	.			trans	-60.7	123.1	179	-171.2	85.2	0	0	0	109.4	K29 K33 T34 K35 Q36 V38 L83 R88	K29-D31 PolarHBondContact O-N 2.79Å; D31-K33 PolarHBondContact O-N 2.94Å; D31-K33 WeakPolarHBondContact OD2-CA 3.33Å; D31-K33 WeakPolarHBondContact OD2-CB 3.37Å; D31-K33 PolarHBondContact OD2-N 3.26Å; D31-T34 WeakPolarHBondContact CB-OG1 3.39Å; D31-T34 PolarHBondContact OD2-N 3.44Å; D31-K35 VanDerWaalsContact O-CA 3.27Å; D31-K35 WeakPolarHBondContact O-CA 3.38Å; D31-K35 PolarHBondContact O-N 1.76Å; D31-Q36 PolarHBondContact N-O 3.37Å; D31-V38 HydrophobicContact CB-CG2 4.14Å; D31-L83 HydrophobicContact CB-CD1 4.42Å; D31-L83 HydrophobicContact CB-CD2 3.96Å; D31-R88 VanDerWaalsContact CG-NE 3.3Å; D31-R88 IonicContact OD1-CZ 2.61Å; D31-R88 IonicContact OD1-NE 2.78Å; D31-R88 PolarHBondContact OD1-NE 3.17Å; D31-R88 IonicContact OD1-NH2 3.57Å; D31-R88 PolarHBondContact OD1-NH2 2.81Å; D31-R88 IonicContact OD2-CZ 2.96Å; D31-R88 IonicContact OD2-NE 2.93Å; D31-R88 PolarHBondContact OD2-NE 3.33Å; D31-R88 IonicContact OD2-NH2 2.75Å
32	K	82.1	Confident	67.5	Low	183 Å²	183	69.7 Å²	69.7	80%	0.796	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.5	-174.8	-71.3	-167.3	175.2	-170.8	0	112.5	L30 K35	L30-K32 PolarHBondContact O-N 3.45Å; L30-K32 VanDerWaalsContact O-N 3.16Å; K32-K35 PolarHBondContact O-NZ 2.65Å
33	K	83.4	Confident	70.5	Confident	135 Å²	135	67 Å²	67	59%	0.587	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-51.1	-175.6	-58.9	-179.4	178.5	179	0	112.2	D31 E90	D31-K33 PolarHBondContact O-N 2.94Å; D31-K33 WeakPolarHBondContact OD2-CA 3.33Å; D31-K33 WeakPolarHBondContact OD2-CB 3.37Å; D31-K33 PolarHBondContact OD2-N 3.26Å; K33-E90 WeakPolarHBondContact CE-OE1 3.5Å; K33-E90 IonicContact NZ-OE1 3.44Å; K33-E90 PolarHBondContact NZ-OE1 2.88Å; K33-E90 IonicContact NZ-OE2 3Å
34	T	85.1	Confident	73.6	Confident	49 Å²	49	61.9 Å²	61.9	30%	0.301	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-12.2	-175.6	72.8	0	0	0	0	114.2	D31 Q36 L83	D31-T34 WeakPolarHBondContact CB-OG1 3.39Å; D31-T34 PolarHBondContact OD2-N 3.44Å; T34-Q36 VanDerWaalsContact CB-OE1 3.3Å; T34-Q36 PolarHBondContact O-N 3.45Å; T34-Q36 VanDerWaalsContact O-N 3.14Å; T34-Q36 WeakPolarHBondContact OG1-CB 3.42Å; T34-Q36 WeakPolarHBondContact OG1-CG 3.27Å; T34-Q36 PolarHBondContact OG1-N 3.46Å; T34-Q36 PolarHBondContact OG1-OE1 3.18Å; T34-L83 HydrophobicContact CG2-CD1 4.07Å
35	K	85.1	Confident	76.8	Confident	144 Å²	144	58.6 Å²	58.6	63%	0.626	28%	0.28	S	S	*	.			trans	60.9	8.6	-173.4	-46.6	-53.2	-175.4	-168.5	0	115.2	D31 K32	D31-K35 VanDerWaalsContact O-CA 3.27Å; D31-K35 WeakPolarHBondContact O-CA 3.38Å; D31-K35 PolarHBondContact O-N 1.76Å; K32-K35 PolarHBondContact O-NZ 2.65Å
36	Q	84.5	Confident	80	Confident	35 Å²	35	55.3 Å²	55.3	16%	0.164	26%	0.263	C	S	.	.			trans	-78.7	156.5	178	-64.3	164.3	-37.8	0	0	111.8	L30 D31 T34 V38 L83 D85 Q86	L30-Q36 WeakPolarHBondContact CA-O 3Å; D31-Q36 PolarHBondContact N-O 3.37Å; T34-Q36 VanDerWaalsContact CB-OE1 3.3Å; T34-Q36 PolarHBondContact O-N 3.45Å; T34-Q36 VanDerWaalsContact O-N 3.14Å; T34-Q36 WeakPolarHBondContact OG1-CB 3.42Å; T34-Q36 WeakPolarHBondContact OG1-CG 3.27Å; T34-Q36 PolarHBondContact OG1-N 3.46Å; T34-Q36 PolarHBondContact OG1-OE1 3.18Å; Q36-V38 PolarHBondContact O-N 3.42Å; Q36-L83 HydrophobicContact CB-CB 4.35Å; Q36-D85 PolarHBondContact NE2-OD1 3.04Å; Q36-D85 PolarHBondContact NE2-OD2 2.9Å; Q36-D85 PolarHBondContact OE1-OD1 2.9Å; Q36-Q86 VanDerWaalsContact OE1-NE2 3.13Å
37	S	84.4	Confident	83.1	Confident	17 Å²	17	52.2 Å²	52.2	12%	0.119	25%	0.246	C	C	.	.			trans	-54	125.3	165.6	-74.8	0	0	0	0	111.4	Y39 L83 E167	S37-Y39 WeakPolarHBondContact O-CD2 3.46Å; S37-L83 WeakPolarHBondContact O-CA 3.42Å; S37-E167 VanDerWaalsContact CB-OE1 3.3Å; S37-E167 WeakPolarHBondContact CB-OE1 3.28Å; S37-E167 PolarHBondContact OG-OE1 3.47Å
38	V	87.7	Confident	85.7	Confident	7 Å²	7	48.7 Å²	48.7	4%	0.042	23%	0.229	C	C	.	.			trans	-85.6	107.6	164.7	175.4	0	0	0	0	108.2	K29 D31 Q36 Y40 M41 Y81 L83	K29-V38 VanDerWaalsContact O-CB 3.27Å; K29-V38 WeakPolarHBondContact O-CB 3.41Å; K29-V38 WeakPolarHBondContact O-CG2 3.35Å; D31-V38 HydrophobicContact CB-CG2 4.14Å; Q36-V38 PolarHBondContact O-N 3.42Å; V38-Y40 WeakPolarHBondContact CG1-O 3.45Å; V38-M41 HydrophobicContact CG1-CB 4.25Å; V38-Y81 HydrophobicContact CG1-CD1 4.11Å; V38-Y81 HydrophobicContact CG2-CD1 3.96Å; V38-L83 HydrophobicContact CB-CD2 4.34Å; V38-L83 HydrophobicContact CG2-CD2 3.55Å
39	Y	87.1	Confident	87.8	Confident	13 Å²	13	51.2 Å²	51.2	5%	0.051	24%	0.235	C	C	.	.			trans	-72.8	-35.7	176.8	-74.7	-100.3	0	0	0	112	S37 C82 Q84 L165 E167	S37-Y39 WeakPolarHBondContact O-CD2 3.46Å; Y39-C82 PolarHBondContact N-O 2.71Å; Y39-Q84 HydrophobicContact CE2-CB 4.25Å; Y39-L165 HydrophobicContact CD1-CB 4.16Å; Y39-L165 HydrophobicContact CD1-CD1 4.28Å; Y39-L165 HydrophobicContact CD2-CB 4.14Å; Y39-L165 HydrophobicContact CD2-CD1 4.18Å; Y39-L165 HydrophobicContact CE1-CB 4.01Å; Y39-L165 HydrophobicContact CE2-CB 4.03Å; Y39-L165 HydrophobicContact CG-CB 4.22Å; Y39-L165 HydrophobicContact CG-CD1 3.87Å; Y39-L165 PolarHBondContact OH-O 3.04Å; Y39-E167 HydrophobicContact CE1-CB 4.46Å; Y39-E167 HydrophobicContact CE1-CG 3.75Å; Y39-E167 PolarHBondContact OH-N 3.35Å
40	Y	89.6	Confident	88.9	Confident	10 Å²	10	49.6 Å²	49.6	4%	0.039	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	149.6	-176.5	-175.6	-116.7	0	0	0	111.3	V38 C42 C82 D146 M149 L150 L153 K173 S175	V38-Y40 WeakPolarHBondContact CG1-O 3.45Å; Y40-C42 HydrophobicContact CE1-CB 3.88Å; Y40-C82 PolarHBondContact O-N 2.93Å; Y40-D146 WeakPolarHBondContact OH-CA 3.42Å; Y40-D146 PolarHBondContact OH-OD1 2.81Å; Y40-M149 HydrophobicContact CD1-CG 4Å; Y40-M149 HydrophobicContact CD2-CG 3.82Å; Y40-M149 HydrophobicContact CE1-CB 3.96Å; Y40-M149 HydrophobicContact CE1-CG 3.78Å; Y40-M149 HydrophobicContact CE2-CB 4.3Å; Y40-M149 HydrophobicContact CE2-CG 3.66Å; Y40-M149 HydrophobicContact CG-CG 4.03Å; Y40-L150 HydrophobicContact CD1-CD2 4.06Å; Y40-L150 HydrophobicContact CE1-CD2 4.15Å; Y40-L150 HydrophobicContact CE1-CG 4.23Å; Y40-L153 HydrophobicContact CD1-CD1 3.69Å; Y40-L153 HydrophobicContact CG-CD1 3.65Å; Y40-K173 WeakPolarHBondContact CA-O 3.42Å; Y40-K173 HydrophobicContact CD2-CB 4.21Å; Y40-K173 WeakPolarHBondContact CD2-O 3.24Å; Y40-S175 PolarHBondContact OH-OG 3.21Å
41	M	90.4	Very high	89.6	Confident	11 Å²	11	49.5 Å²	49.5	5%	0.054	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	131.3	175	-170.9	-166.4	72.8	0	0	111.3	V38 L80 Y81 V174 S175 I176	V38-M41 HydrophobicContact CG1-CB 4.25Å; M41-L80 VanDerWaalsContact CA-O 3.3Å; M41-L80 WeakPolarHBondContact CA-O 3.38Å; M41-Y81 HydrophobicContact CB-CD1 4.35Å; M41-Y81 HydrophobicContact CG-CD1 3.83Å; M41-Y81 HydrophobicContact CG-CE1 3.71Å; M41-Y81 HydrophobicContact CG-CG 4.35Å; M41-Y81 HydrophobicContact SD-CD1 4.01Å; M41-Y81 HydrophobicContact SD-CE1 3.31Å; M41-Y81 WeakPolarHBondContact SD-CE1 3.42Å; M41-V174 HydrophobicContact CE-CG1 3.98Å; M41-S175 PolarHBondContact O-N 2.92Å; M41-I176 HydrophobicContact CE-CD1 3.7Å; M41-I176 HydrophobicContact CE-CG1 3.52Å
42	C	90.4	Very high	90.1	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.007	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	170.3	174.8	69.2	0	0	0	0	112.5	Y40 N79 L80 D146	Y40-C42 HydrophobicContact CE1-CB 3.88Å; C42-N79 WeakPolarHBondContact O-CA 3.24Å; C42-L80 PolarHBondContact N-O 2.86Å; C42-L80 VanDerWaalsContact N-O 3.12Å; C42-L80 PolarHBondContact O-N 2.75Å; C42-D146 HydrophobicContact CB-CB 3.96Å
43	H	91.9	Very high	90.6	Very high	48 Å²	48	47 Å²	47	22%	0.222	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	129.9	174.1	-67.5	-69.5	0	0	0	111	N79 K142	H43-N79 PolarHBondContact CE1-OD1 3.03Å; H43-N79 PolarHBondContact ND1-OD1 2.69Å; H43-K142 PolarHBondContact O-N 2.74Å
44	V	94.2	Very high	90.8	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	148	-177.7	80.1	0	0	0	0	112.1	H77 C78 L80 F122 Y139 K140	V44-H77 PolarHBondContact O-ND1 3.32Å; V44-C78 WeakPolarHBondContact CG1-SG 3.34Å; V44-C78 PolarHBondContact N-O 3.16Å; V44-C78 PolarHBondContact O-N 3.09Å; V44-L80 HydrophobicContact CG1-CB 4.03Å; V44-L80 HydrophobicContact CG1-CD1 4.38Å; V44-F122 HydrophobicContact CG2-CE1 4.34Å; V44-Y139 HydrophobicContact CG1-CD1 4.3Å; V44-Y139 HydrophobicContact CG2-CD1 3.83Å; V44-Y139 HydrophobicContact CG2-CG 4.3Å; V44-K140 CarbonylContact C-O 3.46Å; V44-K140 WeakPolarHBondContact CA-O 3.14Å; V44-K140 WeakPolarHBondContact CG2-O 3.46Å
45	C	94.8	Very high	90.8	Very high	20 Å²	20	48.5 Å²	48.5	14%	0.135	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.5	166.9	-65.4	0	0	0	0	108.4	L47 R74 A76 H77 Y139 K140	C45-L47 HydrophobicContact CB-CD2 4.19Å; C45-R74 HydrophobicContact CB-CG 4.09Å; C45-R74 WeakPolarHBondContact SG-CD 3.47Å; C45-A76 CarbonylContact C-O 3.58Å; C45-A76 WeakPolarHBondContact CA-O 3.34Å; C45-H77 PolarHBondContact SG-ND1 2.61Å; C45-H77 VanDerWaalsContact SG-ND1 3.45Å; C45-Y139 CarbonylContact O-C 3.48Å; C45-Y139 WeakPolarHBondContact O-CA 3.32Å; C45-K140 HydrophobicContact CB-CB 4.28Å; C45-K140 PolarHBondContact N-O 3.03Å; C45-K140 PolarHBondContact O-N 3.25Å
46	I	95.4	Very high	90.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	120.7	171.1	-49.4	-175.1	0	0	0	106.5	L75 A76 F89 P99 Y139	I46-L75 WeakPolarHBondContact O-CB 3.19Å; I46-L75 PolarHBondContact O-N 2.71Å; I46-A76 HydrophobicContact CB-CB 4.24Å; I46-A76 HydrophobicContact CD1-CB 4.27Å; I46-A76 HydrophobicContact CG1-CB 4.31Å; I46-A76 PolarHBondContact N-O 2.78Å; I46-A76 PolarHBondContact O-N 2.77Å; I46-F89 HydrophobicContact CD1-CD1 4.49Å; I46-P99 HydrophobicContact CD1-CB 3.72Å; I46-Y139 HydrophobicContact CD1-CE1 3.95Å; I46-Y139 HydrophobicContact CG1-CD1 3.95Å; I46-Y139 HydrophobicContact CG1-CE1 3.7Å; I46-Y139 HydrophobicContact CG2-CE1 4.39Å
47	L	95.9	Very high	91.1	Very high	11 Å²	11	48.7 Å²	48.7	6%	0.058	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-46.9	-173	-58.8	-175.6	0	0	0	112.4	C45 S70 L71 R74 L75 T121 V138 K140	C45-L47 HydrophobicContact CB-CD2 4.19Å; L47-S70 WeakPolarHBondContact CD1-OG 3.48Å; L47-L71 HydrophobicContact CD1-CD2 4.02Å; L47-R74 HydrophobicContact CD2-CB 4.29Å; L47-L75 WeakPolarHBondContact O-CG 2.44Å; L47-T121 HydrophobicContact CD1-CG2 4.26Å; L47-V138 HydrophobicContact CB-CB 4.31Å; L47-V138 HydrophobicContact CB-CG1 4.42Å; L47-V138 HydrophobicContact CD1-CG1 4.37Å; L47-V138 PolarHBondContact N-O 3.26Å; L47-K140 HydrophobicContact CD1-CB 3.84Å; L47-K140 HydrophobicContact CD2-CB 4.29Å; L47-K140 HydrophobicContact CG-CB 4.1Å
48	K	95	Very high	91.4	Very high	65 Å²	65	49.4 Å²	49.4	28%	0.283	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	145.1	-172.7	-168.4	167.7	-178.1	172.7	0	110.6	L66 S69 E137 V138	K48-L66 HydrophobicContact CD-CD1 3.91Å; K48-S69 PolarHBondContact NZ-O 3.39Å; K48-S69 VanDerWaalsContact NZ-O 3.16Å; K48-S69 PolarHBondContact NZ-OG 2.85Å; K48-E137 WeakPolarHBondContact O-CA 3.35Å; K48-V138 HydrophobicContact CB-CB 4.25Å; K48-V138 HydrophobicContact CB-CG2 3.95Å; K48-V138 PolarHBondContact O-N 2.79Å
49	R	94.4	Very high	91.7	Very high	95 Å²	95	52 Å²	52	36%	0.358	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	127.7	166.5	172.7	178	167.8	170.1	-9.1	106.5	E51 I135 Y136 E137	R49-E51 IonicContact CZ-OE1 2.77Å; R49-E51 IonicContact NE-OE1 2.78Å; R49-E51 PolarHBondContact NE-OE1 2.85Å; R49-E51 IonicContact NH2-OE1 3.24Å; R49-E51 PolarHBondContact NH2-OE1 2.87Å; R49-I135 HydrophobicContact CG-CG2 3.54Å; R49-Y136 WeakPolarHBondContact CA-O 3.48Å; R49-E137 HydrophobicContact CB-CG 4.23Å; R49-E137 WeakPolarHBondContact CD-OE1 2.8Å; R49-E137 HydrophobicContact CG-CG 4.15Å
50	K	93.6	Very high	92	Very high	91 Å²	91	56.1 Å²	56.1	40%	0.396	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	132	171.3	-172	-161.4	174.1	-158.7	0	107.8	V52 D56 L66 I135 Y136	K50-V52 HydrophobicContact CD-CG1 3.69Å; K50-V52 HydrophobicContact CG-CG1 4.2Å; K50-D56 IonicContact NZ-OD2 3.92Å; K50-D56 PolarHBondContact NZ-OD2 2.99Å; K50-L66 HydrophobicContact CB-CD1 4.45Å; K50-I135 WeakPolarHBondContact O-CA 3.28Å; K50-Y136 PolarHBondContact N-O 3.2Å; K50-Y136 PolarHBondContact O-N 3.11Å
51	E	94	Very high	92.2	Very high	101 Å²	101	61.7 Å²	61.7	47%	0.472	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	143.1	170.1	-51.3	-161.2	168.8	0	0	108.9	R49 R134 I135	R49-E51 IonicContact CZ-OE1 2.77Å; R49-E51 IonicContact NE-OE1 2.78Å; R49-E51 PolarHBondContact NE-OE1 2.85Å; R49-E51 IonicContact NH2-OE1 3.24Å; R49-E51 PolarHBondContact NH2-OE1 2.87Å; E51-R134 WeakPolarHBondContact CA-O 3.42Å; E51-I135 HydrophobicContact CG-CG1 4.22Å; E51-I135 HydrophobicContact CG-CG2 4.39Å
52	V	93.6	Very high	92.4	Very high	8 Å²	8	65.2 Å²	65.2	5%	0.048	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	149.1	-166.8	-88	0	0	0	0	110.4	K50 D56 C133 R134 Y136	K50-V52 HydrophobicContact CD-CG1 3.69Å; K50-V52 HydrophobicContact CG-CG1 4.2Å; V52-D56 HydrophobicContact CB-CB 4.22Å; V52-D56 HydrophobicContact CG1-CB 4.41Å; V52-D56 WeakPolarHBondContact CG1-OD2 3.29Å; V52-C133 CarbonylContact O-C 3.58Å; V52-C133 VanDerWaalsContact O-CA 3.25Å; V52-C133 WeakPolarHBondContact O-CA 3.14Å; V52-C133 VanDerWaalsContact O-CB 3.28Å; V52-C133 WeakPolarHBondContact O-CB 3.19Å; V52-R134 HydrophobicContact CG2-CB 3.82Å; V52-R134 VanDerWaalsContact CG2-O 3.31Å; V52-R134 WeakPolarHBondContact CG2-O 3.25Å; V52-R134 PolarHBondContact N-O 3.29Å; V52-R134 PolarHBondContact O-N 3.11Å; V52-Y136 HydrophobicContact CB-CE2 4.38Å; V52-Y136 HydrophobicContact CG1-CD2 4.28Å; V52-Y136 HydrophobicContact CG1-CE2 4.18Å; V52-Y136 HydrophobicContact CG2-CD1 4.13Å; V52-Y136 HydrophobicContact CG2-CD2 3.77Å; V52-Y136 HydrophobicContact CG2-CE1 4.05Å; V52-Y136 HydrophobicContact CG2-CE2 3.68Å; V52-Y136 HydrophobicContact CG2-CG 3.99Å
53	N	91.5	Very high	92.6	Very high	125 Å²	125	65.2 Å²	65.2	67%	0.668	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	151.7	177.6	-62.6	-21.9	0	0	0	110.4	N55 D56	N53-N55 PolarHBondContact O-N 3.29Å; N53-D56 PolarHBondContact O-N 2.9Å
54	L	87.6	Confident	92.8	Very high	63 Å²	63	64.6 Å²	64.6	33%	0.33	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-28.9	178.7	-63.7	174.4	0	0	0	112.9	E127 R134	L54-E127 HydrophobicContact CD2-CG 4.12Å; L54-R134 HydrophobicContact CD2-CG 4.25Å; L54-R134 VanDerWaalsContact O-CZ 3.29Å; L54-R134 PolarHBondContact O-NH1 2.88Å
55	N	86	Confident	92.8	Very high	152 Å²	152	72.9 Å²	72.9	81%	0.813	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-3.9	-178.4	-55	11.5	0	0	0	113.9	N53 E57	N53-N55 PolarHBondContact O-N 3.29Å; N55-E57 PolarHBondContact O-N 2.79Å
56	D	88.1	Confident	92.8	Very high	40 Å²	40	72.6 Å²	72.6	21%	0.214	35%	0.348	C	S	.	.			trans	-81.7	96.8	177	-175	21.1	0	0	0	109.9	K50 V52 N53 K62 Y136	K50-D56 IonicContact NZ-OD2 3.92Å; K50-D56 PolarHBondContact NZ-OD2 2.99Å; V52-D56 HydrophobicContact CB-CB 4.22Å; V52-D56 HydrophobicContact CG1-CB 4.41Å; V52-D56 WeakPolarHBondContact CG1-OD2 3.29Å; N53-D56 PolarHBondContact O-N 2.9Å; D56-K62 IonicContact OD1-NZ 3.48Å; D56-K62 PolarHBondContact OD1-NZ 3.41Å; D56-Y136 PolarHBondContact O-OH 2.86Å
57	E	88.1	Confident	92.9	Very high	143 Å²	143	72.6 Å²	72.6	67%	0.668	35%	0.348	S	S	*	.			trans	-74.4	135.5	177	-61.7	-165.8	150.1	0	0	112.2	N55 T59 K62	N55-E57 PolarHBondContact O-N 2.79Å; E57-T59 PolarHBondContact O-N 2.96Å; E57-K62 VanDerWaalsContact O-CD 3.25Å; E57-K62 WeakPolarHBondContact O-CD 3.28Å; E57-K62 PolarHBondContact O-NZ 2.93Å
58	L	91.2	Very high	92.8	Very high	32 Å²	32	76.5 Å²	76.5	17%	0.168	37%	0.366	C	S	.	.			trans	-82.9	90	176.4	-169.4	77.8	0	0	0	110.7	K62 A63 F111 I123 Y136	L58-K62 HydrophobicContact CD1-CB 4.04Å; L58-A63 HydrophobicContact CD1-CB 4.17Å; L58-A63 HydrophobicContact CD2-CB 3.8Å; L58-A63 HydrophobicContact CG-CB 3.88Å; L58-F111 HydrophobicContact CB-CE2 4.25Å; L58-F111 HydrophobicContact CB-CZ 3.84Å; L58-F111 HydrophobicContact CD2-CE2 3.74Å; L58-F111 HydrophobicContact CD2-CZ 4.16Å; L58-I123 HydrophobicContact CD2-CB 4.47Å; L58-I123 HydrophobicContact CD2-CD1 4.11Å; L58-I123 HydrophobicContact CD2-CG2 4.06Å; L58-Y136 HydrophobicContact CB-CE2 4.03Å; L58-Y136 HydrophobicContact CD1-CD2 3.87Å; L58-Y136 HydrophobicContact CD1-CE2 3.66Å; L58-Y136 HydrophobicContact CG-CE2 4.38Å; L58-Y136 PolarHBondContact N-OH 2.86Å
59	T	92.9	Very high	92.8	Very high	63 Å²	63	75.7 Å²	75.7	39%	0.387	37%	0.368	S	S	.	.			trans	-66.6	160.8	166.4	66.1	0	0	0	0	111.1	E57 D61 K62 A63	E57-T59 PolarHBondContact O-N 2.96Å; T59-D61 VanDerWaalsContact C-N 3.3Å; T59-D61 PolarHBondContact O-N 3.36Å; T59-K62 PolarHBondContact O-N 3.28Å; T59-K62 WeakPolarHBondContact OG1-CG 3.26Å; T59-K62 PolarHBondContact OG1-N 3.26Å; T59-A63 PolarHBondContact O-N 2.9Å
60	Q	93.7	Very high	92.7	Very high	99 Å²	99	71.4 Å²	71.4	46%	0.463	35%	0.353	S	S	.	.	H	α-helix	trans	-55.1	-43.8	178.6	176.7	154	-3.5	0	0	112.2	K62 A63 E64 E116	Q60-K62 PolarHBondContact O-N 2.73Å; Q60-A63 WeakPolarHBondContact O-CB 3.25Å; Q60-A63 PolarHBondContact O-N 2.81Å; Q60-A63 VanDerWaalsContact O-N 3.11Å; Q60-E64 PolarHBondContact O-N 3.24Å; Q60-E116 PolarHBondContact NE2-OE2 2.71Å
61	D	94.2	Very high	92.6	Very high	126 Å²	126	69.3 Å²	69.3	67%	0.674	35%	0.345	S	S	*	.	H	α-helix	trans	-66.6	-40.7	179.7	-41.4	-68.8	0	0	0	112.1	T59 A63 Y65	T59-D61 VanDerWaalsContact C-N 3.3Å; T59-D61 PolarHBondContact O-N 3.36Å; D61-A63 VanDerWaalsContact C-N 3.25Å; D61-A63 PolarHBondContact O-N 2.94Å; D61-Y65 WeakPolarHBondContact O-CB 3.48Å; D61-Y65 PolarHBondContact O-N 3.17Å
