A0A077Z2E5_TRITR Loading...

WD repeat-containing protein 79

AlphaFold DB , UniProt , Accession A0A077Z2E5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 589 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	35.1	Very low	33.7	Very low	223 Å²	223	171.1 Å²	171.1	100%	1.099	82%	0.817	S	S	*	*				0	122.4	0	-70.9	-171.4	170.2	0	0	108.2	H3	M1-H3 PolarHBondContact O-N 3.37Å
2	P	34.8	Very low	34.6	Very low	125 Å²	125	170.1 Å²	170.1	81%	0.812	82%	0.818	S	S	*	*			trans	-72.4	117.4	-174.9	29.3	-29.8	0	0	0	108.8	T4	P2-T4 PolarHBondContact O-N 3.48Å
3	H	31.9	Very low	34.9	Very low	184 Å²	184	162.1 Å²	162.1	85%	0.852	79%	0.786	S	S	*	*			trans	-59.3	97.3	175.2	-68.8	-84.3	0	0	0	109.7	M1 K5	M1-H3 PolarHBondContact O-N 3.37Å; H3-K5 PolarHBondContact O-N 3.41Å
4	T	35.1	Very low	34.9	Very low	124 Å²	124	156.7 Å²	156.7	76%	0.761	77%	0.771	S	S	*	*			trans	-64.3	106.5	168.1	43	0	0	0	0	107.7	P2 R6	P2-T4 PolarHBondContact O-N 3.48Å; T4-R6 PolarHBondContact O-N 2.91Å
5	K	29.8	Very low	36	Very low	206 Å²	206	148.3 Å²	148.3	90%	0.896	73%	0.73	S	S	*	*			trans	-55.2	101.1	173.4	-74.7	-178.6	176.3	177.4	0	108.4	H3 K7	H3-K5 PolarHBondContact O-N 3.41Å; K5-K7 PolarHBondContact O-N 3.12Å
6	R	34.7	Very low	36.3	Very low	206 Å²	206	143.3 Å²	143.3	78%	0.777	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-60.8	116	177.9	-74.2	-176.6	177.6	-172	-0.1	108.9	T4 K8 E441	T4-R6 PolarHBondContact O-N 2.91Å; R6-K8 PolarHBondContact O-N 2.83Å; R6-E441 IonicContact NH1-OE2 2.79Å
7	K	31.2	Very low	36.5	Very low	209 Å²	209	139.1 Å²	139.1	91%	0.909	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-66	123.3	173.7	-77.3	-178.9	175.8	176.8	0	108.9	K5	K5-K7 PolarHBondContact O-N 3.12Å
8	K	31	Very low	37	Very low	200 Å²	200	132.9 Å²	132.9	87%	0.87	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-60.5	138.5	172.4	-76.7	-176.7	174.6	-178.1	0	110.1	R6 R10	R6-K8 PolarHBondContact O-N 2.83Å; K8-R10 PolarHBondContact O-N 2.84Å
9	A	38.3	Very low	37.3	Very low	76 Å²	76	129 Å²	129	63%	0.628	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-55.1	126.1	176.2	0	0	0	0	0	110.3
10	R	33.5	Very low	37.5	Very low	232 Å²	232	129.9 Å²	129.9	88%	0.875	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-95.7	124.4	170.3	-80.2	-176.6	173.9	178.7	-3	107.8	K8 L12	K8-R10 PolarHBondContact O-N 2.84Å; R10-L12 PolarHBondContact O-N 2.78Å
11	L	35.5	Very low	37.7	Very low	97 Å²	97	128.5 Å²	128.5	51%	0.508	65%	0.646	S	S	.	*	P	Polyproline II helix	trans	-60.2	123.1	165.5	-80	146.7	0	0	0	108.2	T13 I15	L11-T13 VanDerWaalsContact C-N 3.35Å; L11-I15 HydrophobicContact CD2-CD1 4.27Å; L11-I15 HydrophobicContact CD2-CG1 4.25Å
12	L	44.6	Very low	37.9	Very low	159 Å²	159	118.9 Å²	118.9	83%	0.832	60%	0.602	S	S	*	*	S	Bend	trans	-80.1	-18.6	177.4	-84.2	159.6	0	0	0	112.3	R10	R10-L12 PolarHBondContact O-N 2.78Å
13	T	37.6	Very low	37.9	Very low	66 Å²	66	118.5 Å²	118.5	41%	0.405	59%	0.592	S	S	.	*	S	Bend	trans	-148.2	144	174.6	42.5	0	0	0	0	111.3	L11 I15	L11-T13 VanDerWaalsContact C-N 3.35Å; T13-I15 PolarHBondContact O-N 3.34Å
14	P	35.7	Very low	38.1	Very low	87 Å²	87	112.2 Å²	112.2	57%	0.565	57%	0.572	S	S	*	*			trans	-66.8	125.1	172.7	-16.9	30.9	0	0	0	110.7	S16 C17	P14-S16 PolarHBondContact O-N 3.05Å; P14-C17 PolarHBondContact O-N 3.19Å
15	I	50.5	Low	38.1	Very low	31 Å²	31	109.4 Å²	109.4	16%	0.159	56%	0.558	C	S	.	*	H	α-helix	trans	-52.6	-26.3	-178.8	-62.5	162.7	0	0	0	112.6	L11 T13 C17 V18 L19 M438	L11-I15 HydrophobicContact CD2-CD1 4.27Å; L11-I15 HydrophobicContact CD2-CG1 4.25Å; T13-I15 PolarHBondContact O-N 3.34Å; I15-C17 PolarHBondContact O-N 3.47Å; I15-C17 VanDerWaalsContact O-N 3.14Å; I15-V18 PolarHBondContact O-N 3.07Å; I15-V18 VanDerWaalsContact O-N 3.11Å; I15-L19 HydrophobicContact CG2-CD1 3.65Å; I15-L19 HydrophobicContact CG2-CG 3.87Å; I15-L19 PolarHBondContact O-N 3.13Å; I15-M438 HydrophobicContact CD1-CE 3.39Å; I15-M438 HydrophobicContact CG1-CE 4.14Å
16	S	41.4	Very low	38.3	Very low	67 Å²	67	103.6 Å²	103.6	47%	0.469	54%	0.543	S	S	.	.	H	α-helix	trans	-56	-29.6	176.8	56.8	0	0	0	0	113.3	P14 K20	P14-S16 PolarHBondContact O-N 3.05Å; S16-K20 VanDerWaalsContact O-CB 3.23Å; S16-K20 WeakPolarHBondContact O-CB 3.3Å; S16-K20 WeakPolarHBondContact O-CG 3.47Å; S16-K20 PolarHBondContact O-N 3.09Å
17	C	40.4	Very low	38.3	Very low	73 Å²	73	97.2 Å²	97.2	49%	0.493	53%	0.534	S	S	.	.	H	α-helix	trans	-73.8	-42.1	177.9	-60.5	0	0	0	0	111.5	P14 I15 K20 D21	P14-C17 PolarHBondContact O-N 3.19Å; I15-C17 PolarHBondContact O-N 3.47Å; I15-C17 VanDerWaalsContact O-N 3.14Å; C17-K20 PolarHBondContact O-N 2.92Å; C17-D21 PolarHBondContact O-N 3.23Å
18	V	44.9	Very low	38.2	Very low	28 Å²	28	92.9 Å²	92.9	17%	0.17	53%	0.525	C	S	.	.	H	α-helix	trans	-67.5	-41	178.5	-174.4	0	0	0	0	111.2	I15 A22 M433	I15-V18 PolarHBondContact O-N 3.07Å; I15-V18 VanDerWaalsContact O-N 3.11Å; V18-A22 PolarHBondContact O-N 3.05Å; V18-M433 HydrophobicContact CB-CE 4.45Å; V18-M433 HydrophobicContact CG1-CE 3.94Å; V18-M433 HydrophobicContact CG2-CE 3.6Å; V18-M433 HydrophobicContact CG2-SD 4.3Å
19	L	41.6	Very low	38.2	Very low	58 Å²	58	90.5 Å²	90.5	30%	0.304	52%	0.521	S	S	.	.	H	α-helix	trans	-73.1	-30.4	177.5	-70.2	177.3	0	0	0	113	I15 A22 L23 R475	I15-L19 HydrophobicContact CG2-CD1 3.65Å; I15-L19 HydrophobicContact CG2-CG 3.87Å; I15-L19 PolarHBondContact O-N 3.13Å; L19-A22 PolarHBondContact O-N 3.48Å; L19-L23 WeakPolarHBondContact O-CB 3.46Å; L19-L23 WeakPolarHBondContact O-CG 3.25Å; L19-L23 PolarHBondContact O-N 3.15Å; L19-R475 HydrophobicContact CD1-CG 4.45Å
20	K	43	Very low	37.7	Very low	146 Å²	146	92.8 Å²	92.8	64%	0.635	53%	0.531	S	S	*	.	H	α-helix	trans	-65.4	-39.5	174.6	-86.2	179.2	178.9	-172.1	0	111.6	S16 C17 L23 A24	S16-K20 VanDerWaalsContact O-CB 3.23Å; S16-K20 WeakPolarHBondContact O-CB 3.3Å; S16-K20 WeakPolarHBondContact O-CG 3.47Å; S16-K20 PolarHBondContact O-N 3.09Å; C17-K20 PolarHBondContact O-N 2.92Å; K20-L23 PolarHBondContact O-N 3.06Å; K20-A24 VanDerWaalsContact O-CB 3.31Å; K20-A24 WeakPolarHBondContact O-CB 3.32Å; K20-A24 PolarHBondContact O-N 2.88Å
21	D	40.4	Very low	37.4	Very low	101 Å²	101	84.8 Å²	84.8	54%	0.54	52%	0.52	S	S	.	.	H	α-helix	trans	-70.4	-34.8	178	-70.3	-14.3	0	0	0	112.2	C17 A24 S25	C17-D21 PolarHBondContact O-N 3.23Å; D21-A24 PolarHBondContact O-N 2.73Å; D21-S25 PolarHBondContact O-N 3.32Å; D21-S25 VanDerWaalsContact O-N 3.08Å; D21-S25 PolarHBondContact O-OG 2.91Å
22	A	39.1	Very low	37	Very low	22 Å²	22	87.9 Å²	87.9	18%	0.182	54%	0.537	C	S	.	.	H	α-helix	trans	-64.1	-43.1	172.1	0	0	0	0	0	111.7	V18 L19 S25 S26	V18-A22 PolarHBondContact O-N 3.05Å; L19-A22 PolarHBondContact O-N 3.48Å; A22-S25 PolarHBondContact O-N 2.85Å; A22-S25 PolarHBondContact O-OG 2.94Å; A22-S26 PolarHBondContact O-N 3.03Å
23	L	35.9	Very low	36.3	Very low	117 Å²	117	89.6 Å²	89.6	61%	0.613	54%	0.541	S	S	*	.	H	α-helix	trans	-71.1	-35.7	176.9	-73.8	167.3	0	0	0	112.8	L19 K20 S25 S26 A27	L19-L23 WeakPolarHBondContact O-CB 3.46Å; L19-L23 WeakPolarHBondContact O-CG 3.25Å; L19-L23 PolarHBondContact O-N 3.15Å; K20-L23 PolarHBondContact O-N 3.06Å; L23-S25 VanDerWaalsContact C-N 3.33Å; L23-S25 PolarHBondContact O-N 3Å; L23-S26 WeakPolarHBondContact CA-OG 2.93Å; L23-S26 PolarHBondContact O-N 3.07Å; L23-S26 VanDerWaalsContact O-N 3.13Å; L23-S26 PolarHBondContact O-OG 3.44Å; L23-A27 PolarHBondContact O-N 2.74Å; L23-A27 VanDerWaalsContact O-N 3.07Å
24	A	35.3	Very low	35.8	Very low	52 Å²	52	95.2 Å²	95.2	43%	0.43	56%	0.563	S	S	.	*	H	α-helix	trans	-62.8	-41.3	175	0	0	0	0	0	110.8	K20 D21 S26 A27 T28	K20-A24 VanDerWaalsContact O-CB 3.31Å; K20-A24 WeakPolarHBondContact O-CB 3.32Å; K20-A24 PolarHBondContact O-N 2.88Å; D21-A24 PolarHBondContact O-N 2.73Å; A24-S26 PolarHBondContact O-N 3.44Å; A24-A27 PolarHBondContact O-N 3.23Å; A24-T28 PolarHBondContact O-N 2.88Å; A24-T28 PolarHBondContact O-OG1 3.34Å
25	S	35.8	Very low	35.4	Very low	65 Å²	65	95.5 Å²	95.5	46%	0.455	57%	0.572	S	S	.	*	H	α-helix	trans	-65.7	-22.4	174.7	59.1	0	0	0	0	114.4	D21 A22 L23	D21-S25 PolarHBondContact O-N 3.32Å; D21-S25 VanDerWaalsContact O-N 3.08Å; D21-S25 PolarHBondContact O-OG 2.91Å; A22-S25 PolarHBondContact O-N 2.85Å; A22-S25 PolarHBondContact O-OG 2.94Å; L23-S25 VanDerWaalsContact C-N 3.33Å; L23-S25 PolarHBondContact O-N 3Å
26	S	34.2	Very low	34.3	Very low	83 Å²	83	100.9 Å²	100.9	58%	0.58	60%	0.6	S	S	*	*	H	α-helix	trans	-84.8	-19	171.8	61.9	0	0	0	0	114	A22 L23 A24	A22-S26 PolarHBondContact O-N 3.03Å; L23-S26 WeakPolarHBondContact CA-OG 2.93Å; L23-S26 PolarHBondContact O-N 3.07Å; L23-S26 VanDerWaalsContact O-N 3.13Å; L23-S26 PolarHBondContact O-OG 3.44Å; A24-S26 PolarHBondContact O-N 3.44Å
27	A	33.4	Very low	33.5	Very low	72 Å²	72	103.9 Å²	103.9	60%	0.595	62%	0.616	S	S	*	*	H	α-helix	trans	-90.6	-15.9	-177.2	0	0	0	0	0	113.7	L23 A24 I29	L23-A27 PolarHBondContact O-N 2.74Å; L23-A27 VanDerWaalsContact O-N 3.07Å; A24-A27 PolarHBondContact O-N 3.23Å; A27-I29 VanDerWaalsContact C-N 3.27Å; A27-I29 PolarHBondContact O-N 2.96Å
28	T	30.3	Very low	32.9	Very low	118 Å²	118	108.1 Å²	108.1	72%	0.724	63%	0.628	S	S	*	*	S	Bend	trans	-81.3	1.6	-177.9	-14	0	0	0	0	114.8	A24	A24-T28 PolarHBondContact O-N 2.88Å; A24-T28 PolarHBondContact O-OG1 3.34Å
29	I	31.4	Very low	32	Very low	151 Å²	151	115.9 Å²	115.9	77%	0.774	66%	0.663	S	S	*	*	S	Bend	trans	-105.1	54.9	171.5	-45.1	177.8	0	0	0	109.4	A27	A27-I29 VanDerWaalsContact C-N 3.27Å; A27-I29 PolarHBondContact O-N 2.96Å
30	C	26.3	Very low	31.3	Very low	124 Å²	124	119.1 Å²	119.1	84%	0.838	68%	0.684	S	S	*	*			trans	-169.5	60	165.1	-100.4	0	0	0	0	109.2
31	G	28	Very low	30.5	Very low	63 Å²	63	121 Å²	121	65%	0.649	70%	0.696	S	S	*	*			trans	-122	96.8	168.8	0	0	0	0	0	108.3	E33	G31-E33 PolarHBondContact O-N 3.43Å; G31-E33 VanDerWaalsContact O-N 3.13Å
32	N	26.9	Very low	29.7	Very low	162 Å²	162	125 Å²	125	87%	0.866	71%	0.711	S	S	*	*			trans	-58.2	110.7	169.4	-73.7	-20.6	0	0	0	108.5	E34	N32-E34 PolarHBondContact O-N 2.81Å; N32-E34 VanDerWaalsContact O-N 3.12Å
33	E	29.3	Very low	29.1	Very low	195 Å²	195	130.1 Å²	130.1	91%	0.911	74%	0.74	S	S	*	*			trans	-74	95.7	165.4	-74.2	-172.8	156.6	0	0	107.9	G31 A35	G31-E33 PolarHBondContact O-N 3.43Å; G31-E33 VanDerWaalsContact O-N 3.13Å; E33-A35 PolarHBondContact O-N 2.89Å
34	E	28.7	Very low	28.6	Very low	185 Å²	185	129.5 Å²	129.5	86%	0.864	75%	0.752	S	S	*	*			trans	-64.5	125.2	166.6	-78.7	-177	159.5	0	0	109.7	N32 L36	N32-E34 PolarHBondContact O-N 2.81Å; N32-E34 VanDerWaalsContact O-N 3.12Å; E34-L36 PolarHBondContact O-N 3.09Å
35	A	26.1	Very low	28.3	Very low	92 Å²	92	133.4 Å²	133.4	76%	0.76	77%	0.771	S	S	*	*			trans	-56.8	112.2	-179.9	0	0	0	0	0	112.3	E33 V37	E33-A35 PolarHBondContact O-N 2.89Å; A35-V37 PolarHBondContact O-N 2.88Å
36	L	27.6	Very low	27.9	Very low	144 Å²	144	135.8 Å²	135.8	75%	0.754	78%	0.784	S	S	*	*			trans	-89.3	95	159.3	-161.7	79.3	0	0	0	108.3	E34 Q38	E34-L36 PolarHBondContact O-N 3.09Å; L36-Q38 HydrophobicContact CD2-CG 4.21Å; L36-Q38 HydrophobicContact CG-CG 4.42Å; L36-Q38 PolarHBondContact O-N 2.95Å
37	V	24.5	Very low	27.6	Very low	131 Å²	131	140.9 Å²	140.9	79%	0.794	80%	0.799	S	S	*	*			trans	-63.9	101.4	168.4	177.2	0	0	0	0	107.9	A35	A35-V37 PolarHBondContact O-N 2.88Å
38	Q	28.9	Very low	27.4	Very low	161 Å²	161	143 Å²	143	75%	0.752	81%	0.807	S	S	*	*			trans	-112	133.8	163.7	-81.9	-172.8	-13.4	0	0	110	L36	L36-Q38 HydrophobicContact CD2-CG 4.21Å; L36-Q38 HydrophobicContact CG-CG 4.42Å; L36-Q38 PolarHBondContact O-N 2.95Å
39	Q	26	Very low	27.2	Very low	191 Å²	191	144 Å²	144	89%	0.893	82%	0.817	S	S	*	*			trans	-62.1	139.7	-164.4	-73	170.5	-33.9	0	0	112.9	E41	Q39-E41 PolarHBondContact O-N 2.82Å
40	V	26	Very low	26.9	Very low	126 Å²	126	143.3 Å²	143.3	76%	0.764	82%	0.82	S	S	*	*			trans	-66.6	114	176.7	175.2	0	0	0	0	109.6	Q42	V40-Q42 HydrophobicContact CG1-CG 3.86Å
41	E	26.3	Very low	26.9	Very low	187 Å²	187	142.1 Å²	142.1	87%	0.874	82%	0.818	S	S	*	*			trans	-104.3	110.6	158.4	-122.9	177.3	-179.2	0	0	108.1	Q39 T43	Q39-E41 PolarHBondContact O-N 2.82Å; E41-T43 PolarHBondContact O-N 2.82Å