62	K	94.2	Very high	92.4	Very high	86 Å²	86	74.7 Å²	74.7	37%	0.374	37%	0.367	S	S	.	.	H	α-helix	trans	-61.7	-36.1	172.6	-72.2	176.9	-173.2	180	0	111.2	D56 E57 L58 T59 Q60 L66	D56-K62 IonicContact OD1-NZ 3.48Å; D56-K62 PolarHBondContact OD1-NZ 3.41Å; E57-K62 VanDerWaalsContact O-CD 3.25Å; E57-K62 WeakPolarHBondContact O-CD 3.28Å; E57-K62 PolarHBondContact O-NZ 2.93Å; L58-K62 HydrophobicContact CD1-CB 4.04Å; T59-K62 PolarHBondContact O-N 3.28Å; T59-K62 WeakPolarHBondContact OG1-CG 3.26Å; T59-K62 PolarHBondContact OG1-N 3.26Å; Q60-K62 PolarHBondContact O-N 2.73Å; K62-L66 WeakPolarHBondContact O-CB 3.3Å; K62-L66 PolarHBondContact O-N 2.94Å
63	A	95	Very high	92.2	Very high	1 Å²	1	81.8 Å²	81.8	1%	0.008	40%	0.398	C	S	.	.	H	α-helix	trans	-70.1	-52.1	-179.7	0	0	0	0	0	112.1	L58 T59 Q60 D61 L66 I67 Y113 I123	L58-A63 HydrophobicContact CD1-CB 4.17Å; L58-A63 HydrophobicContact CD2-CB 3.8Å; L58-A63 HydrophobicContact CG-CB 3.88Å; T59-A63 PolarHBondContact O-N 2.9Å; Q60-A63 WeakPolarHBondContact O-CB 3.25Å; Q60-A63 PolarHBondContact O-N 2.81Å; Q60-A63 VanDerWaalsContact O-N 3.11Å; D61-A63 VanDerWaalsContact C-N 3.25Å; D61-A63 PolarHBondContact O-N 2.94Å; A63-L66 PolarHBondContact O-N 2.67Å; A63-I67 WeakPolarHBondContact O-CG1 3.46Å; A63-I67 PolarHBondContact O-N 2.84Å; A63-Y113 HydrophobicContact CB-CD1 3.59Å; A63-Y113 HydrophobicContact CB-CD2 4.24Å; A63-Y113 HydrophobicContact CB-CE1 3.43Å; A63-Y113 VanDerWaalsContact CB-CE1 3.43Å; A63-Y113 HydrophobicContact CB-CE2 4.12Å; A63-Y113 HydrophobicContact CB-CG 4Å; A63-I123 HydrophobicContact CB-CD1 3.93Å; A63-I123 WeakPolarHBondContact O-CD1 3.5Å
64	E	95.7	Very high	92.2	Very high	34 Å²	34	82.7 Å²	82.7	16%	0.159	39%	0.392	C	S	.	.	H	α-helix	trans	-61.3	-44.7	176.1	-70.6	-69.4	158.4	0	0	111	Q60 L66 I67 E68 Y113 S115 E116 S117	Q60-E64 PolarHBondContact O-N 3.24Å; E64-L66 PolarHBondContact O-N 2.96Å; E64-I67 WeakPolarHBondContact O-CB 3.36Å; E64-I67 PolarHBondContact O-N 2.9Å; E64-E68 WeakPolarHBondContact O-CB 3.46Å; E64-E68 PolarHBondContact O-N 3.06Å; E64-Y113 PolarHBondContact OE1-OH 2.88Å; E64-Y113 VanDerWaalsContact OE1-OH 3.14Å; E64-S115 WeakPolarHBondContact OE1-CA 3.3Å; E64-S115 WeakPolarHBondContact OE1-CB 3.29Å; E64-S115 PolarHBondContact OE1-OG 2.87Å; E64-S115 PolarHBondContact OE2-OG 3.44Å; E64-E116 PolarHBondContact OE1-N 2.88Å; E64-S117 WeakPolarHBondContact OE2-CB 2.91Å; E64-S117 PolarHBondContact OE2-OG 3.08Å
65	Y	94.9	Very high	92.4	Very high	176 Å²	176	83.3 Å²	83.3	69%	0.69	40%	0.395	S	S	*	.	H	α-helix	trans	-62.3	-39.7	175.1	179.1	-91.2	0	0	0	113.3	D61 I67 E68 S69	D61-Y65 WeakPolarHBondContact O-CB 3.48Å; D61-Y65 PolarHBondContact O-N 3.17Å; Y65-I67 VanDerWaalsContact C-N 3.31Å; Y65-I67 PolarHBondContact O-N 2.92Å; Y65-E68 PolarHBondContact O-N 2.9Å; Y65-S69 VanDerWaalsContact O-CB 3.28Å; Y65-S69 WeakPolarHBondContact O-CB 3.38Å; Y65-S69 PolarHBondContact O-N 3.28Å; Y65-S69 PolarHBondContact O-OG 2.95Å
66	L	95	Very high	92.8	Very high	14 Å²	14	76 Å²	76	7%	0.073	36%	0.356	C	S	.	.	H	α-helix	trans	-66.7	-35.2	176.6	-179.4	59.5	0	0	0	111.6	K48 K50 K62 A63 E64 S69 S70 I123 Y136 V138	K48-L66 HydrophobicContact CD-CD1 3.91Å; K50-L66 HydrophobicContact CB-CD1 4.45Å; K62-L66 WeakPolarHBondContact O-CB 3.3Å; K62-L66 PolarHBondContact O-N 2.94Å; A63-L66 PolarHBondContact O-N 2.67Å; E64-L66 PolarHBondContact O-N 2.96Å; L66-S69 PolarHBondContact O-OG 2.86Å; L66-S70 WeakPolarHBondContact O-CB 3.38Å; L66-S70 PolarHBondContact O-N 3.37Å; L66-I123 HydrophobicContact CB-CD1 4.26Å; L66-I123 HydrophobicContact CD2-CD1 4.05Å; L66-I123 HydrophobicContact CG-CD1 4.36Å; L66-Y136 HydrophobicContact CD2-CD2 4.14Å; L66-Y136 HydrophobicContact CD2-CG 4.47Å; L66-V138 HydrophobicContact CD1-CG2 4.39Å; L66-V138 HydrophobicContact CD2-CG2 4.2Å; L66-V138 HydrophobicContact CG-CG2 3.82Å
67	I	95.8	Very high	93	Very high	0 Å²	0	76.7 Å²	76.7	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-66.5	-53	171.7	-75.4	168.1	0	0	0	110.2	A63 E64 Y65 S69 S70 L71 Y113 T121 I123 V138	A63-I67 WeakPolarHBondContact O-CG1 3.46Å; A63-I67 PolarHBondContact O-N 2.84Å; E64-I67 WeakPolarHBondContact O-CB 3.36Å; E64-I67 PolarHBondContact O-N 2.9Å; Y65-I67 VanDerWaalsContact C-N 3.31Å; Y65-I67 PolarHBondContact O-N 2.92Å; I67-S69 PolarHBondContact O-N 2.73Å; I67-S70 WeakPolarHBondContact O-CA 3.34Å; I67-S70 WeakPolarHBondContact O-CB 3.47Å; I67-S70 PolarHBondContact O-N 2.94Å; I67-S70 PolarHBondContact O-OG 3.27Å; I67-L71 PolarHBondContact O-N 3.02Å; I67-Y113 HydrophobicContact CD1-CD1 4.34Å; I67-Y113 HydrophobicContact CD1-CE1 4.25Å; I67-T121 HydrophobicContact CG2-CG2 4.18Å; I67-T121 WeakPolarHBondContact CG2-OG1 3.26Å; I67-I123 HydrophobicContact CD1-CD1 3.99Å; I67-I123 HydrophobicContact CD1-CG1 4.05Å; I67-I123 HydrophobicContact CG1-CD1 3.9Å; I67-I123 HydrophobicContact CG1-CG1 3.96Å; I67-V138 HydrophobicContact CG1-CG1 3.76Å
68	E	94.9	Very high	93.2	Very high	93 Å²	93	69.9 Å²	69.9	44%	0.435	33%	0.326	S	S	.	.	H	α-helix	trans	-56.5	-48.9	-177.5	-159.2	58.9	-138	0	0	112	E64 Y65 S70 L71 K118	E64-E68 WeakPolarHBondContact O-CB 3.46Å; E64-E68 PolarHBondContact O-N 3.06Å; Y65-E68 PolarHBondContact O-N 2.9Å; E68-S70 PolarHBondContact O-N 3.22Å; E68-L71 PolarHBondContact O-N 3.31Å; E68-K118 IonicContact OE1-NZ 3.62Å; E68-K118 PolarHBondContact OE1-NZ 3.19Å; E68-K118 IonicContact OE2-NZ 2.61Å; E68-K118 PolarHBondContact OE2-NZ 3.41Å
69	S	94.3	Very high	93.3	Very high	48 Å²	48	69.6 Å²	69.6	34%	0.336	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	1.5	177	68.5	0	0	0	0	114.7	K48 Y65 L66 I67	K48-S69 PolarHBondContact NZ-O 3.39Å; K48-S69 VanDerWaalsContact NZ-O 3.16Å; K48-S69 PolarHBondContact NZ-OG 2.85Å; Y65-S69 VanDerWaalsContact O-CB 3.28Å; Y65-S69 WeakPolarHBondContact O-CB 3.38Å; Y65-S69 PolarHBondContact O-N 3.28Å; Y65-S69 PolarHBondContact O-OG 2.95Å; L66-S69 PolarHBondContact O-OG 2.86Å; I67-S69 PolarHBondContact O-N 2.73Å
70	S	93.4	Very high	93.3	Very high	5 Å²	5	66.7 Å²	66.7	4%	0.035	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-26.7	176.5	78.4	0	0	0	0	113.9	L47 L66 I67 E68 K72 K73 V138	L47-S70 WeakPolarHBondContact CD1-OG 3.48Å; L66-S70 WeakPolarHBondContact O-CB 3.38Å; L66-S70 PolarHBondContact O-N 3.37Å; I67-S70 WeakPolarHBondContact O-CA 3.34Å; I67-S70 WeakPolarHBondContact O-CB 3.47Å; I67-S70 PolarHBondContact O-N 2.94Å; I67-S70 PolarHBondContact O-OG 3.27Å; E68-S70 PolarHBondContact O-N 3.22Å; S70-K72 PolarHBondContact O-N 3.16Å; S70-K73 PolarHBondContact O-N 2.61Å; S70-K73 VanDerWaalsContact O-N 3.12Å; S70-V138 WeakPolarHBondContact OG-CG1 3.29Å
71	L	91.1	Very high	93.2	Very high	46 Å²	46	63.2 Å²	63.2	24%	0.241	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-27.6	-168.4	-70.8	164.1	0	0	0	114.5	L47 I67 E68 K73 K118 Y120 T121 K140	L47-L71 HydrophobicContact CD1-CD2 4.02Å; I67-L71 PolarHBondContact O-N 3.02Å; E68-L71 PolarHBondContact O-N 3.31Å; L71-K73 VanDerWaalsContact C-N 3.35Å; L71-K73 PolarHBondContact O-N 3.08Å; L71-K118 HydrophobicContact CD1-CD 3.55Å; L71-Y120 HydrophobicContact CD2-CE2 4.32Å; L71-T121 HydrophobicContact CD2-CG2 4.1Å; L71-K140 HydrophobicContact CD2-CD 4.42Å
72	K	89.2	Confident	93.2	Very high	214 Å²	214	57.2 Å²	57.2	93%	0.93	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-18.8	-178.4	-60.5	-174.2	-178.4	-177.2	0	114.1	S70	S70-K72 PolarHBondContact O-N 3.16Å
73	K	90	Very high	93	Very high	158 Å²	158	53.1 Å²	53.1	69%	0.687	24%	0.239	S	C	*	.			trans	-136.2	133.1	-176.4	-170.4	171.2	-177.6	174	0	111.3	S70 L71	S70-K73 PolarHBondContact O-N 2.61Å; S70-K73 VanDerWaalsContact O-N 3.12Å; L71-K73 VanDerWaalsContact C-N 3.35Å; L71-K73 PolarHBondContact O-N 3.08Å
74	R	91.4	Very high	92.9	Very high	144 Å²	144	57 Å²	57	54%	0.543	26%	0.257	S	S	.	.			trans	-107	128	174.8	178.3	174.6	63	-166.5	-6.9	110	C45 L47 A76	C45-R74 HydrophobicContact CB-CG 4.09Å; C45-R74 WeakPolarHBondContact SG-CD 3.47Å; L47-R74 HydrophobicContact CD2-CB 4.29Å; R74-A76 WeakPolarHBondContact CD-O 3.23Å; R74-A76 VanDerWaalsContact CG-O 3.25Å; R74-A76 WeakPolarHBondContact CG-O 3.18Å
75	L	92.4	Very high	92.7	Very high	75 Å²	75	57.8 Å²	57.8	39%	0.393	26%	0.263	S	S	.	.	S	Bend	trans	-77.8	-48.2	172.1	-67.3	173	0	0	0	111.5	I46 L47 T97	I46-L75 WeakPolarHBondContact O-CB 3.19Å; I46-L75 PolarHBondContact O-N 2.71Å; L47-L75 WeakPolarHBondContact O-CG 2.44Å; L75-T97 VanDerWaalsContact O-CB 3.29Å; L75-T97 WeakPolarHBondContact O-CB 3.41Å; L75-T97 PolarHBondContact O-OG1 3.39Å
76	A	92.8	Very high	92.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	158.5	-176.3	0	0	0	0	0	113	C45 I46 R74 T97 P99	C45-A76 CarbonylContact C-O 3.58Å; C45-A76 WeakPolarHBondContact CA-O 3.34Å; I46-A76 HydrophobicContact CB-CB 4.24Å; I46-A76 HydrophobicContact CD1-CB 4.27Å; I46-A76 HydrophobicContact CG1-CB 4.31Å; I46-A76 PolarHBondContact N-O 2.78Å; I46-A76 PolarHBondContact O-N 2.77Å; R74-A76 WeakPolarHBondContact CD-O 3.23Å; R74-A76 VanDerWaalsContact CG-O 3.25Å; R74-A76 WeakPolarHBondContact CG-O 3.18Å; A76-T97 WeakPolarHBondContact CA-OG1 3.22Å; A76-P99 HydrophobicContact CB-CB 4.42Å
77	H	93	Very high	92.7	Very high	54 Å²	54	49.6 Å²	49.6	25%	0.25	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	125.7	169.5	-173.3	35.8	0	0	0	109.6	V44 C45 S92	V44-H77 PolarHBondContact O-ND1 3.32Å; C45-H77 PolarHBondContact SG-ND1 2.61Å; C45-H77 VanDerWaalsContact SG-ND1 3.45Å; H77-S92 PolarHBondContact CD2-OG 2.66Å; H77-S92 PolarHBondContact O-N 2.87Å; H77-S92 PolarHBondContact O-OG 3.5Å; H77-S92 VanDerWaalsContact O-OG 3.11Å
78	C	92.8	Very high	92.7	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	159.8	-163.1	47.5	0	0	0	0	112.1	V44 E90	V44-C78 WeakPolarHBondContact CG1-SG 3.34Å; V44-C78 PolarHBondContact N-O 3.16Å; V44-C78 PolarHBondContact O-N 3.09Å; C78-E90 CarbonylContact C-O 3.53Å; C78-E90 WeakPolarHBondContact CA-O 3.4Å; C78-E90 WeakPolarHBondContact CB-O 3.46Å
79	N	91.8	Very high	92.6	Very high	26 Å²	26	46.1 Å²	46.1	14%	0.139	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	133.5	166.3	-49.9	-15.7	0	0	0	107.1	C42 H43 Y81 F89 E90 S92	C42-N79 WeakPolarHBondContact O-CA 3.24Å; H43-N79 PolarHBondContact CE1-OD1 3.03Å; H43-N79 PolarHBondContact ND1-OD1 2.69Å; N79-Y81 HydrophobicContact CB-CE2 3.63Å; N79-Y81 PolarHBondContact ND2-OH 2.96Å; N79-F89 WeakPolarHBondContact O-CA 3.45Å; N79-E90 HydrophobicContact CB-CB 4.32Å; N79-E90 PolarHBondContact N-O 3.15Å; N79-E90 PolarHBondContact O-N 2.94Å; N79-S92 VanDerWaalsContact OD1-CB 3.32Å; N79-S92 WeakPolarHBondContact OD1-CB 3.28Å
80	L	94.1	Very high	92.4	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129	174.5	-169.7	171.4	0	0	0	107.8	M41 C42 V44 I87 R88 F89 F122 L150	M41-L80 VanDerWaalsContact CA-O 3.3Å; M41-L80 WeakPolarHBondContact CA-O 3.38Å; C42-L80 PolarHBondContact N-O 2.86Å; C42-L80 VanDerWaalsContact N-O 3.12Å; C42-L80 PolarHBondContact O-N 2.75Å; V44-L80 HydrophobicContact CG1-CB 4.03Å; V44-L80 HydrophobicContact CG1-CD1 4.38Å; L80-I87 HydrophobicContact CD2-CB 4.01Å; L80-I87 HydrophobicContact CD2-CG2 3.81Å; L80-I87 HydrophobicContact CG-CB 4.5Å; L80-R88 WeakPolarHBondContact CA-O 3.27Å; L80-F89 HydrophobicContact CB-CD1 4.47Å; L80-F89 HydrophobicContact CB-CE1 4.46Å; L80-F89 HydrophobicContact CD1-CE1 3.92Å; L80-F89 HydrophobicContact CG-CD1 4.3Å; L80-F89 HydrophobicContact CG-CE1 3.9Å; L80-F122 HydrophobicContact CD1-CZ 4.45Å; L80-L150 HydrophobicContact CD1-CD1 3.93Å; L80-L150 HydrophobicContact CD1-CD2 3.95Å; L80-L150 HydrophobicContact CD2-CD2 3.67Å; L80-L150 HydrophobicContact CG-CD2 4.44Å
81	Y	92.1	Very high	92.2	Very high	26 Å²	26	49 Å²	49	10%	0.102	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126	175.4	-55.1	-104.1	0	0	0	108.6	V38 M41 N79 I87 R88 E90	V38-Y81 HydrophobicContact CG1-CD1 4.11Å; V38-Y81 HydrophobicContact CG2-CD1 3.96Å; M41-Y81 HydrophobicContact CB-CD1 4.35Å; M41-Y81 HydrophobicContact CG-CD1 3.83Å; M41-Y81 HydrophobicContact CG-CE1 3.71Å; M41-Y81 HydrophobicContact CG-CG 4.35Å; M41-Y81 HydrophobicContact SD-CD1 4.01Å; M41-Y81 HydrophobicContact SD-CE1 3.31Å; M41-Y81 WeakPolarHBondContact SD-CE1 3.42Å; N79-Y81 HydrophobicContact CB-CE2 3.63Å; N79-Y81 PolarHBondContact ND2-OH 2.96Å; Y81-I87 CarbonylContact O-C 3.51Å; Y81-I87 VanDerWaalsContact O-CA 3.31Å; Y81-I87 WeakPolarHBondContact O-CA 3.09Å; Y81-R88 PolarHBondContact N-O 2.92Å; Y81-R88 PolarHBondContact O-N 3.14Å; Y81-E90 HydrophobicContact CD2-CB 4.44Å; Y81-E90 HydrophobicContact CE2-CB 3.52Å; Y81-E90 HydrophobicContact CE2-CG 4.45Å
82	C	92.4	Very high	91.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	116.8	165	-59.9	0	0	0	0	108	Y39 Y40 L153 L165	Y39-C82 PolarHBondContact N-O 2.71Å; Y40-C82 PolarHBondContact O-N 2.93Å; C82-L153 HydrophobicContact CB-CD1 4.22Å; C82-L165 HydrophobicContact CB-CD1 4.01Å
83	L	91.7	Very high	91.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.201	C	C	.	.			trans	-106.9	-168.9	179.6	-52.2	-178.2	0	0	0	109	D31 T34 Q36 S37 V38 Q86 R88 Y106	D31-L83 HydrophobicContact CB-CD1 4.42Å; D31-L83 HydrophobicContact CB-CD2 3.96Å; T34-L83 HydrophobicContact CG2-CD1 4.07Å; Q36-L83 HydrophobicContact CB-CB 4.35Å; S37-L83 WeakPolarHBondContact O-CA 3.42Å; V38-L83 HydrophobicContact CB-CD2 4.34Å; V38-L83 HydrophobicContact CG2-CD2 3.55Å; L83-Q86 HydrophobicContact CB-CG 4.09Å; L83-Q86 WeakPolarHBondContact CB-O 3Å; L83-Q86 HydrophobicContact CD1-CG 3.93Å; L83-Q86 HydrophobicContact CG-CG 4.37Å; L83-Q86 PolarHBondContact N-O 2.89Å; L83-R88 HydrophobicContact CD1-CB 3.73Å; L83-R88 HydrophobicContact CG-CB 4.41Å; L83-Y106 WeakPolarHBondContact O-CE2 3.47Å; L83-Y106 PolarHBondContact O-OH 2.64Å
84	Q	91.7	Very high	90.6	Very high	83 Å²	83	45.4 Å²	45.4	39%	0.388	21%	0.21	S	C	.	.	S	Bend	trans	-68.9	-38.4	-178	-171	179.5	-30.6	0	0	113.2	Y39 L164 L165	Y39-Q84 HydrophobicContact CE2-CB 4.25Å; Q84-L164 HydrophobicContact CG-CD2 4.42Å; Q84-L164 CarbonylContact O-C 3.58Å; Q84-L164 WeakPolarHBondContact O-CA 3.49Å; Q84-L165 PolarHBondContact O-N 3Å
85	D	93	Very high	89.7	Confident	50 Å²	50	44.9 Å²	44.9	27%	0.267	23%	0.227	S	C	.	.	S	Bend	trans	-121.7	-6.7	-169.6	62.2	-18.4	0	0	0	114.2	Q36 L105 Y106 L164	Q36-D85 PolarHBondContact NE2-OD1 3.04Å; Q36-D85 PolarHBondContact NE2-OD2 2.9Å; Q36-D85 PolarHBondContact OE1-OD1 2.9Å; D85-L105 WeakPolarHBondContact O-CA 3.02Å; D85-Y106 WeakPolarHBondContact O-CD2 3.43Å; D85-Y106 PolarHBondContact O-N 3.47Å; D85-L164 HydrophobicContact CB-CD2 3.9Å
86	Q	94.5	Very high	88.9	Confident	15 Å²	15	43 Å²	43	7%	0.07	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	159.7	-168.5	71.2	-163.5	-61.4	0	0	113.6	Q36 L83 F103 I104 L105 Y106	Q36-Q86 VanDerWaalsContact OE1-NE2 3.13Å; L83-Q86 HydrophobicContact CB-CG 4.09Å; L83-Q86 WeakPolarHBondContact CB-O 3Å; L83-Q86 HydrophobicContact CD1-CG 3.93Å; L83-Q86 HydrophobicContact CG-CG 4.37Å; L83-Q86 PolarHBondContact N-O 2.89Å; Q86-F103 VanDerWaalsContact OE1-CG 3.26Å; Q86-I104 CarbonylContact C-O 3.47Å; Q86-I104 VanDerWaalsContact CA-O 3.26Å; Q86-I104 WeakPolarHBondContact CA-O 3.31Å; Q86-I104 VanDerWaalsContact CB-O 3.29Å; Q86-I104 WeakPolarHBondContact CB-O 3.05Å; Q86-L105 HydrophobicContact CB-CD2 3.93Å; Q86-Y106 VanDerWaalsContact N-CD2 3.34Å; Q86-Y106 PolarHBondContact O-OH 2.85Å
87	I	95.2	Very high	88.6	Confident	3 Å²	3	47 Å²	47	2%	0.015	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131.1	153.8	55.1	-178.7	0	0	0	110	L80 Y81 F89 F103 I104 Y106 I109 L124 L154	L80-I87 HydrophobicContact CD2-CB 4.01Å; L80-I87 HydrophobicContact CD2-CG2 3.81Å; L80-I87 HydrophobicContact CG-CB 4.5Å; Y81-I87 CarbonylContact O-C 3.51Å; Y81-I87 VanDerWaalsContact O-CA 3.31Å; Y81-I87 WeakPolarHBondContact O-CA 3.09Å; I87-F89 HydrophobicContact CD1-CE2 4.22Å; I87-F89 HydrophobicContact CD1-CZ 3.72Å; I87-F89 HydrophobicContact CG1-CE2 4.18Å; I87-F89 HydrophobicContact CG1-CZ 4.11Å; I87-F103 CarbonylContact O-C 3.57Å; I87-F103 WeakPolarHBondContact O-CA 3.29Å; I87-F103 WeakPolarHBondContact O-CB 3.28Å; I87-I104 HydrophobicContact CD1-CB 4.32Å; I87-I104 HydrophobicContact CD1-CD1 4.09Å; I87-I104 HydrophobicContact CG1-CB 3.87Å; I87-I104 HydrophobicContact CG1-CD1 4.47Å; I87-I104 PolarHBondContact N-O 3.12Å; I87-I104 PolarHBondContact O-N 3.16Å; I87-Y106 HydrophobicContact CG2-CE1 3.82Å; I87-I109 HydrophobicContact CD1-CD1 4.38Å; I87-L124 HydrophobicContact CD1-CD2 3.59Å; I87-L154 HydrophobicContact CG2-CD2 4.4Å
88	R	93.9	Very high	88.3	Confident	15 Å²	15	49.6 Å²	49.6	6%	0.057	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	142.5	174.9	-166.3	-179.4	71.6	79	-10.6	110.6	D31 L80 Y81 L83 E90 R102	D31-R88 VanDerWaalsContact CG-NE 3.3Å; D31-R88 IonicContact OD1-CZ 2.61Å; D31-R88 IonicContact OD1-NE 2.78Å; D31-R88 PolarHBondContact OD1-NE 3.17Å; D31-R88 IonicContact OD1-NH2 3.57Å; D31-R88 PolarHBondContact OD1-NH2 2.81Å; D31-R88 IonicContact OD2-CZ 2.96Å; D31-R88 IonicContact OD2-NE 2.93Å; D31-R88 PolarHBondContact OD2-NE 3.33Å; D31-R88 IonicContact OD2-NH2 2.75Å; L80-R88 WeakPolarHBondContact CA-O 3.27Å; Y81-R88 PolarHBondContact N-O 2.92Å; Y81-R88 PolarHBondContact O-N 3.14Å; L83-R88 HydrophobicContact CD1-CB 3.73Å; L83-R88 HydrophobicContact CG-CB 4.41Å; R88-E90 IonicContact CZ-OE2 3.22Å; R88-E90 VanDerWaalsContact CZ-OE2 3.24Å; R88-E90 VanDerWaalsContact NH1-CD 3.31Å; R88-E90 IonicContact NH1-OE1 2.71Å; R88-E90 IonicContact NH1-OE2 2.64Å; R88-E90 PolarHBondContact NH1-OE2 3.08Å; R88-E90 IonicContact NH2-OE2 3.77Å; R88-E90 PolarHBondContact NH2-OE2 2.98Å; R88-R102 WeakPolarHBondContact CG-O 3.4Å