42	Q	22.9	Very low	26.8	Very low	183 Å²	183	150.6 Å²	150.6	86%	0.855	83%	0.831	S	S	*	*			trans	-75.3	110.4	-179.5	-69.9	174.1	-17.8	0	0	109.7	V40	V40-Q42 HydrophobicContact CG1-CG 3.86Å
43	T	26.4	Very low	26.6	Very low	130 Å²	130	147.9 Å²	147.9	80%	0.798	83%	0.831	S	S	*	*			trans	-121	124.3	163.4	48	0	0	0	0	110.3	E41	E41-T43 PolarHBondContact O-N 2.82Å
44	A	27.1	Very low	26.5	Very low	105 Å²	105	150 Å²	150	87%	0.868	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-56.6	134.9	-168.4	0	0	0	0	0	114.4
45	V	27.8	Very low	26.4	Very low	134 Å²	134	146.4 Å²	146.4	81%	0.812	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-91.7	126.3	173.8	179.5	0	0	0	0	108.6
46	P	28.7	Very low	26.5	Very low	115 Å²	115	148.7 Å²	148.7	75%	0.747	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-80.8	139.7	177.3	31.3	-30.5	0	0	0	111.4
47	E	27.8	Very low	26.5	Very low	189 Å²	189	149.6 Å²	149.6	88%	0.883	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-62.7	137	-177.9	-67.3	-175.6	152	0	0	113.1
48	P	27.6	Very low	26.5	Very low	118 Å²	118	150.9 Å²	150.9	77%	0.766	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-88.5	125.9	178.2	32.2	-29.8	0	0	0	112.4	V50	P48-V50 PolarHBondContact O-N 3.37Å
49	C	26.7	Very low	26.6	Very low	137 Å²	137	151.1 Å²	151.1	93%	0.926	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-59.9	124	171.5	-92.4	0	0	0	0	112.4	A51	C49-A51 PolarHBondContact O-N 3.22Å
50	V	25.9	Very low	26.7	Very low	138 Å²	138	148.3 Å²	148.3	84%	0.836	83%	0.834	S	S	*	*			trans	-83.7	107.3	177.1	-178.8	0	0	0	0	110	P48	P48-V50 PolarHBondContact O-N 3.37Å
51	A	25.9	Very low	26.6	Very low	98 Å²	98	151.4 Å²	151.4	81%	0.81	84%	0.84	S	S	*	*			trans	-97.3	112.1	169.8	0	0	0	0	0	110.6	C49	C49-A51 PolarHBondContact O-N 3.22Å
52	R	25.4	Very low	26.7	Very low	241 Å²	241	148 Å²	148	91%	0.909	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-63.6	124.5	176.8	-86.4	173.5	164	152.8	-5.6	111.8
53	A	23.5	Very low	26.8	Very low	105 Å²	105	147.6 Å²	147.6	87%	0.868	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-76.8	123.8	166.6	0	0	0	0	0	110.4
54	R	26.2	Very low	26.9	Very low	240 Å²	240	144.8 Å²	144.8	91%	0.906	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-92.5	140.3	170.2	-80.7	-176	173.2	175.2	-1.6	110
55	S	26.9	Very low	26.8	Very low	109 Å²	109	147 Å²	147	76%	0.762	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-65.2	132.4	-179.9	55.7	0	0	0	0	112.2
56	V	28.8	Very low	26.8	Very low	140 Å²	140	145.9 Å²	145.9	85%	0.848	84%	0.838	S	S	*	*			trans	-84	113.9	172.8	178.2	0	0	0	0	108
57	Q	26.9	Very low	27.1	Very low	163 Å²	163	145.8 Å²	145.8	76%	0.762	84%	0.838	S	S	*	*			trans	-95.7	132.3	165.9	-85.2	177	-25.8	0	0	109.1
58	D	25.7	Very low	27	Very low	158 Å²	158	144.7 Å²	144.7	85%	0.845	84%	0.838	S	S	*	*			trans	21.4	104.7	151.6	-54.8	-28.5	0	0	0	117.7
59	L	29.5	Very low	27.2	Very low	167 Å²	167	145.8 Å²	145.8	87%	0.874	84%	0.843	S	S	*	*			trans	-109.4	110.2	165.6	-85.1	159.4	0	0	0	109.1
60	V	28.2	Very low	27.2	Very low	132 Å²	132	148.6 Å²	148.6	80%	0.8	84%	0.842	S	S	*	*			trans	-71.1	138.4	171.4	170.3	0	0	0	0	109.7
61	E	24.2	Very low	27.3	Very low	190 Å²	190	150.9 Å²	150.9	89%	0.888	84%	0.844	S	S	*	*			trans	-58.9	130.8	174.3	-66.7	171.1	152.9	0	0	111.8
62	S	28.5	Very low	27.3	Very low	115 Å²	115	155.6 Å²	155.6	80%	0.804	85%	0.849	S	S	*	*			trans	-148.8	122	158.5	64.6	0	0	0	0	110.5
63	D	24.7	Very low	27.2	Very low	175 Å²	175	150.7 Å²	150.7	94%	0.936	85%	0.846	S	S	*	*			trans	-52.3	142.4	171.2	-71.1	-47.8	0	0	0	112.8
64	G	27.9	Very low	27.5	Very low	71 Å²	71	150.2 Å²	150.2	73%	0.732	84%	0.843	S	S	*	*			trans	-172.9	93.7	178.5	0	0	0	0	0	112.6
65	T	24.8	Very low	27.9	Very low	151 Å²	151	144.7 Å²	144.7	93%	0.926	84%	0.838	S	S	*	*			trans	-38.2	130.9	171.3	-12.2	0	0	0	0	113.6
66	S	29.1	Very low	27.8	Very low	111 Å²	111	144 Å²	144	78%	0.776	84%	0.839	S	S	*	*			trans	-110.6	136.1	171.5	49.8	0	0	0	0	110.3
67	P	34.9	Very low	27.9	Very low	114 Å²	114	144.1 Å²	144.1	74%	0.74	84%	0.839	S	S	*	*			trans	-93.5	152.1	-178.2	35.6	-31.4	0	0	0	112.6
68	D	26.5	Very low	27.9	Very low	165 Å²	165	142.7 Å²	142.7	88%	0.882	84%	0.842	S	S	*	*			trans	-53.6	136.7	176.9	-58.4	-56.4	0	0	0	113.2
69	T	30.3	Very low	27.9	Very low	142 Å²	142	139 Å²	139	87%	0.871	84%	0.841	S	S	*	*			trans	-142.4	132.3	159.7	-12.1	0	0	0	0	110.2
70	E	28.2	Very low	27.9	Very low	195 Å²	195	136.6 Å²	136.6	91%	0.911	84%	0.839	S	S	*	*			trans	-65.8	140.4	-163	-65.2	170.8	140.5	0	0	114.4
71	E	26.8	Very low	27.9	Very low	187 Å²	187	139.5 Å²	139.5	87%	0.874	84%	0.843	S	S	*	*			trans	-86	109.3	-177	-161.6	174.2	-159.3	0	0	110
72	Q	26.5	Very low	28.1	Very low	196 Å²	196	136.1 Å²	136.1	92%	0.916	84%	0.838	S	S	*	*			trans	-82.6	122.1	168.3	-86.9	-176.8	-1.1	0	0	110.6
73	T	23.5	Very low	28.2	Very low	138 Å²	138	141.2 Å²	141.2	85%	0.847	84%	0.841	S	S	*	*			trans	-79.1	133.2	-178.6	38.8	0	0	0	0	111.7
74	A	29.2	Very low	28.5	Very low	96 Å²	96	140 Å²	140	79%	0.793	84%	0.839	S	S	*	*			trans	-138	151.4	169.1	0	0	0	0	0	110.2
75	P	34.8	Very low	28.9	Very low	123 Å²	123	139.8 Å²	139.8	80%	0.799	84%	0.837	S	S	*	*			trans	-92	152.2	-138.2	33.7	-34.7	0	0	0	115.4	V77	P75-V77 PolarHBondContact O-N 3.09Å
76	A	26	Very low	29.5	Very low	95 Å²	95	135.6 Å²	135.6	79%	0.785	82%	0.815	S	S	*	*			trans	-63.2	113.1	177.6	0	0	0	0	0	112.6	T78	A76-T78 PolarHBondContact O-N 3Å
77	V	29.6	Very low	30.3	Very low	143 Å²	143	135.2 Å²	135.2	87%	0.867	81%	0.807	S	S	*	*			trans	-87.6	106	162.4	177.4	0	0	0	0	108	P75	P75-V77 PolarHBondContact O-N 3.09Å
78	T	27.1	Very low	30.7	Very low	132 Å²	132	133.4 Å²	133.4	81%	0.81	80%	0.797	S	S	*	*			trans	-71.2	129.4	173.7	45.1	0	0	0	0	110.2	A76	A76-T78 PolarHBondContact O-N 3Å
79	G	26.1	Very low	31.6	Very low	81 Å²	81	132.2 Å²	132.2	84%	0.835	78%	0.784	S	S	*	*			trans	156.6	63	172.6	0	0	0	0	0	114.9
80	S	29.2	Very low	32.3	Very low	117 Å²	117	130.6 Å²	130.6	82%	0.818	77%	0.769	S	S	*	*			trans	-131.7	110.7	157.2	55.6	0	0	0	0	109.3
81	Q	28.3	Very low	33	Very low	192 Å²	192	126.2 Å²	126.2	90%	0.897	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-63.5	134.8	171.7	-75.6	-176.3	-26.6	0	0	109.1	Y83	Q81-Y83 PolarHBondContact O-N 3.22Å
82	P	29	Very low	33.7	Very low	120 Å²	120	122.8 Å²	122.8	78%	0.779	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-74	128	-172.5	28.4	-32.1	0	0	0	110.9	V84	P82-V84 PolarHBondContact O-N 2.82Å
83	Y	30.1	Very low	34.7	Very low	222 Å²	222	119.6 Å²	119.6	87%	0.871	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-62.2	119.6	-179.5	-146.2	-100.7	0	0	0	110.8	Q81 G85	Q81-Y83 PolarHBondContact O-N 3.22Å; Y83-G85 PolarHBondContact O-N 2.44Å
84	V	31.8	Very low	35.3	Very low	148 Å²	148	119.5 Å²	119.5	90%	0.897	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	97	178.3	-177.9	0	0	0	0	108.5	P82	P82-V84 PolarHBondContact O-N 2.82Å
85	G	34.4	Very low	35.7	Very low	67 Å²	67	123.2 Å²	123.2	69%	0.691	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	161.5	-0.6	178.1	0	0	0	0	0	116.9	Y83	Y83-G85 PolarHBondContact O-N 2.44Å
86	S	38.3	Very low	35.5	Very low	64 Å²	64	122.5 Å²	122.5	45%	0.448	71%	0.71	S	S	.	*			trans	-76.8	131.2	176.1	175.8	0	0	0	0	111.8	S88 F89	S86-S88 PolarHBondContact O-N 3.03Å; S86-S88 PolarHBondContact OG-N 3.11Å; S86-S88 PolarHBondContact OG-OG 3.42Å; S86-F89 WeakPolarHBondContact O-CB 3.43Å; S86-F89 PolarHBondContact O-N 2.95Å
87	V	45	Very low	35.6	Very low	103 Å²	103	126.4 Å²	126.4	62%	0.624	71%	0.712	S	S	*	*	H	α-helix	trans	-52.7	-25.8	175.1	178	0	0	0	0	112.5	F89 I90 L91	V87-F89 VanDerWaalsContact C-N 3.31Å; V87-F89 PolarHBondContact O-N 2.95Å; V87-I90 PolarHBondContact O-N 2.95Å; V87-L91 HydrophobicContact CG1-CD1 3.94Å; V87-L91 PolarHBondContact O-N 3.18Å
88	S	45.2	Very low	35.5	Very low	76 Å²	76	125.2 Å²	125.2	53%	0.531	71%	0.71	S	S	.	*	H	α-helix	trans	-63.3	-33	173.9	60.1	0	0	0	0	113.5	S86 N92	S86-S88 PolarHBondContact O-N 3.03Å; S86-S88 PolarHBondContact OG-N 3.11Å; S86-S88 PolarHBondContact OG-OG 3.42Å; S88-N92 PolarHBondContact O-N 3.19Å; S88-N92 VanDerWaalsContact O-N 3.12Å
89	F	43.8	Very low	35.5	Very low	139 Å²	139	123.7 Å²	123.7	61%	0.61	70%	0.7	S	S	*	*	H	α-helix	trans	-69.7	-41.8	177.6	-175.5	-97.3	0	0	0	111.6	S86 V87 N92 Q93	S86-F89 WeakPolarHBondContact O-CB 3.43Å; S86-F89 PolarHBondContact O-N 2.95Å; V87-F89 VanDerWaalsContact C-N 3.31Å; V87-F89 PolarHBondContact O-N 2.95Å; F89-N92 PolarHBondContact O-N 2.95Å; F89-Q93 PolarHBondContact O-N 2.95Å
90	I	45.7	Very low	35.4	Very low	108 Å²	108	129.4 Å²	129.4	55%	0.554	70%	0.702	S	S	*	*	H	α-helix	trans	-68.1	-38.1	177.7	-59.7	178.6	0	0	0	110.6	V87 N92 Q93 L94	V87-I90 PolarHBondContact O-N 2.95Å; I90-N92 PolarHBondContact O-N 3.13Å; I90-Q93 PolarHBondContact O-N 3.19Å; I90-L94 HydrophobicContact CG2-CD1 4.38Å; I90-L94 PolarHBondContact O-N 3.39Å
91	L	41.7	Very low	35.2	Very low	104 Å²	104	132.1 Å²	132.1	55%	0.545	70%	0.699	S	S	.	*	H	α-helix	trans	-67.5	-33.3	177	-83.5	163.4	0	0	0	113.1	V87 L94	V87-L91 HydrophobicContact CG1-CD1 3.94Å; V87-L91 PolarHBondContact O-N 3.18Å; L91-L94 PolarHBondContact O-N 2.88Å
92	N	43.5	Very low	35.1	Very low	115 Å²	115	132.5 Å²	132.5	62%	0.615	70%	0.701	S	S	*	*	H	α-helix	trans	-71.9	-33.9	176.4	-90	-3.9	0	0	0	112.9	S88 F89 I90 L94 K95	S88-N92 PolarHBondContact O-N 3.19Å; S88-N92 VanDerWaalsContact O-N 3.12Å; F89-N92 PolarHBondContact O-N 2.95Å; I90-N92 PolarHBondContact O-N 3.13Å; N92-L94 VanDerWaalsContact C-N 3.28Å; N92-L94 PolarHBondContact O-N 3.04Å; N92-K95 PolarHBondContact O-N 3.11Å
93	Q	45.5	Very low	34.9	Very low	129 Å²	129	135.3 Å²	135.3	60%	0.603	70%	0.703	S	S	*	*	H	α-helix	trans	-65.2	-30.5	172.7	-81.2	-86.3	-11.3	0	0	112.6	F89 I90 K95 T96	F89-Q93 PolarHBondContact O-N 2.95Å; I90-Q93 PolarHBondContact O-N 3.19Å; Q93-K95 VanDerWaalsContact C-N 3.32Å; Q93-K95 PolarHBondContact O-N 3.24Å; Q93-T96 PolarHBondContact O-OG1 3.4Å
94	L	38.1	Very low	34.8	Very low	135 Å²	135	132.4 Å²	132.4	71%	0.707	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-5.6	-179.8	-73.5	168.5	0	0	0	114.4	I90 L91 N92	I90-L94 HydrophobicContact CG2-CD1 4.38Å; I90-L94 PolarHBondContact O-N 3.39Å; L91-L94 PolarHBondContact O-N 2.88Å; N92-L94 VanDerWaalsContact C-N 3.28Å; N92-L94 PolarHBondContact O-N 3.04Å
95	K	37.3	Very low	34.6	Very low	174 Å²	174	133.8 Å²	133.8	76%	0.757	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-2.7	178	-84.4	-173.4	175.5	-178.6	0	114.5	N92 Q93	N92-K95 PolarHBondContact O-N 3.11Å; Q93-K95 VanDerWaalsContact C-N 3.32Å; Q93-K95 PolarHBondContact O-N 3.24Å
96	T	30	Very low	34.6	Very low	108 Å²	108	136.3 Å²	136.3	66%	0.663	70%	0.704	S	S	*	*			trans	-112.4	56.7	-177.3	54	0	0	0	0	112.9	Q93	Q93-T96 PolarHBondContact O-OG1 3.4Å
97	E	28.3	Very low	34.2	Very low	177 Å²	177	141.2 Å²	141.2	83%	0.827	72%	0.724	S	S	*	*			trans	-142.3	77.3	158.8	-74.5	-167.4	166	0	0	109.4	V99	E97-V99 PolarHBondContact O-N 3.05Å; E97-V99 VanDerWaalsContact O-N 3.16Å
98	S	27.7	Very low	33.5	Very low	119 Å²	119	141.1 Å²	141.1	83%	0.832	73%	0.728	S	S	*	*			trans	-79	84.3	168.2	42.8	0	0	0	0	109.6	K100	S98-K100 PolarHBondContact O-N 3.09Å
99	V	26.5	Very low	32.8	Very low	99 Å²	99	143.5 Å²	143.5	60%	0.6	74%	0.741	S	S	*	*			trans	-77.2	109.3	170.7	-179.6	0	0	0	0	108.6	E97 F101	E97-V99 PolarHBondContact O-N 3.05Å; E97-V99 VanDerWaalsContact O-N 3.16Å; V99-F101 HydrophobicContact CB-CE2 4.27Å; V99-F101 HydrophobicContact CG1-CD2 4.33Å; V99-F101 HydrophobicContact CG1-CE2 3.87Å; V99-F101 HydrophobicContact CG1-CZ 4.18Å; V99-F101 PolarHBondContact O-N 3.49Å
100	K	23.8	Very low	32.1	Very low	201 Å²	201	143.6 Å²	143.6	87%	0.874	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-65.3	120.1	171.3	-71.7	178.3	175.8	180	0	109	S98	S98-K100 PolarHBondContact O-N 3.09Å
101	F	25.9	Very low	31.1	Very low	174 Å²	174	143.1 Å²	143.1	76%	0.763	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-100	117.9	166.9	-76.8	-86.1	0	0	0	108.2	V99	V99-F101 HydrophobicContact CB-CE2 4.27Å; V99-F101 HydrophobicContact CG1-CD2 4.33Å; V99-F101 HydrophobicContact CG1-CE2 3.87Å; V99-F101 HydrophobicContact CG1-CZ 4.18Å; V99-F101 PolarHBondContact O-N 3.49Å