89	F	93.8	Very high	88.1	Confident	6 Å²	6	50.6 Å²	50.6	3%	0.026	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130.2	176	-57.1	-79.8	0	0	0	110.8	I46 N79 L80 I87 P99 R101 R102 I104 Y139	I46-F89 HydrophobicContact CD1-CD1 4.49Å; N79-F89 WeakPolarHBondContact O-CA 3.45Å; L80-F89 HydrophobicContact CB-CD1 4.47Å; L80-F89 HydrophobicContact CB-CE1 4.46Å; L80-F89 HydrophobicContact CD1-CE1 3.92Å; L80-F89 HydrophobicContact CG-CD1 4.3Å; L80-F89 HydrophobicContact CG-CE1 3.9Å; I87-F89 HydrophobicContact CD1-CE2 4.22Å; I87-F89 HydrophobicContact CD1-CZ 3.72Å; I87-F89 HydrophobicContact CG1-CE2 4.18Å; I87-F89 HydrophobicContact CG1-CZ 4.11Å; F89-P99 HydrophobicContact CB-CB 3.98Å; F89-P99 HydrophobicContact CB-CG 3.84Å; F89-R101 HydrophobicContact CD2-CG 4.36Å; F89-R101 HydrophobicContact CE2-CG 4.35Å; F89-R102 PolarHBondContact N-O 3.23Å; F89-I104 HydrophobicContact CE2-CD1 4.01Å; F89-I104 HydrophobicContact CE2-CG1 4.21Å; F89-I104 HydrophobicContact CZ-CD1 4.29Å; F89-Y139 HydrophobicContact CE1-CD1 4.44Å; F89-Y139 AromaticContact CE1-CE1 3.54Å; F89-Y139 HydrophobicContact CE1-CE1 3.54Å; F89-Y139 AromaticContact CZ-CE1 3.76Å; F89-Y139 HydrophobicContact CZ-CE1 3.76Å; F89-Y139 AromaticContact CZ-CZ 3.82Å; F89-Y139 VanDerWaalsContact CZ-OH 3.29Å; F89-Y139 WeakPolarHBondContact CZ-OH 3.31Å
90	E	90.2	Very high	87.9	Confident	47 Å²	47	52.1 Å²	52.1	22%	0.22	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	134.5	173.7	-170.5	95.3	-105.9	0	0	109.4	K33 C78 N79 Y81 R88 S92	K33-E90 WeakPolarHBondContact CE-OE1 3.5Å; K33-E90 IonicContact NZ-OE1 3.44Å; K33-E90 PolarHBondContact NZ-OE1 2.88Å; K33-E90 IonicContact NZ-OE2 3Å; C78-E90 CarbonylContact C-O 3.53Å; C78-E90 WeakPolarHBondContact CA-O 3.4Å; C78-E90 WeakPolarHBondContact CB-O 3.46Å; N79-E90 HydrophobicContact CB-CB 4.32Å; N79-E90 PolarHBondContact N-O 3.15Å; N79-E90 PolarHBondContact O-N 2.94Å; Y81-E90 HydrophobicContact CD2-CB 4.44Å; Y81-E90 HydrophobicContact CE2-CB 3.52Å; Y81-E90 HydrophobicContact CE2-CG 4.45Å; R88-E90 IonicContact CZ-OE2 3.22Å; R88-E90 VanDerWaalsContact CZ-OE2 3.24Å; R88-E90 VanDerWaalsContact NH1-CD 3.31Å; R88-E90 IonicContact NH1-OE1 2.71Å; R88-E90 IonicContact NH1-OE2 2.64Å; R88-E90 PolarHBondContact NH1-OE2 3.08Å; R88-E90 IonicContact NH2-OE2 3.77Å; R88-E90 PolarHBondContact NH2-OE2 2.98Å; E90-S92 PolarHBondContact O-N 2.99Å
91	K	89.7	Confident	87.7	Confident	66 Å²	66	53.8 Å²	53.8	29%	0.287	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	124	172.3	-165.8	-170	-161.7	174	0	110.3	K93 Q94 G96 N98	K91-K93 VanDerWaalsContact CD-O 3.3Å; K91-K93 WeakPolarHBondContact CD-O 3.31Å; K91-K93 VanDerWaalsContact CE-O 3.3Å; K91-K93 WeakPolarHBondContact CE-O 3.34Å; K91-K93 WeakPolarHBondContact CG-O 3.49Å; K91-Q94 VanDerWaalsContact CE-O 3.28Å; K91-Q94 WeakPolarHBondContact CE-O 3.24Å; K91-Q94 PolarHBondContact NZ-O 2.85Å; K91-G96 WeakPolarHBondContact CE-O 3.31Å; K91-G96 PolarHBondContact NZ-O 3.39Å; K91-N98 VanDerWaalsContact CD-OD1 3.29Å; K91-N98 WeakPolarHBondContact CD-OD1 3.49Å; K91-N98 VanDerWaalsContact CE-OD1 3.28Å; K91-N98 WeakPolarHBondContact CE-OD1 3.3Å; K91-N98 PolarHBondContact NZ-OD1 2.85Å
92	S	83.9	Confident	87.6	Confident	35 Å²	35	62.3 Å²	62.3	25%	0.245	32%	0.321	C	S	.	.	S	Bend	trans	-81.4	-21.8	-172.8	64.6	0	0	0	0	114.6	H77 N79 E90	H77-S92 PolarHBondContact CD2-OG 2.66Å; H77-S92 PolarHBondContact O-N 2.87Å; H77-S92 PolarHBondContact O-OG 3.5Å; H77-S92 VanDerWaalsContact O-OG 3.11Å; N79-S92 VanDerWaalsContact OD1-CB 3.32Å; N79-S92 WeakPolarHBondContact OD1-CB 3.28Å; E90-S92 PolarHBondContact O-N 2.99Å
93	K	79.2	Confident	87.7	Confident	123 Å²	123	67.2 Å²	67.2	54%	0.535	34%	0.343	S	S	.	.	S	Bend	trans	-135.1	139.9	176.4	-62.5	-168.7	177.3	-166.8	0	110.2	K91 C95 G96	K91-K93 VanDerWaalsContact CD-O 3.3Å; K91-K93 WeakPolarHBondContact CD-O 3.31Å; K91-K93 VanDerWaalsContact CE-O 3.3Å; K91-K93 WeakPolarHBondContact CE-O 3.34Å; K91-K93 WeakPolarHBondContact CG-O 3.49Å; K93-C95 VanDerWaalsContact C-N 3.3Å; K93-C95 PolarHBondContact O-N 3.4Å; K93-G96 PolarHBondContact O-N 3Å
94	Q	73.1	Confident	87.9	Confident	185 Å²	185	67.2 Å²	67.2	86%	0.864	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-45.6	-179.3	-71.5	177.7	-14.6	0	0	112.4	K91 G96	K91-Q94 VanDerWaalsContact CE-O 3.28Å; K91-Q94 WeakPolarHBondContact CE-O 3.24Å; K91-Q94 PolarHBondContact NZ-O 2.85Å; Q94-G96 VanDerWaalsContact C-N 3.34Å; Q94-G96 PolarHBondContact O-N 2.96Å
95	C	72.1	Confident	88	Confident	133 Å²	133	65.1 Å²	65.1	90%	0.899	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	10.7	-180	-48.9	0	0	0	0	115	K93	K93-C95 VanDerWaalsContact C-N 3.3Å; K93-C95 PolarHBondContact O-N 3.4Å
96	G	75.9	Confident	88.2	Confident	34 Å²	34	62.8 Å²	62.8	35%	0.351	32%	0.322	S	S	.	.	S	Bend	trans	-73.5	178.6	176.8	0	0	0	0	0	113.9	K91 K93 Q94	K91-G96 WeakPolarHBondContact CE-O 3.31Å; K91-G96 PolarHBondContact NZ-O 3.39Å; K93-G96 PolarHBondContact O-N 3Å; Q94-G96 VanDerWaalsContact C-N 3.34Å; Q94-G96 PolarHBondContact O-N 2.96Å
97	T	86.7	Confident	88.2	Confident	84 Å²	84	66.3 Å²	66.3	52%	0.515	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-77.3	149.2	159.6	42.5	0	0	0	0	110.6	L75 A76	L75-T97 VanDerWaalsContact O-CB 3.29Å; L75-T97 WeakPolarHBondContact O-CB 3.41Å; L75-T97 PolarHBondContact O-OG1 3.39Å; A76-T97 WeakPolarHBondContact CA-OG1 3.22Å
98	N	86.8	Confident	88.2	Confident	110 Å²	110	67.6 Å²	67.6	59%	0.588	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-78.4	148.7	174.6	-66.9	-27.5	0	0	0	110.4	K91	K91-N98 VanDerWaalsContact CD-OD1 3.29Å; K91-N98 WeakPolarHBondContact CD-OD1 3.49Å; K91-N98 VanDerWaalsContact CE-OD1 3.28Å; K91-N98 WeakPolarHBondContact CE-OD1 3.3Å; K91-N98 PolarHBondContact NZ-OD1 2.85Å
99	P	88.6	Confident	88.3	Confident	20 Å²	20	67 Å²	67	13%	0.13	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-63.5	148.9	168.2	29.8	-35.3	0	0	0	110.4	I46 A76 F89 R101	I46-P99 HydrophobicContact CD1-CB 3.72Å; A76-P99 HydrophobicContact CB-CB 4.42Å; F89-P99 HydrophobicContact CB-CB 3.98Å; F89-P99 HydrophobicContact CB-CG 3.84Å; P99-R101 PolarHBondContact O-N 3.34Å; P99-R101 VanDerWaalsContact O-N 3.09Å
100	P	87.6	Confident	88.3	Confident	59 Å²	59	71.6 Å²	71.6	38%	0.383	36%	0.361	S	S	.	.	S	Bend	trans	-70	-7.6	-175	30.7	-36.1	0	0	0	113.7
101	R	89.5	Confident	88.5	Confident	36 Å²	36	72.5 Å²	72.5	14%	0.136	36%	0.364	C	S	.	.			trans	-151.4	152.7	174	62.6	-172.1	77.7	-116.7	9	108.9	F89 P99 I104 E137	F89-R101 HydrophobicContact CD2-CG 4.36Å; F89-R101 HydrophobicContact CE2-CG 4.35Å; P99-R101 PolarHBondContact O-N 3.34Å; P99-R101 VanDerWaalsContact O-N 3.09Å; R101-I104 HydrophobicContact CG-CG1 4.37Å; R101-E137 IonicContact CZ-OE1 2.73Å; R101-E137 VanDerWaalsContact CZ-OE1 3.25Å; R101-E137 IonicContact CZ-OE2 3.29Å; R101-E137 VanDerWaalsContact NE-CD 3.28Å; R101-E137 IonicContact NE-OE1 3.28Å; R101-E137 PolarHBondContact NE-OE1 3.44Å; R101-E137 IonicContact NE-OE2 3.69Å; R101-E137 PolarHBondContact NE-OE2 2.87Å; R101-E137 IonicContact NH2-OE1 2.94Å; R101-E137 PolarHBondContact NH2-OE1 3.01Å; R101-E137 IonicContact NH2-OE2 2.61Å
102	R	90.9	Very high	88.7	Confident	205 Å²	205	69.9 Å²	69.9	77%	0.774	35%	0.353	S	S	*	.	S	Bend	trans	-85.6	-25.9	-179.6	-66.9	-178.6	-179.4	178.9	1.2	113.3	R88 F89	R88-R102 WeakPolarHBondContact CG-O 3.4Å; F89-R102 PolarHBondContact N-O 3.23Å
103	F	94.1	Very high	89.3	Confident	102 Å²	102	70.2 Å²	70.2	45%	0.447	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	168.3	179.1	62.4	-86.6	0	0	0	111.3	Q86 I87 L105	Q86-F103 VanDerWaalsContact OE1-CG 3.26Å; I87-F103 CarbonylContact O-C 3.57Å; I87-F103 WeakPolarHBondContact O-CA 3.29Å; I87-F103 WeakPolarHBondContact O-CB 3.28Å; F103-L105 HydrophobicContact CD2-CD2 3.9Å; F103-L105 HydrophobicContact CD2-CG 4.29Å; F103-L105 HydrophobicContact CE2-CD2 3.88Å; F103-L105 HydrophobicContact CE2-CG 4.11Å
104	I	94.6	Very high	90.1	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	124.2	164.3	-62.5	162.7	0	0	0	106.9	Q86 I87 F89 R101 H108 I109 L124 T126	Q86-I104 CarbonylContact C-O 3.47Å; Q86-I104 VanDerWaalsContact CA-O 3.26Å; Q86-I104 WeakPolarHBondContact CA-O 3.31Å; Q86-I104 VanDerWaalsContact CB-O 3.29Å; Q86-I104 WeakPolarHBondContact CB-O 3.05Å; I87-I104 HydrophobicContact CD1-CB 4.32Å; I87-I104 HydrophobicContact CD1-CD1 4.09Å; I87-I104 HydrophobicContact CG1-CB 3.87Å; I87-I104 HydrophobicContact CG1-CD1 4.47Å; I87-I104 PolarHBondContact N-O 3.12Å; I87-I104 PolarHBondContact O-N 3.16Å; F89-I104 HydrophobicContact CE2-CD1 4.01Å; F89-I104 HydrophobicContact CE2-CG1 4.21Å; F89-I104 HydrophobicContact CZ-CD1 4.29Å; R101-I104 HydrophobicContact CG-CG1 4.37Å; I104-H108 HydrophobicContact CG2-CB 4.29Å; I104-I109 HydrophobicContact CG2-CD1 3.99Å; I104-I109 HydrophobicContact CG2-CG1 3.62Å; I104-L124 HydrophobicContact CD1-CD2 3.66Å; I104-T126 HydrophobicContact CD1-CG2 3.96Å; I104-T126 HydrophobicContact CG1-CG2 4.47Å; I104-T126 HydrophobicContact CG2-CG2 3.77Å
105	L	94.8	Very high	91.1	Very high	39 Å²	39	57.4 Å²	57.4	20%	0.204	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	142.3	172.5	-55.5	-178.1	0	0	0	110	D85 Q86 F103 K107 H108	D85-L105 WeakPolarHBondContact O-CA 3.02Å; Q86-L105 HydrophobicContact CB-CD2 3.93Å; F103-L105 HydrophobicContact CD2-CD2 3.9Å; F103-L105 HydrophobicContact CD2-CG 4.29Å; F103-L105 HydrophobicContact CE2-CD2 3.88Å; F103-L105 HydrophobicContact CE2-CG 4.11Å; L105-K107 HydrophobicContact CB-CG 4.01Å; L105-K107 HydrophobicContact CD1-CG 4.46Å; L105-K107 PolarHBondContact O-N 3.04Å; L105-H108 PolarHBondContact O-N 3.34Å
106	Y	96.3	Very high	92.1	Very high	1 Å²	1	58.2 Å²	58.2	0%	0.004	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-58.1	-34.3	-178.9	-68.9	-47.8	0	0	0	112.7	L83 D85 Q86 I87 H108 I109 L154 A157 F163 L165	L83-Y106 WeakPolarHBondContact O-CE2 3.47Å; L83-Y106 PolarHBondContact O-OH 2.64Å; D85-Y106 WeakPolarHBondContact O-CD2 3.43Å; D85-Y106 PolarHBondContact O-N 3.47Å; Q86-Y106 VanDerWaalsContact N-CD2 3.34Å; Q86-Y106 PolarHBondContact O-OH 2.85Å; I87-Y106 HydrophobicContact CG2-CE1 3.82Å; Y106-H108 PolarHBondContact O-N 2.81Å; Y106-H108 VanDerWaalsContact O-N 3.17Å; Y106-I109 HydrophobicContact CD1-CD1 4.09Å; Y106-I109 PolarHBondContact O-N 2.9Å; Y106-I109 VanDerWaalsContact O-N 3.08Å; Y106-L154 HydrophobicContact CD1-CD2 3.7Å; Y106-L154 HydrophobicContact CE1-CD2 3.56Å; Y106-A157 HydrophobicContact CD1-CB 3.89Å; Y106-A157 HydrophobicContact CD2-CB 3.65Å; Y106-A157 HydrophobicContact CE1-CB 4.29Å; Y106-A157 HydrophobicContact CE2-CB 4.08Å; Y106-A157 HydrophobicContact CG-CB 3.58Å; Y106-F163 WeakPolarHBondContact CB-O 3.46Å; Y106-F163 VanDerWaalsContact CD2-O 3.27Å; Y106-F163 WeakPolarHBondContact CD2-O 3.47Å; Y106-L165 HydrophobicContact CE2-CB 4.36Å; Y106-L165 HydrophobicContact CE2-CD1 4.16Å; Y106-L165 HydrophobicContact CE2-CG 3.83Å; Y106-L165 VanDerWaalsContact OH-CD1 3.28Å; Y106-L165 WeakPolarHBondContact OH-CD1 3.4Å
107	K	94.9	Very high	92.9	Very high	88 Å²	88	60 Å²	60	38%	0.383	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-62.1	-17.7	174.6	68.4	143.4	-178.2	162.7	0	115.9	L105 D129 F163	L105-K107 HydrophobicContact CB-CG 4.01Å; L105-K107 HydrophobicContact CD1-CG 4.46Å; L105-K107 PolarHBondContact O-N 3.04Å; K107-D129 IonicContact NZ-OD1 3.59Å; K107-D129 IonicContact NZ-OD2 2.67Å; K107-D129 PolarHBondContact NZ-OD2 3.36Å; K107-F163 HydrophobicContact CB-CB 4.07Å; K107-F163 HydrophobicContact CB-CD1 4.26Å; K107-F163 HydrophobicContact CB-CD2 3.65Å; K107-F163 HydrophobicContact CB-CE2 4.12Å; K107-F163 HydrophobicContact CB-CG 3.73Å
108	H	95	Very high	93.3	Very high	31 Å²	31	58.1 Å²	58.1	14%	0.144	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-92.7	-6.2	177.2	-65.2	146.1	0	0	0	112.8	I104 L105 Y106 T126 E127 F128 D129	I104-H108 HydrophobicContact CG2-CB 4.29Å; L105-H108 PolarHBondContact O-N 3.34Å; Y106-H108 PolarHBondContact O-N 2.81Å; Y106-H108 VanDerWaalsContact O-N 3.17Å; H108-T126 CarbonylContact O-C 3.44Å; H108-T126 WeakPolarHBondContact O-CA 3.46Å; H108-E127 PolarHBondContact O-N 3.41Å; H108-F128 HydrophobicContact CB-CD1 4.28Å; H108-F128 HydrophobicContact CB-CE1 4.15Å; H108-F128 AromaticContact CG-CD1 3.83Å; H108-F128 AromaticContact CG-CE1 3.99Å; H108-F128 AromaticContact ND1-CD1 3.6Å; H108-F128 AromaticContact ND1-CE1 3.6Å; H108-D129 IonicContact CD2-OD2 3.91Å; H108-D129 IonicContact CE1-OD2 3.17Å; H108-D129 IonicContact NE2-OD1 1.76Å; H108-D129 PolarHBondContact NE2-OD1 2.92Å; H108-D129 VanDerWaalsContact NE2-OD1 3.17Å; H108-D129 CovalentContact NE2-OD2 1.76Å; H108-D129 IonicContact NE2-OD2 3.23Å; H108-D129 PolarHBondContact NE2-OD2 3.12Å
109	I	96	Very high	93.6	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	129.5	177.8	-60.7	170	0	0	0	107.9	I87 I104 Y106 L124 C125 T126 L154 L158	I87-I109 HydrophobicContact CD1-CD1 4.38Å; I104-I109 HydrophobicContact CG2-CD1 3.99Å; I104-I109 HydrophobicContact CG2-CG1 3.62Å; Y106-I109 HydrophobicContact CD1-CD1 4.09Å; Y106-I109 PolarHBondContact O-N 2.9Å; Y106-I109 VanDerWaalsContact O-N 3.08Å; I109-L124 HydrophobicContact CD1-CD1 4.17Å; I109-L124 HydrophobicContact CD1-CD2 4.05Å; I109-L124 HydrophobicContact CD1-CG 4.48Å; I109-L124 HydrophobicContact CG1-CD1 4.32Å; I109-L124 HydrophobicContact CG1-CD2 4.22Å; I109-L124 HydrophobicContact CG1-CG 4.36Å; I109-L124 HydrophobicContact CG2-CD1 3.58Å; I109-L124 HydrophobicContact CG2-CG 4.24Å; I109-C125 WeakPolarHBondContact CA-O 3.47Å; I109-T126 HydrophobicContact CG1-CG2 4.11Å; I109-L154 HydrophobicContact CD1-CD2 3.56Å; I109-L158 HydrophobicContact CB-CD2 4.16Å; I109-L158 HydrophobicContact CG2-CD1 4.11Å; I109-L158 HydrophobicContact CG2-CD2 4.3Å; I109-L158 WeakPolarHBondContact O-CD2 3.35Å
110	K	93.8	Very high	93.9	Very high	102 Å²	102	57.7 Å²	57.7	44%	0.443	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-40.7	178.2	-65.8	-78.9	153.3	143	0	111.4	C125 E127	K110-C125 PolarHBondContact N-O 2.9Å; K110-E127 HydrophobicContact CD-CB 4.31Å; K110-E127 VanDerWaalsContact CE-OE1 3.29Å; K110-E127 WeakPolarHBondContact CE-OE1 3.44Å; K110-E127 HydrophobicContact CG-CB 3.73Å; K110-E127 IonicContact NZ-OE1 3.68Å; K110-E127 PolarHBondContact NZ-OE1 3.01Å
111	F	94.1	Very high	94.3	Very high	66 Å²	66	54.9 Å²	54.9	29%	0.289	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	165.8	173.1	58.8	-99	0	0	0	111.5	L58 C125 Y136	L58-F111 HydrophobicContact CB-CE2 4.25Å; L58-F111 HydrophobicContact CB-CZ 3.84Å; L58-F111 HydrophobicContact CD2-CE2 3.74Å; L58-F111 HydrophobicContact CD2-CZ 4.16Å; F111-C125 HydrophobicContact CD1-CB 3.77Å; F111-C125 HydrophobicContact CD2-CB 3.68Å; F111-C125 HydrophobicContact CE1-CB 3.54Å; F111-C125 WeakPolarHBondContact CE1-SG 3.26Å; F111-C125 HydrophobicContact CE2-CB 3.44Å; F111-C125 VanDerWaalsContact CE2-CB 3.44Å; F111-C125 HydrophobicContact CG-CB 3.84Å; F111-C125 HydrophobicContact CZ-CB 3.36Å; F111-C125 PolarHBondContact O-N 2.76Å; F111-Y136 HydrophobicContact CZ-CE1 4.14Å
112	I	95.6	Very high	94.7	Very high	10 Å²	10	53.2 Å²	53.2	5%	0.051	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	131.1	167	170.9	165.3	0	0	0	108.9	F122 I123 L124 Y151 L154	I112-F122 HydrophobicContact CD1-CB 4.15Å; I112-F122 HydrophobicContact CD1-CD2 3.55Å; I112-F122 HydrophobicContact CD1-CE2 4.12Å; I112-F122 HydrophobicContact CD1-CG 3.97Å; I112-F122 HydrophobicContact CG1-CB 4.29Å; I112-F122 HydrophobicContact CG1-CD2 4.07Å; I112-I123 WeakPolarHBondContact CA-O 3.16Å; I112-L124 HydrophobicContact CB-CD1 4.08Å; I112-Y151 HydrophobicContact CG1-CD2 4.31Å; I112-Y151 HydrophobicContact CG2-CD2 3.65Å; I112-Y151 HydrophobicContact CG2-CE2 4.2Å; I112-Y151 HydrophobicContact CG2-CG 4.48Å; I112-L154 HydrophobicContact CB-CD1 4.25Å; I112-L154 HydrophobicContact CD1-CD1 3.65Å; I112-L154 HydrophobicContact CG2-CB 4.14Å; I112-L154 HydrophobicContact CG2-CD1 4.24Å
113	Y	96.2	Very high	95	Very high	42 Å²	42	43.5 Å²	43.5	17%	0.165	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	128.6	172.4	174.9	-90.3	0	0	0	109.1	A63 E64 I67 F122 I123	A63-Y113 HydrophobicContact CB-CD1 3.59Å; A63-Y113 HydrophobicContact CB-CD2 4.24Å; A63-Y113 HydrophobicContact CB-CE1 3.43Å; A63-Y113 VanDerWaalsContact CB-CE1 3.43Å; A63-Y113 HydrophobicContact CB-CE2 4.12Å; A63-Y113 HydrophobicContact CB-CG 4Å; E64-Y113 PolarHBondContact OE1-OH 2.88Å; E64-Y113 VanDerWaalsContact OE1-OH 3.14Å; I67-Y113 HydrophobicContact CD1-CD1 4.34Å; I67-Y113 HydrophobicContact CD1-CE1 4.25Å; Y113-F122 CarbonylContact O-C 3.52Å; Y113-F122 WeakPolarHBondContact O-CA 3.44Å; Y113-F122 VanDerWaalsContact O-CB 3.23Å; Y113-F122 WeakPolarHBondContact O-CB 3.15Å; Y113-I123 HydrophobicContact CD1-CD1 4.46Å; Y113-I123 PolarHBondContact N-O 2.84Å; Y113-I123 PolarHBondContact O-N 3.18Å
114	I	95.6	Very high	95.1	Very high	38 Å²	38	38.6 Å²	38.6	20%	0.195	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	136.2	168.6	-59.6	163.9	0	0	0	107.5	F122 Y151	I114-F122 HydrophobicContact CG1-CB 4.32Å; I114-Y151 VanDerWaalsContact CD1-CB 3.47Å; I114-Y151 HydrophobicContact CD1-CD1 4.45Å; I114-Y151 HydrophobicContact CD1-CD2 3.84Å; I114-Y151 HydrophobicContact CD1-CG 3.69Å; I114-Y151 HydrophobicContact CG1-CD2 4.21Å; I114-Y151 HydrophobicContact CG1-CG 4.48Å
115	S	95	Very high	95.2	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.014	19%	0.186	C	C	.	.			trans	-71.3	135.7	173.8	163.4	0	0	0	0	111.9	E64 S117 K118 P119 T121	E64-S115 WeakPolarHBondContact OE1-CA 3.3Å; E64-S115 WeakPolarHBondContact OE1-CB 3.29Å; E64-S115 PolarHBondContact OE1-OG 2.87Å; E64-S115 PolarHBondContact OE2-OG 3.44Å; S115-S117 PolarHBondContact OG-N 3.45Å; S115-S117 PolarHBondContact OG-OG 2.94Å; S115-K118 CarbonylContact O-C 3.54Å; S115-K118 PolarHBondContact OG-N 2.88Å; S115-P119 WeakPolarHBondContact O-CA 3.45Å; S115-T121 PolarHBondContact N-O 3.01Å
116	E	92.5	Very high	95.2	Very high	150 Å²	150	36.7 Å²	36.7	70%	0.701	18%	0.176	S	C	*	.	S	Bend	trans	-78.1	-38.7	175	-60.5	-170.8	136.9	0	0	110.5	Q60 E64 K118	Q60-E116 PolarHBondContact NE2-OE2 2.71Å; E64-E116 PolarHBondContact OE1-N 2.88Å; E116-K118 VanDerWaalsContact C-N 3.34Å; E116-K118 PolarHBondContact O-N 3.48Å
117	S	93.4	Very high	95.1	Very high	72 Å²	72	38.4 Å²	38.4	50%	0.503	18%	0.184	S	C	.	.	S	Bend	trans	-66.5	-36	176.2	81.8	0	0	0	0	112.4	E64 S115	E64-S117 WeakPolarHBondContact OE2-CB 2.91Å; E64-S117 PolarHBondContact OE2-OG 3.08Å; S115-S117 PolarHBondContact OG-N 3.45Å; S115-S117 PolarHBondContact OG-OG 2.94Å
118	K	94.4	Very high	94.8	Very high	44 Å²	44	36.8 Å²	36.8	19%	0.191	18%	0.178	C	C	.	.			trans	-133.9	79.3	-171.8	-72.9	170.8	-174.1	169.6	0	109.4	E68 L71 S115 E116 Y120 T121	E68-K118 IonicContact OE1-NZ 3.62Å; E68-K118 PolarHBondContact OE1-NZ 3.19Å; E68-K118 IonicContact OE2-NZ 2.61Å; E68-K118 PolarHBondContact OE2-NZ 3.41Å; L71-K118 HydrophobicContact CD1-CD 3.55Å; S115-K118 CarbonylContact O-C 3.54Å; S115-K118 PolarHBondContact OG-N 2.88Å; E116-K118 VanDerWaalsContact C-N 3.34Å; E116-K118 PolarHBondContact O-N 3.48Å; K118-Y120 HydrophobicContact CB-CE1 4.33Å; K118-Y120 HydrophobicContact CB-CE2 4.28Å; K118-Y120 HydrophobicContact CG-CE1 4.43Å; K118-Y120 PolarHBondContact O-N 3.08Å; K118-T121 VanDerWaalsContact CB-OG1 3.24Å; K118-T121 WeakPolarHBondContact CB-OG1 3.42Å; K118-T121 PolarHBondContact O-N 3.48Å; K118-T121 PolarHBondContact O-OG1 2.76Å
119	P	93.5	Very high	94.2	Very high	49 Å²	49	40 Å²	40	32%	0.318	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	5.2	-172.1	28.9	-37.6	0	0	0	115.1	S115 S144	S115-P119 WeakPolarHBondContact O-CA 3.45Å; P119-S144 VanDerWaalsContact O-CA 3.28Å; P119-S144 WeakPolarHBondContact O-CA 3.45Å; P119-S144 WeakPolarHBondContact O-CB 3.48Å
120	Y	94.8	Very high	93.5	Very high	71 Å²	71	50.2 Å²	50.2	28%	0.278	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-4.1	168.3	57	-104.3	0	0	0	113	L71 K118 K140 C141	L71-Y120 HydrophobicContact CD2-CE2 4.32Å; K118-Y120 HydrophobicContact CB-CE1 4.33Å; K118-Y120 HydrophobicContact CB-CE2 4.28Å; K118-Y120 HydrophobicContact CG-CE1 4.43Å; K118-Y120 PolarHBondContact O-N 3.08Å; Y120-K140 HydrophobicContact CD2-CD 3.78Å; Y120-K140 HydrophobicContact CD2-CG 3.84Å; Y120-K140 HydrophobicContact CE2-CD 3.67Å; Y120-K140 VanDerWaalsContact CE2-CE 3.41Å; Y120-K140 HydrophobicContact CE2-CG 4.25Å; Y120-K140 VanDerWaalsContact CE2-NZ 3.32Å; Y120-K140 WeakPolarHBondContact O-CA 3.25Å; Y120-C141 PolarHBondContact O-N 2.76Å
121	T	96.6	Very high	92.9	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	145	175.9	36.2	0	0	0	0	112.5	L47 I67 L71 S115 K118 Y139 K140	L47-T121 HydrophobicContact CD1-CG2 4.26Å; I67-T121 HydrophobicContact CG2-CG2 4.18Å; I67-T121 WeakPolarHBondContact CG2-OG1 3.26Å; L71-T121 HydrophobicContact CD2-CG2 4.1Å; S115-T121 PolarHBondContact N-O 3.01Å; K118-T121 VanDerWaalsContact CB-OG1 3.24Å; K118-T121 WeakPolarHBondContact CB-OG1 3.42Å; K118-T121 PolarHBondContact O-N 3.48Å; K118-T121 PolarHBondContact O-OG1 2.76Å; T121-Y139 WeakPolarHBondContact CA-O 3.44Å; T121-Y139 WeakPolarHBondContact CG2-O 3.5Å; T121-K140 HydrophobicContact CG2-CB 3.85Å; T121-K140 HydrophobicContact CG2-CD 4.5Å; T121-K140 HydrophobicContact CG2-CG 4.38Å
122	F	96.9	Very high	92.4	Very high	2 Å²	2	53 Å²	53	1%	0.009	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	153.3	172.9	68.1	-88.6	0	0	0	111.1	V44 L80 I112 Y113 I114 L124 Y139 A147 L150	V44-F122 HydrophobicContact CG2-CE1 4.34Å; L80-F122 HydrophobicContact CD1-CZ 4.45Å; I112-F122 HydrophobicContact CD1-CB 4.15Å; I112-F122 HydrophobicContact CD1-CD2 3.55Å; I112-F122 HydrophobicContact CD1-CE2 4.12Å; I112-F122 HydrophobicContact CD1-CG 3.97Å; I112-F122 HydrophobicContact CG1-CB 4.29Å; I112-F122 HydrophobicContact CG1-CD2 4.07Å; Y113-F122 CarbonylContact O-C 3.52Å; Y113-F122 WeakPolarHBondContact O-CA 3.44Å; Y113-F122 VanDerWaalsContact O-CB 3.23Å; Y113-F122 WeakPolarHBondContact O-CB 3.15Å; I114-F122 HydrophobicContact CG1-CB 4.32Å; F122-L124 HydrophobicContact CE2-CB 4.49Å; F122-Y139 HydrophobicContact CD2-CD2 4.06Å; F122-Y139 HydrophobicContact CD2-CG 4.4Å; F122-Y139 VanDerWaalsContact CE1-CB 3.41Å; F122-Y139 HydrophobicContact CE1-CG 4.18Å; F122-Y139 AromaticContact CE2-CD2 3.47Å; F122-Y139 HydrophobicContact CE2-CD2 3.47Å; F122-Y139 VanDerWaalsContact CE2-CD2 3.47Å; F122-Y139 HydrophobicContact CE2-CE2 4.27Å; F122-Y139 AromaticContact CE2-CG 3.68Å; F122-Y139 HydrophobicContact CE2-CG 3.68Å; F122-Y139 HydrophobicContact CZ-CD1 4.21Å; F122-Y139 AromaticContact CZ-CD2 3.87Å; F122-Y139 HydrophobicContact CZ-CD2 3.87Å; F122-Y139 AromaticContact CZ-CG 3.55Å; F122-Y139 HydrophobicContact CZ-CG 3.55Å; F122-Y139 PolarHBondContact N-O 3.02Å; F122-Y139 PolarHBondContact O-N 2.84Å; F122-A147 HydrophobicContact CD1-CB 4.22Å; F122-L150 HydrophobicContact CD1-CD1 4.48Å; F122-L150 HydrophobicContact CE1-CD1 3.54Å; F122-L150 HydrophobicContact CZ-CD1 3.67Å
123	I	97.2	Very high	92.2	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	132.8	167.6	-69.1	161.9	0	0	0	108.1	L58 A63 L66 I67 I112 Y113 Y136 E137 V138	L58-I123 HydrophobicContact CD2-CB 4.47Å; L58-I123 HydrophobicContact CD2-CD1 4.11Å; L58-I123 HydrophobicContact CD2-CG2 4.06Å; A63-I123 HydrophobicContact CB-CD1 3.93Å; A63-I123 WeakPolarHBondContact O-CD1 3.5Å; L66-I123 HydrophobicContact CB-CD1 4.26Å; L66-I123 HydrophobicContact CD2-CD1 4.05Å; L66-I123 HydrophobicContact CG-CD1 4.36Å; I67-I123 HydrophobicContact CD1-CD1 3.99Å; I67-I123 HydrophobicContact CD1-CG1 4.05Å; I67-I123 HydrophobicContact CG1-CD1 3.9Å; I67-I123 HydrophobicContact CG1-CG1 3.96Å; I112-I123 WeakPolarHBondContact CA-O 3.16Å; Y113-I123 HydrophobicContact CD1-CD1 4.46Å; Y113-I123 PolarHBondContact N-O 2.84Å; Y113-I123 PolarHBondContact O-N 3.18Å; I123-Y136 HydrophobicContact CG2-CG 4.49Å; I123-E137 WeakPolarHBondContact CA-O 3.3Å; I123-V138 HydrophobicContact CG1-CG1 4.39Å; I123-V138 HydrophobicContact CG1-CG2 4.16Å
124	L	96.8	Very high	92.1	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	124.1	167	-162.3	65.2	0	0	0	109.1	I87 I104 I109 I112 F122 T126 E137 Y139 L154	I87-L124 HydrophobicContact CD1-CD2 3.59Å; I104-L124 HydrophobicContact CD1-CD2 3.66Å; I109-L124 HydrophobicContact CD1-CD1 4.17Å; I109-L124 HydrophobicContact CD1-CD2 4.05Å; I109-L124 HydrophobicContact CD1-CG 4.48Å; I109-L124 HydrophobicContact CG1-CD1 4.32Å; I109-L124 HydrophobicContact CG1-CD2 4.22Å; I109-L124 HydrophobicContact CG1-CG 4.36Å; I109-L124 HydrophobicContact CG2-CD1 3.58Å; I109-L124 HydrophobicContact CG2-CG 4.24Å; I112-L124 HydrophobicContact CB-CD1 4.08Å; F122-L124 HydrophobicContact CE2-CB 4.49Å; L124-T126 HydrophobicContact CD2-CG2 4.27Å; L124-T126 HydrophobicContact CG-CG2 4.28Å; L124-E137 PolarHBondContact N-O 2.89Å; L124-E137 PolarHBondContact O-N 2.95Å; L124-Y139 HydrophobicContact CB-CD2 4.22Å; L124-Y139 HydrophobicContact CB-CE2 3.81Å; L124-Y139 HydrophobicContact CD2-CE2 4.35Å; L124-L154 HydrophobicContact CD1-CD1 3.86Å
125	C	95.7	Very high	92	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	121.7	170.5	174.9	0	0	0	0	109.5	I109 K110 F111 Y136	I109-C125 WeakPolarHBondContact CA-O 3.47Å; K110-C125 PolarHBondContact N-O 2.9Å; F111-C125 HydrophobicContact CD1-CB 3.77Å; F111-C125 HydrophobicContact CD2-CB 3.68Å; F111-C125 HydrophobicContact CE1-CB 3.54Å; F111-C125 WeakPolarHBondContact CE1-SG 3.26Å; F111-C125 HydrophobicContact CE2-CB 3.44Å; F111-C125 VanDerWaalsContact CE2-CB 3.44Å; F111-C125 HydrophobicContact CG-CB 3.84Å; F111-C125 HydrophobicContact CZ-CB 3.36Å; F111-C125 PolarHBondContact O-N 2.76Å; C125-Y136 HydrophobicContact CB-CD1 4.04Å; C125-Y136 HydrophobicContact CB-CE1 4.02Å
126	T	94.9	Very high	92.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	145.1	175.6	53.8	0	0	0	0	112	I104 H108 I109 L124 R134 I135	I104-T126 HydrophobicContact CD1-CG2 3.96Å; I104-T126 HydrophobicContact CG1-CG2 4.47Å; I104-T126 HydrophobicContact CG2-CG2 3.77Å; H108-T126 CarbonylContact O-C 3.44Å; H108-T126 WeakPolarHBondContact O-CA 3.46Å; I109-T126 HydrophobicContact CG1-CG2 4.11Å; L124-T126 HydrophobicContact CD2-CG2 4.27Å; L124-T126 HydrophobicContact CG-CG2 4.28Å; T126-R134 CarbonylContact O-C 3.57Å; T126-R134 WeakPolarHBondContact O-CA 3.47Å; T126-I135 PolarHBondContact N-O 2.65Å; T126-I135 PolarHBondContact O-N 3.26Å; T126-I135 PolarHBondContact OG1-O 3.21Å
127	E	93.8	Very high	92.2	Very high	37 Å²	37	46.3 Å²	46.3	17%	0.173	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	120.1	-180	-168.8	-175.2	98	0	0	106.2	L54 H108 K110 R134	L54-E127 HydrophobicContact CD2-CG 4.12Å; H108-E127 PolarHBondContact O-N 3.41Å; K110-E127 HydrophobicContact CD-CB 4.31Å; K110-E127 VanDerWaalsContact CE-OE1 3.29Å; K110-E127 WeakPolarHBondContact CE-OE1 3.44Å; K110-E127 HydrophobicContact CG-CB 3.73Å; K110-E127 IonicContact NZ-OE1 3.68Å; K110-E127 PolarHBondContact NZ-OE1 3.01Å; E127-R134 HydrophobicContact CB-CG 4.18Å; E127-R134 HydrophobicContact CG-CG 4.11Å; E127-R134 IonicContact OE2-CZ 3.25Å; E127-R134 VanDerWaalsContact OE2-CZ 3.29Å; E127-R134 IonicContact OE2-NE 2.74Å; E127-R134 PolarHBondContact OE2-NE 3.24Å; E127-R134 IonicContact OE2-NH2 3.75Å; E127-R134 PolarHBondContact OE2-NH2 2.75Å
128	F	88.4	Confident	92.4	Very high	54 Å²	54	42.9 Å²	42.9	24%	0.237	21%	0.205	C	C	.	.			trans	-99.3	147.7	-172.2	-70.5	-90.2	0	0	0	110.8	H108 K130 A131 I135	H108-F128 HydrophobicContact CB-CD1 4.28Å; H108-F128 HydrophobicContact CB-CE1 4.15Å; H108-F128 AromaticContact CG-CD1 3.83Å; H108-F128 AromaticContact CG-CE1 3.99Å; H108-F128 AromaticContact ND1-CD1 3.6Å; H108-F128 AromaticContact ND1-CE1 3.6Å; F128-K130 PolarHBondContact O-N 2.79Å; F128-A131 HydrophobicContact CB-CB 4.09Å; F128-A131 VanDerWaalsContact O-CB 3.29Å; F128-A131 WeakPolarHBondContact O-CB 3.4Å; F128-A131 PolarHBondContact O-N 3.14Å; F128-I135 HydrophobicContact CD2-CD1 4.25Å; F128-I135 HydrophobicContact CE2-CD1 4.09Å
129	D	82.8	Confident	92.5	Very high	99 Å²	99	40.9 Å²	40.9	53%	0.529	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	128.9	177.5	-49.7	-60	0	0	0	110.1	K107 H108 A131	K107-D129 IonicContact NZ-OD1 3.59Å; K107-D129 IonicContact NZ-OD2 2.67Å; K107-D129 PolarHBondContact NZ-OD2 3.36Å; H108-D129 IonicContact CD2-OD2 3.91Å; H108-D129 IonicContact CE1-OD2 3.17Å; H108-D129 IonicContact NE2-OD1 1.76Å; H108-D129 PolarHBondContact NE2-OD1 2.92Å; H108-D129 VanDerWaalsContact NE2-OD1 3.17Å; H108-D129 CovalentContact NE2-OD2 1.76Å; H108-D129 IonicContact NE2-OD2 3.23Å; H108-D129 PolarHBondContact NE2-OD2 3.12Å; D129-A131 VanDerWaalsContact C-N 3.26Å; D129-A131 PolarHBondContact O-N 3.01Å
130	K	81.1	Confident	92.6	Very high	216 Å²	216	42 Å²	42	94%	0.939	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.7	-0.2	-175.2	-46.2	176.4	-177.3	-179.6	0	116.6	F128	F128-K130 PolarHBondContact O-N 2.79Å
131	A	80.9	Confident	92.6	Very high	36 Å²	36	38.9 Å²	38.9	30%	0.298	18%	0.184	S	C	.	.			trans	-76.9	136.8	175.6	0	0	0	0	0	112	F128 D129 C133	F128-A131 HydrophobicContact CB-CB 4.09Å; F128-A131 VanDerWaalsContact O-CB 3.29Å; F128-A131 WeakPolarHBondContact O-CB 3.4Å; F128-A131 PolarHBondContact O-N 3.14Å; D129-A131 VanDerWaalsContact C-N 3.26Å; D129-A131 PolarHBondContact O-N 3.01Å; A131-C133 PolarHBondContact O-N 3.09Å
132	K	85	Confident	92.2	Very high	190 Å²	190	43.2 Å²	43.2	83%	0.826	20%	0.203	S	C	*	.	S	Bend	trans	-87.5	14.1	172.9	-65	-172.3	178.1	-176.8	0	113.3
133	C	90.8	Very high	91.8	Very high	35 Å²	35	46.4 Å²	46.4	24%	0.236	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	152.7	-177.7	60.1	0	0	0	0	111.7	V52 A131	V52-C133 CarbonylContact O-C 3.58Å; V52-C133 VanDerWaalsContact O-CA 3.25Å; V52-C133 WeakPolarHBondContact O-CA 3.14Å; V52-C133 VanDerWaalsContact O-CB 3.28Å; V52-C133 WeakPolarHBondContact O-CB 3.19Å; A131-C133 PolarHBondContact O-N 3.09Å
134	R	93.7	Very high	91.5	Very high	56 Å²	56	48.2 Å²	48.2	21%	0.211	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	157.5	162	-76.8	169.6	-178.7	159	7.3	109.3	E51 V52 L54 T126 E127 Y136	E51-R134 WeakPolarHBondContact CA-O 3.42Å; V52-R134 HydrophobicContact CG2-CB 3.82Å; V52-R134 VanDerWaalsContact CG2-O 3.31Å; V52-R134 WeakPolarHBondContact CG2-O 3.25Å; V52-R134 PolarHBondContact N-O 3.29Å; V52-R134 PolarHBondContact O-N 3.11Å; L54-R134 HydrophobicContact CD2-CG 4.25Å; L54-R134 VanDerWaalsContact O-CZ 3.29Å; L54-R134 PolarHBondContact O-NH1 2.88Å; T126-R134 CarbonylContact O-C 3.57Å; T126-R134 WeakPolarHBondContact O-CA 3.47Å; E127-R134 HydrophobicContact CB-CG 4.18Å; E127-R134 HydrophobicContact CG-CG 4.11Å; E127-R134 IonicContact OE2-CZ 3.25Å; E127-R134 VanDerWaalsContact OE2-CZ 3.29Å; E127-R134 IonicContact OE2-NE 2.74Å; E127-R134 PolarHBondContact OE2-NE 3.24Å; E127-R134 IonicContact OE2-NH2 3.75Å; E127-R134 PolarHBondContact OE2-NH2 2.75Å; R134-Y136 HydrophobicContact CB-CE1 4.34Å
135	I	94.3	Very high	91	Very high	9 Å²	9	52 Å²	52	5%	0.046	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	118.6	173.5	-49.4	-178.8	0	0	0	108.4	R49 K50 E51 T126 F128 E137	R49-I135 HydrophobicContact CG-CG2 3.54Å; K50-I135 WeakPolarHBondContact O-CA 3.28Å; E51-I135 HydrophobicContact CG-CG1 4.22Å; E51-I135 HydrophobicContact CG-CG2 4.39Å; T126-I135 PolarHBondContact N-O 2.65Å; T126-I135 PolarHBondContact O-N 3.26Å; T126-I135 PolarHBondContact OG1-O 3.21Å; F128-I135 HydrophobicContact CD2-CD1 4.25Å; F128-I135 HydrophobicContact CE2-CD1 4.09Å; I135-E137 HydrophobicContact CG2-CG 3.91Å
136	Y	95.8	Very high	90.7	Very high	3 Å²	3	52.1 Å²	52.1	1%	0.012	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	116.3	171.5	-61	-21.7	0	0	0	108.9	R49 K50 V52 D56 L58 L66 F111 I123 C125 R134	R49-Y136 WeakPolarHBondContact CA-O 3.48Å; K50-Y136 PolarHBondContact N-O 3.2Å; K50-Y136 PolarHBondContact O-N 3.11Å; V52-Y136 HydrophobicContact CB-CE2 4.38Å; V52-Y136 HydrophobicContact CG1-CD2 4.28Å; V52-Y136 HydrophobicContact CG1-CE2 4.18Å; V52-Y136 HydrophobicContact CG2-CD1 4.13Å; V52-Y136 HydrophobicContact CG2-CD2 3.77Å; V52-Y136 HydrophobicContact CG2-CE1 4.05Å; V52-Y136 HydrophobicContact CG2-CE2 3.68Å; V52-Y136 HydrophobicContact CG2-CG 3.99Å; D56-Y136 PolarHBondContact O-OH 2.86Å; L58-Y136 HydrophobicContact CB-CE2 4.03Å; L58-Y136 HydrophobicContact CD1-CD2 3.87Å; L58-Y136 HydrophobicContact CD1-CE2 3.66Å; L58-Y136 HydrophobicContact CG-CE2 4.38Å; L58-Y136 PolarHBondContact N-OH 2.86Å; L66-Y136 HydrophobicContact CD2-CD2 4.14Å; L66-Y136 HydrophobicContact CD2-CG 4.47Å; F111-Y136 HydrophobicContact CZ-CE1 4.14Å; I123-Y136 HydrophobicContact CG2-CG 4.49Å; C125-Y136 HydrophobicContact CB-CD1 4.04Å; C125-Y136 HydrophobicContact CB-CE1 4.02Å; R134-Y136 HydrophobicContact CB-CE1 4.34Å
137	E	95.6	Very high	90.5	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.5	176.2	-65.1	-165.1	144.8	0	0	110.3	K48 R49 R101 I123 L124 I135 Y139	K48-E137 WeakPolarHBondContact O-CA 3.35Å; R49-E137 HydrophobicContact CB-CG 4.23Å; R49-E137 WeakPolarHBondContact CD-OE1 2.8Å; R49-E137 HydrophobicContact CG-CG 4.15Å; R101-E137 IonicContact CZ-OE1 2.73Å; R101-E137 VanDerWaalsContact CZ-OE1 3.25Å; R101-E137 IonicContact CZ-OE2 3.29Å; R101-E137 VanDerWaalsContact NE-CD 3.28Å; R101-E137 IonicContact NE-OE1 3.28Å; R101-E137 PolarHBondContact NE-OE1 3.44Å; R101-E137 IonicContact NE-OE2 3.69Å; R101-E137 PolarHBondContact NE-OE2 2.87Å; R101-E137 IonicContact NH2-OE1 2.94Å; R101-E137 PolarHBondContact NH2-OE1 3.01Å; R101-E137 IonicContact NH2-OE2 2.61Å; I123-E137 WeakPolarHBondContact CA-O 3.3Å; L124-E137 PolarHBondContact N-O 2.89Å; L124-E137 PolarHBondContact O-N 2.95Å; I135-E137 HydrophobicContact CG2-CG 3.91Å; E137-Y139 HydrophobicContact CB-CD2 4.32Å; E137-Y139 HydrophobicContact CB-CE2 3.47Å; E137-Y139 VanDerWaalsContact CB-CE2 3.47Å; E137-Y139 VanDerWaalsContact O-CD2 3.26Å; E137-Y139 WeakPolarHBondContact O-CD2 3.36Å; E137-Y139 WeakPolarHBondContact O-CE2 3.43Å; E137-Y139 PolarHBondContact OE2-OH 3.06Å
138	V	97.1	Very high	90.3	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.3	-177.5	-165.8	0	0	0	0	109.8	L47 K48 L66 I67 S70 I123	L47-V138 HydrophobicContact CB-CB 4.31Å; L47-V138 HydrophobicContact CB-CG1 4.42Å; L47-V138 HydrophobicContact CD1-CG1 4.37Å; L47-V138 PolarHBondContact N-O 3.26Å; K48-V138 HydrophobicContact CB-CB 4.25Å; K48-V138 HydrophobicContact CB-CG2 3.95Å; K48-V138 PolarHBondContact O-N 2.79Å; L66-V138 HydrophobicContact CD1-CG2 4.39Å; L66-V138 HydrophobicContact CD2-CG2 4.2Å; L66-V138 HydrophobicContact CG-CG2 3.82Å; I67-V138 HydrophobicContact CG1-CG1 3.76Å; S70-V138 WeakPolarHBondContact OG-CG1 3.29Å; I123-V138 HydrophobicContact CG1-CG1 4.39Å; I123-V138 HydrophobicContact CG1-CG2 4.16Å