102	E	25.7	Very low	30.4	Very low	200 Å²	200	145.5 Å²	145.5	94%	0.935	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-69.9	134.9	168.8	-84.2	173.2	153.1	0	0	109.9
103	H	24.8	Very low	29.6	Very low	179 Å²	179	147 Å²	147	83%	0.829	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-102	127.6	-178.6	-86.5	-81.4	0	0	0	109.7
104	D	27.3	Very low	28.7	Very low	162 Å²	162	148.5 Å²	148.5	87%	0.866	80%	0.797	S	S	*	*			trans	-153	131.9	157.4	-76.3	-38.6	0	0	0	104.2
105	E	29	Very low	28.4	Very low	176 Å²	176	147.8 Å²	147.8	82%	0.822	80%	0.8	S	S	*	*			cis	-155.6	167.2	10.1	-111.6	-166.8	159.6	0	0	107.2
106	P	34.5	Very low	27.9	Very low	120 Å²	120	148.5 Å²	148.5	78%	0.779	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-92.3	138	-156.2	34.9	-32.7	0	0	0	114.3
107	I	29.5	Very low	27.8	Very low	168 Å²	168	152.1 Å²	152.1	86%	0.862	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-101.1	118.5	166.6	-60.2	173.2	0	0	0	108.2
108	S	29.1	Very low	27.7	Very low	101 Å²	101	151.4 Å²	151.4	71%	0.706	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-56.9	138.5	-178.3	52.2	0	0	0	0	113.7
109	P	31.6	Very low	27.8	Very low	126 Å²	126	150.6 Å²	150.6	82%	0.818	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-86.7	130.4	-175.6	33.5	-31.2	0	0	0	112.1	S111	P109-S111 PolarHBondContact O-N 2.85Å
110	V	28.3	Very low	28	Very low	140 Å²	140	151.6 Å²	151.6	85%	0.848	83%	0.831	S	S	*	*			trans	-76.7	107.8	169.6	177	0	0	0	0	108.3
111	S	26.1	Very low	28.2	Very low	99 Å²	99	147.2 Å²	147.2	69%	0.692	83%	0.826	S	S	*	*			trans	-65.2	125.8	172.3	53.5	0	0	0	0	111.2	P109	P109-S111 PolarHBondContact O-N 2.85Å
112	N	25.3	Very low	28.4	Very low	154 Å²	154	144.9 Å²	144.9	82%	0.824	83%	0.829	S	S	*	*			trans	-171	74.1	154.2	-91.1	-21.6	0	0	0	109.7
113	V	27.5	Very low	28.6	Very low	147 Å²	147	145.3 Å²	145.3	89%	0.891	83%	0.827	S	S	*	*			trans	-143.4	116.4	160.4	-176	0	0	0	0	108.7
114	L	27.3	Very low	28.5	Very low	160 Å²	160	145.7 Å²	145.7	84%	0.838	83%	0.83	S	S	*	*			trans	-76	153.9	171.7	-78.2	164.8	0	0	0	110.8
115	P	31.3	Very low	28.4	Very low	120 Å²	120	147.3 Å²	147.3	78%	0.779	83%	0.832	S	S	*	*			trans	-86.4	140	-155.1	34.2	-33	0	0	0	112.6
116	M	26.9	Very low	28.2	Very low	189 Å²	189	144.9 Å²	144.9	93%	0.931	83%	0.829	S	S	*	*			trans	-114.6	127.6	165.3	-84.4	-88.8	-69.3	0	0	108.2
117	E	27.8	Very low	27.7	Very low	183 Å²	183	145 Å²	145	86%	0.855	83%	0.827	S	S	*	*			trans	-66.3	134.3	-169.7	-69.1	172.4	133.4	0	0	114.1
118	N	26.9	Very low	27.4	Very low	162 Å²	162	141.9 Å²	141.9	87%	0.866	82%	0.821	S	S	*	*			trans	20.6	95.7	141	-62	-19.4	0	0	0	117.9
119	A	29	Very low	27.2	Very low	102 Å²	102	143 Å²	143	84%	0.843	82%	0.824	S	S	*	*			trans	-116.8	113.8	151.4	0	0	0	0	0	108.6
120	S	30.5	Very low	26.8	Very low	120 Å²	120	141.5 Å²	141.5	84%	0.839	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-57.9	140.3	-177.8	48.6	0	0	0	0	113.6
121	S	27.5	Very low	26.7	Very low	110 Å²	110	143.8 Å²	143.8	77%	0.769	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-56.9	148.7	178.3	48.6	0	0	0	0	114.9
122	P	31.9	Very low	26.4	Very low	125 Å²	125	145.7 Å²	145.7	81%	0.812	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-82.2	144.6	-175.8	33.8	-33	0	0	0	112.2
123	K	28.2	Very low	26.4	Very low	208 Å²	208	144.6 Å²	144.6	90%	0.904	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-75.8	132.6	172.2	-74.3	-179.2	174.2	-179.5	0	110.3
124	E	22.3	Very low	26.2	Very low	187 Å²	187	143.2 Å²	143.2	87%	0.874	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-63.3	127.9	165.7	-64.9	172.4	145.6	0	0	109.7
125	E	26.9	Very low	25.9	Very low	196 Å²	196	144.4 Å²	144.4	92%	0.916	83%	0.825	S	S	*	*			trans	-126.2	129.7	160.6	-90.1	-175.2	178.1	0	0	110.2
126	T	24.4	Very low	25.6	Very low	125 Å²	125	144.6 Å²	144.6	77%	0.767	83%	0.825	S	S	*	*			trans	-90.7	133.6	-167.3	39	0	0	0	0	112.6
127	V	24.2	Very low	25.6	Very low	122 Å²	122	141.7 Å²	141.7	74%	0.739	82%	0.818	S	S	*	*			trans	61.7	99	131.5	-171.4	0	0	0	0	118.9
128	S	23.7	Very low	25.6	Very low	103 Å²	103	144.9 Å²	144.9	72%	0.72	82%	0.822	S	S	*	*			trans	35.8	111	131.4	77.1	0	0	0	0	120.3
129	T	23.8	Very low	25.8	Very low	126 Å²	126	148.5 Å²	148.5	77%	0.773	82%	0.823	S	S	*	*			trans	-94.5	114.4	148	41.3	0	0	0	0	109.1
130	A	24.2	Very low	26.1	Very low	94 Å²	94	148.2 Å²	148.2	78%	0.777	81%	0.811	S	S	*	*			trans	-77.4	118.4	176.6	0	0	0	0	0	109.8
131	F	24.9	Very low	26.3	Very low	188 Å²	188	146.9 Å²	146.9	83%	0.825	80%	0.8	S	S	*	*			trans	-85.4	111.7	171.5	-88.1	-88.7	0	0	0	110.2	T133	F131-T133 PolarHBondContact O-N 2.85Å
132	T	20.9	Very low	27.3	Very low	138 Å²	138	144.4 Å²	144.4	85%	0.847	79%	0.786	S	S	*	*			trans	-74.9	103.1	171.8	-39.6	0	0	0	0	109
133	T	23.7	Very low	28	Very low	131 Å²	131	145.5 Å²	145.5	80%	0.804	79%	0.785	S	S	*	*			trans	-94.4	117	175	-19.5	0	0	0	0	109.9	F131	F131-T133 PolarHBondContact O-N 2.85Å
134	T	23.2	Very low	29	Very low	119 Å²	119	136.8 Å²	136.8	73%	0.73	75%	0.75	S	S	*	*			trans	-65	130.9	179.1	34.5	0	0	0	0	111.9	T136	T134-T136 PolarHBondContact O-N 2.95Å
135	L	23	Very low	30.3	Very low	184 Å²	184	134.2 Å²	134.2	96%	0.963	74%	0.741	S	S	*	*			trans	-59.2	99.9	177.1	-79.8	147.6	0	0	0	111.1
136	T	24.8	Very low	31.5	Very low	124 Å²	124	128.5 Å²	128.5	76%	0.761	72%	0.723	S	S	*	*			trans	-103.2	120.2	167.2	44.1	0	0	0	0	110	T134	T134-T136 PolarHBondContact O-N 2.95Å
137	T	27.1	Very low	33.2	Very low	129 Å²	129	126.5 Å²	126.5	79%	0.791	70%	0.704	S	S	*	*			trans	10.6	113.9	167.1	53	0	0	0	0	118	R139	T137-R139 PolarHBondContact O-N 3.48Å
138	R	27.8	Very low	34.4	Very low	249 Å²	249	125.3 Å²	125.3	94%	0.94	69%	0.692	S	S	*	*			trans	-42.2	100.6	169.5	-89.8	-178.9	170.4	176.1	-3.1	111.5	V140	R138-V140 PolarHBondContact O-N 2.81Å
139	R	29.6	Very low	35.8	Very low	238 Å²	238	125.3 Å²	125.3	90%	0.898	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-73.7	116.8	158.6	-76.3	-175.8	176.5	-180	-0.6	107.6	T137	T137-R139 PolarHBondContact O-N 3.48Å
140	V	35.3	Very low	37.5	Very low	96 Å²	96	122 Å²	122	58%	0.582	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-62.8	123.5	173.6	-179.8	0	0	0	0	107.6	R138 S144	R138-V140 PolarHBondContact O-N 2.81Å; V140-S144 WeakPolarHBondContact CG1-OG 3.39Å
141	P	35.5	Very low	38.9	Very low	93 Å²	93	122.3 Å²	122.3	60%	0.604	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-63.6	141.4	-176.4	22.6	-30.7	0	0	0	110.9	N143 S144	P141-N143 PolarHBondContact O-N 2.91Å; P141-S144 PolarHBondContact O-N 2.8Å; P141-S144 PolarHBondContact O-OG 2.86Å
142	A	49.1	Very low	39.8	Very low	58 Å²	58	118.6 Å²	118.6	48%	0.479	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.4	-4	-174.9	0	0	0	0	0	115	F147	A142-F147 HydrophobicContact CB-CD1 4.37Å; A142-F147 HydrophobicContact CB-CE1 4.22Å; A142-F147 VanDerWaalsContact O-CD1 3.26Å; A142-F147 WeakPolarHBondContact O-CD1 3.24Å
143	N	45.5	Very low	40.9	Very low	148 Å²	148	120.4 Å²	120.4	79%	0.791	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	7.8	178.4	-57.6	-0.1	0	0	0	112.5	P141	P141-N143 PolarHBondContact O-N 2.91Å
144	S	49.7	Very low	42	Very low	25 Å²	25	120.8 Å²	120.8	18%	0.175	63%	0.628	C	S	.	*	S	Bend	trans	-74.6	137.7	173.2	65.2	0	0	0	0	110.5	V140 P141 S146 F147 L148	V140-S144 WeakPolarHBondContact CG1-OG 3.39Å; P141-S144 PolarHBondContact O-N 2.8Å; P141-S144 PolarHBondContact O-OG 2.86Å; S144-S146 PolarHBondContact O-N 2.83Å; S144-S146 VanDerWaalsContact O-N 3.12Å; S144-S146 PolarHBondContact OG-OG 2.85Å; S144-F147 WeakPolarHBondContact O-CB 3.28Å; S144-F147 PolarHBondContact O-N 2.93Å; S144-F147 WeakPolarHBondContact OG-CB 3.44Å; S144-F147 PolarHBondContact OG-N 3.46Å; S144-L148 PolarHBondContact O-N 2.87Å
145	I	50.4	Low	42.9	Very low	132 Å²	132	117.4 Å²	117.4	68%	0.677	62%	0.617	S	S	*	*	H	α-helix	trans	-54.5	-32.4	176.6	-65.7	170.6	0	0	0	110.9	L148 L149	I145-L148 PolarHBondContact O-N 2.84Å; I145-L149 HydrophobicContact CG2-CD1 3.79Å; I145-L149 HydrophobicContact CG2-CG 4.25Å; I145-L149 WeakPolarHBondContact O-CB 3.37Å; I145-L149 VanDerWaalsContact O-CG 3.27Å; I145-L149 WeakPolarHBondContact O-CG 3.44Å; I145-L149 PolarHBondContact O-N 3Å
146	S	50.2	Low	43.4	Very low	76 Å²	76	115.4 Å²	115.4	53%	0.531	61%	0.606	S	S	.	*	H	α-helix	trans	-65.5	-35.8	175.5	54.9	0	0	0	0	113.6	S144 S150	S144-S146 PolarHBondContact O-N 2.83Å; S144-S146 VanDerWaalsContact O-N 3.12Å; S144-S146 PolarHBondContact OG-OG 2.85Å; S146-S150 PolarHBondContact O-N 2.98Å; S146-S150 VanDerWaalsContact O-N 3.1Å
147	F	60.8	Low	43.9	Very low	84 Å²	84	118.1 Å²	118.1	37%	0.368	61%	0.61	S	S	.	*	H	α-helix	trans	-70.5	-40.2	175.2	179.9	-98.1	0	0	0	111.7	A142 S144 S150 Q151	A142-F147 HydrophobicContact CB-CD1 4.37Å; A142-F147 HydrophobicContact CB-CE1 4.22Å; A142-F147 VanDerWaalsContact O-CD1 3.26Å; A142-F147 WeakPolarHBondContact O-CD1 3.24Å; S144-F147 WeakPolarHBondContact O-CB 3.28Å; S144-F147 PolarHBondContact O-N 2.93Å; S144-F147 WeakPolarHBondContact OG-CB 3.44Å; S144-F147 PolarHBondContact OG-N 3.46Å; F147-S150 PolarHBondContact O-N 3.44Å; F147-S150 PolarHBondContact O-OG 2.88Å; F147-Q151 HydrophobicContact CE1-CG 4.18Å; F147-Q151 HydrophobicContact CZ-CG 4.29Å; F147-Q151 WeakPolarHBondContact O-CG 3.47Å; F147-Q151 PolarHBondContact O-N 3.35Å; F147-Q151 VanDerWaalsContact O-N 3.17Å
148	L	49.7	Very low	44.2	Very low	96 Å²	96	121 Å²	121	50%	0.503	61%	0.612	S	S	.	*	H	α-helix	trans	-66.6	-38.3	175.9	-67	173.6	0	0	0	111.9	S144 I145 Q151 L152	S144-L148 PolarHBondContact O-N 2.87Å; I145-L148 PolarHBondContact O-N 2.84Å; L148-Q151 PolarHBondContact O-N 3.29Å; L148-L152 PolarHBondContact O-N 2.9Å
149	L	52.8	Low	44.2	Very low	103 Å²	103	115.6 Å²	115.6	54%	0.539	61%	0.606	S	S	.	*	H	α-helix	trans	-68.2	-33.8	176	-75	169.3	0	0	0	112.9	I145 L152 K153	I145-L149 HydrophobicContact CG2-CD1 3.79Å; I145-L149 HydrophobicContact CG2-CG 4.25Å; I145-L149 WeakPolarHBondContact O-CB 3.37Å; I145-L149 VanDerWaalsContact O-CG 3.27Å; I145-L149 WeakPolarHBondContact O-CG 3.44Å; I145-L149 PolarHBondContact O-N 3Å; L149-L152 PolarHBondContact O-N 3.23Å; L149-K153 PolarHBondContact O-N 2.9Å; L149-K153 VanDerWaalsContact O-N 3.1Å
150	S	58.6	Low	44	Very low	56 Å²	56	112.9 Å²	112.9	39%	0.392	60%	0.604	S	S	.	*	H	α-helix	trans	-69.7	-38.7	175.2	70.9	0	0	0	0	111.9	S146 F147 K153 E154	S146-S150 PolarHBondContact O-N 2.98Å; S146-S150 VanDerWaalsContact O-N 3.1Å; F147-S150 PolarHBondContact O-N 3.44Å; F147-S150 PolarHBondContact O-OG 2.88Å; S150-K153 PolarHBondContact O-N 3.12Å; S150-E154 PolarHBondContact O-N 2.63Å
151	Q	54.8	Low	43.4	Very low	101 Å²	101	113.8 Å²	113.8	47%	0.472	62%	0.615	S	S	.	*	H	α-helix	trans	-64.2	-38.8	174.6	-70.5	-67.5	-45.2	0	0	112	F147 L148 E154 G155	F147-Q151 HydrophobicContact CE1-CG 4.18Å; F147-Q151 HydrophobicContact CZ-CG 4.29Å; F147-Q151 WeakPolarHBondContact O-CG 3.47Å; F147-Q151 PolarHBondContact O-N 3.35Å; F147-Q151 VanDerWaalsContact O-N 3.17Å; L148-Q151 PolarHBondContact O-N 3.29Å; Q151-E154 PolarHBondContact O-N 2.86Å; Q151-G155 PolarHBondContact O-N 3.08Å
152	L	44.3	Very low	42.9	Very low	111 Å²	111	114.8 Å²	114.8	58%	0.581	62%	0.624	S	S	*	*	H	α-helix	trans	-66.7	-38.3	175.9	-83.9	163.2	0	0	0	112.6	L148 L149 G155 L156	L148-L152 PolarHBondContact O-N 2.9Å; L149-L152 PolarHBondContact O-N 3.23Å; L152-G155 PolarHBondContact O-N 3.08Å; L152-L156 PolarHBondContact O-N 3.44Å
153	K	44	Very low	41.7	Very low	175 Å²	175	117.2 Å²	117.2	76%	0.761	64%	0.637	S	S	*	*	H	α-helix	trans	-66.2	-36.1	175.9	-94.4	-173.3	174.3	-176.5	0	113	L149 S150	L149-K153 PolarHBondContact O-N 2.9Å; L149-K153 VanDerWaalsContact O-N 3.1Å; S150-K153 PolarHBondContact O-N 3.12Å
154	E	46.7	Very low	40.6	Very low	140 Å²	140	116.3 Å²	116.3	65%	0.654	64%	0.636	S	S	*	*	H	α-helix	trans	-74.3	-32.6	175	-74.6	-176.1	166.6	0	0	112.6	S150 Q151 L156	S150-E154 PolarHBondContact O-N 2.63Å; Q151-E154 PolarHBondContact O-N 2.86Å; E154-L156 PolarHBondContact O-N 3.49Å