139	Y	97.1	Very high	90.4	Very high	1 Å²	1	55.7 Å²	55.7	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146	-175.9	-67	-89.9	0	0	0	111.3	V44 C45 I46 F89 T121 F122 L124 E137	V44-Y139 HydrophobicContact CG1-CD1 4.3Å; V44-Y139 HydrophobicContact CG2-CD1 3.83Å; V44-Y139 HydrophobicContact CG2-CG 4.3Å; C45-Y139 CarbonylContact O-C 3.48Å; C45-Y139 WeakPolarHBondContact O-CA 3.32Å; I46-Y139 HydrophobicContact CD1-CE1 3.95Å; I46-Y139 HydrophobicContact CG1-CD1 3.95Å; I46-Y139 HydrophobicContact CG1-CE1 3.7Å; I46-Y139 HydrophobicContact CG2-CE1 4.39Å; F89-Y139 HydrophobicContact CE1-CD1 4.44Å; F89-Y139 AromaticContact CE1-CE1 3.54Å; F89-Y139 HydrophobicContact CE1-CE1 3.54Å; F89-Y139 AromaticContact CZ-CE1 3.76Å; F89-Y139 HydrophobicContact CZ-CE1 3.76Å; F89-Y139 AromaticContact CZ-CZ 3.82Å; F89-Y139 VanDerWaalsContact CZ-OH 3.29Å; F89-Y139 WeakPolarHBondContact CZ-OH 3.31Å; T121-Y139 WeakPolarHBondContact CA-O 3.44Å; T121-Y139 WeakPolarHBondContact CG2-O 3.5Å; F122-Y139 HydrophobicContact CD2-CD2 4.06Å; F122-Y139 HydrophobicContact CD2-CG 4.4Å; F122-Y139 VanDerWaalsContact CE1-CB 3.41Å; F122-Y139 HydrophobicContact CE1-CG 4.18Å; F122-Y139 AromaticContact CE2-CD2 3.47Å; F122-Y139 HydrophobicContact CE2-CD2 3.47Å; F122-Y139 VanDerWaalsContact CE2-CD2 3.47Å; F122-Y139 HydrophobicContact CE2-CE2 4.27Å; F122-Y139 AromaticContact CE2-CG 3.68Å; F122-Y139 HydrophobicContact CE2-CG 3.68Å; F122-Y139 HydrophobicContact CZ-CD1 4.21Å; F122-Y139 AromaticContact CZ-CD2 3.87Å; F122-Y139 HydrophobicContact CZ-CD2 3.87Å; F122-Y139 AromaticContact CZ-CG 3.55Å; F122-Y139 HydrophobicContact CZ-CG 3.55Å; F122-Y139 PolarHBondContact N-O 3.02Å; F122-Y139 PolarHBondContact O-N 2.84Å; L124-Y139 HydrophobicContact CB-CD2 4.22Å; L124-Y139 HydrophobicContact CB-CE2 3.81Å; L124-Y139 HydrophobicContact CD2-CE2 4.35Å; E137-Y139 HydrophobicContact CB-CD2 4.32Å; E137-Y139 HydrophobicContact CB-CE2 3.47Å; E137-Y139 VanDerWaalsContact CB-CE2 3.47Å; E137-Y139 VanDerWaalsContact O-CD2 3.26Å; E137-Y139 WeakPolarHBondContact O-CD2 3.36Å; E137-Y139 WeakPolarHBondContact O-CE2 3.43Å; E137-Y139 PolarHBondContact OE2-OH 3.06Å
140	K	96.3	Very high	90.9	Very high	72 Å²	72	51 Å²	51	31%	0.313	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	116.3	172.5	168.3	158.8	-175.1	165.8	0	110.6	V44 C45 L47 L71 Y120 T121	V44-K140 CarbonylContact C-O 3.46Å; V44-K140 WeakPolarHBondContact CA-O 3.14Å; V44-K140 WeakPolarHBondContact CG2-O 3.46Å; C45-K140 HydrophobicContact CB-CB 4.28Å; C45-K140 PolarHBondContact N-O 3.03Å; C45-K140 PolarHBondContact O-N 3.25Å; L47-K140 HydrophobicContact CD1-CB 3.84Å; L47-K140 HydrophobicContact CD2-CB 4.29Å; L47-K140 HydrophobicContact CG-CB 4.1Å; L71-K140 HydrophobicContact CD2-CD 4.42Å; Y120-K140 HydrophobicContact CD2-CD 3.78Å; Y120-K140 HydrophobicContact CD2-CG 3.84Å; Y120-K140 HydrophobicContact CE2-CD 3.67Å; Y120-K140 VanDerWaalsContact CE2-CE 3.41Å; Y120-K140 HydrophobicContact CE2-CG 4.25Å; Y120-K140 VanDerWaalsContact CE2-NZ 3.32Å; Y120-K140 WeakPolarHBondContact O-CA 3.25Å; T121-K140 HydrophobicContact CG2-CB 3.85Å; T121-K140 HydrophobicContact CG2-CD 4.5Å; T121-K140 HydrophobicContact CG2-CG 4.38Å
141	C	93.1	Very high	91.5	Very high	6 Å²	6	45.2 Å²	45.2	4%	0.041	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	170.2	173.7	-68	0	0	0	0	112.4	Y120 L143 D146	Y120-C141 PolarHBondContact O-N 2.76Å; C141-L143 WeakPolarHBondContact CB-O 3.46Å; C141-D146 HydrophobicContact CB-CB 3.74Å
142	K	89.7	Confident	92	Very high	91 Å²	91	47.1 Å²	47.1	40%	0.396	22%	0.223	S	C	.	.	S	Bend	trans	-74.7	-38.9	165.3	-174.3	171.1	178.1	173.7	0	111.1	H43 G177	H43-K142 PolarHBondContact O-N 2.74Å; K142-G177 PolarHBondContact NZ-O 2.74Å
143	L	87.8	Confident	92.4	Very high	70 Å²	70	38.2 Å²	38.2	37%	0.366	18%	0.184	S	C	.	.	S	Bend	trans	-121.3	151.2	-179.9	-54	174.4	0	0	0	111.5	C141 Q145 D146	C141-L143 WeakPolarHBondContact CB-O 3.46Å; L143-Q145 VanDerWaalsContact C-N 3.27Å; L143-Q145 HydrophobicContact CB-CB 4.46Å; L143-Q145 PolarHBondContact O-N 2.84Å; L143-D146 WeakPolarHBondContact CB-OD2 3.43Å; L143-D146 PolarHBondContact N-OD2 3.4Å; L143-D146 WeakPolarHBondContact O-CB 3.32Å; L143-D146 PolarHBondContact O-N 2.87Å
144	S	90.1	Very high	92.6	Very high	37 Å²	37	36.7 Å²	36.7	26%	0.259	17%	0.174	S	C	.	.	H	α-helix	trans	-70.5	-26.8	172.6	57.8	0	0	0	0	112.3	P119 D146 A147 K148	P119-S144 VanDerWaalsContact O-CA 3.28Å; P119-S144 WeakPolarHBondContact O-CA 3.45Å; P119-S144 WeakPolarHBondContact O-CB 3.48Å; S144-D146 VanDerWaalsContact C-N 3.26Å; S144-D146 PolarHBondContact O-N 3.39Å; S144-A147 PolarHBondContact O-N 3.03Å; S144-K148 WeakPolarHBondContact O-CG 3.42Å; S144-K148 PolarHBondContact O-N 3Å; S144-K148 VanDerWaalsContact O-N 3.11Å
145	Q	86	Confident	92.6	Very high	80 Å²	80	36.5 Å²	36.5	37%	0.374	18%	0.175	S	C	.	.	H	α-helix	trans	-58.6	-37.2	169.2	-67.8	81	-4.6	0	0	111.8	L143 K148 M149 F294	L143-Q145 VanDerWaalsContact C-N 3.27Å; L143-Q145 HydrophobicContact CB-CB 4.46Å; L143-Q145 PolarHBondContact O-N 2.84Å; Q145-K148 PolarHBondContact O-N 2.83Å; Q145-M149 WeakPolarHBondContact O-CB 3.2Å; Q145-M149 PolarHBondContact O-N 2.81Å; Q145-F294 HydrophobicContact CG-CD1 4.17Å; Q145-F294 HydrophobicContact CG-CE1 3.94Å; Q145-F294 HydrophobicContact CG-CE2 4.45Å; Q145-F294 HydrophobicContact CG-CZ 4.1Å
146	D	89.5	Confident	92.5	Very high	2 Å²	2	39 Å²	39	1%	0.011	19%	0.186	C	C	.	.	H	α-helix	trans	-65	-45.6	178.6	-53.8	-39.7	0	0	0	110.8	Y40 C42 C141 L143 S144 K148 M149 L150 S175	Y40-D146 WeakPolarHBondContact OH-CA 3.42Å; Y40-D146 PolarHBondContact OH-OD1 2.81Å; C42-D146 HydrophobicContact CB-CB 3.96Å; C141-D146 HydrophobicContact CB-CB 3.74Å; L143-D146 WeakPolarHBondContact CB-OD2 3.43Å; L143-D146 PolarHBondContact N-OD2 3.4Å; L143-D146 WeakPolarHBondContact O-CB 3.32Å; L143-D146 PolarHBondContact O-N 2.87Å; S144-D146 VanDerWaalsContact C-N 3.26Å; S144-D146 PolarHBondContact O-N 3.39Å; D146-K148 VanDerWaalsContact C-N 3.35Å; D146-K148 PolarHBondContact O-N 2.59Å; D146-M149 PolarHBondContact O-N 2.96Å; D146-L150 WeakPolarHBondContact O-CB 3.43Å; D146-L150 VanDerWaalsContact O-CG 3.26Å; D146-L150 WeakPolarHBondContact O-CG 3.22Å; D146-L150 PolarHBondContact O-N 3.4Å; D146-S175 VanDerWaalsContact OD1-CB 3.32Å; D146-S175 WeakPolarHBondContact OD1-CB 3.48Å; D146-S175 PolarHBondContact OD1-OG 2.87Å
147	A	90.9	Very high	92.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-41.8	178.2	0	0	0	0	0	111.8	F122 S144 L150 Y151	F122-A147 HydrophobicContact CD1-CB 4.22Å; S144-A147 PolarHBondContact O-N 3.03Å; A147-L150 PolarHBondContact O-N 3.05Å; A147-Y151 PolarHBondContact O-N 3.24Å
148	K	91.1	Very high	92.3	Very high	124 Å²	124	40.7 Å²	40.7	54%	0.539	20%	0.195	S	C	.	.	H	α-helix	trans	-65	-38.9	174.7	-69.3	178.4	179.7	-176.5	0	112.5	S144 Q145 D146 Y151 V152	S144-K148 WeakPolarHBondContact O-CG 3.42Å; S144-K148 PolarHBondContact O-N 3Å; S144-K148 VanDerWaalsContact O-N 3.11Å; Q145-K148 PolarHBondContact O-N 2.83Å; D146-K148 VanDerWaalsContact C-N 3.35Å; D146-K148 PolarHBondContact O-N 2.59Å; K148-Y151 PolarHBondContact O-N 2.89Å; K148-V152 WeakPolarHBondContact O-CG2 3.37Å; K148-V152 PolarHBondContact O-N 3.46Å; K148-V152 VanDerWaalsContact O-N 3.08Å
149	M	89.8	Confident	92.2	Very high	42 Å²	42	48.7 Å²	48.7	21%	0.207	23%	0.229	C	C	.	.	H	α-helix	trans	-68.1	-44.1	176.3	-171.9	60.9	66.5	0	0	111.8	Y40 Q145 D146 Y151 V152 L153 K173	Y40-M149 HydrophobicContact CD1-CG 4Å; Y40-M149 HydrophobicContact CD2-CG 3.82Å; Y40-M149 HydrophobicContact CE1-CB 3.96Å; Y40-M149 HydrophobicContact CE1-CG 3.78Å; Y40-M149 HydrophobicContact CE2-CB 4.3Å; Y40-M149 HydrophobicContact CE2-CG 3.66Å; Y40-M149 HydrophobicContact CG-CG 4.03Å; Q145-M149 WeakPolarHBondContact O-CB 3.2Å; Q145-M149 PolarHBondContact O-N 2.81Å; D146-M149 PolarHBondContact O-N 2.96Å; M149-Y151 VanDerWaalsContact C-N 3.3Å; M149-Y151 PolarHBondContact O-N 3.29Å; M149-V152 PolarHBondContact O-N 2.97Å; M149-L153 HydrophobicContact CG-CD1 3.99Å; M149-L153 WeakPolarHBondContact O-CG 3.45Å; M149-L153 PolarHBondContact O-N 3.43Å; M149-K173 HydrophobicContact CE-CD 4.33Å
150	L	92.8	Very high	92	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-57.9	-43	174.3	-71.1	171.3	0	0	0	111.5	Y40 L80 F122 D146 A147 L153 L154	Y40-L150 HydrophobicContact CD1-CD2 4.06Å; Y40-L150 HydrophobicContact CE1-CD2 4.15Å; Y40-L150 HydrophobicContact CE1-CG 4.23Å; L80-L150 HydrophobicContact CD1-CD1 3.93Å; L80-L150 HydrophobicContact CD1-CD2 3.95Å; L80-L150 HydrophobicContact CD2-CD2 3.67Å; L80-L150 HydrophobicContact CG-CD2 4.44Å; F122-L150 HydrophobicContact CD1-CD1 4.48Å; F122-L150 HydrophobicContact CE1-CD1 3.54Å; F122-L150 HydrophobicContact CZ-CD1 3.67Å; D146-L150 WeakPolarHBondContact O-CB 3.43Å; D146-L150 VanDerWaalsContact O-CG 3.26Å; D146-L150 WeakPolarHBondContact O-CG 3.22Å; D146-L150 PolarHBondContact O-N 3.4Å; A147-L150 PolarHBondContact O-N 3.05Å; L150-L153 PolarHBondContact O-N 3.11Å; L150-L154 VanDerWaalsContact O-CB 3.31Å; L150-L154 WeakPolarHBondContact O-CB 3.13Å; L150-L154 VanDerWaalsContact O-CG 3.24Å; L150-L154 WeakPolarHBondContact O-CG 3.35Å; L150-L154 PolarHBondContact O-N 3.14Å
151	Y	94	Very high	91.8	Very high	94 Å²	94	56.4 Å²	56.4	37%	0.369	27%	0.265	S	S	.	.	H	α-helix	trans	-60.4	-47.3	174	176.5	-88.1	0	0	0	112.4	I112 I114 A147 K148 M149 L153 L154 Q155	I112-Y151 HydrophobicContact CG1-CD2 4.31Å; I112-Y151 HydrophobicContact CG2-CD2 3.65Å; I112-Y151 HydrophobicContact CG2-CE2 4.2Å; I112-Y151 HydrophobicContact CG2-CG 4.48Å; I114-Y151 VanDerWaalsContact CD1-CB 3.47Å; I114-Y151 HydrophobicContact CD1-CD1 4.45Å; I114-Y151 HydrophobicContact CD1-CD2 3.84Å; I114-Y151 HydrophobicContact CD1-CG 3.69Å; I114-Y151 HydrophobicContact CG1-CD2 4.21Å; I114-Y151 HydrophobicContact CG1-CG 4.48Å; A147-Y151 PolarHBondContact O-N 3.24Å; K148-Y151 PolarHBondContact O-N 2.89Å; M149-Y151 VanDerWaalsContact C-N 3.3Å; M149-Y151 PolarHBondContact O-N 3.29Å; Y151-L153 VanDerWaalsContact C-N 3.32Å; Y151-L153 PolarHBondContact O-N 3.34Å; Y151-L154 PolarHBondContact O-N 2.92Å; Y151-Q155 HydrophobicContact CD1-CG 4.06Å; Y151-Q155 HydrophobicContact CD2-CG 4.26Å; Y151-Q155 HydrophobicContact CE1-CG 3.8Å; Y151-Q155 HydrophobicContact CE2-CG 4.01Å; Y151-Q155 HydrophobicContact CG-CG 4.27Å; Y151-Q155 WeakPolarHBondContact O-CB 3.23Å; Y151-Q155 WeakPolarHBondContact O-CG 3.13Å; Y151-Q155 PolarHBondContact O-N 2.95Å; Y151-Q155 PolarHBondContact OH-NE2 3.33Å
152	V	92.4	Very high	91.8	Very high	77 Å²	77	62 Å²	62	47%	0.467	29%	0.29	S	S	.	.	H	α-helix	trans	-60.6	-40.8	177.7	170	0	0	0	0	111.9	K148 M149 K156	K148-V152 WeakPolarHBondContact O-CG2 3.37Å; K148-V152 PolarHBondContact O-N 3.46Å; K148-V152 VanDerWaalsContact O-N 3.08Å; M149-V152 PolarHBondContact O-N 2.97Å; V152-K156 PolarHBondContact O-N 3.41Å; V152-K156 VanDerWaalsContact O-N 3.12Å
153	L	91.9	Very high	91.9	Very high	3 Å²	3	61.5 Å²	61.5	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-69.2	-48.5	178.4	-69.2	166.1	0	0	0	111.9	Y40 C82 M149 L150 Y151 Q155 K156 A157 L165 L169	Y40-L153 HydrophobicContact CD1-CD1 3.69Å; Y40-L153 HydrophobicContact CG-CD1 3.65Å; C82-L153 HydrophobicContact CB-CD1 4.22Å; M149-L153 HydrophobicContact CG-CD1 3.99Å; M149-L153 WeakPolarHBondContact O-CG 3.45Å; M149-L153 PolarHBondContact O-N 3.43Å; L150-L153 PolarHBondContact O-N 3.11Å; Y151-L153 VanDerWaalsContact C-N 3.32Å; Y151-L153 PolarHBondContact O-N 3.34Å; L153-Q155 VanDerWaalsContact C-N 3.3Å; L153-Q155 PolarHBondContact O-N 3.4Å; L153-K156 WeakPolarHBondContact O-CB 3.43Å; L153-K156 PolarHBondContact O-N 3.19Å; L153-A157 PolarHBondContact O-N 3.5Å; L153-L165 HydrophobicContact CB-CD1 4.39Å; L153-L165 HydrophobicContact CB-CD2 4.43Å; L153-L165 HydrophobicContact CD2-CD1 4.1Å; L153-L165 HydrophobicContact CD2-CD2 4.23Å; L153-L165 WeakPolarHBondContact O-CD2 3.39Å; L153-L169 HydrophobicContact CD2-CD1 3.74Å
154	L	94.9	Very high	92.1	Very high	3 Å²	3	59.6 Å²	59.6	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-61.4	-39.8	176.9	-71.1	169.5	0	0	0	111.5	I87 Y106 I109 I112 L124 L150 Y151 K156 A157 L158	I87-L154 HydrophobicContact CG2-CD2 4.4Å; Y106-L154 HydrophobicContact CD1-CD2 3.7Å; Y106-L154 HydrophobicContact CE1-CD2 3.56Å; I109-L154 HydrophobicContact CD1-CD2 3.56Å; I112-L154 HydrophobicContact CB-CD1 4.25Å; I112-L154 HydrophobicContact CD1-CD1 3.65Å; I112-L154 HydrophobicContact CG2-CB 4.14Å; I112-L154 HydrophobicContact CG2-CD1 4.24Å; L124-L154 HydrophobicContact CD1-CD1 3.86Å; L150-L154 VanDerWaalsContact O-CB 3.31Å; L150-L154 WeakPolarHBondContact O-CB 3.13Å; L150-L154 VanDerWaalsContact O-CG 3.24Å; L150-L154 WeakPolarHBondContact O-CG 3.35Å; L150-L154 PolarHBondContact O-N 3.14Å; Y151-L154 PolarHBondContact O-N 2.92Å; L154-K156 PolarHBondContact O-N 3.11Å; L154-A157 PolarHBondContact O-N 3.21Å; L154-L158 WeakPolarHBondContact O-CB 3.5Å; L154-L158 VanDerWaalsContact O-CG 3.23Å; L154-L158 WeakPolarHBondContact O-CG 3.34Å; L154-L158 PolarHBondContact O-N 2.94Å
155	Q	93.8	Very high	92.1	Very high	52 Å²	52	58 Å²	58	24%	0.243	27%	0.267	C	S	.	.	H	α-helix	trans	-69.4	-16.2	174.1	-71.1	-74.3	-2.6	0	0	114.1	Y151 L153 K159	Y151-Q155 HydrophobicContact CD1-CG 4.06Å; Y151-Q155 HydrophobicContact CD2-CG 4.26Å; Y151-Q155 HydrophobicContact CE1-CG 3.8Å; Y151-Q155 HydrophobicContact CE2-CG 4.01Å; Y151-Q155 HydrophobicContact CG-CG 4.27Å; Y151-Q155 WeakPolarHBondContact O-CB 3.23Å; Y151-Q155 WeakPolarHBondContact O-CG 3.13Å; Y151-Q155 PolarHBondContact O-N 2.95Å; Y151-Q155 PolarHBondContact OH-NE2 3.33Å; L153-Q155 VanDerWaalsContact C-N 3.3Å; L153-Q155 PolarHBondContact O-N 3.4Å; Q155-K159 VanDerWaalsContact O-CD 3.22Å; Q155-K159 WeakPolarHBondContact O-CD 3.36Å; Q155-K159 VanDerWaalsContact O-CG 3.24Å; Q155-K159 WeakPolarHBondContact O-CG 3.27Å
156	K	92.5	Very high	91.9	Very high	60 Å²	60	59.7 Å²	59.7	26%	0.261	27%	0.27	S	S	.	.	H	α-helix	trans	-78.3	-52.6	165.1	-78.9	-163.9	173.1	-155.9	0	110.7	V152 L153 L154 L158 K159 D160 L165 E168	V152-K156 PolarHBondContact O-N 3.41Å; V152-K156 VanDerWaalsContact O-N 3.12Å; L153-K156 WeakPolarHBondContact O-CB 3.43Å; L153-K156 PolarHBondContact O-N 3.19Å; L154-K156 PolarHBondContact O-N 3.11Å; K156-L158 VanDerWaalsContact C-N 3.34Å; K156-L158 PolarHBondContact O-N 2.85Å; K156-K159 PolarHBondContact O-N 2.92Å; K156-K159 VanDerWaalsContact O-N 3.08Å; K156-D160 PolarHBondContact O-N 3.26Å; K156-L165 HydrophobicContact CB-CD2 3.93Å; K156-E168 IonicContact NZ-OE2 2.71Å; K156-E168 PolarHBondContact NZ-OE2 3.06Å
157	A	94.1	Very high	90.8	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59.3	-42	-178.9	0	0	0	0	0	112.5	Y106 L153 L154 K159 D160 F163 L165	Y106-A157 HydrophobicContact CD1-CB 3.89Å; Y106-A157 HydrophobicContact CD2-CB 3.65Å; Y106-A157 HydrophobicContact CE1-CB 4.29Å; Y106-A157 HydrophobicContact CE2-CB 4.08Å; Y106-A157 HydrophobicContact CG-CB 3.58Å; L153-A157 PolarHBondContact O-N 3.5Å; L154-A157 PolarHBondContact O-N 3.21Å; A157-K159 PolarHBondContact O-N 3.46Å; A157-D160 WeakPolarHBondContact O-CB 3.2Å; A157-D160 PolarHBondContact O-N 2.87Å; A157-D160 VanDerWaalsContact O-N 3.16Å; A157-F163 WeakPolarHBondContact O-CA 3.39Å; A157-L165 HydrophobicContact CB-CD2 4.19Å; A157-L165 HydrophobicContact CB-CG 4.27Å
158	L	94.1	Very high	89	Confident	39 Å²	39	70.5 Å²	70.5	20%	0.204	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-10	178.1	-66.9	174.1	0	0	0	114.6	I109 L154 K156 F163	I109-L158 HydrophobicContact CB-CD2 4.16Å; I109-L158 HydrophobicContact CG2-CD1 4.11Å; I109-L158 HydrophobicContact CG2-CD2 4.3Å; I109-L158 WeakPolarHBondContact O-CD2 3.35Å; L154-L158 WeakPolarHBondContact O-CB 3.5Å; L154-L158 VanDerWaalsContact O-CG 3.23Å; L154-L158 WeakPolarHBondContact O-CG 3.34Å; L154-L158 PolarHBondContact O-N 2.94Å; K156-L158 VanDerWaalsContact C-N 3.34Å; K156-L158 PolarHBondContact O-N 2.85Å; L158-F163 HydrophobicContact CD2-CD1 4.27Å; L158-F163 HydrophobicContact CD2-CE1 4.35Å
159	K	93.4	Very high	87	Confident	168 Å²	168	67.7 Å²	67.7	73%	0.73	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-8.6	174.1	-68.5	179.3	-171.7	-176.9	0	112.8	Q155 K156 A157	Q155-K159 VanDerWaalsContact O-CD 3.22Å; Q155-K159 WeakPolarHBondContact O-CD 3.36Å; Q155-K159 VanDerWaalsContact O-CG 3.24Å; Q155-K159 WeakPolarHBondContact O-CG 3.27Å; K156-K159 PolarHBondContact O-N 2.92Å; K156-K159 VanDerWaalsContact O-N 3.08Å; A157-K159 PolarHBondContact O-N 3.46Å
160	D	92.9	Very high	85.1	Confident	32 Å²	32	70.4 Å²	70.4	17%	0.171	32%	0.321	C	S	.	.	S	Bend	trans	-83.4	136.8	176.3	-175.9	-92.9	0	0	0	110.6	K156 A157 E162 F163 L164 R166	K156-D160 PolarHBondContact O-N 3.26Å; A157-D160 WeakPolarHBondContact O-CB 3.2Å; A157-D160 PolarHBondContact O-N 2.87Å; A157-D160 VanDerWaalsContact O-N 3.16Å; D160-E162 PolarHBondContact O-N 2.85Å; D160-E162 WeakPolarHBondContact OD1-CA 3.26Å; D160-E162 PolarHBondContact OD1-N 3.45Å; D160-F163 PolarHBondContact O-N 3.48Å; D160-F163 PolarHBondContact OD1-N 2.78Å; D160-L164 WeakPolarHBondContact CB-O 3.47Å; D160-L164 PolarHBondContact OD1-N 3.45Å; D160-R166 IonicContact OD1-CZ 2.65Å; D160-R166 IonicContact OD1-NE 3.25Å; D160-R166 IonicContact OD1-NH2 2.76Å; D160-R166 PolarHBondContact OD1-NH2 3.38Å; D160-R166 IonicContact OD2-CZ 3.64Å; D160-R166 VanDerWaalsContact OD2-CZ 3.25Å; D160-R166 IonicContact OD2-NE 3.78Å; D160-R166 PolarHBondContact OD2-NE 2.78Å; D160-R166 IonicContact OD2-NH2 2.9Å; D160-R166 PolarHBondContact OD2-NH2 2.65Å
161	K	93	Very high	82.7	Confident	203 Å²	203	75 Å²	75	88%	0.883	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-25.9	-175.8	-65.9	-174.9	179.3	-177.9	0	113.8
162	E	93.1	Very high	80.5	Confident	123 Å²	123	72.4 Å²	72.4	58%	0.575	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	6.8	179.7	-57.6	-179.5	122.7	0	0	111.3	D160 L164 R166	D160-E162 PolarHBondContact O-N 2.85Å; D160-E162 WeakPolarHBondContact OD1-CA 3.26Å; D160-E162 PolarHBondContact OD1-N 3.45Å; E162-L164 VanDerWaalsContact C-N 3.29Å; E162-L164 HydrophobicContact CB-CD1 3.91Å; E162-L164 HydrophobicContact CB-CG 3.81Å; E162-L164 PolarHBondContact O-N 3.12Å; E162-R166 IonicContact OE2-CZ 3.12Å; E162-R166 VanDerWaalsContact OE2-CZ 3.23Å; E162-R166 IonicContact OE2-NH1 2.84Å; E162-R166 PolarHBondContact OE2-NH1 3.3Å; E162-R166 IonicContact OE2-NH2 2.68Å; E162-R166 PolarHBondContact OE2-NH2 2.92Å
163	F	92.2	Very high	78.7	Confident	81 Å²	81	71.4 Å²	71.4	36%	0.355	33%	0.327	S	S	.	.			trans	58.1	33	-171	-61.2	-90.4	0	0	0	114.2	Y106 K107 A157 L158 D160	Y106-F163 WeakPolarHBondContact CB-O 3.46Å; Y106-F163 VanDerWaalsContact CD2-O 3.27Å; Y106-F163 WeakPolarHBondContact CD2-O 3.47Å; K107-F163 HydrophobicContact CB-CB 4.07Å; K107-F163 HydrophobicContact CB-CD1 4.26Å; K107-F163 HydrophobicContact CB-CD2 3.65Å; K107-F163 HydrophobicContact CB-CE2 4.12Å; K107-F163 HydrophobicContact CB-CG 3.73Å; A157-F163 WeakPolarHBondContact O-CA 3.39Å; L158-F163 HydrophobicContact CD2-CD1 4.27Å; L158-F163 HydrophobicContact CD2-CE1 4.35Å; D160-F163 PolarHBondContact O-N 3.48Å; D160-F163 PolarHBondContact OD1-N 2.78Å
164	L	92.1	Very high	76.9	Confident	30 Å²	30	74.9 Å²	74.9	16%	0.157	35%	0.348	C	S	.	.			trans	-100.2	140.1	-176.2	-58.3	-179.2	0	0	0	113.4	Q84 D85 D160 E162 R166	Q84-L164 HydrophobicContact CG-CD2 4.42Å; Q84-L164 CarbonylContact O-C 3.58Å; Q84-L164 WeakPolarHBondContact O-CA 3.49Å; D85-L164 HydrophobicContact CB-CD2 3.9Å; D160-L164 WeakPolarHBondContact CB-O 3.47Å; D160-L164 PolarHBondContact OD1-N 3.45Å; E162-L164 VanDerWaalsContact C-N 3.29Å; E162-L164 HydrophobicContact CB-CD1 3.91Å; E162-L164 HydrophobicContact CB-CG 3.81Å; E162-L164 PolarHBondContact O-N 3.12Å; L164-R166 HydrophobicContact CB-CG 4.36Å
165	L	89	Confident	74.6	Confident	4 Å²	4	76.1 Å²	76.1	2%	0.021	36%	0.357	C	S	.	.			trans	-72.3	128	152.9	-77.5	-174.1	0	0	0	108.7	Y39 C82 Q84 Y106 L153 K156 A157	Y39-L165 HydrophobicContact CD1-CB 4.16Å; Y39-L165 HydrophobicContact CD1-CD1 4.28Å; Y39-L165 HydrophobicContact CD2-CB 4.14Å; Y39-L165 HydrophobicContact CD2-CD1 4.18Å; Y39-L165 HydrophobicContact CE1-CB 4.01Å; Y39-L165 HydrophobicContact CE2-CB 4.03Å; Y39-L165 HydrophobicContact CG-CB 4.22Å; Y39-L165 HydrophobicContact CG-CD1 3.87Å; Y39-L165 PolarHBondContact OH-O 3.04Å; C82-L165 HydrophobicContact CB-CD1 4.01Å; Q84-L165 PolarHBondContact O-N 3Å; Y106-L165 HydrophobicContact CE2-CB 4.36Å; Y106-L165 HydrophobicContact CE2-CD1 4.16Å; Y106-L165 HydrophobicContact CE2-CG 3.83Å; Y106-L165 VanDerWaalsContact OH-CD1 3.28Å; Y106-L165 WeakPolarHBondContact OH-CD1 3.4Å; L153-L165 HydrophobicContact CB-CD1 4.39Å; L153-L165 HydrophobicContact CB-CD2 4.43Å; L153-L165 HydrophobicContact CD2-CD1 4.1Å; L153-L165 HydrophobicContact CD2-CD2 4.23Å; L153-L165 WeakPolarHBondContact O-CD2 3.39Å; K156-L165 HydrophobicContact CB-CD2 3.93Å; A157-L165 HydrophobicContact CB-CD2 4.19Å; A157-L165 HydrophobicContact CB-CG 4.27Å
166	R	83.5	Confident	72.4	Confident	115 Å²	115	78.1 Å²	78.1	43%	0.434	37%	0.368	S	S	.	.			trans	-116	150.1	174.8	-52.6	-168.9	-161.4	-104.8	-6.2	110.6	D160 E162 L164 E168	D160-R166 IonicContact OD1-CZ 2.65Å; D160-R166 IonicContact OD1-NE 3.25Å; D160-R166 IonicContact OD1-NH2 2.76Å; D160-R166 PolarHBondContact OD1-NH2 3.38Å; D160-R166 IonicContact OD2-CZ 3.64Å; D160-R166 VanDerWaalsContact OD2-CZ 3.25Å; D160-R166 IonicContact OD2-NE 3.78Å; D160-R166 PolarHBondContact OD2-NE 2.78Å; D160-R166 IonicContact OD2-NH2 2.9Å; D160-R166 PolarHBondContact OD2-NH2 2.65Å; E162-R166 IonicContact OE2-CZ 3.12Å; E162-R166 VanDerWaalsContact OE2-CZ 3.23Å; E162-R166 IonicContact OE2-NH1 2.84Å; E162-R166 PolarHBondContact OE2-NH1 3.3Å; E162-R166 IonicContact OE2-NH2 2.68Å; E162-R166 PolarHBondContact OE2-NH2 2.92Å; L164-R166 HydrophobicContact CB-CG 4.36Å; R166-E168 VanDerWaalsContact C-N 3.32Å; R166-E168 PolarHBondContact O-N 3.07Å
167	E	65.6	Low	69.7	Low	107 Å²	107	76.6 Å²	76.6	50%	0.5	37%	0.369	S	S	.	.	S	Bend	trans	-73.2	71.5	-171.1	-95	163.2	-145.7	0	0	114.1	L28 S37 Y39	L28-E167 WeakPolarHBondContact CD1-OE1 3.48Å; L28-E167 HydrophobicContact CD2-CG 4.35Å; S37-E167 VanDerWaalsContact CB-OE1 3.3Å; S37-E167 WeakPolarHBondContact CB-OE1 3.28Å; S37-E167 PolarHBondContact OG-OE1 3.47Å; Y39-E167 HydrophobicContact CE1-CB 4.46Å; Y39-E167 HydrophobicContact CE1-CG 3.75Å; Y39-E167 PolarHBondContact OH-N 3.35Å
168	E	52.8	Low	66.6	Low	122 Å²	122	84.4 Å²	84.4	57%	0.57	41%	0.41	S	S	*	.			trans	-95.5	-13.6	165.3	-67.1	-169.6	135.1	0	0	113.5	K156 R166 K170	K156-E168 IonicContact NZ-OE2 2.71Å; K156-E168 PolarHBondContact NZ-OE2 3.06Å; R166-E168 VanDerWaalsContact C-N 3.32Å; R166-E168 PolarHBondContact O-N 3.07Å; E168-K170 PolarHBondContact O-N 3.29Å; E168-K170 VanDerWaalsContact O-N 3.16Å
169	L	49.4	Very low	63.5	Low	65 Å²	65	90.3 Å²	90.3	34%	0.34	44%	0.437	S	S	.	.			trans	-80.8	97.9	179.2	-73.6	173.3	0	0	0	109.5	L153 H171	L153-L169 HydrophobicContact CD2-CD1 3.74Å; L169-H171 PolarHBondContact O-N 2.81Å
170	K	48.6	Very low	60.3	Low	99 Å²	99	87.4 Å²	87.4	43%	0.43	44%	0.437	S	S	.	.	S	Bend	trans	-45.7	-22.3	177.7	-71.2	-176.7	173.7	176	0	115.5	E168 M215 P216 V217	E168-K170 PolarHBondContact O-N 3.29Å; E168-K170 VanDerWaalsContact O-N 3.16Å; K170-M215 PolarHBondContact NZ-O 2.88Å; K170-P216 VanDerWaalsContact CE-C 3.41Å; K170-P216 WeakPolarHBondContact CE-O 3.49Å; K170-P216 PolarHBondContact NZ-O 3.43Å; K170-V217 HydrophobicContact CD-CG1 4.1Å; K170-V217 HydrophobicContact CD-CG2 4.22Å; K170-V217 HydrophobicContact CG-CB 4.29Å; K170-V217 HydrophobicContact CG-CG1 3.81Å; K170-V217 HydrophobicContact CG-CG2 3.59Å
171	H	43.6	Very low	57.2	Low	98 Å²	98	91.4 Å²	91.4	45%	0.454	47%	0.465	S	S	.	.	S	Bend	trans	-142.9	126.7	176.4	-45.8	95.2	0	0	0	108.8	L169 K173	L169-H171 PolarHBondContact O-N 2.81Å; H171-K173 PolarHBondContact O-N 3.16Å
172	P	48.2	Very low	54	Low	39 Å²	39	89.2 Å²	89.2	25%	0.253	46%	0.463	S	S	.	.			trans	-68.1	127.2	171.4	28.1	-32.4	0	0	0	109.6	L28	L28-P172 HydrophobicContact CD2-CB 4.22Å; L28-P172 HydrophobicContact CD2-CG 4.43Å
173	K	53.9	Low	50.9	Low	57 Å²	57	90.3 Å²	90.3	25%	0.248	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	141.8	-173.9	-70.1	-179.8	177.9	176.7	0	111.1	Y40 M149 H171 F294 I295	Y40-K173 WeakPolarHBondContact CA-O 3.42Å; Y40-K173 HydrophobicContact CD2-CB 4.21Å; Y40-K173 WeakPolarHBondContact CD2-O 3.24Å; M149-K173 HydrophobicContact CE-CD 4.33Å; H171-K173 PolarHBondContact O-N 3.16Å; K173-F294 PolarHBondContact NZ-O 2.96Å; K173-I295 PolarHBondContact NZ-O 2.71Å
174	V	54.3	Low	47.8	Very low	75 Å²	75	96.7 Å²	96.7	46%	0.455	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	116.3	-176.9	174.5	0	0	0	0	109.5	M41 I176	M41-V174 HydrophobicContact CE-CG1 3.98Å; V174-I176 HydrophobicContact CG1-CB 4.43Å; V174-I176 HydrophobicContact CG1-CD1 3.56Å; V174-I176 HydrophobicContact CG1-CG1 3.58Å
175	S	46.4	Very low	44.9	Very low	30 Å²	30	98.2 Å²	98.2	21%	0.21	52%	0.517	C	S	.	.			trans	-102.3	63.6	176.7	44.8	0	0	0	0	111.8	Y40 M41 D146 G177	Y40-S175 PolarHBondContact OH-OG 3.21Å; M41-S175 PolarHBondContact O-N 2.92Å; D146-S175 VanDerWaalsContact OD1-CB 3.32Å; D146-S175 WeakPolarHBondContact OD1-CB 3.48Å; D146-S175 PolarHBondContact OD1-OG 2.87Å; S175-G177 VanDerWaalsContact C-N 3.32Å; S175-G177 PolarHBondContact O-N 3.49Å
176	I	47.8	Very low	42	Very low	94 Å²	94	104 Å²	104	48%	0.482	55%	0.552	S	S	.	*			trans	-75.5	88.6	165.8	-62.1	160.9	0	0	0	107.8	M41 V174 L178	M41-I176 HydrophobicContact CE-CD1 3.7Å; M41-I176 HydrophobicContact CE-CG1 3.52Å; V174-I176 HydrophobicContact CG1-CB 4.43Å; V174-I176 HydrophobicContact CG1-CD1 3.56Å; V174-I176 HydrophobicContact CG1-CG1 3.58Å; I176-L178 PolarHBondContact O-N 2.85Å
177	G	35	Very low	39.4	Very low	27 Å²	27	104 Å²	104	28%	0.278	57%	0.565	S	S	.	*			trans	-70.7	99.6	173.1	0	0	0	0	0	111	K142 S175 Q179	K142-G177 PolarHBondContact NZ-O 2.74Å; S175-G177 VanDerWaalsContact C-N 3.32Å; S175-G177 PolarHBondContact O-N 3.49Å; G177-Q179 PolarHBondContact O-N 3.42Å; G177-Q179 VanDerWaalsContact O-N 3.12Å
178	L	29.9	Very low	37.9	Very low	165 Å²	165	106.8 Å²	106.8	86%	0.864	58%	0.58	S	S	*	*			trans	-40.9	111.3	174.7	-81.8	161.2	0	0	0	112.3	I176	I176-L178 PolarHBondContact O-N 2.85Å
179	Q	29.2	Very low	36.8	Very low	162 Å²	162	108 Å²	108	76%	0.757	59%	0.591	S	S	*	*			trans	171.9	101.6	160.4	-105.4	176.9	-4.6	0	0	109.1	G177	G177-Q179 PolarHBondContact O-N 3.42Å; G177-Q179 VanDerWaalsContact O-N 3.12Å
180	C	26.3	Very low	36.1	Very low	108 Å²	108	112 Å²	112	73%	0.73	62%	0.618	S	S	*	*			trans	176.6	54.8	152.3	-97.6	0	0	0	0	111.4
181	C	26.2	Very low	35.3	Very low	115 Å²	115	111.7 Å²	111.7	78%	0.777	63%	0.634	S	S	*	*			trans	-134.5	58	166.3	-81	0	0	0	0	110.2	I183	C181-I183 PolarHBondContact O-N 2.81Å; C181-I183 VanDerWaalsContact O-N 3.11Å
182	L	26.4	Very low	34.9	Very low	158 Å²	158	112 Å²	112	83%	0.827	65%	0.647	S	S	*	*			trans	-74.6	84.2	153.5	-75.1	173.6	0	0	0	107.1	Y184	L182-Y184 PolarHBondContact O-N 3.5Å
183	I	29.1	Very low	34.2	Very low	145 Å²	145	117 Å²	117	74%	0.744	67%	0.672	S	S	*	*			trans	-83.7	99.7	164.8	-60.1	179.7	0	0	0	105.6	C181 G185	C181-I183 PolarHBondContact O-N 2.81Å; C181-I183 VanDerWaalsContact O-N 3.11Å; I183-G185 PolarHBondContact O-N 3.2Å
184	Y	27.3	Very low	33.3	Very low	216 Å²	216	120.7 Å²	120.7	85%	0.847	69%	0.692	S	S	*	*			trans	-65.8	113.5	164.6	-91.3	-96.2	0	0	0	107.7	L182	L182-Y184 PolarHBondContact O-N 3.5Å
185	G	30.5	Very low	32.3	Very low	61 Å²	61	123.5 Å²	123.5	63%	0.629	71%	0.705	S	S	*	*			trans	-147.4	63.1	-172.3	0	0	0	0	0	111.4	I183	I183-G185 PolarHBondContact O-N 3.2Å
186	T	27.3	Very low	31.6	Very low	125 Å²	125	129 Å²	129	77%	0.767	73%	0.732	S	S	*	*			trans	29.7	139	156.3	-16.8	0	0	0	0	121.3
187	T	28.9	Very low	31	Very low	115 Å²	115	129.4 Å²	129.4	71%	0.706	74%	0.744	S	S	*	*			trans	65.7	109.9	167.4	64.4	0	0	0	0	117.6
188	M	34.4	Very low	30.7	Very low	167 Å²	167	134.2 Å²	134.2	82%	0.823	76%	0.761	S	S	*	*				-161.5	163.7	89.5	-92.1	-57.8	169.1	0	0	111
189	N	29.9	Very low	30.8	Very low	147 Å²	147	135.5 Å²	135.5	79%	0.786	76%	0.756	S	S	*	*			trans	-88.5	138.2	-172	-57.6	-41.6	0	0	0	112.7
190	T	35.4	Very low	30.8	Very low	150 Å²	150	136.4 Å²	136.4	92%	0.92	76%	0.76	S	S	*	*				-170.4	161.3	118.2	15	0	0	0	0	110.3
191	A	30.7	Very low	31.1	Very low	91 Å²	91	134.2 Å²	134.2	75%	0.752	76%	0.756	S	S	*	*			trans	-110.3	145.5	-170.5	0	0	0	0	0	112.7
192	S	35.3	Very low	31.4	Very low	104 Å²	104	135.7 Å²	135.7	73%	0.727	76%	0.756	S	S	*	*				170	134.9	119.8	48.6	0	0	0	0	113.1
193	N	33.4	Very low	31.6	Very low	145 Å²	145	134.9 Å²	134.9	78%	0.775	75%	0.751	S	S	*	*				42.6	141	126.6	-60.5	-0.2	0	0	0	121
194	I	34.8	Very low	31.7	Very low	134 Å²	134	136.7 Å²	136.7	69%	0.687	76%	0.756	S	S	*	*			cis	-171.1	163	-9.3	-123.6	164	0	0	0	110.1
195	N	34	Very low	31.7	Very low	135 Å²	135	136.1 Å²	136.1	72%	0.722	75%	0.754	S	S	*	*			trans	65.9	115.4	163.3	-71.2	-8.5	0	0	0	124
196	N	31.2	Very low	31.8	Very low	144 Å²	144	140.5 Å²	140.5	77%	0.77	76%	0.763	S	S	*	*				9.7	148.4	118.7	-51.2	-18.9	0	0	0	119.2
197	S	34.8	Very low	32	Very low	104 Å²	104	140.2 Å²	140.2	73%	0.727	76%	0.757	S	S	*	*				-160.2	142.8	50	45.5	0	0	0	0	115.8
198	I	29.8	Very low	32.1	Very low	127 Å²	127	141.3 Å²	141.3	65%	0.651	76%	0.758	S	S	*	*				66.5	138.8	95.9	-26.4	160.2	0	0	0	118.9
199	Y	31.8	Very low	32.1	Very low	193 Å²	193	139.6 Å²	139.6	76%	0.757	75%	0.751	S	S	*	*			trans	77.9	152.4	162.4	-61.1	-64.5	0	0	0	119.5
200	E	30.2	Very low	32.1	Very low	181 Å²	181	141.2 Å²	141.2	85%	0.846	75%	0.751	S	S	*	*			cis	-167.7	174.3	-37.4	-145.2	170.2	-144	0	0	110.3
201	G	32.5	Very low	31.9	Very low	62 Å²	62	144.1 Å²	144.1	64%	0.639	75%	0.751	S	S	*	*			trans	117.1	102.7	150.9	0	0	0	0	0	121.4
202	N	31	Very low	31.7	Very low	145 Å²	145	148.4 Å²	148.4	78%	0.775	76%	0.756	S	S	*	*			trans	40.8	112.9	133.8	-54.5	-23	0	0	0	121.2
203	I	30.9	Very low	31.4	Very low	142 Å²	142	149.3 Å²	149.3	73%	0.728	76%	0.762	S	S	*	*				76.2	107.1	72	-63.2	161.6	0	0	0	115.5
204	H	30.9	Very low	31	Very low	183 Å²	183	149.6 Å²	149.6	85%	0.847	76%	0.757	S	S	*	*				-157.3	155.1	126.4	-120.9	72.3	0	0	0	113.6
205	Y	29	Very low	30.8	Very low	203 Å²	203	150.9 Å²	150.9	80%	0.796	76%	0.762	S	S	*	*			trans	-115.7	152.1	176.2	-94.6	-99.5	0	0	0	110.4
206	N	31.8	Very low	30.6	Very low	153 Å²	153	149.3 Å²	149.3	82%	0.818	76%	0.758	S	S	*	*			trans	-152.3	160.9	135	-140.4	-27.6	0	0	0	112.3
207	N	30.7	Very low	30.6	Very low	119 Å²	119	146.9 Å²	146.9	64%	0.636	75%	0.749	S	S	*	*			trans	-102.8	164.3	-173.7	-65.7	-72.1	0	0	0	112.3
208	N	32.7	Very low	30.6	Very low	139 Å²	139	147 Å²	147	74%	0.743	75%	0.75	S	S	*	*				-179.2	130.7	117.9	-92.5	-34.2	0	0	0	117.2
209	I	34.4	Very low	30.8	Very low	130 Å²	130	151.9 Å²	151.9	67%	0.667	76%	0.76	S	S	*	*			trans	70.9	107.9	131.5	-61.5	169.9	0	0	0	121.9
210	K	27.9	Very low	30.7	Very low	182 Å²	182	147.3 Å²	147.3	79%	0.791	76%	0.756	S	S	*	*			trans	40.1	124.6	132.9	-50.3	173.7	-171.3	171.5	0	121.5
211	K	32.5	Very low	30.8	Very low	210 Å²	210	144.3 Å²	144.3	91%	0.913	75%	0.745	S	S	*	*				-174.9	172.1	103.8	-101.6	175.7	-179.3	179.4	0	113.2
212	Q	26.1	Very low	31	Very low	182 Å²	182	144 Å²	144	85%	0.85	73%	0.733	S	S	*	*			trans	-122.6	153.2	-172.7	-60.2	165.9	-49.2	0	0	112.4
213	S	29	Very low	31.1	Very low	123 Å²	123	145.4 Å²	145.4	86%	0.86	73%	0.728	S	S	*	*			trans	-164.8	161	149.5	56.7	0	0	0	0	111.9
214	F	25.7	Very low	31.3	Very low	151 Å²	151	144.5 Å²	144.5	66%	0.662	73%	0.729	S	S	*	*			trans	-129.2	157.8	-173.7	-85.7	-113.6	0	0	0	111.3
215	M	30.3	Very low	31.7	Very low	161 Å²	161	145.1 Å²	145.1	79%	0.793	73%	0.729	S	S	*	*			trans	-157.7	149.3	152.5	-94.9	-57	101.1	0	0	112.8	K170	K170-M215 PolarHBondContact NZ-O 2.88Å
216	P	30.4	Very low	31.7	Very low	101 Å²	101	143.4 Å²	143.4	66%	0.656	73%	0.733	S	S	*	*			trans	-97	-161.1	-154.6	40.7	-40.5	0	0	0	116.8	K170	K170-P216 VanDerWaalsContact CE-C 3.41Å; K170-P216 WeakPolarHBondContact CE-O 3.49Å; K170-P216 PolarHBondContact NZ-O 3.43Å
217	V	30.6	Very low	31.9	Very low	94 Å²	94	142.7 Å²	142.7	57%	0.57	73%	0.734	S	S	*	*			trans	-129.8	154	-161.7	-135.1	0	0	0	0	114.1	K170	K170-V217 HydrophobicContact CD-CG1 4.1Å; K170-V217 HydrophobicContact CD-CG2 4.22Å; K170-V217 HydrophobicContact CG-CB 4.29Å; K170-V217 HydrophobicContact CG-CG1 3.81Å; K170-V217 HydrophobicContact CG-CG2 3.59Å
218	S	33.6	Very low	31.8	Very low	106 Å²	106	140.3 Å²	140.3	74%	0.741	74%	0.737	S	S	*	*			trans	177.8	152	153.8	39.7	0	0	0	0	108.6
219	R	34.3	Very low	31.8	Very low	229 Å²	229	140.7 Å²	140.7	86%	0.864	75%	0.745	S	S	*	*			cis	-150.8	147	-16.8	-90.3	161.3	179.4	175.6	-1.6	104.4
220	S	31.1	Very low	31.5	Very low	98 Å²	98	141 Å²	141	69%	0.685	75%	0.752	S	S	*	*			cis	67.4	153.5	48.7	92	0	0	0	0	114.4
221	L	31.7	Very low	31.6	Very low	118 Å²	118	136.7 Å²	136.7	62%	0.618	75%	0.746	S	S	*	*			cis	-104	0	8.2	-132.3	-177.6	0	0	0	113.2	Y23	Y23-L221 WeakPolarHBondContact CB-O 3.47Å; Y23-L221 HydrophobicContact CD1-CB 3.93Å; Y23-L221 HydrophobicContact CD1-CD2 3.28Å; Y23-L221 HydrophobicContact CD1-CG 4.16Å; Y23-L221 WeakPolarHBondContact CD1-O 3.29Å; Y23-L221 WeakPolarHBondContact CD2-O 3.34Å; Y23-L221 HydrophobicContact CE1-CB 2.82Å; Y23-L221 HydrophobicContact CE1-CD1 4.32Å; Y23-L221 HydrophobicContact CE1-CD2 3.26Å; Y23-L221 HydrophobicContact CE1-CG 3.51Å; Y23-L221 WeakPolarHBondContact CE1-O 3.42Å; Y23-L221 HydrophobicContact CE2-CB 4.35Å; Y23-L221 WeakPolarHBondContact CE2-O 3.27Å; Y23-L221 WeakPolarHBondContact OH-CA 3.21Å; Y23-L221 WeakPolarHBondContact OH-CB 3.29Å; Y23-L221 PolarHBondContact OH-N 2.92Å
222	S	36.2	Very low	31.3	Very low	54 Å²	54	135.1 Å²	135.1	38%	0.378	75%	0.747	S	S	.	*				0	152.2	0	50.2	0	0	0	0	108	S21 Y23	S21-S222 PolarHBondContact OG-OG 3.49Å; Y23-S222 WeakPolarHBondContact CB-O 3.48Å; Y23-S222 VanDerWaalsContact CE2-CA 3.48Å; Y23-S222 WeakPolarHBondContact CE2-OG 3.17Å; Y23-S222 VanDerWaalsContact CG-O 3.23Å; Y23-S222 PolarHBondContact OH-N 2.89Å
223	R	32.8	Very low	31.5	Very low	176 Å²	176	131.9 Å²	131.9	66%	0.664	73%	0.734	S	S	*	*			trans	-158.3	143.9	-177	-176.3	-173.9	-176.4	-162.7	4.2	113.4
224	T	36.6	Very low	31.4	Very low	123 Å²	123	137.7 Å²	137.7	76%	0.755	74%	0.739	S	S	*	*			trans	-142.5	115.4	169.2	30.3	0	0	0	0	109.8
225	K	37.5	Very low	31.6	Very low	195 Å²	195	138 Å²	138	85%	0.848	74%	0.743	S	S	*	*				101.1	127.9	83.8	-86.7	-173	178.3	-178.5	0	110.7
226	L	30.4	Very low	31.5	Very low	168 Å²	168	138.8 Å²	138.8	88%	0.88	75%	0.745	S	S	*	*			trans	-152.9	153.1	-169.7	-169.1	114.5	0	0	0	110.4
227	T	35	Very low	31.6	Very low	138 Å²	138	142.2 Å²	142.2	85%	0.847	75%	0.751	S	S	*	*			trans	-147.4	113.9	-174.5	48.8	0	0	0	0	114.4
228	G	29.4	Very low	31.6	Very low	68 Å²	68	141 Å²	141	70%	0.701	75%	0.747	S	S	*	*			trans	72.8	152	166.9	0	0	0	0	0	116.1