155	G	41.6	Very low	39.2	Very low	47 Å²	47	122.1 Å²	122.1	49%	0.485	66%	0.664	S	S	.	*	H	α-helix	trans	-68.7	-30.7	177.5	0	0	0	0	0	114.3	Q151 L152 Q157 K158	Q151-G155 PolarHBondContact O-N 3.08Å; L152-G155 PolarHBondContact O-N 3.08Å; G155-Q157 VanDerWaalsContact C-N 3.32Å; G155-Q157 PolarHBondContact O-N 2.78Å; G155-K158 PolarHBondContact O-N 3.14Å
156	L	33.7	Very low	37.7	Very low	143 Å²	143	124.1 Å²	124.1	75%	0.749	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-12.9	-177.3	-98.7	138.9	0	0	0	114.6	L152 E154	L152-L156 PolarHBondContact O-N 3.44Å; E154-L156 PolarHBondContact O-N 3.49Å
157	Q	35.8	Very low	36.3	Very low	181 Å²	181	126.2 Å²	126.2	85%	0.846	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	5.5	175	-88.5	-171.3	-13.6	0	0	114.6	G155	G155-Q157 VanDerWaalsContact C-N 3.32Å; G155-Q157 PolarHBondContact O-N 2.78Å
158	K	32.4	Very low	34.4	Very low	188 Å²	188	131.3 Å²	131.3	82%	0.817	71%	0.705	S	S	*	*	S	Bend	trans	-123.8	18.9	-172.4	-99	-177	178.9	177.6	0	117.2	G155	G155-K158 PolarHBondContact O-N 3.14Å
159	V	28.4	Very low	33.1	Very low	136 Å²	136	133.5 Å²	133.5	82%	0.824	72%	0.722	S	S	*	*			trans	-123.1	67.3	175	-166.4	0	0	0	0	110.5
160	E	24.2	Very low	31.8	Very low	181 Å²	181	134 Å²	134	85%	0.846	74%	0.735	S	S	*	*			trans	-111.9	130.5	156.1	-77.2	-172.1	168.1	0	0	108.5
161	S	23.9	Very low	30	Very low	116 Å²	116	135.1 Å²	135.1	81%	0.811	75%	0.754	S	S	*	*			trans	75.7	105.2	168.8	73.5	0	0	0	0	118.8
162	S	23.6	Very low	28.6	Very low	114 Å²	114	135.4 Å²	135.4	80%	0.797	77%	0.768	S	S	*	*				-174.7	108.2	122.6	34.1	0	0	0	0	113.1
163	S	24.6	Very low	27.6	Very low	108 Å²	108	134.7 Å²	134.7	76%	0.755	78%	0.778	S	S	*	*			trans	46.7	109.4	141.8	59.1	0	0	0	0	121.5
164	V	21.4	Very low	26.7	Very low	129 Å²	129	135.9 Å²	135.9	78%	0.782	78%	0.783	S	S	*	*			trans	-44.5	131.7	154.1	178.3	0	0	0	0	112.8	E166	V164-E166 HydrophobicContact CG1-CG 3.99Å
165	I	21.4	Very low	25.4	Very low	148 Å²	148	134 Å²	134	76%	0.759	79%	0.786	S	S	*	*			trans	-117.8	105.1	163.5	-62	176.1	0	0	0	106.9	T167	I165-T167 HydrophobicContact CG2-CG2 4.33Å
166	E	19.8	Very low	24.7	Very low	173 Å²	173	138 Å²	138	81%	0.808	80%	0.801	S	S	*	*			trans	-82.9	124.7	169.5	-76.9	-179.8	157.7	0	0	109.6	V164	V164-E166 HydrophobicContact CG1-CG 3.99Å
167	T	20.8	Very low	24.1	Very low	120 Å²	120	136.1 Å²	136.1	74%	0.736	80%	0.799	S	S	*	*			trans	-119	107.8	168.6	41.8	0	0	0	0	109.5	I165	I165-T167 HydrophobicContact CG2-CG2 4.33Å
168	Q	20.5	Very low	23.6	Very low	192 Å²	192	138.1 Å²	138.1	90%	0.897	80%	0.799	S	S	*	*			trans	-73.4	122.3	173.5	-74.7	-173.9	-22.8	0	0	110.4
169	V	22	Very low	23.1	Very low	141 Å²	141	136.7 Å²	136.7	86%	0.855	80%	0.796	S	S	*	*			trans	-101.2	111.6	171.5	178.6	0	0	0	0	108.1
170	S	24.7	Very low	22.8	Very low	115 Å²	115	141.2 Å²	141.2	80%	0.804	80%	0.8	S	S	*	*			trans	-85	117.3	174.7	43.8	0	0	0	0	110
171	G	21.1	Very low	23	Very low	78 Å²	78	138.6 Å²	138.6	80%	0.804	80%	0.798	S	S	*	*			trans	-76.6	136.1	174.7	0	0	0	0	0	111.5
172	S	25.6	Very low	23.1	Very low	108 Å²	108	141.8 Å²	141.8	76%	0.755	80%	0.8	S	S	*	*			trans	-126.8	119.7	159.8	55.7	0	0	0	0	108.6
173	A	22.7	Very low	23.1	Very low	95 Å²	95	142 Å²	142	79%	0.785	80%	0.801	S	S	*	*			trans	-77.4	133.4	-178.8	0	0	0	0	0	110.4
174	F	25.1	Very low	23.1	Very low	201 Å²	201	143 Å²	143	88%	0.882	80%	0.803	S	S	*	*			trans	-131.6	103.7	159.2	-88.7	-81.8	0	0	0	108.8
175	S	20.9	Very low	23.1	Very low	101 Å²	101	141.5 Å²	141.5	71%	0.706	80%	0.804	S	S	*	*			trans	-99	142	165.8	59.3	0	0	0	0	110
176	T	26.2	Very low	23.2	Very low	129 Å²	129	140.2 Å²	140.2	79%	0.791	80%	0.803	S	S	*	*			trans	166.8	102.2	143.9	32.1	0	0	0	0	106.7
177	S	20.6	Very low	23.2	Very low	104 Å²	104	137.4 Å²	137.4	73%	0.727	80%	0.802	S	S	*	*				66	112.8	80.9	72.3	0	0	0	0	115.3
178	R	25.3	Very low	23.4	Very low	223 Å²	223	140.3 Å²	140.3	84%	0.842	81%	0.807	S	S	*	*			trans	149.2	145.5	147.7	-93.3	-176.7	157.1	156.5	0.9	110.1
179	E	22.9	Very low	23.5	Very low	159 Å²	159	140.3 Å²	140.3	74%	0.743	81%	0.808	S	S	*	*			cis	-170.9	146	-19.7	-123.3	168.1	-179.6	0	0	103.6
180	Y	22.6	Very low	23.4	Very low	231 Å²	231	141.6 Å²	141.6	91%	0.906	81%	0.809	S	S	*	*			trans	-72.8	150.5	-172.4	-72.3	-95.7	0	0	0	114
181	P	28.5	Very low	23.4	Very low	125 Å²	125	141.9 Å²	141.9	81%	0.812	81%	0.811	S	S	*	*			trans	-108	151.3	155.5	35	-24	0	0	0	112.6
182	E	26	Very low	23.4	Very low	184 Å²	184	143.7 Å²	143.7	86%	0.86	81%	0.806	S	S	*	*			trans	-77.8	163	-159.7	-64.3	172.8	138.1	0	0	116.6
183	S	23.5	Very low	23.2	Very low	117 Å²	117	143.3 Å²	143.3	82%	0.818	81%	0.81	S	S	*	*			trans	-46.6	135.9	172.2	51.3	0	0	0	0	116.3
184	V	24.1	Very low	23.1	Very low	129 Å²	129	145.6 Å²	145.6	78%	0.782	81%	0.808	S	S	*	*			trans	-115	114.5	162.2	179.3	0	0	0	0	108.4	V186	V184-V186 HydrophobicContact CG1-CG2 4.06Å
185	A	21	Very low	23.1	Very low	99 Å²	99	140.7 Å²	140.7	82%	0.818	80%	0.804	S	S	*	*			trans	-79.2	126	170.3	0	0	0	0	0	109.4
186	V	23.8	Very low	23.2	Very low	120 Å²	120	143 Å²	143	73%	0.727	81%	0.809	S	S	*	*			trans	-126.8	108.4	168.2	-176.5	0	0	0	0	107.9	V184 E188	V184-V186 HydrophobicContact CG1-CG2 4.06Å; V186-E188 HydrophobicContact CG1-CG 4.5Å
187	S	20.5	Very low	23.2	Very low	114 Å²	114	142.7 Å²	142.7	80%	0.797	81%	0.812	S	S	*	*			trans	-96.6	113.1	168.1	47.7	0	0	0	0	108
188	E	24.7	Very low	23.3	Very low	181 Å²	181	143.2 Å²	143.2	85%	0.846	82%	0.815	S	S	*	*			trans	-134.4	128	163.8	-79.8	-167.8	158.1	0	0	110.5	V186	V186-E188 HydrophobicContact CG1-CG 4.5Å
189	E	22.1	Very low	23.2	Very low	193 Å²	193	141.6 Å²	141.6	90%	0.902	82%	0.817	S	S	*	*			trans	-74.3	132.1	-171.2	-69.2	176.3	138.6	0	0	112	S191	E189-S191 PolarHBondContact O-N 2.85Å
190	L	20.5	Very low	23.3	Very low	167 Å²	167	138.5 Å²	138.5	87%	0.874	82%	0.819	S	S	*	*			trans	-64.9	117.5	168.6	-81.7	126.8	0	0	0	110.7
191	S	23.4	Very low	23.3	Very low	121 Å²	121	133 Å²	133	85%	0.846	81%	0.809	S	S	*	*			trans	-111.7	112.4	159.9	53	0	0	0	0	109.8	E189	E189-S191 PolarHBondContact O-N 2.85Å
192	V	20.7	Very low	23	Very low	117 Å²	117	138.5 Å²	138.5	71%	0.709	81%	0.814	S	S	*	*			trans	-85.4	117.8	-178	174.4	0	0	0	0	108.9	L194	V192-L194 HydrophobicContact CG1-CD1 4Å
193	A	23.2	Very low	22.9	Very low	100 Å²	100	138.1 Å²	138.1	83%	0.826	81%	0.81	S	S	*	*			trans	-103.2	104.6	167.8	0	0	0	0	0	109.7	A195	A193-A195 PolarHBondContact O-N 3.48Å
194	L	20.4	Very low	22.9	Very low	143 Å²	143	137.8 Å²	137.8	75%	0.749	81%	0.805	S	S	*	*			trans	-63.7	122.3	168	-105.5	80.3	0	0	0	110	V192	V192-L194 HydrophobicContact CG1-CD1 4Å
195	A	24.4	Very low	23.1	Very low	98 Å²	98	137.8 Å²	137.8	81%	0.81	81%	0.805	S	S	*	*			trans	-127.3	106.3	158.4	0	0	0	0	0	109.2	A193	A193-A195 PolarHBondContact O-N 3.48Å
196	N	22.3	Very low	23.5	Very low	150 Å²	150	139.9 Å²	139.9	80%	0.802	80%	0.802	S	S	*	*			trans	-64.9	124.1	177.4	-65.7	-44.9	0	0	0	111
197	S	26.5	Very low	23.6	Very low	122 Å²	122	142 Å²	142	85%	0.853	81%	0.809	S	S	*	*			trans	-143.5	113.7	145.7	63.2	0	0	0	0	109.9
198	S	23.4	Very low	24	Very low	114 Å²	114	146.3 Å²	146.3	80%	0.797	81%	0.808	S	S	*	*			trans	-81.8	123.2	-174.7	48.7	0	0	0	0	111.1
199	E	23.4	Very low	23.9	Very low	190 Å²	190	147 Å²	147	89%	0.888	81%	0.808	S	S	*	*			trans	-160.2	60.8	147.4	-112.7	178.7	-160.6	0	0	109.6	V201	E199-V201 PolarHBondContact O-N 3.13Å
200	A	24.9	Very low	24.2	Very low	94 Å²	94	143.9 Å²	143.9	78%	0.777	80%	0.797	S	S	*	*			trans	-80.2	96.3	174.5	0	0	0	0	0	110	R202	A200-R202 PolarHBondContact O-N 2.58Å
201	V	23	Very low	24.3	Very low	115 Å²	115	143.8 Å²	143.8	70%	0.697	80%	0.796	S	S	*	*			trans	-65.5	102.5	169.8	179	0	0	0	0	108.9	E199 F203	E199-V201 PolarHBondContact O-N 3.13Å; V201-F203 HydrophobicContact CG1-CE2 4.28Å; V201-F203 HydrophobicContact CG1-CZ 4.39Å; V201-F203 PolarHBondContact O-N 3.42Å
202	R	20.7	Very low	24.3	Very low	241 Å²	241	141.1 Å²	141.1	91%	0.909	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-72.4	116.4	177	-71.9	-179.4	175.3	176.7	-1.4	110.5	A200	A200-R202 PolarHBondContact O-N 2.58Å
203	F	23.6	Very low	24.5	Very low	176 Å²	176	141.3 Å²	141.3	77%	0.772	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-87.1	139.3	167.3	-71.3	-83.7	0	0	0	110.5	V201 V205	V201-F203 HydrophobicContact CG1-CE2 4.28Å; V201-F203 HydrophobicContact CG1-CZ 4.39Å; V201-F203 PolarHBondContact O-N 3.42Å; F203-V205 PolarHBondContact O-N 3.32Å
204	P	25.3	Very low	24.4	Very low	110 Å²	110	143.9 Å²	143.9	71%	0.714	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-71.6	122.6	-177.3	27.8	-31.4	0	0	0	110.6	N206	P204-N206 PolarHBondContact O-N 2.62Å
205	V	27.3	Very low	24.5	Very low	129 Å²	129	146.1 Å²	146.1	78%	0.782	80%	0.795	S	S	*	*			trans	-73.4	103	175.3	-177.2	0	0	0	0	108	F203	F203-V205 PolarHBondContact O-N 3.32Å
206	N	29.1	Very low	24.3	Very low	143 Å²	143	148.2 Å²	148.2	77%	0.765	79%	0.791	S	S	*	*			trans	-81.5	119.8	172.9	-77.5	-14.9	0	0	0	109.8	P204 W208	P204-N206 PolarHBondContact O-N 2.62Å; N206-W208 PolarHBondContact O-N 3.09Å
207	N	26.7	Very low	24.3	Very low	164 Å²	164	151.9 Å²	151.9	88%	0.877	79%	0.794	S	S	*	*			trans	-48.1	114.2	177.8	-71	-27.8	0	0	0	112.5
208	W	28	Very low	24.3	Very low	204 Å²	204	152.1 Å²	152.1	77%	0.773	79%	0.79	S	S	*	*			trans	-86.9	133.2	169.2	53.2	-84	0	0	0	109.3	N206 L210	N206-W208 PolarHBondContact O-N 3.09Å; W208-L210 HydrophobicContact CE3-CB 4.47Å; W208-L210 HydrophobicContact CZ3-CB 4.1Å; W208-L210 HydrophobicContact CZ3-CD1 4.22Å
209	K	22.8	Very low	24.3	Very low	196 Å²	196	154.7 Å²	154.7	85%	0.852	79%	0.789	S	S	*	*			trans	-101.4	120.1	172	-136.3	178.9	-176.3	-177.7	0	107.3	I211	K209-I211 PolarHBondContact O-N 3.39Å; K209-I211 VanDerWaalsContact O-N 3.11Å
210	L	27.8	Very low	24.4	Very low	127 Å²	127	155.2 Å²	155.2	67%	0.665	79%	0.788	S	S	*	*			trans	-64	105.1	180	-175.7	70.7	0	0	0	109.9	W208 G212	W208-L210 HydrophobicContact CE3-CB 4.47Å; W208-L210 HydrophobicContact CZ3-CB 4.1Å; W208-L210 HydrophobicContact CZ3-CD1 4.22Å; L210-G212 PolarHBondContact O-N 2.8Å
211	I	22.5	Very low	24.6	Very low	166 Å²	166	159 Å²	159	85%	0.851	79%	0.787	S	S	*	*			trans	-94.7	91.4	173	-54.8	175	0	0	0	107.6	K209	K209-I211 PolarHBondContact O-N 3.39Å; K209-I211 VanDerWaalsContact O-N 3.11Å
212	G	23.8	Very low	24.7	Very low	64 Å²	64	162.3 Å²	162.3	66%	0.66	80%	0.795	S	S	*	*			trans	78.1	119	162.1	0	0	0	0	0	116.3	L210	L210-G212 PolarHBondContact O-N 2.8Å
213	T	24.9	Very low	25.1	Very low	121 Å²	121	156.5 Å²	156.5	74%	0.742	78%	0.782	S	S	*	*			trans	-84.7	112.3	168.2	1.3	0	0	0	0	108.9	Q215	T213-Q215 PolarHBondContact O-N 3.31Å
214	L	21.5	Very low	25.4	Very low	154 Å²	154	155.9 Å²	155.9	81%	0.806	79%	0.787	S	S	*	*			trans	-77.6	103.8	172.8	-150	101.1	0	0	0	108.8	L216	L214-L216 HydrophobicContact CD2-CD1 4.08Å; L214-L216 HydrophobicContact CD2-CG 4.33Å; L214-L216 PolarHBondContact O-N 3Å
215	Q	21.8	Very low	25.5	Very low	191 Å²	191	158.8 Å²	158.8	89%	0.893	79%	0.791	S	S	*	*			trans	-76.9	96.4	173.2	-78.8	-170.2	-37	0	0	110	T213 R217	T213-Q215 PolarHBondContact O-N 3.31Å; Q215-R217 PolarHBondContact O-N 3.07Å
216	L	21.1	Very low	25.6	Very low	142 Å²	142	161 Å²	161	74%	0.743	80%	0.798	S	S	*	*			trans	-76.3	111.7	166.8	-91	138.2	0	0	0	109.2	L214 V218	L214-L216 HydrophobicContact CD2-CD1 4.08Å; L214-L216 HydrophobicContact CD2-CG 4.33Å; L214-L216 PolarHBondContact O-N 3Å; L216-V218 PolarHBondContact O-N 3.47Å; L216-V218 VanDerWaalsContact O-N 3.13Å
217	R	23	Very low	25.5	Very low	227 Å²	227	163.7 Å²	163.7	86%	0.857	81%	0.805	S	S	*	*			trans	-69.3	101.7	166	-101.3	-178.9	178.5	158.6	0.1	108.3	Q215 H219	Q215-R217 PolarHBondContact O-N 3.07Å; R217-H219 PolarHBondContact O-N 3.01Å
218	V	26	Very low	25.6	Very low	127 Å²	127	164.8 Å²	164.8	77%	0.77	81%	0.805	S	S	*	*			trans	-73.6	103.1	169	-178.3	0	0	0	0	107.3	L216 K220	L216-V218 PolarHBondContact O-N 3.47Å; L216-V218 VanDerWaalsContact O-N 3.13Å; V218-K220 PolarHBondContact O-N 3.07Å
219	H	23.6	Very low	25.7	Very low	167 Å²	167	162.8 Å²	162.8	77%	0.773	81%	0.805	S	S	*	*			trans	-72	105.6	166.5	-81.6	-40.8	0	0	0	108.1	R217 K221	R217-H219 PolarHBondContact O-N 3.01Å; H219-K221 VanDerWaalsContact C-N 3.33Å; H219-K221 PolarHBondContact O-N 3.48Å