229	V	31.6	Very low	31.6	Very low	148 Å²	148	143.3 Å²	143.3	90%	0.897	75%	0.751	S	S	*	*			cis	-135.7	164.3	-6.5	173.8	0	0	0	0	108.2
230	T	28.3	Very low	31.6	Very low	135 Å²	135	137.1 Å²	137.1	83%	0.828	73%	0.732	S	S	*	*			trans	-82.1	132.9	-162.7	52.9	0	0	0	0	116.7
231	S	29.3	Very low	31.9	Very low	93 Å²	93	138.1 Å²	138.1	65%	0.65	73%	0.729	S	S	*	*			trans	-132.1	144.1	149.2	58.8	0	0	0	0	109.4	I233	S231-I233 PolarHBondContact O-N 2.88Å; S231-I233 VanDerWaalsContact O-N 3.14Å
232	N	27	Very low	32.2	Very low	176 Å²	176	136.8 Å²	136.8	94%	0.941	72%	0.722	S	S	*	*			trans	-86.4	79.7	-176.7	-74.5	-53.6	0	0	0	111.3
233	I	31.1	Very low	32.2	Very low	114 Å²	114	138.8 Å²	138.8	59%	0.585	73%	0.725	S	S	*	*			trans	-118.8	136.9	169.9	-54.4	-177.7	0	0	0	108.5	S231 E235	S231-I233 PolarHBondContact O-N 2.88Å; S231-I233 VanDerWaalsContact O-N 3.14Å; I233-E235 VanDerWaalsContact C-N 3.28Å; I233-E235 HydrophobicContact CG2-CG 3.99Å; I233-E235 PolarHBondContact O-N 3.31Å; I233-E235 VanDerWaalsContact O-N 3.11Å
234	Y	27.2	Very low	32.5	Very low	245 Å²	245	137.9 Å²	137.9	96%	0.961	73%	0.726	S	S	*	*			trans	-84.1	72.2	174.4	-89.3	-93.6	0	0	0	110.5
235	E	29.6	Very low	32.5	Very low	159 Å²	159	138.5 Å²	138.5	74%	0.743	72%	0.72	S	S	*	*			trans	-95.6	150	161.9	-74.1	164.5	163.1	0	0	109.1	I233	I233-E235 VanDerWaalsContact C-N 3.28Å; I233-E235 HydrophobicContact CG2-CG 3.99Å; I233-E235 PolarHBondContact O-N 3.31Å; I233-E235 VanDerWaalsContact O-N 3.11Å
236	E	28.6	Very low	32.3	Very low	177 Å²	177	134.1 Å²	134.1	83%	0.827	71%	0.712	S	S	*	*			cis	-138.6	154.1	7.7	-156.3	-179.1	175.1	0	0	110.5
237	H	31.2	Very low	32.5	Very low	172 Å²	172	132.2 Å²	132.2	80%	0.796	70%	0.701	S	S	*	*			trans	-75.4	126.5	176.6	-94.5	-85.3	0	0	0	111.6	N239	H237-N239 PolarHBondContact O-ND2 2.68Å
238	S	32	Very low	32.4	Very low	68 Å²	68	131.9 Å²	131.9	48%	0.476	69%	0.693	S	S	.	*			trans	-99.2	113.8	-172.7	53	0	0	0	0	113.5	E240	S238-E240 VanDerWaalsContact C-N 3.26Å; S238-E240 PolarHBondContact O-N 3.16Å
239	N	32.2	Very low	32.7	Very low	156 Å²	156	132.8 Å²	132.8	83%	0.834	69%	0.688	S	S	*	*			trans	-83.6	27.5	-162.7	-62.5	-59.1	0	0	0	115.6	H237 L241	H237-N239 PolarHBondContact O-ND2 2.68Å; N239-L241 PolarHBondContact O-N 2.88Å
240	E	34.9	Very low	32.8	Very low	99 Å²	99	131.7 Å²	131.7	46%	0.463	68%	0.682	S	S	.	*			trans	-83.3	113.7	-179.4	-68.8	-165	156.6	0	0	112.7	L25 S238	L25-E240 HydrophobicContact CD2-CB 3.84Å; L25-E240 HydrophobicContact CD2-CG 3.9Å; S238-E240 VanDerWaalsContact C-N 3.26Å; S238-E240 PolarHBondContact O-N 3.16Å
241	L	37.5	Very low	33.2	Very low	119 Å²	119	127.2 Å²	127.2	62%	0.623	66%	0.657	S	S	*	*			trans	67	50.9	157.9	-54.8	179.4	0	0	0	117.3	N239 Q243	N239-L241 PolarHBondContact O-N 2.88Å; L241-Q243 HydrophobicContact CB-CG 4.34Å; L241-Q243 HydrophobicContact CD2-CG 4.44Å; L241-Q243 PolarHBondContact O-N 2.62Å
242	I	37	Very low	34.1	Very low	90 Å²	90	128 Å²	128	46%	0.462	66%	0.659	S	S	.	*			trans	-61.3	93.8	130.8	-60.5	-179.2	0	0	0	106.7	K244 I300	I242-K244 VanDerWaalsContact C-N 3.31Å; I242-K244 PolarHBondContact O-N 2.98Å; I242-I300 HydrophobicContact CG2-CD1 3.65Å; I242-I300 HydrophobicContact CG2-CG1 3.55Å
243	Q	36.9	Very low	35.1	Very low	96 Å²	96	124.4 Å²	124.4	45%	0.449	65%	0.648	S	S	.	*			trans	-68.3	92.5	173.3	-76.9	-172.6	-31.3	0	0	108.9	L241 Q245 R299	L241-Q243 HydrophobicContact CB-CG 4.34Å; L241-Q243 HydrophobicContact CD2-CG 4.44Å; L241-Q243 PolarHBondContact O-N 2.62Å; Q243-Q245 PolarHBondContact O-N 2.82Å; Q243-R299 VanDerWaalsContact OE1-CZ 3.28Å
244	K	39.1	Very low	36	Very low	157 Å²	157	126.2 Å²	126.2	68%	0.683	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-49.7	121	157.8	-76	-178.1	175.9	177.8	0	107.4	I242 I300	I242-K244 VanDerWaalsContact C-N 3.31Å; I242-K244 PolarHBondContact O-N 2.98Å; K244-I300 HydrophobicContact CG-CD1 4.18Å
245	Q	37	Very low	37.3	Very low	135 Å²	135	118.9 Å²	118.9	63%	0.631	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-57.9	140.2	151.4	-71	-174.8	-6.9	0	0	106.9	Q243 I247	Q243-Q245 PolarHBondContact O-N 2.82Å; Q245-I247 PolarHBondContact O-N 2.9Å; Q245-I247 VanDerWaalsContact O-N 3.08Å
246	P	32.6	Very low	39	Very low	104 Å²	104	112.9 Å²	112.9	68%	0.675	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-58.6	119.5	171.3	25.4	-32.6	0	0	0	107.9	I248	P246-I248 HydrophobicContact CB-CG1 4.3Å; P246-I248 PolarHBondContact O-N 3.43Å
247	I	35.5	Very low	41	Very low	127 Å²	127	111.1 Å²	111.1	65%	0.651	59%	0.591	S	S	*	*			trans	-78.5	75.6	-178.6	-54.7	177.8	0	0	0	107.6	Q245 S249 T250	Q245-I247 PolarHBondContact O-N 2.9Å; Q245-I247 VanDerWaalsContact O-N 3.08Å; I247-S249 PolarHBondContact O-N 3.23Å; I247-S249 VanDerWaalsContact O-N 3.09Å; I247-T250 HydrophobicContact CG2-CG2 3.78Å
248	I	33.1	Very low	42.8	Very low	132 Å²	132	109.1 Å²	109.1	68%	0.677	58%	0.581	S	S	*	*			trans	-72.4	100.2	171.5	-55.8	175	0	0	0	106.4	P246	P246-I248 HydrophobicContact CB-CG1 4.3Å; P246-I248 PolarHBondContact O-N 3.43Å
249	S	34.1	Very low	44.4	Very low	86 Å²	86	106 Å²	106	60%	0.601	56%	0.559	S	S	*	*			trans	56.1	132.3	-171.2	78	0	0	0	0	116.8	I247 S251	I247-S249 PolarHBondContact O-N 3.23Å; I247-S249 VanDerWaalsContact O-N 3.09Å; S249-S251 VanDerWaalsContact C-N 3.29Å; S249-S251 PolarHBondContact O-N 2.86Å; S249-S251 VanDerWaalsContact O-N 3.1Å
250	T	33.8	Very low	46.1	Very low	125 Å²	125	101.5 Å²	101.5	77%	0.767	54%	0.535	S	S	*	.			trans	-83.5	70	172.4	48	0	0	0	0	110.3	I247 P252	I247-T250 HydrophobicContact CG2-CG2 3.78Å; T250-P252 WeakPolarHBondContact O-CD 3.46Å
251	S	38.1	Very low	48.1	Very low	42 Å²	42	100.5 Å²	100.5	29%	0.294	53%	0.53	S	S	.	.			trans	-72.8	125	170.4	63	0	0	0	0	109.9	S249 S253	S249-S251 VanDerWaalsContact C-N 3.29Å; S249-S251 PolarHBondContact O-N 2.86Å; S249-S251 VanDerWaalsContact O-N 3.1Å; S251-S253 WeakPolarHBondContact CB-OG 3.15Å; S251-S253 PolarHBondContact O-N 3.18Å; S251-S253 PolarHBondContact OG-OG 3.08Å
252	P	47.4	Very low	49.7	Very low	109 Å²	109	96.9 Å²	96.9	71%	0.708	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-60.6	-11.6	179.8	-26.2	35.9	0	0	0	115.4	T250 R254	T250-P252 WeakPolarHBondContact O-CD 3.46Å; P252-R254 VanDerWaalsContact C-N 3.29Å; P252-R254 PolarHBondContact O-N 2.83Å
253	S	49.2	Very low	51.4	Low	101 Å²	101	94.2 Å²	94.2	71%	0.706	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-75	8	-172	52.3	0	0	0	0	117	S251	S251-S253 WeakPolarHBondContact CB-OG 3.15Å; S251-S253 PolarHBondContact O-N 3.18Å; S251-S253 PolarHBondContact OG-OG 3.08Å
254	R	48.4	Very low	53	Low	151 Å²	151	95.2 Å²	95.2	57%	0.57	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-114.8	8.7	-179.3	-56.8	-160.5	-144	167.9	9.7	115.5	P252 D302	P252-R254 VanDerWaalsContact C-N 3.29Å; P252-R254 PolarHBondContact O-N 2.83Å; R254-D302 WeakPolarHBondContact O-CB 3.37Å
255	Y	55.2	Low	54.8	Low	92 Å²	92	93.6 Å²	93.6	36%	0.361	50%	0.495	S	S	.	.	S	Bend	trans	-88	125.6	172	-71.4	-74.4	0	0	0	109.8	S259 I260	Y255-S259 WeakPolarHBondContact CA-OG 3.15Å; Y255-S259 WeakPolarHBondContact CB-OG 3.4Å; Y255-I260 VanDerWaalsContact CB-CG1 3.43Å; Y255-I260 HydrophobicContact CG-CG1 4.44Å
256	S	64.9	Low	56.5	Low	33 Å²	33	88.9 Å²	88.9	23%	0.231	47%	0.474	C	S	.	.			trans	-57.4	145.3	165.7	65	0	0	0	0	110	H258 S259 I260 D302	S256-H258 PolarHBondContact O-N 3.09Å; S256-S259 PolarHBondContact N-OG 2.95Å; S256-S259 WeakPolarHBondContact O-CA 3.42Å; S256-S259 PolarHBondContact O-N 2.78Å; S256-S259 PolarHBondContact O-OG 3.05Å; S256-S259 WeakPolarHBondContact OG-CB 3.15Å; S256-S259 PolarHBondContact OG-N 2.83Å; S256-S259 PolarHBondContact OG-OG 3.37Å; S256-S259 VanDerWaalsContact OG-OG 3.14Å; S256-I260 PolarHBondContact O-N 3.29Å; S256-D302 PolarHBondContact OG-O 3.25Å
257	N	69.9	Low	58.2	Low	140 Å²	140	86.3 Å²	86.3	75%	0.749	46%	0.455	S	S	*	.	H	α-helix	trans	-50.3	-39	-177.1	-68.1	-0.8	0	0	0	112.8	I260 E261	N257-I260 WeakPolarHBondContact O-CB 3.28Å; N257-I260 PolarHBondContact O-N 2.87Å; N257-E261 WeakPolarHBondContact O-CB 3.33Å; N257-E261 PolarHBondContact O-N 3.21Å
258	H	69.7	Low	59.9	Low	129 Å²	129	84 Å²	84	60%	0.597	45%	0.45	S	S	*	.	H	α-helix	trans	-65.1	-36.8	175.9	-175.6	55.4	0	0	0	113.5	S256 E261 L262	S256-H258 PolarHBondContact O-N 3.09Å; H258-E261 IonicContact ND1-OE2 2.62Å; H258-E261 PolarHBondContact ND1-OE2 3.11Å; H258-E261 PolarHBondContact O-N 3.12Å; H258-L262 WeakPolarHBondContact O-CB 3.39Å; H258-L262 PolarHBondContact O-N 2.61Å
259	S	65.1	Low	61.4	Low	2 Å²	2	82.6 Å²	82.6	1%	0.014	45%	0.452	C	S	.	.	H	α-helix	trans	-72.4	-29.8	173.8	69.3	0	0	0	0	113.2	Y255 S256 L263 L289	Y255-S259 WeakPolarHBondContact CA-OG 3.15Å; Y255-S259 WeakPolarHBondContact CB-OG 3.4Å; S256-S259 PolarHBondContact N-OG 2.95Å; S256-S259 WeakPolarHBondContact O-CA 3.42Å; S256-S259 PolarHBondContact O-N 2.78Å; S256-S259 PolarHBondContact O-OG 3.05Å; S256-S259 WeakPolarHBondContact OG-CB 3.15Å; S256-S259 PolarHBondContact OG-N 2.83Å; S256-S259 PolarHBondContact OG-OG 3.37Å; S256-S259 VanDerWaalsContact OG-OG 3.14Å; S259-L263 WeakPolarHBondContact O-CB 3.22Å; S259-L263 PolarHBondContact O-N 2.79Å; S259-L289 VanDerWaalsContact CB-CD1 3.44Å
260	I	68.6	Low	62.8	Low	62 Å²	62	83.7 Å²	83.7	32%	0.318	44%	0.444	S	S	.	.	H	α-helix	trans	-66.3	-48.5	169.9	-58	178	0	0	0	109.7	Y255 S256 N257 L262 L263 Q264	Y255-I260 VanDerWaalsContact CB-CG1 3.43Å; Y255-I260 HydrophobicContact CG-CG1 4.44Å; S256-I260 PolarHBondContact O-N 3.29Å; N257-I260 WeakPolarHBondContact O-CB 3.28Å; N257-I260 PolarHBondContact O-N 2.87Å; I260-L262 VanDerWaalsContact C-N 3.34Å; I260-L262 PolarHBondContact O-N 3.1Å; I260-L263 PolarHBondContact O-N 3.38Å; I260-Q264 HydrophobicContact CG2-CG 4.42Å; I260-Q264 WeakPolarHBondContact O-CB 3.44Å; I260-Q264 WeakPolarHBondContact O-CG 3.48Å; I260-Q264 PolarHBondContact O-N 3.45Å
261	E	76.1	Confident	64.1	Low	78 Å²	78	81.4 Å²	81.4	36%	0.364	43%	0.427	S	S	.	.	H	α-helix	trans	-58.5	-43.1	177.1	-170	-155.4	159.5	0	0	111.8	N257 H258 Q264 K265	N257-E261 WeakPolarHBondContact O-CB 3.33Å; N257-E261 PolarHBondContact O-N 3.21Å; H258-E261 IonicContact ND1-OE2 2.62Å; H258-E261 PolarHBondContact ND1-OE2 3.11Å; H258-E261 PolarHBondContact O-N 3.12Å; E261-Q264 PolarHBondContact O-N 3.39Å; E261-K265 HydrophobicContact CG-CD 4.41Å; E261-K265 WeakPolarHBondContact O-CB 3.41Å; E261-K265 WeakPolarHBondContact O-CG 3.37Å; E261-K265 PolarHBondContact O-N 2.86Å; E261-K265 WeakPolarHBondContact OE1-CE 3.26Å; E261-K265 IonicContact OE1-NZ 2.69Å; E261-K265 PolarHBondContact OE1-NZ 2.88Å
262	L	72.2	Confident	65	Low	43 Å²	43	84.3 Å²	84.3	23%	0.225	44%	0.444	C	S	.	.	H	α-helix	trans	-63.6	-45	174.9	-164	92	0	0	0	111.5	H258 I260 Q264 K265 L266 L287 Y307	H258-L262 WeakPolarHBondContact O-CB 3.39Å; H258-L262 PolarHBondContact O-N 2.61Å; I260-L262 VanDerWaalsContact C-N 3.34Å; I260-L262 PolarHBondContact O-N 3.1Å; L262-Q264 VanDerWaalsContact C-N 3.35Å; L262-K265 PolarHBondContact O-N 3.22Å; L262-L266 HydrophobicContact CD2-CD1 4.01Å; L262-L266 HydrophobicContact CG-CD1 4.02Å; L262-L266 WeakPolarHBondContact O-CB 3.19Å; L262-L266 VanDerWaalsContact O-CG 3.26Å; L262-L266 WeakPolarHBondContact O-CG 3.47Å; L262-L266 PolarHBondContact O-N 3.18Å; L262-L287 HydrophobicContact CB-CD2 4.46Å; L262-L287 HydrophobicContact CD2-CD1 4.09Å; L262-L287 HydrophobicContact CD2-CD2 3.9Å; L262-Y307 HydrophobicContact CD2-CD1 4.21Å; L262-Y307 HydrophobicContact CD2-CD2 4.33Å; L262-Y307 HydrophobicContact CD2-CG 3.98Å
263	L	71.6	Confident	65.3	Low	34 Å²	34	84.8 Å²	84.8	18%	0.178	44%	0.441	C	S	.	.	H	α-helix	trans	-63	-40.2	176.8	175.4	59.7	0	0	0	111.7	S259 I260 N267 L287 F309	S259-L263 WeakPolarHBondContact O-CB 3.22Å; S259-L263 PolarHBondContact O-N 2.79Å; I260-L263 PolarHBondContact O-N 3.38Å; L263-N267 VanDerWaalsContact O-CB 3.25Å; L263-N267 WeakPolarHBondContact O-CB 3.48Å; L263-N267 PolarHBondContact O-N 2.96Å; L263-N267 PolarHBondContact O-ND2 2.92Å; L263-L287 HydrophobicContact CB-CD2 4.05Å; L263-L287 HydrophobicContact CD1-CB 4.12Å; L263-F309 HydrophobicContact CD1-CE2 4.27Å
264	Q	72.2	Confident	65.4	Low	118 Å²	118	83.9 Å²	83.9	55%	0.551	45%	0.448	S	S	*	.	H	α-helix	trans	-62.1	-51.5	174.4	-75.2	172.1	-20.4	0	0	111.1	I260 E261 L262 L266 N267 S268	I260-Q264 HydrophobicContact CG2-CG 4.42Å; I260-Q264 WeakPolarHBondContact O-CB 3.44Å; I260-Q264 WeakPolarHBondContact O-CG 3.48Å; I260-Q264 PolarHBondContact O-N 3.45Å; E261-Q264 PolarHBondContact O-N 3.39Å; L262-Q264 VanDerWaalsContact C-N 3.35Å; Q264-L266 PolarHBondContact O-N 3.15Å; Q264-N267 PolarHBondContact O-N 3.2Å; Q264-N267 VanDerWaalsContact O-N 3.14Å; Q264-S268 PolarHBondContact O-N 2.83Å; Q264-S268 PolarHBondContact O-OG 2.92Å
265	K	76.7	Confident	65	Low	122 Å²	122	84.1 Å²	84.1	53%	0.53	46%	0.455	S	S	.	.	H	α-helix	trans	-55.3	-48.6	176.6	-76.7	171	171	174.7	0	111.9	E261 L262 N267 S268 S269	E261-K265 HydrophobicContact CG-CD 4.41Å; E261-K265 WeakPolarHBondContact O-CB 3.41Å; E261-K265 WeakPolarHBondContact O-CG 3.37Å; E261-K265 PolarHBondContact O-N 2.86Å; E261-K265 WeakPolarHBondContact OE1-CE 3.26Å; E261-K265 IonicContact OE1-NZ 2.69Å; E261-K265 PolarHBondContact OE1-NZ 2.88Å; L262-K265 PolarHBondContact O-N 3.22Å; K265-N267 PolarHBondContact O-N 2.81Å; K265-S268 PolarHBondContact O-N 2.87Å; K265-S269 PolarHBondContact O-N 3.39Å; K265-S269 PolarHBondContact O-OG 3.31Å; K265-S269 VanDerWaalsContact O-OG 3.04Å
266	L	71.7	Confident	64.6	Low	37 Å²	37	90.3 Å²	90.3	19%	0.194	48%	0.48	C	S	.	.	H	α-helix	trans	-65.1	-36.1	177.5	-69.3	167.7	0	0	0	112.9	L262 Q264 S269 Y270 L287 Y307 F309	L262-L266 HydrophobicContact CD2-CD1 4.01Å; L262-L266 HydrophobicContact CG-CD1 4.02Å; L262-L266 WeakPolarHBondContact O-CB 3.19Å; L262-L266 VanDerWaalsContact O-CG 3.26Å; L262-L266 WeakPolarHBondContact O-CG 3.47Å; L262-L266 PolarHBondContact O-N 3.18Å; Q264-L266 PolarHBondContact O-N 3.15Å; L266-S269 PolarHBondContact O-N 3.24Å; L266-Y270 WeakPolarHBondContact O-CB 3.38Å; L266-Y270 PolarHBondContact O-N 3.01Å; L266-L287 HydrophobicContact CD1-CD1 4.01Å; L266-Y307 HydrophobicContact CD1-CD2 4.26Å; L266-Y307 HydrophobicContact CD1-CE2 4.18Å; L266-Y307 HydrophobicContact CD2-CE2 4.45Å; L266-F309 HydrophobicContact CB-CD2 3.95Å; L266-F309 HydrophobicContact CB-CE2 3.87Å; L266-F309 HydrophobicContact CB-CZ 4.38Å; L266-F309 HydrophobicContact CD1-CB 4.16Å; L266-F309 HydrophobicContact CD1-CD2 3.93Å; L266-F309 HydrophobicContact CD1-CG 4.24Å
267	N	69.5	Low	63.4	Low	49 Å²	49	96.1 Å²	96.1	26%	0.262	51%	0.508	S	S	.	.	H	α-helix	trans	-65.4	-45.1	175.8	-78.9	-22.8	0	0	0	111.9	L263 Q264 K265 Y270 N271 K285	L263-N267 VanDerWaalsContact O-CB 3.25Å; L263-N267 WeakPolarHBondContact O-CB 3.48Å; L263-N267 PolarHBondContact O-N 2.96Å; L263-N267 PolarHBondContact O-ND2 2.92Å; Q264-N267 PolarHBondContact O-N 3.2Å; Q264-N267 VanDerWaalsContact O-N 3.14Å; K265-N267 PolarHBondContact O-N 2.81Å; N267-Y270 PolarHBondContact O-N 3.2Å; N267-N271 PolarHBondContact O-N 3.28Å; N267-K285 WeakPolarHBondContact OD1-CD 3.26Å
268	S	69.5	Low	62.2	Low	80 Å²	80	95 Å²	95	56%	0.559	50%	0.502	S	S	*	.	H	α-helix	trans	-68.1	-32.6	175.9	-61.7	0	0	0	0	112.9	Q264 K265 Y270 N271	Q264-S268 PolarHBondContact O-N 2.83Å; Q264-S268 PolarHBondContact O-OG 2.92Å; K265-S268 PolarHBondContact O-N 2.87Å; S268-Y270 VanDerWaalsContact C-N 3.26Å; S268-Y270 PolarHBondContact O-N 3Å; S268-N271 CarbonylContact O-C 3.23Å; S268-N271 VanDerWaalsContact O-C 3.23Å; S268-N271 VanDerWaalsContact O-O 3.13Å
269	S	66.2	Low	61.4	Low	102 Å²	102	96.2 Å²	96.2	71%	0.713	51%	0.513	S	S	*	.	H	α-helix	trans	-69.4	-21.6	171.6	-60.3	0	0	0	0	113.6	K265 L266	K265-S269 PolarHBondContact O-N 3.39Å; K265-S269 PolarHBondContact O-OG 3.31Å; K265-S269 VanDerWaalsContact O-OG 3.04Å; L266-S269 PolarHBondContact O-N 3.24Å
270	Y	62.8	Low	60.8	Low	108 Å²	108	102.5 Å²	102.5	42%	0.424	55%	0.546	S	S	.	.	H	α-helix	trans	-97.4	-27.9	179.9	-160.6	-87	0	0	0	113.3	L266 N267 S268 W283 F309 A311	L266-Y270 WeakPolarHBondContact O-CB 3.38Å; L266-Y270 PolarHBondContact O-N 3.01Å; N267-Y270 PolarHBondContact O-N 3.2Å; S268-Y270 VanDerWaalsContact C-N 3.26Å; S268-Y270 PolarHBondContact O-N 3Å; Y270-W283 HydrophobicContact CE1-CD2 4.48Å; Y270-W283 HydrophobicContact CE1-CE3 4.29Å; Y270-W283 WeakPolarHBondContact OH-CZ3 3.16Å; Y270-F309 HydrophobicContact CD2-CE1 4.31Å; Y270-A311 HydrophobicContact CE1-CB 4.26Å; Y270-A311 HydrophobicContact CE2-CB 4.31Å
271	N	61.9	Low	60.3	Low	78 Å²	78	103.9 Å²	103.9	42%	0.417	56%	0.555	S	S	.	*			trans	-124.7	88.9	166.4	-82.1	69	0	0	0	107.8	N267 S268 D273 K285	N267-N271 PolarHBondContact O-N 3.28Å; S268-N271 CarbonylContact O-C 3.23Å; S268-N271 VanDerWaalsContact O-C 3.23Å; S268-N271 VanDerWaalsContact O-O 3.13Å; N271-D273 VanDerWaalsContact C-N 3.26Å; N271-K285 PolarHBondContact OD1-NZ 3.04Å
272	P	56.6	Low	59.7	Low	102 Å²	102	102.8 Å²	102.8	66%	0.662	56%	0.559	S	S	*	*	S	Bend	trans	-66.1	-36.8	167.8	27.8	-32.9	0	0	0	110.2	G274	P272-G274 PolarHBondContact O-N 3.04Å
273	D	54.3	Low	59.4	Low	120 Å²	120	105.7 Å²	105.7	64%	0.642	57%	0.567	S	S	*	*	S	Bend	trans	-79	106	174.8	-47.2	-52.1	0	0	0	108.7	N271 E275	N271-D273 VanDerWaalsContact C-N 3.26Å; D273-E275 PolarHBondContact O-N 3.14Å; D273-E275 VanDerWaalsContact O-N 3.16Å
274	G	50.7	Low	59.2	Low	82 Å²	82	107.6 Å²	107.6	85%	0.845	58%	0.575	S	S	*	*			trans	-70.9	-2.1	-174.8	0	0	0	0	0	115.1	P272	P272-G274 PolarHBondContact O-N 3.04Å