220	K	25.8	Very low	26.2	Very low	202 Å²	202	161.8 Å²	161.8	88%	0.878	80%	0.801	S	S	*	*			trans	-63	95.1	166.1	-83.8	-175.4	172	-175.8	0	108	V218	V218-K220 PolarHBondContact O-N 3.07Å
221	K	27.5	Very low	26.3	Very low	174 Å²	174	161 Å²	161	76%	0.757	81%	0.806	S	S	*	*			trans	-83.1	117.5	163.9	-132.6	-176.3	177.8	-162.5	0	106.8	H219 D223	H219-K221 VanDerWaalsContact C-N 3.33Å; H219-K221 PolarHBondContact O-N 3.48Å; K221-D223 PolarHBondContact O-N 3.15Å
222	Q	25.9	Very low	27.5	Very low	184 Å²	184	156.9 Å²	156.9	86%	0.86	79%	0.785	S	S	*	*			trans	-75.3	68.3	178.2	-113.8	173.5	-23.6	0	0	109.2
223	D	29.8	Very low	28.3	Very low	118 Å²	118	159.4 Å²	159.4	63%	0.631	79%	0.787	S	S	*	*			trans	-102.9	92.8	168.6	-71.1	-32.7	0	0	0	106.6	K221 Q225	K221-D223 PolarHBondContact O-N 3.15Å; D223-Q225 PolarHBondContact O-N 3.4Å
224	N	30.3	Very low	29.6	Very low	163 Å²	163	159.8 Å²	159.8	87%	0.872	78%	0.779	S	S	*	*			trans	-78.8	35.8	-168.9	-132.7	23.2	0	0	0	113
225	Q	27	Very low	31.5	Very low	171 Å²	171	159 Å²	159	80%	0.799	78%	0.776	S	S	*	*	S	Bend	trans	-141.6	124.3	177.4	-63.9	-174.7	4.3	0	0	108.2	D223	D223-Q225 PolarHBondContact O-N 3.4Å
226	L	29.1	Very low	33.7	Very low	177 Å²	177	153.2 Å²	153.2	93%	0.927	75%	0.746	S	S	*	*	S	Bend	trans	96.1	40.6	176.6	-49.6	168.9	0	0	0	118.1
227	E	26.7	Very low	36.4	Very low	199 Å²	199	152.3 Å²	152.3	93%	0.93	74%	0.742	S	S	*	*			trans	-111.6	28.7	156.9	-76.7	-163.9	164.5	0	0	112.9
228	E	28.5	Very low	39.2	Very low	187 Å²	187	143.9 Å²	143.9	87%	0.874	71%	0.71	S	S	*	*			trans	-104.5	7.8	176	-88.2	-166.8	168.6	0	0	115.6
229	E	30.2	Very low	42.1	Very low	162 Å²	162	142.3 Å²	142.3	76%	0.757	70%	0.702	S	S	*	*	S	Bend	trans	-100.5	131.5	166.9	-80.8	-172.2	145.9	0	0	110.5
230	F	33.8	Very low	45.3	Very low	175 Å²	175	134.9 Å²	134.9	77%	0.768	67%	0.669	S	S	*	*			trans	99.9	19.5	174.5	-47.6	-66.9	0	0	0	119.2	L232	F230-L232 PolarHBondContact O-N 3.44Å
231	S	30.5	Very low	48.4	Very low	111 Å²	111	132.3 Å²	132.3	78%	0.776	66%	0.658	S	S	*	*			trans	-72.1	74.4	146.3	64.3	0	0	0	0	108.4	V233	S231-V233 PolarHBondContact O-N 3.16Å
232	L	46.3	Very low	51.6	Low	78 Å²	78	128.1 Å²	128.1	41%	0.408	64%	0.643	S	S	.	*			trans	-53.8	113.3	176.8	-80.4	153.8	0	0	0	108.3	F230 K234 R500	F230-L232 PolarHBondContact O-N 3.44Å; L232-K234 VanDerWaalsContact O-CG 3.32Å; L232-K234 WeakPolarHBondContact O-CG 3.41Å; L232-K234 PolarHBondContact O-N 3.22Å; L232-R500 HydrophobicContact CD2-CB 4.42Å
233	V	40.9	Very low	54.8	Low	118 Å²	118	122.2 Å²	122.2	72%	0.715	62%	0.617	S	S	*	*			trans	-49.3	107.4	171.9	177.6	0	0	0	0	107.6	S231 D235	S231-V233 PolarHBondContact O-N 3.16Å; V233-D235 VanDerWaalsContact C-N 3.26Å; V233-D235 HydrophobicContact CG1-CB 4.32Å
234	K	52.9	Low	57.9	Low	128 Å²	128	119.1 Å²	119.1	56%	0.557	60%	0.599	S	S	*	*			trans	-86.5	3.8	-176.7	-69.4	-164.9	173.9	-166	0	112.7	L232 Y236 E517	L232-K234 VanDerWaalsContact O-CG 3.32Å; L232-K234 WeakPolarHBondContact O-CG 3.41Å; L232-K234 PolarHBondContact O-N 3.22Å; K234-Y236 VanDerWaalsContact O-CD2 3.28Å; K234-Y236 WeakPolarHBondContact O-CD2 3.38Å; K234-Y236 PolarHBondContact O-N 3.24Å; K234-E517 IonicContact NZ-OE2 3.34Å; K234-E517 PolarHBondContact NZ-OE2 3.06Å; K234-E517 VanDerWaalsContact NZ-OE2 3.09Å
235	D	60.4	Low	60.9	Low	139 Å²	139	113.3 Å²	113.3	74%	0.743	57%	0.571	S	S	*	*			trans	-87	81.1	-176.1	-64.5	-19.7	0	0	0	109.7	V233	V233-D235 VanDerWaalsContact C-N 3.26Å; V233-D235 HydrophobicContact CG1-CB 4.32Å
236	Y	68.5	Low	64.1	Low	68 Å²	68	106.3 Å²	106.3	27%	0.267	54%	0.539	S	S	.	.			trans	-81.8	128.9	166.4	-59.2	-84.8	0	0	0	108.2	K234 W238 I502	K234-Y236 VanDerWaalsContact O-CD2 3.28Å; K234-Y236 WeakPolarHBondContact O-CD2 3.38Å; K234-Y236 PolarHBondContact O-N 3.24Å; Y236-W238 VanDerWaalsContact C-N 3.26Å; Y236-W238 PolarHBondContact O-N 3.43Å; Y236-I502 HydrophobicContact CD1-CD1 3.54Å; Y236-I502 HydrophobicContact CD2-CD1 3.47Å; Y236-I502 VanDerWaalsContact CD2-CD1 3.47Å; Y236-I502 HydrophobicContact CD2-CG1 4.49Å; Y236-I502 HydrophobicContact CE1-CD1 3.32Å; Y236-I502 HydrophobicContact CE1-CG1 4.45Å; Y236-I502 HydrophobicContact CE2-CD1 3.26Å; Y236-I502 HydrophobicContact CE2-CG1 3.97Å; Y236-I502 HydrophobicContact CG-CD1 3.59Å
237	N	77.4	Confident	67	Low	123 Å²	123	101.7 Å²	101.7	66%	0.658	51%	0.513	S	S	*	.			trans	-77	82.8	175.3	-71.4	-48.4	0	0	0	108.9	V589	N237-V589 WeakPolarHBondContact CA-OXT 3.38Å; N237-V589 PolarHBondContact N-OXT 3.33Å
238	W	81.8	Confident	69.8	Low	51 Å²	51	99.8 Å²	99.8	19%	0.193	51%	0.508	C	S	.	.			trans	-107.8	134.3	175	-156	-87	0	0	0	110.2	Y236 P240 V512 L514 S529 T531 L550 V589	Y236-W238 VanDerWaalsContact C-N 3.26Å; Y236-W238 PolarHBondContact O-N 3.43Å; W238-P240 VanDerWaalsContact CD2-CD 3.5Å; W238-P240 HydrophobicContact CE3-CG 4.44Å; W238-P240 HydrophobicContact CH2-CG 3.87Å; W238-P240 HydrophobicContact CZ2-CG 3.99Å; W238-P240 HydrophobicContact CZ3-CB 4.38Å; W238-P240 HydrophobicContact CZ3-CG 4.1Å; W238-V512 HydrophobicContact CH2-CG1 3.83Å; W238-V512 HydrophobicContact CZ2-CG1 4.25Å; W238-L514 HydrophobicContact CD2-CD2 3.86Å; W238-L514 HydrophobicContact CE3-CD2 4.11Å; W238-L514 HydrophobicContact CG-CD2 4.03Å; W238-L514 HydrophobicContact CZ2-CB 4.37Å; W238-S529 PolarHBondContact NE1-OG 2.8Å; W238-T531 PolarHBondContact NE1-OG1 3Å; W238-L550 HydrophobicContact CH2-CD2 4.16Å; W238-L550 HydrophobicContact CZ3-CD2 4.29Å; W238-V589 HydrophobicContact CE3-CG1 4.13Å; W238-V589 HydrophobicContact CZ3-CG1 3.86Å
239	P	86.3	Confident	72.7	Confident	93 Å²	93	92.5 Å²	92.5	60%	0.604	47%	0.474	S	S	*	.	S	Bend	cis	-74.9	152.1	9.1	31	-36.1	0	0	0	114.8	T531	P239-T531 HydrophobicContact CB-CG2 4.26Å
240	P	90.8	Very high	75.4	Confident	11 Å²	11	84.8 Å²	84.8	7%	0.071	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-60.6	136.8	179.4	23.9	-34.2	0	0	0	111.1	W238 T531 W587 S588 V589	W238-P240 VanDerWaalsContact CD2-CD 3.5Å; W238-P240 HydrophobicContact CE3-CG 4.44Å; W238-P240 HydrophobicContact CH2-CG 3.87Å; W238-P240 HydrophobicContact CZ2-CG 3.99Å; W238-P240 HydrophobicContact CZ3-CB 4.38Å; W238-P240 HydrophobicContact CZ3-CG 4.1Å; P240-T531 HydrophobicContact CG-CG2 3.99Å; P240-W587 HydrophobicContact CB-CB 3.76Å; P240-W587 HydrophobicContact CB-CD2 4.39Å; P240-W587 HydrophobicContact CB-CE3 4.23Å; P240-W587 HydrophobicContact CB-CG 4.2Å; P240-W587 HydrophobicContact CG-CE3 4.49Å; P240-S588 WeakPolarHBondContact CA-O 3.25Å; P240-V589 HydrophobicContact CB-CG1 3.76Å
241	K	91.7	Very high	77.6	Confident	149 Å²	149	80.1 Å²	80.1	65%	0.648	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	125.3	177.3	177.8	179.9	-176.5	172.7	0	110.9	L243 W587 S588	K241-L243 PolarHBondContact O-N 3.12Å; K241-W587 CarbonylContact O-C 3.53Å; K241-W587 VanDerWaalsContact O-CA 3.25Å; K241-W587 WeakPolarHBondContact O-CA 3.44Å; K241-S588 WeakPolarHBondContact CB-OG 3.26Å; K241-S588 PolarHBondContact N-O 3.49Å; K241-S588 PolarHBondContact O-N 3.21Å; K241-S588 PolarHBondContact O-OG 3.03Å
242	L	94	Very high	79.3	Confident	85 Å²	85	76.5 Å²	76.5	45%	0.445	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	125.9	179.4	-175.5	64.4	0	0	0	111	K585 W587	L242-K585 HydrophobicContact CD1-CB 3.99Å; L242-K585 HydrophobicContact CD1-CD 4.5Å; L242-K585 HydrophobicContact CD1-CG 4.35Å; L242-W587 HydrophobicContact CB-CE3 3.78Å; L242-W587 HydrophobicContact CB-CH2 4.34Å; L242-W587 HydrophobicContact CB-CZ3 3.63Å; L242-W587 HydrophobicContact CD1-CD2 4.1Å; L242-W587 HydrophobicContact CD1-CE3 4Å; L242-W587 HydrophobicContact CD1-CH2 3.83Å; L242-W587 HydrophobicContact CD1-CZ2 3.93Å; L242-W587 HydrophobicContact CD1-CZ3 3.88Å; L242-W587 HydrophobicContact CG-CZ3 4.26Å
243	L	93.7	Very high	80	Confident	61 Å²	61	77.8 Å²	77.8	32%	0.319	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-42.5	174.4	-62.4	-179.8	0	0	0	111.9	K241 L549 L586	K241-L243 PolarHBondContact O-N 3.12Å; L243-L549 HydrophobicContact CD1-CD2 3.54Å; L243-L586 HydrophobicContact CB-CD2 4.27Å; L243-L586 HydrophobicContact CB-CG 4.39Å; L243-L586 HydrophobicContact CD1-CD2 4.13Å; L243-L586 HydrophobicContact CD1-CG 4.29Å; L243-L586 PolarHBondContact N-O 2.92Å
244	Q	94.5	Very high	81	Confident	52 Å²	52	76.5 Å²	76.5	24%	0.243	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	139.9	-176.7	-173.6	177.4	2.6	0	0	110.9	I246 S296 L297 K585 L586	Q244-I246 HydrophobicContact CG-CG1 4.14Å; Q244-S296 VanDerWaalsContact OE1-CA 3.29Å; Q244-S296 VanDerWaalsContact OE1-CB 3.28Å; Q244-L297 PolarHBondContact NE2-O 2.85Å; Q244-L297 VanDerWaalsContact NE2-O 3.13Å; Q244-L297 PolarHBondContact OE1-O 3.05Å; Q244-K585 WeakPolarHBondContact O-CA 3.44Å; Q244-L586 HydrophobicContact CB-CB 4.31Å; Q244-L586 PolarHBondContact N-O 3.43Å; Q244-L586 PolarHBondContact O-N 3.44Å
245	S	94.5	Very high	81.2	Confident	41 Å²	41	75.8 Å²	75.8	29%	0.287	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	132.1	167.1	-169.1	0	0	0	0	109.2	E247	S245-E247 WeakPolarHBondContact CB-OE1 3.19Å; S245-E247 PolarHBondContact OG-OE1 2.97Å
246	I	94	Very high	81.4	Confident	25 Å²	25	74.7 Å²	74.7	13%	0.128	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	94.7	176.1	-52.1	-178.8	0	0	0	107.6	Q244 E249 F250 F285 L297 A583 L584	Q244-I246 HydrophobicContact CG-CG1 4.14Å; I246-E249 HydrophobicContact CG2-CB 3.66Å; I246-F250 HydrophobicContact CG2-CE2 4.23Å; I246-F250 VanDerWaalsContact O-CD2 3.27Å; I246-F250 WeakPolarHBondContact O-CD2 3.33Å; I246-F250 WeakPolarHBondContact O-CE2 3.49Å; I246-F285 HydrophobicContact CD1-CD1 4.03Å; I246-F285 HydrophobicContact CD1-CE1 3.71Å; I246-F285 HydrophobicContact CG2-CE1 4.48Å; I246-L297 HydrophobicContact CD1-CB 4Å; I246-A583 WeakPolarHBondContact O-CA 3.38Å; I246-L584 HydrophobicContact CB-CB 4.35Å; I246-L584 HydrophobicContact CD1-CD2 4.44Å; I246-L584 PolarHBondContact N-O 2.9Å; I246-L584 PolarHBondContact O-N 3.36Å
247	E	89.9	Confident	81.5	Confident	80 Å²	80	75.6 Å²	75.6	37%	0.374	42%	0.417	S	S	.	.			trans	-101.2	-51.8	-178.2	-75.4	156.4	-143.2	0	0	111.2	S245 E249 F250 H251 A583	S245-E247 WeakPolarHBondContact CB-OE1 3.19Å; S245-E247 PolarHBondContact OG-OE1 2.97Å; E247-E249 PolarHBondContact O-N 2.94Å; E247-F250 PolarHBondContact O-N 2.86Å; E247-H251 PolarHBondContact O-CD2 2.94Å; E247-H251 PolarHBondContact O-N 2.95Å; E247-A583 HydrophobicContact CG-CB 3.55Å
248	L	86.2	Confident	81.6	Confident	159 Å²	159	71 Å²	71	83%	0.832	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-28.5	-174.9	-66.7	175.4	0	0	0	114.3	F250	L248-F250 PolarHBondContact O-N 3.48Å
249	E	87.6	Confident	81.9	Confident	33 Å²	33	68.9 Å²	68.9	15%	0.154	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-23	178.6	-177.7	51.8	-145.5	0	0	113.7	I246 E247 R283 F285 R302	I246-E249 HydrophobicContact CG2-CB 3.66Å; E247-E249 PolarHBondContact O-N 2.94Å; E249-R283 PolarHBondContact O-NH2 2.94Å; E249-R283 IonicContact OE1-CZ 2.73Å; E249-R283 IonicContact OE1-NE 3.3Å; E249-R283 PolarHBondContact OE1-NE 3.35Å; E249-R283 IonicContact OE1-NH2 3.6Å; E249-R283 PolarHBondContact OE1-NH2 2.81Å; E249-F285 HydrophobicContact CG-CZ 4.49Å; E249-R302 WeakPolarHBondContact OE1-CD 3.13Å; E249-R302 IonicContact OE1-CZ 2.79Å; E249-R302 IonicContact OE1-NE 3.48Å; E249-R302 PolarHBondContact OE1-NE 3.3Å; E249-R302 IonicContact OE1-NH2 3.76Å; E249-R302 IonicContact OE2-CZ 2.81Å; E249-R302 IonicContact OE2-NE 3.99Å; E249-R302 PolarHBondContact OE2-NE 3.27Å; E249-R302 IonicContact OE2-NH2 3.72Å; E249-R302 PolarHBondContact OE2-NH2 2.8Å
250	F	87.8	Confident	82.1	Confident	1 Å²	1	65.1 Å²	65.1	0%	0.004	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	-14.5	-175.6	-55.7	-77.1	0	0	0	113	I246 E247 L248 A252 N259 L261 S277 R283 F285 L584	I246-F250 HydrophobicContact CG2-CE2 4.23Å; I246-F250 VanDerWaalsContact O-CD2 3.27Å; I246-F250 WeakPolarHBondContact O-CD2 3.33Å; I246-F250 WeakPolarHBondContact O-CE2 3.49Å; E247-F250 PolarHBondContact O-N 2.86Å; L248-F250 PolarHBondContact O-N 3.48Å; F250-A252 PolarHBondContact O-N 2.75Å; F250-N259 VanDerWaalsContact O-CB 3.29Å; F250-N259 WeakPolarHBondContact O-CB 3.49Å; F250-N259 PolarHBondContact O-ND2 2.83Å; F250-L261 HydrophobicContact CB-CD1 4.06Å; F250-L261 HydrophobicContact CD1-CD1 3.66Å; F250-L261 HydrophobicContact CD1-CD2 4.13Å; F250-L261 HydrophobicContact CD1-CG 3.74Å; F250-L261 HydrophobicContact CD2-CD1 3.83Å; F250-L261 HydrophobicContact CE1-CD1 4Å; F250-L261 HydrophobicContact CE1-CD2 3.59Å; F250-L261 HydrophobicContact CE1-CG 3.7Å; F250-L261 HydrophobicContact CE2-CD1 4.19Å; F250-L261 HydrophobicContact CE2-CD2 4.09Å; F250-L261 HydrophobicContact CG-CD1 3.55Å; F250-L261 HydrophobicContact CG-CG 4.17Å; F250-L261 HydrophobicContact CZ-CD1 4.28Å; F250-L261 HydrophobicContact CZ-CD2 3.59Å; F250-L261 HydrophobicContact CZ-CG 4.15Å; F250-S277 WeakPolarHBondContact CD1-OG 3.3Å; F250-S277 WeakPolarHBondContact CE1-OG 2.96Å; F250-R283 VanDerWaalsContact CE1-CD 3.47Å; F250-F285 HydrophobicContact CZ-CE2 4.37Å; F250-F285 HydrophobicContact CZ-CZ 4.06Å; F250-L584 HydrophobicContact CE2-CB 3.66Å; F250-L584 HydrophobicContact CZ-CB 4.05Å
251	H	81	Confident	82.2	Confident	77 Å²	77	64.6 Å²	64.6	36%	0.356	36%	0.355	S	S	.	.	S	Bend	trans	-64.9	127.6	167.1	-68.7	-76.3	0	0	0	109.8	E247 A253 S580	E247-H251 PolarHBondContact O-CD2 2.94Å; E247-H251 PolarHBondContact O-N 2.95Å; H251-A253 PolarHBondContact O-N 2.94Å; H251-S580 PolarHBondContact CE1-O 3.1Å; H251-S580 VanDerWaalsContact CE1-O 3.3Å; H251-S580 PolarHBondContact CE1-OG 2.96Å; H251-S580 PolarHBondContact ND1-OG 3.17Å
252	A	65.4	Low	82.3	Confident	34 Å²	34	59.3 Å²	59.3	28%	0.281	33%	0.332	S	S	.	.			trans	-67.4	134.8	177.3	0	0	0	0	0	110.2	F250 V254 F257 N259	F250-A252 PolarHBondContact O-N 2.75Å; A252-V254 WeakPolarHBondContact CB-O 3.37Å; A252-V254 PolarHBondContact O-N 2.99Å; A252-F257 HydrophobicContact CB-CB 3.92Å; A252-F257 HydrophobicContact CB-CD1 3.99Å; A252-F257 HydrophobicContact CB-CG 4.47Å; A252-F257 WeakPolarHBondContact CB-O 3.41Å; A252-N259 HydrophobicContact CB-CB 4.39Å
253	A	61.1	Low	82.4	Confident	106 Å²	106	56 Å²	56	88%	0.876	32%	0.315	S	S	*	.	S	Bend	trans	-61.6	-27.1	169.5	0	0	0	0	0	111.7	H251	H251-A253 PolarHBondContact O-N 2.94Å
254	V	62	Low	82.5	Confident	91 Å²	91	53.3 Å²	53.3	55%	0.552	30%	0.301	S	S	*	.	S	Bend	trans	-92.4	119.9	175.8	-174.5	0	0	0	0	108.4	A252 L256 F257	A252-V254 WeakPolarHBondContact CB-O 3.37Å; A252-V254 PolarHBondContact O-N 2.99Å; V254-L256 PolarHBondContact O-N 2.79Å; V254-F257 HydrophobicContact CB-CB 4.44Å; V254-F257 PolarHBondContact O-N 2.92Å; V254-F257 VanDerWaalsContact O-N 3.12Å
255	P	56.5	Low	82.7	Confident	113 Å²	113	54.2 Å²	54.2	73%	0.734	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-20.6	-173.9	-26.1	32.5	0	0	0	115.4
256	L	64.1	Low	82.8	Confident	116 Å²	116	52.9 Å²	52.9	61%	0.607	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-6.8	-173.3	-64	170.5	0	0	0	114.1	V254 L575	V254-L256 PolarHBondContact O-N 2.79Å; L256-L575 HydrophobicContact CD2-CB 4.41Å; L256-L575 HydrophobicContact CD2-CD1 3.56Å
257	F	72.1	Confident	83	Confident	87 Å²	87	51.9 Å²	51.9	38%	0.382	29%	0.288	S	S	.	.			trans	-94.7	108	-178.9	-175.6	-99.9	0	0	0	110.2	A252 V254 N259 E278 D279	A252-F257 HydrophobicContact CB-CB 3.92Å; A252-F257 HydrophobicContact CB-CD1 3.99Å; A252-F257 HydrophobicContact CB-CG 4.47Å; A252-F257 WeakPolarHBondContact CB-O 3.41Å; V254-F257 HydrophobicContact CB-CB 4.44Å; V254-F257 PolarHBondContact O-N 2.92Å; V254-F257 VanDerWaalsContact O-N 3.12Å; F257-N259 HydrophobicContact CD1-CB 3.81Å; F257-N259 HydrophobicContact CE1-CB 3.69Å; F257-N259 PolarHBondContact O-N 2.89Å; F257-E278 HydrophobicContact CZ-CG 4.23Å; F257-D279 HydrophobicContact CE1-CB 3.78Å; F257-D279 HydrophobicContact CZ-CB 4.33Å
258	N	79.1	Confident	83.1	Confident	26 Å²	26	51 Å²	51	14%	0.139	29%	0.294	C	S	.	.			trans	-74.1	96.1	172.7	-179.8	12.7	0	0	0	110.7	E556 R557 M558	N258-E556 PolarHBondContact ND2-O 2.95Å; N258-E556 VanDerWaalsContact ND2-O 3.15Å; N258-R557 WeakPolarHBondContact ND2-CA 3.27Å; N258-M558 PolarHBondContact ND2-N 3.03Å
259	N	88.4	Confident	83.5	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.037	27%	0.273	C	S	.	.			trans	-92	120.2	172.8	-174.6	34.3	0	0	0	110.6	F250 A252 F257 E278 D279 N582	F250-N259 VanDerWaalsContact O-CB 3.29Å; F250-N259 WeakPolarHBondContact O-CB 3.49Å; F250-N259 PolarHBondContact O-ND2 2.83Å; A252-N259 HydrophobicContact CB-CB 4.39Å; F257-N259 HydrophobicContact CD1-CB 3.81Å; F257-N259 HydrophobicContact CE1-CB 3.69Å; F257-N259 PolarHBondContact O-N 2.89Å; N259-E278 PolarHBondContact OD1-N 3.24Å; N259-D279 PolarHBondContact ND2-OD2 3.49Å; N259-D279 WeakPolarHBondContact OD1-CB 3.44Å; N259-D279 PolarHBondContact OD1-N 2.89Å; N259-D279 VanDerWaalsContact OD1-N 3.09Å; N259-N582 PolarHBondContact O-ND2 3.31Å
260	F	89.7	Confident	83.8	Confident	13 Å²	13	45.3 Å²	45.3	6%	0.057	27%	0.266	C	S	.	.			trans	-129	155.5	177.2	59.4	-88.2	0	0	0	110.9	K262 S277 E278 R557	F260-K262 HydrophobicContact CD2-CG 4.49Å; F260-K262 HydrophobicContact CE2-CG 4.13Å; F260-S277 WeakPolarHBondContact O-CA 3.47Å; F260-E278 HydrophobicContact CD1-CB 3.99Å; F260-E278 HydrophobicContact CD1-CG 4.33Å; F260-E278 HydrophobicContact CE1-CB 3.76Å; F260-E278 HydrophobicContact CE1-CG 3.68Å; F260-E278 HydrophobicContact CE2-CB 4.43Å; F260-E278 HydrophobicContact CG-CB 4.42Å; F260-E278 HydrophobicContact CZ-CB 3.99Å; F260-E278 HydrophobicContact CZ-CG 3.98Å; F260-E278 PolarHBondContact O-N 3.41Å; F260-R557 HydrophobicContact CD1-CB 4.43Å; F260-R557 HydrophobicContact CE1-CB 3.85Å; F260-R557 HydrophobicContact CE1-CG 4.16Å; F260-R557 HydrophobicContact CZ-CB 4.16Å
261	L	94	Very high	84.1	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	143.9	174.8	-67.9	94.9	0	0	0	111.1	F250 T275 N539 S554 N582 L584	F250-L261 HydrophobicContact CB-CD1 4.06Å; F250-L261 HydrophobicContact CD1-CD1 3.66Å; F250-L261 HydrophobicContact CD1-CD2 4.13Å; F250-L261 HydrophobicContact CD1-CG 3.74Å; F250-L261 HydrophobicContact CD2-CD1 3.83Å; F250-L261 HydrophobicContact CE1-CD1 4Å; F250-L261 HydrophobicContact CE1-CD2 3.59Å; F250-L261 HydrophobicContact CE1-CG 3.7Å; F250-L261 HydrophobicContact CE2-CD1 4.19Å; F250-L261 HydrophobicContact CE2-CD2 4.09Å; F250-L261 HydrophobicContact CG-CD1 3.55Å; F250-L261 HydrophobicContact CG-CG 4.17Å; F250-L261 HydrophobicContact CZ-CD1 4.28Å; F250-L261 HydrophobicContact CZ-CD2 3.59Å; F250-L261 HydrophobicContact CZ-CG 4.15Å; L261-T275 HydrophobicContact CD2-CG2 4.06Å; L261-N539 PolarHBondContact O-ND2 3.22Å; L261-S554 WeakPolarHBondContact CD1-O 3.43Å; L261-N582 HydrophobicContact CD1-CB 4.47Å; L261-L584 HydrophobicContact CD2-CB 4.24Å
262	K	93.6	Very high	84.9	Confident	38 Å²	38	42.8 Å²	42.8	17%	0.165	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-31.5	178.1	-67	177.6	176.6	170.9	0	113.3	F260 A276 E278 N539	F260-K262 HydrophobicContact CD2-CG 4.49Å; F260-K262 HydrophobicContact CE2-CG 4.13Å; K262-A276 PolarHBondContact N-O 2.7Å; K262-E278 WeakPolarHBondContact CE-OE2 3.37Å; K262-E278 IonicContact NZ-OE2 2.81Å; K262-E278 PolarHBondContact NZ-OE2 3.1Å; K262-N539 WeakPolarHBondContact O-CB 3.48Å
263	M	94.8	Very high	86.4	Confident	17 Å²	17	41.2 Å²	41.2	8%	0.084	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.5	159.3	-178.5	59.2	180	83.4	0	0	110.9	T275 A276 Y310 F312	M263-T275 WeakPolarHBondContact O-CA 3.29Å; M263-A276 HydrophobicContact CG-CB 3.97Å; M263-A276 PolarHBondContact O-N 2.92Å; M263-A276 VanDerWaalsContact O-N 3.14Å; M263-Y310 WeakPolarHBondContact CE-O 3.48Å; M263-F312 HydrophobicContact CB-CE1 4.46Å; M263-F312 HydrophobicContact CG-CD1 3.94Å; M263-F312 HydrophobicContact CG-CE1 3.21Å; M263-F312 HydrophobicContact CG-CZ 3.72Å; M263-F312 HydrophobicContact SD-CD1 3.31Å; M263-F312 WeakPolarHBondContact SD-CD1 3.41Å; M263-F312 HydrophobicContact SD-CE1 3.19Å; M263-F312 WeakPolarHBondContact SD-CE1 3.26Å; M263-F312 HydrophobicContact SD-CE2 4.46Å; M263-F312 HydrophobicContact SD-CG 4.05Å; M263-F312 HydrophobicContact SD-CZ 3.79Å
264	C	97	Very high	88.2	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.02	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	144.8	167.5	63	0	0	0	0	110.4	L273 I274 T275 L584	C264-L273 HydrophobicContact CB-CD1 4.48Å; C264-I274 CarbonylContact C-O 3.58Å; C264-I274 WeakPolarHBondContact CA-O 3.25Å; C264-T275 HydrophobicContact CB-CG2 3.88Å; C264-L584 HydrophobicContact CB-CD1 4.17Å
265	K	97.5	Very high	89.9	Confident	72 Å²	72	31.8 Å²	31.8	31%	0.313	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	130.4	178.3	-160.5	86.1	-177.4	164.5	0	111.7	L273 I274 F312 W314 E497	K265-L273 VanDerWaalsContact C-CD1 3.46Å; K265-I274 PolarHBondContact N-O 2.98Å; K265-I274 PolarHBondContact O-N 2.99Å; K265-F312 HydrophobicContact CB-CE2 3.61Å; K265-F312 HydrophobicContact CB-CZ 4.14Å; K265-W314 PolarHBondContact O-NE1 3.41Å; K265-W314 VanDerWaalsContact O-NE1 3.13Å; K265-E497 IonicContact NZ-OE2 2.95Å; K265-E497 PolarHBondContact NZ-OE2 3.49Å
266	W	97.7	Very high	91.7	Very high	12 Å²	12	26.4 Å²	26.4	5%	0.045	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	148.2	169.4	-73	105.6	0	0	0	111.4	G270 N272 L273 L287 L297 S542 N544 A551 L586	W266-G270 VanDerWaalsContact CZ3-O 3.28Å; W266-G270 WeakPolarHBondContact CZ3-O 3.19Å; W266-N272 VanDerWaalsContact CE3-O 3.28Å; W266-L273 HydrophobicContact CB-CD1 4.47Å; W266-L273 HydrophobicContact CD2-CB 4.16Å; W266-L273 HydrophobicContact CD2-CD1 3.68Å; W266-L273 HydrophobicContact CD2-CG 4.44Å; W266-L273 HydrophobicContact CE3-CB 3.83Å; W266-L273 HydrophobicContact CE3-CD1 4.23Å; W266-L273 HydrophobicContact CG-CD1 3.79Å; W266-L273 HydrophobicContact CH2-CB 4.25Å; W266-L273 HydrophobicContact CZ2-CD1 4.4Å; W266-L273 HydrophobicContact CZ2-CD2 4.32Å; W266-L273 HydrophobicContact CZ3-CB 3.87Å; W266-L287 HydrophobicContact CH2-CB 4.41Å; W266-L287 HydrophobicContact CH2-CD1 3.98Å; W266-L287 HydrophobicContact CH2-CD2 4.39Å; W266-L287 HydrophobicContact CH2-CG 4.5Å; W266-L287 HydrophobicContact CZ3-CB 4.14Å; W266-L287 HydrophobicContact CZ3-CD2 4.37Å; W266-L297 HydrophobicContact CH2-CD2 3.64Å; W266-L297 HydrophobicContact CZ2-CD2 4.45Å; W266-L297 HydrophobicContact CZ3-CD2 4.18Å; W266-S542 PolarHBondContact N-OG 3.4Å; W266-S542 PolarHBondContact NE1-O 3.42Å; W266-N544 HydrophobicContact CD2-CB 3.81Å; W266-N544 HydrophobicContact CE3-CB 4.44Å; W266-N544 HydrophobicContact CG-CB 3.81Å; W266-N544 HydrophobicContact CZ2-CB 4.42Å; W266-A551 HydrophobicContact CZ2-CB 4.16Å; W266-A551 VanDerWaalsContact NE1-CB 3.32Å; W266-L586 HydrophobicContact CH2-CD1 4.17Å; W266-L586 HydrophobicContact CZ2-CD1 3.63Å
267	S	96.9	Very high	93.2	Very high	5 Å²	5	20.9 Å²	20.9	4%	0.035	11%	0.114	C	C	.	.			trans	-68.1	157.3	162.7	57.1	0	0	0	0	110.2	D269 G270 G271 N272	S267-D269 WeakPolarHBondContact CB-OD1 3.31Å; S267-D269 PolarHBondContact O-N 2.97Å; S267-D269 PolarHBondContact OG-OD1 3.47Å; S267-G270 PolarHBondContact O-N 3.13Å; S267-G271 PolarHBondContact OG-N 2.77Å; S267-N272 PolarHBondContact N-O 3.33Å; S267-N272 PolarHBondContact OG-N 2.99Å; S267-N272 PolarHBondContact OG-O 2.91Å
268	A	93.3	Very high	94.2	Very high	61 Å²	61	19.2 Å²	19.2	50%	0.504	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-26.1	-176	0	0	0	0	0	113.9	G270 P316 A318	A268-G270 VanDerWaalsContact C-N 3.33Å; A268-P316 VanDerWaalsContact CB-O 3.29Å; A268-P316 WeakPolarHBondContact CB-O 3.23Å; A268-A318 HydrophobicContact CB-CB 4.23Å
269	D	93.3	Very high	94.7	Very high	71 Å²	71	19.3 Å²	19.3	38%	0.38	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-1.6	174.6	66.1	-11.7	0	0	0	113.4	S267 G271 A318	S267-D269 WeakPolarHBondContact CB-OD1 3.31Å; S267-D269 PolarHBondContact O-N 2.97Å; S267-D269 PolarHBondContact OG-OD1 3.47Å; D269-G271 PolarHBondContact O-N 2.85Å; D269-G271 PolarHBondContact OD1-N 3.13Å; D269-G271 VanDerWaalsContact OD1-N 3.15Å; D269-A318 HydrophobicContact CB-CB 3.98Å; D269-A318 WeakPolarHBondContact OD1-CB 3.39Å