275	E	40.4	Very low	59.1	Low	155 Å²	155	104.4 Å²	104.4	72%	0.724	56%	0.559	S	S	*	*			trans	-128.4	129.4	-178.4	-61.4	-174.7	114.2	0	0	110.2	D273	D273-E275 PolarHBondContact O-N 3.14Å; D273-E275 VanDerWaalsContact O-N 3.16Å
276	Y	45.4	Very low	58.7	Low	222 Å²	222	100 Å²	100	87%	0.871	54%	0.544	S	S	*	.				-163.4	111.8	120	-112	-67.7	0	0	0	110.3	N278	Y276-N278 PolarHBondContact O-N 2.7Å
277	N	40.5	Very low	58.6	Low	155 Å²	155	98.7 Å²	98.7	83%	0.829	54%	0.537	S	S	*	.			trans	-67.9	101.9	170.7	-72.7	-56.2	0	0	0	109.5
278	N	44.5	Very low	58.8	Low	116 Å²	116	98.3 Å²	98.3	62%	0.62	54%	0.535	S	S	*	.			trans	-152.7	116.6	163	-142.1	-27.8	0	0	0	110.8	Y276 N280 N281	Y276-N278 PolarHBondContact O-N 2.7Å; N278-N280 PolarHBondContact O-N 3.04Å; N278-N281 PolarHBondContact O-N 3.43Å
279	N	52.7	Low	58.9	Low	155 Å²	155	95.3 Å²	95.3	83%	0.829	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	0.4	-162.7	-72	-18.8	0	0	0	115.6
280	N	53.6	Low	59.1	Low	134 Å²	134	91.8 Å²	91.8	72%	0.717	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	5.6	-174.6	-61.4	-5	0	0	0	113.9	N278	N278-N280 PolarHBondContact O-N 3.04Å
281	N	56.7	Low	59.3	Low	92 Å²	92	90.2 Å²	90.2	49%	0.492	48%	0.482	S	S	.	.			trans	-130.8	45.1	-177	-89	-37	0	0	0	113.1	N278 W283 Q313	N278-N281 PolarHBondContact O-N 3.43Å; N281-W283 PolarHBondContact O-N 2.8Å; N281-Q313 PolarHBondContact OD1-NE2 3.16Å
282	A	63.9	Low	59.4	Low	55 Å²	55	89.3 Å²	89.3	46%	0.455	48%	0.479	S	S	.	.			trans	-69.8	99.1	-179.8	0	0	0	0	0	112	H284 L314	A282-H284 PolarHBondContact O-N 3.48Å; A282-L314 HydrophobicContact CB-CB 4.37Å; A282-L314 HydrophobicContact CB-CD1 4.08Å; A282-L314 WeakPolarHBondContact O-CB 3.43Å; A282-L314 VanDerWaalsContact O-CG 3.23Å; A282-L314 WeakPolarHBondContact O-CG 3.23Å; A282-L314 PolarHBondContact O-N 2.62Å
283	W	66	Low	59.7	Low	103 Å²	103	87 Å²	87	39%	0.39	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	110.5	173.5	-77.3	84.6	0	0	0	111.5	Y270 N281 K285 A311 R312 Q313	Y270-W283 HydrophobicContact CE1-CD2 4.48Å; Y270-W283 HydrophobicContact CE1-CE3 4.29Å; Y270-W283 WeakPolarHBondContact OH-CZ3 3.16Å; N281-W283 PolarHBondContact O-N 2.8Å; W283-K285 PolarHBondContact O-N 2.92Å; W283-A311 HydrophobicContact CE3-CB 4.05Å; W283-A311 HydrophobicContact CZ3-CB 4.33Å; W283-R312 CarbonylContact C-O 3.41Å; W283-R312 WeakPolarHBondContact CA-O 3.5Å; W283-Q313 HydrophobicContact CD2-CB 4.08Å; W283-Q313 HydrophobicContact CE3-CB 4.22Å; W283-Q313 VanDerWaalsContact CE3-N 3.28Å; W283-Q313 HydrophobicContact CH2-CB 4.01Å; W283-Q313 HydrophobicContact CZ2-CB 3.85Å; W283-Q313 HydrophobicContact CZ2-CG 4.22Å; W283-Q313 HydrophobicContact CZ3-CB 4.19Å
284	H	68.5	Low	59.7	Low	74 Å²	74	87 Å²	87	34%	0.343	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	110.4	169.1	178.1	102.3	0	0	0	109.7	A282 R312 L314	A282-H284 PolarHBondContact O-N 3.48Å; H284-R312 HydrophobicContact CB-CG 3.88Å; H284-R312 PolarHBondContact CD2-NE 2.93Å; H284-R312 PolarHBondContact CD2-NH2 2.93Å; H284-R312 VanDerWaalsContact CD2-NH2 3.29Å; H284-R312 PolarHBondContact CE1-NH2 2.93Å; H284-R312 PolarHBondContact N-O 3.48Å; H284-R312 PolarHBondContact NE2-NH2 3.07Å; H284-R312 PolarHBondContact O-N 3.43Å; H284-L314 HydrophobicContact CB-CD1 4.28Å; H284-L314 HydrophobicContact CB-CD2 4.11Å; H284-L314 HydrophobicContact CB-CG 4.12Å
285	K	68.2	Low	59.8	Low	52 Å²	52	89.9 Å²	89.9	23%	0.226	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	140	176	-58.2	179.4	-176.8	178.9	0	110	N267 N271 W283 F309 V310 A311	N267-K285 WeakPolarHBondContact OD1-CD 3.26Å; N271-K285 PolarHBondContact OD1-NZ 3.04Å; W283-K285 PolarHBondContact O-N 2.92Å; K285-F309 HydrophobicContact CB-CE2 4.39Å; K285-F309 HydrophobicContact CB-CZ 4.3Å; K285-F309 HydrophobicContact CD-CZ 4.26Å; K285-F309 HydrophobicContact CG-CZ 4.38Å; K285-V310 CarbonylContact C-O 3.58Å; K285-V310 WeakPolarHBondContact CA-O 3.43Å; K285-A311 HydrophobicContact CG-CB 4.15Å
286	S	70.2	Confident	60.5	Low	30 Å²	30	91.1 Å²	91.1	21%	0.21	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	146.1	-178.5	62.9	0	0	0	0	111.5	V310	S286-V310 PolarHBondContact N-O 3.42Å; S286-V310 PolarHBondContact O-N 2.94Å; S286-V310 PolarHBondContact OG-O 2.83Å
287	L	69.1	Low	60.8	Low	9 Å²	9	81.7 Å²	81.7	5%	0.047	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	130.8	178	-178.9	69.1	0	0	0	109.5	L262 L263 L266 L289 Y307 F309	L262-L287 HydrophobicContact CB-CD2 4.46Å; L262-L287 HydrophobicContact CD2-CD1 4.09Å; L262-L287 HydrophobicContact CD2-CD2 3.9Å; L263-L287 HydrophobicContact CB-CD2 4.05Å; L263-L287 HydrophobicContact CD1-CB 4.12Å; L266-L287 HydrophobicContact CD1-CD1 4.01Å; L287-L289 HydrophobicContact CD2-CD1 4.49Å; L287-Y307 HydrophobicContact CD1-CD2 4.22Å; L287-F309 HydrophobicContact CD1-CB 4.36Å
288	I	72.9	Confident	61.8	Low	41 Å²	41	78 Å²	78	21%	0.21	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	114.8	176.9	-71.3	171.3	0	0	0	107.7	L290 I300 Y307 M308	I288-L290 HydrophobicContact CG2-CD2 4.37Å; I288-I300 HydrophobicContact CD1-CD1 4.48Å; I288-I300 HydrophobicContact CG2-CB 4.38Å; I288-I300 HydrophobicContact CG2-CD1 3.88Å; I288-I300 HydrophobicContact CG2-CG1 3.69Å; I288-I300 HydrophobicContact CG2-CG2 4.05Å; I288-Y307 CarbonylContact O-C 3.57Å; I288-M308 HydrophobicContact CB-CB 4.39Å; I288-M308 HydrophobicContact CB-CE 4.08Å; I288-M308 HydrophobicContact CD1-CE 3.69Å; I288-M308 HydrophobicContact CG1-CE 4.45Å; I288-M308 HydrophobicContact CG2-CE 4.11Å; I288-M308 PolarHBondContact N-O 3.4Å; I288-M308 PolarHBondContact O-N 3.39Å
289	L	71.1	Confident	62.7	Low	17 Å²	17	75.5 Å²	75.5	9%	0.089	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	139.2	173.2	-75.4	156	0	0	0	109.8	S259 L287 I300 N301 D302	S259-L289 VanDerWaalsContact CB-CD1 3.44Å; L287-L289 HydrophobicContact CD2-CD1 4.49Å; L289-I300 WeakPolarHBondContact O-CA 3.33Å; L289-N301 WeakPolarHBondContact CB-O 3.41Å; L289-N301 PolarHBondContact O-N 3.17Å; L289-D302 VanDerWaalsContact CD1-O 3.26Å; L289-D302 WeakPolarHBondContact CD1-O 3.36Å
290	L	71.7	Confident	63.4	Low	28 Å²	28	70.6 Å²	70.6	15%	0.147	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	107.3	-177.3	-70.1	174.9	0	0	0	110.3	I288 R299 I300 I306	I288-L290 HydrophobicContact CG2-CD2 4.37Å; L290-R299 CarbonylContact C-O 3.57Å; L290-R299 WeakPolarHBondContact CA-O 3.45Å; L290-I300 HydrophobicContact CD2-CG1 4.1Å; L290-I306 HydrophobicContact CB-CB 4.16Å; L290-I306 HydrophobicContact CB-CG2 4.31Å; L290-I306 HydrophobicContact CD1-CG2 4.13Å; L290-I306 PolarHBondContact N-O 3.43Å
291	Q	67.4	Low	64	Low	75 Å²	75	67.2 Å²	67.2	35%	0.35	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	133	173.4	-154.3	178.3	13.3	0	0	110.6	D293 R299 N301 I303	Q291-D293 PolarHBondContact O-N 3.48Å; Q291-R299 PolarHBondContact N-O 2.95Å; Q291-R299 PolarHBondContact O-N 3.32Å; Q291-N301 HydrophobicContact CB-CB 4.16Å; Q291-N301 PolarHBondContact OE1-ND2 3.21Å; Q291-I303 WeakPolarHBondContact CB-O 3.5Å
292	T	63.5	Low	64.4	Low	59 Å²	59	65.4 Å²	65.4	36%	0.362	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	89	178.5	54.4	0	0	0	0	111.6	F294	T292-F294 PolarHBondContact O-N 2.91Å
293	D	61.9	Low	64.3	Low	52 Å²	52	66.5 Å²	66.5	28%	0.278	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	109	168.1	-178.9	-23.1	0	0	0	110.2	Q291 I295 R296 G297 R299	Q291-D293 PolarHBondContact O-N 3.48Å; D293-I295 PolarHBondContact O-N 3.04Å; D293-I295 WeakPolarHBondContact OD1-CA 3.45Å; D293-I295 WeakPolarHBondContact OD1-CB 3.35Å; D293-I295 PolarHBondContact OD1-N 3.43Å; D293-R296 HydrophobicContact CB-CB 4.35Å; D293-R296 PolarHBondContact OD1-N 3.14Å; D293-R296 VanDerWaalsContact OD2-CB 3.26Å; D293-R296 WeakPolarHBondContact OD2-CB 3.45Å; D293-R296 VanDerWaalsContact OD2-CD 3.27Å; D293-R296 WeakPolarHBondContact OD2-CD 3.49Å; D293-R296 WeakPolarHBondContact OD2-CG 3.41Å; D293-G297 WeakPolarHBondContact CB-O 3.4Å; D293-G297 CarbonylContact O-C 3.58Å; D293-G297 WeakPolarHBondContact O-CA 3.25Å; D293-G297 PolarHBondContact O-N 3.47Å; D293-R299 HydrophobicContact CB-CG 4.18Å
294	F	53.8	Low	64.4	Low	120 Å²	120	63 Å²	63	53%	0.526	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-18.6	-178.1	-55.6	-73.9	0	0	0	114	Q145 K173 T292	Q145-F294 HydrophobicContact CG-CD1 4.17Å; Q145-F294 HydrophobicContact CG-CE1 3.94Å; Q145-F294 HydrophobicContact CG-CE2 4.45Å; Q145-F294 HydrophobicContact CG-CZ 4.1Å; K173-F294 PolarHBondContact NZ-O 2.96Å; T292-F294 PolarHBondContact O-N 2.91Å
295	I	54	Low	64.5	Low	143 Å²	143	64.4 Å²	64.4	73%	0.733	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-56.9	175.6	-57.5	177.7	0	0	0	109.2	K173 D293	K173-I295 PolarHBondContact NZ-O 2.71Å; D293-I295 PolarHBondContact O-N 3.04Å; D293-I295 WeakPolarHBondContact OD1-CA 3.45Å; D293-I295 WeakPolarHBondContact OD1-CB 3.35Å; D293-I295 PolarHBondContact OD1-N 3.43Å
296	R	54.6	Low	64.7	Low	181 Å²	181	66.2 Å²	66.2	68%	0.683	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	1.3	-167.9	-53.3	-179	170.1	-170.5	-3.7	115.7	D293 R299	D293-R296 HydrophobicContact CB-CB 4.35Å; D293-R296 PolarHBondContact OD1-N 3.14Å; D293-R296 VanDerWaalsContact OD2-CB 3.26Å; D293-R296 WeakPolarHBondContact OD2-CB 3.45Å; D293-R296 VanDerWaalsContact OD2-CD 3.27Å; D293-R296 WeakPolarHBondContact OD2-CD 3.49Å; D293-R296 WeakPolarHBondContact OD2-CG 3.41Å; R296-R299 PolarHBondContact O-NH2 2.88Å
297	G	52.3	Low	64.9	Low	24 Å²	24	70.9 Å²	70.9	25%	0.247	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80.1	169.7	-173.8	0	0	0	0	0	112.4	D293	D293-G297 WeakPolarHBondContact CB-O 3.4Å; D293-G297 CarbonylContact O-C 3.58Å; D293-G297 WeakPolarHBondContact O-CA 3.25Å; D293-G297 PolarHBondContact O-N 3.47Å
298	P	61	Low	65.2	Low	79 Å²	79	74.2 Å²	74.2	51%	0.513	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	140.1	-179.4	-25.5	34.9	0	0	0	112.9
299	R	63.6	Low	65.3	Low	63 Å²	63	74.8 Å²	74.8	24%	0.238	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	137	-177.5	-65.6	-70.8	150.2	171.2	-10.1	110.1	Q243 L290 Q291 D293 R296 N301	Q243-R299 VanDerWaalsContact OE1-CZ 3.28Å; L290-R299 CarbonylContact C-O 3.57Å; L290-R299 WeakPolarHBondContact CA-O 3.45Å; Q291-R299 PolarHBondContact N-O 2.95Å; Q291-R299 PolarHBondContact O-N 3.32Å; D293-R299 HydrophobicContact CB-CG 4.18Å; R296-R299 PolarHBondContact O-NH2 2.88Å; R299-N301 PolarHBondContact O-N 3.4Å
300	I	68.3	Low	65.5	Low	51 Å²	51	76.7 Å²	76.7	26%	0.262	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	130	158.1	-63.1	-179.6	0	0	0	107.1	I242 K244 I288 L289 L290	I242-I300 HydrophobicContact CG2-CD1 3.65Å; I242-I300 HydrophobicContact CG2-CG1 3.55Å; K244-I300 HydrophobicContact CG-CD1 4.18Å; I288-I300 HydrophobicContact CD1-CD1 4.48Å; I288-I300 HydrophobicContact CG2-CB 4.38Å; I288-I300 HydrophobicContact CG2-CD1 3.88Å; I288-I300 HydrophobicContact CG2-CG1 3.69Å; I288-I300 HydrophobicContact CG2-CG2 4.05Å; L289-I300 WeakPolarHBondContact O-CA 3.33Å; L290-I300 HydrophobicContact CD2-CG1 4.1Å
301	N	65.2	Low	65.5	Low	64 Å²	64	76.7 Å²	76.7	34%	0.342	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	-175.1	170.1	-150	12.8	0	0	0	110.4	L289 Q291 R299 I303	L289-N301 WeakPolarHBondContact CB-O 3.41Å; L289-N301 PolarHBondContact O-N 3.17Å; Q291-N301 HydrophobicContact CB-CB 4.16Å; Q291-N301 PolarHBondContact OE1-ND2 3.21Å; R299-N301 PolarHBondContact O-N 3.4Å; N301-I303 VanDerWaalsContact C-N 3.34Å
302	D	65.3	Low	65.7	Low	54 Å²	54	79.6 Å²	79.6	29%	0.289	41%	0.406	S	S	.	.	S	Bend	trans	-85.4	-5.8	172.9	69.6	-42.6	0	0	0	113.9	R254 S256 L289	R254-D302 WeakPolarHBondContact O-CB 3.37Å; S256-D302 PolarHBondContact OG-O 3.25Å; L289-D302 VanDerWaalsContact CD1-O 3.26Å; L289-D302 WeakPolarHBondContact CD1-O 3.36Å
303	I	62.5	Low	66.1	Low	77 Å²	77	81.2 Å²	81.2	40%	0.395	41%	0.409	S	S	.	.			trans	-137.4	140.1	179.7	57.7	175.6	0	0	0	110.5	Q291 N301	Q291-I303 WeakPolarHBondContact CB-O 3.5Å; N301-I303 VanDerWaalsContact C-N 3.34Å
304	G	68.2	Low	66.4	Low	29 Å²	29	82.6 Å²	82.6	30%	0.299	42%	0.416	S	S	.	.			trans	176.9	151.6	175.8	0	0	0	0	0	113.3	I306	G304-I306 PolarHBondContact O-N 2.93Å
305	P	70.1	Confident	66.7	Low	104 Å²	104	89.5 Å²	89.5	68%	0.675	45%	0.446	S	S	*	.	S	Bend	trans	-75.7	-7.3	176.6	32.7	-37	0	0	0	113.5
306	I	72.1	Confident	67.3	Low	90 Å²	90	86.9 Å²	86.9	46%	0.462	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	132.8	178.7	-61.9	169.2	0	0	0	107.1	L290 G304	L290-I306 HydrophobicContact CB-CB 4.16Å; L290-I306 HydrophobicContact CB-CG2 4.31Å; L290-I306 HydrophobicContact CD1-CG2 4.13Å; L290-I306 PolarHBondContact N-O 3.43Å; G304-I306 PolarHBondContact O-N 2.93Å
307	Y	73.6	Confident	68	Low	128 Å²	128	81.9 Å²	81.9	50%	0.502	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	152.1	173.2	66.8	-89.8	0	0	0	110.8	L262 L266 L287 I288	L262-Y307 HydrophobicContact CD2-CD1 4.21Å; L262-Y307 HydrophobicContact CD2-CD2 4.33Å; L262-Y307 HydrophobicContact CD2-CG 3.98Å; L266-Y307 HydrophobicContact CD1-CD2 4.26Å; L266-Y307 HydrophobicContact CD1-CE2 4.18Å; L266-Y307 HydrophobicContact CD2-CE2 4.45Å; L287-Y307 HydrophobicContact CD1-CD2 4.22Å; I288-Y307 CarbonylContact O-C 3.57Å
308	M	75.6	Confident	68.8	Low	80 Å²	80	85.1 Å²	85.1	39%	0.394	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	108.7	173	-176.7	176.4	71.1	0	0	107.7	I288 V310	I288-M308 HydrophobicContact CB-CB 4.39Å; I288-M308 HydrophobicContact CB-CE 4.08Å; I288-M308 HydrophobicContact CD1-CE 3.69Å; I288-M308 HydrophobicContact CG1-CE 4.45Å; I288-M308 HydrophobicContact CG2-CE 4.11Å; I288-M308 PolarHBondContact N-O 3.4Å; I288-M308 PolarHBondContact O-N 3.39Å; M308-V310 HydrophobicContact CE-CG2 4.38Å; M308-V310 HydrophobicContact CG-CG2 4.09Å
309	F	76	Confident	69.3	Low	52 Å²	52	85.5 Å²	85.5	23%	0.228	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	130.4	174.3	179.1	-99.1	0	0	0	109.1	L263 L266 Y270 K285 L287 A311	L263-F309 HydrophobicContact CD1-CE2 4.27Å; L266-F309 HydrophobicContact CB-CD2 3.95Å; L266-F309 HydrophobicContact CB-CE2 3.87Å; L266-F309 HydrophobicContact CB-CZ 4.38Å; L266-F309 HydrophobicContact CD1-CB 4.16Å; L266-F309 HydrophobicContact CD1-CD2 3.93Å; L266-F309 HydrophobicContact CD1-CG 4.24Å; Y270-F309 HydrophobicContact CD2-CE1 4.31Å; K285-F309 HydrophobicContact CB-CE2 4.39Å; K285-F309 HydrophobicContact CB-CZ 4.3Å; K285-F309 HydrophobicContact CD-CZ 4.26Å; K285-F309 HydrophobicContact CG-CZ 4.38Å; L287-F309 HydrophobicContact CD1-CB 4.36Å; F309-A311 HydrophobicContact CE1-CB 4.01Å; F309-A311 HydrophobicContact CZ-CB 4.46Å
310	V	74.4	Confident	69.7	Low	57 Å²	57	86.9 Å²	86.9	35%	0.345	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	112.4	-179.5	-177.2	0	0	0	0	108.7	K285 S286 M308	K285-V310 CarbonylContact C-O 3.58Å; K285-V310 WeakPolarHBondContact CA-O 3.43Å; S286-V310 PolarHBondContact N-O 3.42Å; S286-V310 PolarHBondContact O-N 2.94Å; S286-V310 PolarHBondContact OG-O 2.83Å; M308-V310 HydrophobicContact CE-CG2 4.38Å; M308-V310 HydrophobicContact CG-CG2 4.09Å
311	A	72.8	Confident	69.8	Low	28 Å²	28	89.3 Å²	89.3	23%	0.231	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.8	166.8	0	0	0	0	0	109	Y270 W283 K285 F309	Y270-A311 HydrophobicContact CE1-CB 4.26Å; Y270-A311 HydrophobicContact CE2-CB 4.31Å; W283-A311 HydrophobicContact CE3-CB 4.05Å; W283-A311 HydrophobicContact CZ3-CB 4.33Å; K285-A311 HydrophobicContact CG-CB 4.15Å; F309-A311 HydrophobicContact CE1-CB 4.01Å; F309-A311 HydrophobicContact CZ-CB 4.46Å
312	R	70.7	Confident	70.1	Confident	136 Å²	136	91.1 Å²	91.1	51%	0.513	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	132.9	174	61.6	-177.5	168	154.6	-1.5	110	W283 H284 L314	W283-R312 CarbonylContact C-O 3.41Å; W283-R312 WeakPolarHBondContact CA-O 3.5Å; H284-R312 HydrophobicContact CB-CG 3.88Å; H284-R312 PolarHBondContact CD2-NE 2.93Å; H284-R312 PolarHBondContact CD2-NH2 2.93Å; H284-R312 VanDerWaalsContact CD2-NH2 3.29Å; H284-R312 PolarHBondContact CE1-NH2 2.93Å; H284-R312 PolarHBondContact N-O 3.48Å; H284-R312 PolarHBondContact NE2-NH2 3.07Å; H284-R312 PolarHBondContact O-N 3.43Å; R312-L314 PolarHBondContact O-N 3.29Å
313	Q	72.4	Confident	70.4	Confident	93 Å²	93	93.9 Å²	93.9	44%	0.435	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	126.2	167.8	-165.2	178.9	15.7	0	0	107.8	N281 W283	N281-Q313 PolarHBondContact OD1-NE2 3.16Å; W283-Q313 HydrophobicContact CD2-CB 4.08Å; W283-Q313 HydrophobicContact CE3-CB 4.22Å; W283-Q313 VanDerWaalsContact CE3-N 3.28Å; W283-Q313 HydrophobicContact CH2-CB 4.01Å; W283-Q313 HydrophobicContact CZ2-CB 3.85Å; W283-Q313 HydrophobicContact CZ2-CG 4.22Å; W283-Q313 HydrophobicContact CZ3-CB 4.19Å
314	L	67.5	Low	71.1	Confident	82 Å²	82	95.3 Å²	95.3	43%	0.429	47%	0.472	S	S	.	.			trans	-76.6	132.1	163.2	-58.3	174.2	0	0	0	107.3	A282 H284 R312	A282-L314 HydrophobicContact CB-CB 4.37Å; A282-L314 HydrophobicContact CB-CD1 4.08Å; A282-L314 WeakPolarHBondContact O-CB 3.43Å; A282-L314 VanDerWaalsContact O-CG 3.23Å; A282-L314 WeakPolarHBondContact O-CG 3.23Å; A282-L314 PolarHBondContact O-N 2.62Å; H284-L314 HydrophobicContact CB-CD1 4.28Å; H284-L314 HydrophobicContact CB-CD2 4.11Å; H284-L314 HydrophobicContact CB-CG 4.12Å; R312-L314 PolarHBondContact O-N 3.29Å
315	K	60	Low	71.4	Confident	265 Å²	265	101.4 Å²	101.4	100%	1.152	49%	0.488	S	S	*	.			trans	-100.7	0	170.7	-71.3	-171.3	174.9	-172	0	109.4

Retrieved 315 of 315 residues in 276.7 ms (Link to these results)

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