270	G	94.2	Very high	95	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.01	13%	0.128	C	C	.	.	S	Bend	trans	67.4	2.3	-178	0	0	0	0	0	115.4	W266 S267 A268 L287 N544	W266-G270 VanDerWaalsContact CZ3-O 3.28Å; W266-G270 WeakPolarHBondContact CZ3-O 3.19Å; S267-G270 PolarHBondContact O-N 3.13Å; A268-G270 VanDerWaalsContact C-N 3.33Å; G270-L287 WeakPolarHBondContact O-CD2 3.44Å; G270-N544 WeakPolarHBondContact CA-ND2 2.87Å; G270-N544 PolarHBondContact O-ND2 3.5Å
271	G	94.9	Very high	95.3	Very high	17 Å²	17	29.5 Å²	29.5	18%	0.175	15%	0.145	C	C	.	.	S	Bend	trans	-81.3	-26.3	-174.9	0	0	0	0	0	114.1	S267 D269 L287	S267-G271 PolarHBondContact OG-N 2.77Å; D269-G271 PolarHBondContact O-N 2.85Å; D269-G271 PolarHBondContact OD1-N 3.13Å; D269-G271 VanDerWaalsContact OD1-N 3.15Å; G271-L287 PolarHBondContact O-N 2.95Å
272	N	97.2	Very high	95.4	Very high	9 Å²	9	29.5 Å²	29.5	5%	0.048	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	150.4	-176.2	-58.9	-69.7	0	0	0	111.8	W266 S267 L284 F285 W314	W266-N272 VanDerWaalsContact CE3-O 3.28Å; S267-N272 PolarHBondContact N-O 3.33Å; S267-N272 PolarHBondContact OG-N 2.99Å; S267-N272 PolarHBondContact OG-O 2.91Å; N272-L284 HydrophobicContact CB-CD1 4Å; N272-F285 CarbonylContact C-O 3.41Å; N272-F285 VanDerWaalsContact CA-O 3.3Å; N272-F285 WeakPolarHBondContact CA-O 3.4Å; N272-W314 HydrophobicContact CB-CH2 3.78Å; N272-W314 HydrophobicContact CB-CZ2 3.82Å
273	L	97.8	Very high	95.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	129.3	178.4	179.1	75.5	0	0	0	109.2	C264 K265 W266 F285 L297 A551 L584	C264-L273 HydrophobicContact CB-CD1 4.48Å; K265-L273 VanDerWaalsContact C-CD1 3.46Å; W266-L273 HydrophobicContact CB-CD1 4.47Å; W266-L273 HydrophobicContact CD2-CB 4.16Å; W266-L273 HydrophobicContact CD2-CD1 3.68Å; W266-L273 HydrophobicContact CD2-CG 4.44Å; W266-L273 HydrophobicContact CE3-CB 3.83Å; W266-L273 HydrophobicContact CE3-CD1 4.23Å; W266-L273 HydrophobicContact CG-CD1 3.79Å; W266-L273 HydrophobicContact CH2-CB 4.25Å; W266-L273 HydrophobicContact CZ2-CD1 4.4Å; W266-L273 HydrophobicContact CZ2-CD2 4.32Å; W266-L273 HydrophobicContact CZ3-CB 3.87Å; L273-F285 HydrophobicContact CB-CB 4.31Å; L273-F285 PolarHBondContact N-O 2.96Å; L273-F285 PolarHBondContact O-N 3.46Å; L273-L297 HydrophobicContact CB-CD2 4.21Å; L273-L297 HydrophobicContact CD2-CD1 3.53Å; L273-L297 HydrophobicContact CD2-CD2 4.09Å; L273-L297 HydrophobicContact CD2-CG 4.48Å; L273-A551 HydrophobicContact CD1-CB 3.79Å; L273-A551 HydrophobicContact CD2-CB 3.84Å; L273-L584 HydrophobicContact CD2-CD1 4.03Å; L273-L584 HydrophobicContact CD2-CD2 3.86Å; L273-L584 HydrophobicContact CD2-CG 4.39Å
274	I	97.7	Very high	95.7	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	141.9	175.8	-69.5	170.7	0	0	0	109.8	C264 K265 V282 R283 L284 F312 W314 F321	C264-I274 CarbonylContact C-O 3.58Å; C264-I274 WeakPolarHBondContact CA-O 3.25Å; K265-I274 PolarHBondContact N-O 2.98Å; K265-I274 PolarHBondContact O-N 2.99Å; I274-V282 HydrophobicContact CG2-CG1 3.42Å; I274-V282 VanDerWaalsContact CG2-CG1 3.42Å; I274-R283 WeakPolarHBondContact CA-O 3.4Å; I274-L284 HydrophobicContact CD1-CD1 4.33Å; I274-L284 HydrophobicContact CG1-CD1 3.64Å; I274-F312 HydrophobicContact CB-CD2 4.42Å; I274-F312 HydrophobicContact CB-CE2 3.79Å; I274-F312 HydrophobicContact CB-CZ 3.94Å; I274-F312 HydrophobicContact CG2-CD1 4.15Å; I274-F312 HydrophobicContact CG2-CD2 3.98Å; I274-F312 HydrophobicContact CG2-CE1 3.72Å; I274-F312 HydrophobicContact CG2-CE2 3.6Å; I274-F312 HydrophobicContact CG2-CG 4.27Å; I274-F312 HydrophobicContact CG2-CZ 3.49Å; I274-F312 VanDerWaalsContact CG2-CZ 3.49Å; I274-W314 HydrophobicContact CB-CZ2 4.4Å; I274-W314 HydrophobicContact CD1-CD2 3.96Å; I274-W314 HydrophobicContact CD1-CE3 4.4Å; I274-W314 HydrophobicContact CD1-CH2 3.69Å; I274-W314 HydrophobicContact CD1-CZ2 3.19Å; I274-W314 HydrophobicContact CD1-CZ3 4.27Å; I274-W314 HydrophobicContact CG1-CH2 4.12Å; I274-W314 HydrophobicContact CG1-CZ2 3.36Å; I274-F321 HydrophobicContact CD1-CB 3.82Å; I274-F321 HydrophobicContact CD1-CD1 3.45Å; I274-F321 VanDerWaalsContact CD1-CD1 3.45Å; I274-F321 HydrophobicContact CD1-CD2 3.52Å; I274-F321 HydrophobicContact CD1-CE1 3.74Å; I274-F321 HydrophobicContact CD1-CE2 3.83Å; I274-F321 HydrophobicContact CD1-CG 3.3Å; I274-F321 HydrophobicContact CD1-CZ 3.92Å
275	T	97.5	Very high	95.7	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	149.9	165	66.1	0	0	0	0	111.1	L261 M263 C264 V282 R283 F285 L584	L261-T275 HydrophobicContact CD2-CG2 4.06Å; M263-T275 WeakPolarHBondContact O-CA 3.29Å; C264-T275 HydrophobicContact CB-CG2 3.88Å; T275-V282 WeakPolarHBondContact O-CA 3.47Å; T275-R283 PolarHBondContact N-O 3.06Å; T275-R283 PolarHBondContact O-N 2.89Å; T275-R283 WeakPolarHBondContact OG1-CB 3.35Å; T275-F285 HydrophobicContact CG2-CD2 4.35Å; T275-F285 HydrophobicContact CG2-CE2 3.97Å; T275-L584 HydrophobicContact CG2-CD1 3.9Å; T275-L584 HydrophobicContact CG2-CD2 3.79Å; T275-L584 HydrophobicContact CG2-CG 4.36Å
276	A	95.9	Very high	95.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	139	168.6	0	0	0	0	0	110	K262 M263 I309 F312	K262-A276 PolarHBondContact N-O 2.7Å; M263-A276 HydrophobicContact CG-CB 3.97Å; M263-A276 PolarHBondContact O-N 2.92Å; M263-A276 VanDerWaalsContact O-N 3.14Å; A276-I309 HydrophobicContact CB-CB 4.3Å; A276-I309 HydrophobicContact CB-CD1 3.97Å; A276-I309 HydrophobicContact CB-CG2 3.87Å; A276-F312 HydrophobicContact CB-CD1 3.89Å; A276-F312 HydrophobicContact CB-CE1 3.66Å
277	S	94.3	Very high	95.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	166.4	-174	-60.3	0	0	0	0	111.8	F250 F260 D279 R281 R283	F250-S277 WeakPolarHBondContact CD1-OG 3.3Å; F250-S277 WeakPolarHBondContact CE1-OG 2.96Å; F260-S277 WeakPolarHBondContact O-CA 3.47Å; S277-D279 VanDerWaalsContact C-N 3.29Å; S277-D279 WeakPolarHBondContact CB-OD1 3.49Å; S277-D279 PolarHBondContact O-N 3.43Å; S277-R281 PolarHBondContact N-O 3.3Å; S277-R283 PolarHBondContact OG-NH1 3.38Å
278	E	92.4	Very high	95.5	Very high	52 Å²	52	31.1 Å²	31.1	24%	0.243	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-26.2	178.2	-173	60.6	-158.9	0	0	113	F257 N259 F260 K262 R280	F257-E278 HydrophobicContact CZ-CG 4.23Å; N259-E278 PolarHBondContact OD1-N 3.24Å; F260-E278 HydrophobicContact CD1-CB 3.99Å; F260-E278 HydrophobicContact CD1-CG 4.33Å; F260-E278 HydrophobicContact CE1-CB 3.76Å; F260-E278 HydrophobicContact CE1-CG 3.68Å; F260-E278 HydrophobicContact CE2-CB 4.43Å; F260-E278 HydrophobicContact CG-CB 4.42Å; F260-E278 HydrophobicContact CZ-CB 3.99Å; F260-E278 HydrophobicContact CZ-CG 3.98Å; F260-E278 PolarHBondContact O-N 3.41Å; K262-E278 WeakPolarHBondContact CE-OE2 3.37Å; K262-E278 IonicContact NZ-OE2 2.81Å; K262-E278 PolarHBondContact NZ-OE2 3.1Å; E278-R280 PolarHBondContact O-N 2.97Å
279	D	91.4	Very high	95.4	Very high	27 Å²	27	33.7 Å²	33.7	14%	0.144	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	15.4	175.8	70.3	-10.6	0	0	0	115.7	F257 N259 S277 R281 R283	F257-D279 HydrophobicContact CE1-CB 3.78Å; F257-D279 HydrophobicContact CZ-CB 4.33Å; N259-D279 PolarHBondContact ND2-OD2 3.49Å; N259-D279 WeakPolarHBondContact OD1-CB 3.44Å; N259-D279 PolarHBondContact OD1-N 2.89Å; N259-D279 VanDerWaalsContact OD1-N 3.09Å; S277-D279 VanDerWaalsContact C-N 3.29Å; S277-D279 WeakPolarHBondContact CB-OD1 3.49Å; S277-D279 PolarHBondContact O-N 3.43Å; D279-R281 PolarHBondContact O-N 3.35Å; D279-R281 WeakPolarHBondContact OD1-CB 3.48Å; D279-R281 PolarHBondContact OD1-N 3.27Å; D279-R283 IonicContact OD1-CZ 3.33Å; D279-R283 IonicContact OD1-NH1 2.64Å; D279-R283 PolarHBondContact OD1-NH1 3.06Å; D279-R283 IonicContact OD1-NH2 2.66Å; D279-R283 IonicContact OD2-CZ 3.93Å; D279-R283 VanDerWaalsContact OD2-CZ 3.3Å; D279-R283 IonicContact OD2-NH1 3.66Å; D279-R283 PolarHBondContact OD2-NH1 2.97Å; D279-R283 VanDerWaalsContact OD2-NH1 3.07Å; D279-R283 IonicContact OD2-NH2 3.39Å; D279-R283 PolarHBondContact OD2-NH2 3.02Å
280	R	93.9	Very high	95.1	Very high	125 Å²	125	36.1 Å²	36.1	47%	0.472	16%	0.163	S	C	.	.	S	Bend	trans	57.6	34.5	-179.1	-51.2	-177.1	-69.1	-92.6	1.2	113.1	E278 I305	E278-R280 PolarHBondContact O-N 2.97Å; R280-I305 WeakPolarHBondContact O-CA 3.39Å; R280-I305 WeakPolarHBondContact O-CB 3.44Å; R280-I305 PolarHBondContact O-N 2.82Å
281	R	95.1	Very high	94.5	Very high	109 Å²	109	47.3 Å²	47.3	41%	0.411	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.7	174.4	-65.7	174.3	177.2	173.5	-2.8	111.3	S277 D279 L303	S277-R281 PolarHBondContact N-O 3.3Å; D279-R281 PolarHBondContact O-N 3.35Å; D279-R281 WeakPolarHBondContact OD1-CB 3.48Å; D279-R281 PolarHBondContact OD1-N 3.27Å; R281-L303 WeakPolarHBondContact CA-O 3.21Å
282	V	96.8	Very high	93.8	Very high	0 Å²	0	56 Å²	56	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	124.3	161.8	175.7	0	0	0	0	106.9	I274 T275 L303 I305 I309 F321 V323	I274-V282 HydrophobicContact CG2-CG1 3.42Å; I274-V282 VanDerWaalsContact CG2-CG1 3.42Å; T275-V282 WeakPolarHBondContact O-CA 3.47Å; V282-L303 HydrophobicContact CB-CB 4.25Å; V282-L303 HydrophobicContact CG1-CD1 4.5Å; V282-L303 PolarHBondContact N-O 3.07Å; V282-L303 WeakPolarHBondContact O-CB 3.39Å; V282-L303 PolarHBondContact O-N 2.9Å; V282-I305 HydrophobicContact CB-CG1 4.39Å; V282-I305 HydrophobicContact CG2-CD1 4.2Å; V282-I305 HydrophobicContact CG2-CG1 3.76Å; V282-I309 HydrophobicContact CG2-CD1 3.55Å; V282-I309 HydrophobicContact CG2-CG1 4.23Å; V282-F321 HydrophobicContact CG1-CE2 4.22Å; V282-V323 HydrophobicContact CG2-CG1 4.17Å; V282-V323 HydrophobicContact CG2-CG2 4.32Å
283	R	97.3	Very high	92.6	Very high	3 Å²	3	59.5 Å²	59.5	1%	0.011	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	129	176.8	-66.6	161.7	172.7	82.9	-4	109.1	E249 F250 I274 T275 S277 D279 F285 L299 R302	E249-R283 PolarHBondContact O-NH2 2.94Å; E249-R283 IonicContact OE1-CZ 2.73Å; E249-R283 IonicContact OE1-NE 3.3Å; E249-R283 PolarHBondContact OE1-NE 3.35Å; E249-R283 IonicContact OE1-NH2 3.6Å; E249-R283 PolarHBondContact OE1-NH2 2.81Å; F250-R283 VanDerWaalsContact CE1-CD 3.47Å; I274-R283 WeakPolarHBondContact CA-O 3.4Å; T275-R283 PolarHBondContact N-O 3.06Å; T275-R283 PolarHBondContact O-N 2.89Å; T275-R283 WeakPolarHBondContact OG1-CB 3.35Å; S277-R283 PolarHBondContact OG-NH1 3.38Å; D279-R283 IonicContact OD1-CZ 3.33Å; D279-R283 IonicContact OD1-NH1 2.64Å; D279-R283 PolarHBondContact OD1-NH1 3.06Å; D279-R283 IonicContact OD1-NH2 2.66Å; D279-R283 IonicContact OD2-CZ 3.93Å; D279-R283 VanDerWaalsContact OD2-CZ 3.3Å; D279-R283 IonicContact OD2-NH1 3.66Å; D279-R283 PolarHBondContact OD2-NH1 2.97Å; D279-R283 VanDerWaalsContact OD2-NH1 3.07Å; D279-R283 IonicContact OD2-NH2 3.39Å; D279-R283 PolarHBondContact OD2-NH2 3.02Å; R283-F285 HydrophobicContact CB-CD2 4.38Å; R283-F285 HydrophobicContact CB-CE2 3.65Å; R283-F285 HydrophobicContact CB-CZ 4.13Å; R283-L299 HydrophobicContact CB-CD1 3.92Å; R283-L299 HydrophobicContact CG-CD1 4.3Å; R283-R302 HydrophobicContact CG-CG 4.39Å
284	L	97.5	Very high	92	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.1	177	179.7	69.3	0	0	0	108.5	N272 I274 N300 C301 W314 K335	N272-L284 HydrophobicContact CB-CD1 4Å; I274-L284 HydrophobicContact CD1-CD1 4.33Å; I274-L284 HydrophobicContact CG1-CD1 3.64Å; L284-N300 HydrophobicContact CD2-CB 4.36Å; L284-N300 WeakPolarHBondContact CD2-ND2 3.35Å; L284-N300 HydrophobicContact CG-CB 4.34Å; L284-N300 WeakPolarHBondContact O-CA 3.15Å; L284-N300 WeakPolarHBondContact O-CB 3.32Å; L284-N300 PolarHBondContact O-N 2.77Å; L284-C301 PolarHBondContact N-O 3.2Å; L284-C301 PolarHBondContact O-N 3.1Å; L284-W314 HydrophobicContact CD1-CH2 3.89Å; L284-W314 HydrophobicContact CD1-CZ2 4.02Å; L284-K335 WeakPolarHBondContact CD2-O 3.43Å
285	F	97.6	Very high	91.9	Very high	2 Å²	2	67.8 Å²	67.8	1%	0.009	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	146.2	174.3	-60	-94.4	0	0	0	109.6	I246 E249 F250 N272 L273 T275 R283 L297 C298 L299 L584	I246-F285 HydrophobicContact CD1-CD1 4.03Å; I246-F285 HydrophobicContact CD1-CE1 3.71Å; I246-F285 HydrophobicContact CG2-CE1 4.48Å; E249-F285 HydrophobicContact CG-CZ 4.49Å; F250-F285 HydrophobicContact CZ-CE2 4.37Å; F250-F285 HydrophobicContact CZ-CZ 4.06Å; N272-F285 CarbonylContact C-O 3.41Å; N272-F285 VanDerWaalsContact CA-O 3.3Å; N272-F285 WeakPolarHBondContact CA-O 3.4Å; L273-F285 HydrophobicContact CB-CB 4.31Å; L273-F285 PolarHBondContact N-O 2.96Å; L273-F285 PolarHBondContact O-N 3.46Å; T275-F285 HydrophobicContact CG2-CD2 4.35Å; T275-F285 HydrophobicContact CG2-CE2 3.97Å; R283-F285 HydrophobicContact CB-CD2 4.38Å; R283-F285 HydrophobicContact CB-CE2 3.65Å; R283-F285 HydrophobicContact CB-CZ 4.13Å; F285-L297 HydrophobicContact CB-CB 4.25Å; F285-L297 HydrophobicContact CB-CD2 3.95Å; F285-L297 HydrophobicContact CD1-CB 4.29Å; F285-C298 CarbonylContact C-O 3.5Å; F285-C298 WeakPolarHBondContact CA-O 3.44Å; F285-L299 HydrophobicContact CD1-CB 4.03Å; F285-L299 HydrophobicContact CD1-CD1 4Å; F285-L299 HydrophobicContact CE1-CB 3.93Å; F285-L299 HydrophobicContact CE1-CD1 3.68Å; F285-L299 HydrophobicContact CE1-CG 4.36Å; F285-L299 HydrophobicContact CE2-CD1 4.25Å; F285-L299 HydrophobicContact CG-CD1 4.42Å; F285-L299 HydrophobicContact CZ-CD1 3.81Å; F285-L584 HydrophobicContact CD1-CD2 4.45Å; F285-L584 HydrophobicContact CD2-CD2 3.75Å; F285-L584 HydrophobicContact CE1-CD2 4.25Å; F285-L584 HydrophobicContact CE2-CD2 3.51Å; F285-L584 HydrophobicContact CG-CD2 4.22Å; F285-L584 HydrophobicContact CZ-CD2 3.79Å
286	R	96.5	Very high	91.7	Very high	98 Å²	98	68.2 Å²	68.2	37%	0.37	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	138.5	172.7	178.9	177.4	-68.1	150.7	-0.6	109.4	L297 C298	R286-L297 WeakPolarHBondContact O-CA 3.37Å; R286-C298 PolarHBondContact N-O 3.38Å; R286-C298 PolarHBondContact O-N 3.01Å
287	L	96.5	Very high	91.8	Very high	24 Å²	24	68.6 Å²	68.6	13%	0.126	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	128.2	173.3	-170.9	58.2	0	0	0	109.9	W266 G270 G271 Y295 L297 Y547 L549	W266-L287 HydrophobicContact CH2-CB 4.41Å; W266-L287 HydrophobicContact CH2-CD1 3.98Å; W266-L287 HydrophobicContact CH2-CD2 4.39Å; W266-L287 HydrophobicContact CH2-CG 4.5Å; W266-L287 HydrophobicContact CZ3-CB 4.14Å; W266-L287 HydrophobicContact CZ3-CD2 4.37Å; G270-L287 WeakPolarHBondContact O-CD2 3.44Å; G271-L287 PolarHBondContact O-N 2.95Å; L287-Y295 HydrophobicContact CD1-CD1 4.24Å; L287-Y295 HydrophobicContact CD1-CG 4.32Å; L287-Y295 HydrophobicContact CD2-CD1 4.22Å; L287-Y295 HydrophobicContact CG-CD1 4.18Å; L287-L297 HydrophobicContact CD1-CD2 4.44Å; L287-Y547 HydrophobicContact CD2-CD1 4.22Å; L287-Y547 HydrophobicContact CD2-CD2 3.71Å; L287-Y547 HydrophobicContact CD2-CE2 4.06Å; L287-Y547 HydrophobicContact CD2-CG 3.78Å; L287-L549 HydrophobicContact CD1-CD1 3.78Å; L287-L549 HydrophobicContact CD2-CD1 3.78Å; L287-L549 HydrophobicContact CG-CD1 4.43Å
288	V	94.7	Very high	91.8	Very high	55 Å²	55	71.1 Å²	71.1	33%	0.333	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	123.5	177.1	-179.1	0	0	0	0	108.5	S296 C298	V288-S296 PolarHBondContact N-O 2.65Å; V288-S296 PolarHBondContact O-N 2.84Å; V288-S296 PolarHBondContact O-OG 2.87Å; V288-C298 HydrophobicContact CG2-CB 4.12Å; V288-C298 WeakPolarHBondContact CG2-SG 3.33Å
289	E	91.6	Very high	92	Very high	114 Å²	114	71.1 Å²	71.1	53%	0.533	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	123.7	170.5	-170.8	171.9	-177.4	0	0	110.2	Y295	E289-Y295 HydrophobicContact CB-CD1 4Å; E289-Y295 HydrophobicContact CB-CE1 3.82Å; E289-Y295 HydrophobicContact CG-CD1 4.16Å; E289-Y295 HydrophobicContact CG-CE1 3.73Å
290	K	86.5	Confident	92.2	Very high	123 Å²	123	72.6 Å²	72.6	54%	0.535	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	170.6	169.3	-63	175.3	167.8	165.2	0	109.5	K292 K294 S296	K290-K292 PolarHBondContact O-N 2.94Å; K290-K294 WeakPolarHBondContact CA-O 3.41Å; K290-K294 HydrophobicContact CB-CB 4.3Å; K290-K294 VanDerWaalsContact CB-O 3.23Å; K290-K294 WeakPolarHBondContact CB-O 3.46Å; K290-K294 PolarHBondContact N-O 3.15Å; K290-K294 PolarHBondContact O-N 3.18Å; K290-S296 WeakPolarHBondContact CE-OG 2.95Å
291	R	82.3	Confident	92.2	Very high	236 Å²	236	68 Å²	68	89%	0.891	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.8	140.6	176.1	-68.1	-176.9	175.5	150.5	-1	112
292	K	79.4	Confident	92.2	Very high	199 Å²	199	68.7 Å²	68.7	87%	0.865	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	43.8	179.8	-53	-177.7	175.8	-174.4	0	113.9	K290 K294	K290-K292 PolarHBondContact O-N 2.94Å; K292-K294 PolarHBondContact O-N 2.94Å
293	S	72.2	Confident	92.1	Very high	82 Å²	82	69.6 Å²	69.6	57%	0.573	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	31.6	176.1	-50.3	0	0	0	0	113.4
294	K	85.8	Confident	92	Very high	132 Å²	132	74.5 Å²	74.5	57%	0.574	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	113.5	175.6	-75.1	-169	176.6	-172.9	0	108.3	K290 K292	K290-K294 WeakPolarHBondContact CA-O 3.41Å; K290-K294 HydrophobicContact CB-CB 4.3Å; K290-K294 VanDerWaalsContact CB-O 3.23Å; K290-K294 WeakPolarHBondContact CB-O 3.46Å; K290-K294 PolarHBondContact N-O 3.15Å; K290-K294 PolarHBondContact O-N 3.18Å; K292-K294 PolarHBondContact O-N 2.94Å
295	Y	93.7	Very high	91.9	Very high	43 Å²	43	75 Å²	75	17%	0.169	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	151.2	177.6	-60.9	-73.6	0	0	0	112.2	L287 E289 Y547 L549	L287-Y295 HydrophobicContact CD1-CD1 4.24Å; L287-Y295 HydrophobicContact CD1-CG 4.32Å; L287-Y295 HydrophobicContact CD2-CD1 4.22Å; L287-Y295 HydrophobicContact CG-CD1 4.18Å; E289-Y295 HydrophobicContact CB-CD1 4Å; E289-Y295 HydrophobicContact CB-CE1 3.82Å; E289-Y295 HydrophobicContact CG-CD1 4.16Å; E289-Y295 HydrophobicContact CG-CE1 3.73Å; Y295-Y547 AromaticContact CE1-CD1 3.74Å; Y295-Y547 HydrophobicContact CE1-CD1 3.74Å; Y295-Y547 HydrophobicContact CE1-CE1 4.35Å; Y295-Y547 AromaticContact CZ-CD1 3.74Å; Y295-L549 HydrophobicContact CD2-CD1 4.04Å; Y295-L549 HydrophobicContact CD2-CD2 3.95Å; Y295-L549 HydrophobicContact CD2-CG 4.29Å; Y295-L549 HydrophobicContact CG-CD1 3.89Å; Y295-L549 HydrophobicContact CG-CD2 4.4Å
296	S	94.8	Very high	91.5	Very high	9 Å²	9	78.5 Å²	78.5	6%	0.063	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	155	172.4	58.1	0	0	0	0	110.7	Q244 V288 K290	Q244-S296 VanDerWaalsContact OE1-CA 3.29Å; Q244-S296 VanDerWaalsContact OE1-CB 3.28Å; V288-S296 PolarHBondContact N-O 2.65Å; V288-S296 PolarHBondContact O-N 2.84Å; V288-S296 PolarHBondContact O-OG 2.87Å; K290-S296 WeakPolarHBondContact CE-OG 2.95Å
297	L	96.6	Very high	91.4	Very high	8 Å²	8	76 Å²	76	4%	0.042	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.8	174.2	-69.2	168.6	0	0	0	109.7	Q244 I246 W266 L273 F285 R286 L287 L584 L586	Q244-L297 PolarHBondContact NE2-O 2.85Å; Q244-L297 VanDerWaalsContact NE2-O 3.13Å; Q244-L297 PolarHBondContact OE1-O 3.05Å; I246-L297 HydrophobicContact CD1-CB 4Å; W266-L297 HydrophobicContact CH2-CD2 3.64Å; W266-L297 HydrophobicContact CZ2-CD2 4.45Å; W266-L297 HydrophobicContact CZ3-CD2 4.18Å; L273-L297 HydrophobicContact CB-CD2 4.21Å; L273-L297 HydrophobicContact CD2-CD1 3.53Å; L273-L297 HydrophobicContact CD2-CD2 4.09Å; L273-L297 HydrophobicContact CD2-CG 4.48Å; F285-L297 HydrophobicContact CB-CB 4.25Å; F285-L297 HydrophobicContact CB-CD2 3.95Å; F285-L297 HydrophobicContact CD1-CB 4.29Å; R286-L297 WeakPolarHBondContact O-CA 3.37Å; L287-L297 HydrophobicContact CD1-CD2 4.44Å; L297-L584 HydrophobicContact CD1-CD2 3.98Å; L297-L584 HydrophobicContact CD1-CG 4.42Å; L297-L586 HydrophobicContact CD1-CB 4.19Å; L297-L586 HydrophobicContact CD1-CD1 4.28Å; L297-L586 HydrophobicContact CG-CD1 4.46Å; L297-L586 HydrophobicContact CG-CD2 4.24Å
298	C	95.5	Very high	91.2	Very high	53 Å²	53	76.2 Å²	76.2	36%	0.358	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	138.9	164.5	69.2	0	0	0	0	109.6	F285 R286 V288 N300	F285-C298 CarbonylContact C-O 3.5Å; F285-C298 WeakPolarHBondContact CA-O 3.44Å; R286-C298 PolarHBondContact N-O 3.38Å; R286-C298 PolarHBondContact O-N 3.01Å; V288-C298 HydrophobicContact CG2-CB 4.12Å; V288-C298 WeakPolarHBondContact CG2-SG 3.33Å; C298-N300 PolarHBondContact O-N 3.43Å
299	L	96.3	Very high	91.3	Very high	51 Å²	51	73.7 Å²	73.7	27%	0.267	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	117.1	175	-179.9	68.5	0	0	0	108.9	R283 F285 R302	R283-L299 HydrophobicContact CB-CD1 3.92Å; R283-L299 HydrophobicContact CG-CD1 4.3Å; F285-L299 HydrophobicContact CD1-CB 4.03Å; F285-L299 HydrophobicContact CD1-CD1 4Å; F285-L299 HydrophobicContact CE1-CB 3.93Å; F285-L299 HydrophobicContact CE1-CD1 3.68Å; F285-L299 HydrophobicContact CE1-CG 4.36Å; F285-L299 HydrophobicContact CE2-CD1 4.25Å; F285-L299 HydrophobicContact CG-CD1 4.42Å; F285-L299 HydrophobicContact CZ-CD1 3.81Å; L299-R302 HydrophobicContact CD1-CG 4.48Å; L299-R302 HydrophobicContact CD2-CG 3.9Å
300	N	94.8	Very high	91.5	Very high	58 Å²	58	71 Å²	71	31%	0.31	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-53.2	177.9	-174	51.9	0	0	0	110.7	L284 C298 N336	L284-N300 HydrophobicContact CD2-CB 4.36Å; L284-N300 WeakPolarHBondContact CD2-ND2 3.35Å; L284-N300 HydrophobicContact CG-CB 4.34Å; L284-N300 WeakPolarHBondContact O-CA 3.15Å; L284-N300 WeakPolarHBondContact O-CB 3.32Å; L284-N300 PolarHBondContact O-N 2.77Å; C298-N300 PolarHBondContact O-N 3.43Å; N300-N336 PolarHBondContact ND2-O 3.43Å
301	C	94.8	Very high	92	Very high	28 Å²	28	65.8 Å²	65.8	19%	0.189	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	158.6	179.1	67.3	0	0	0	0	113.2	L284 N336	L284-C301 PolarHBondContact N-O 3.2Å; L284-C301 PolarHBondContact O-N 3.1Å; C301-N336 PolarHBondContact SG-O 3.39Å
302	R	95.3	Very high	92.7	Very high	125 Å²	125	55.1 Å²	55.1	47%	0.472	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	107.3	173.4	-59.9	178.1	-177.4	85.9	-4.4	107.8	E249 R283 L299 P304	E249-R302 WeakPolarHBondContact OE1-CD 3.13Å; E249-R302 IonicContact OE1-CZ 2.79Å; E249-R302 IonicContact OE1-NE 3.48Å; E249-R302 PolarHBondContact OE1-NE 3.3Å; E249-R302 IonicContact OE1-NH2 3.76Å; E249-R302 IonicContact OE2-CZ 2.81Å; E249-R302 IonicContact OE2-NE 3.99Å; E249-R302 PolarHBondContact OE2-NE 3.27Å; E249-R302 IonicContact OE2-NH2 3.72Å; E249-R302 PolarHBondContact OE2-NH2 2.8Å; R283-R302 HydrophobicContact CG-CG 4.39Å; L299-R302 HydrophobicContact CD1-CG 4.48Å; L299-R302 HydrophobicContact CD2-CG 3.9Å; R302-P304 VanDerWaalsContact O-CD 3.31Å; R302-P304 WeakPolarHBondContact O-CD 3.01Å
303	L	95.1	Very high	93.5	Very high	19 Å²	19	46.5 Å²	46.5	10%	0.099	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	112.4	-177.2	-58.2	175.8	0	0	0	109.5	R281 V282 I305 F321 Y333 G337	R281-L303 WeakPolarHBondContact CA-O 3.21Å; V282-L303 HydrophobicContact CB-CB 4.25Å; V282-L303 HydrophobicContact CG1-CD1 4.5Å; V282-L303 PolarHBondContact N-O 3.07Å; V282-L303 WeakPolarHBondContact O-CB 3.39Å; V282-L303 PolarHBondContact O-N 2.9Å; L303-I305 PolarHBondContact O-N 3.22Å; L303-F321 HydrophobicContact CD1-CE2 4.21Å; L303-F321 HydrophobicContact CD1-CZ 3.63Å; L303-Y333 HydrophobicContact CD1-CD1 4.25Å; L303-Y333 HydrophobicContact CD1-CG 4.43Å; L303-G337 WeakPolarHBondContact CD2-O 3.4Å
304	P	94.7	Very high	94.7	Very high	106 Å²	106	43.8 Å²	43.8	69%	0.688	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	121.6	173.2	29.3	-32.2	0	0	0	108.9	R302	R302-P304 VanDerWaalsContact O-CD 3.31Å; R302-P304 WeakPolarHBondContact O-CD 3.01Å
305	I	94.9	Very high	95.2	Very high	11 Å²	11	37.6 Å²	37.6	6%	0.056	20%	0.203	C	C	.	.			trans	-100.5	146.1	170.2	-54.7	-56.7	0	0	0	107.8	R280 V282 L303 D307 I309 V323 C325 Y333	R280-I305 WeakPolarHBondContact O-CA 3.39Å; R280-I305 WeakPolarHBondContact O-CB 3.44Å; R280-I305 PolarHBondContact O-N 2.82Å; V282-I305 HydrophobicContact CB-CG1 4.39Å; V282-I305 HydrophobicContact CG2-CD1 4.2Å; V282-I305 HydrophobicContact CG2-CG1 3.76Å; L303-I305 PolarHBondContact O-N 3.22Å; I305-D307 PolarHBondContact O-N 3.2Å; I305-I309 HydrophobicContact CB-CD1 4.36Å; I305-I309 HydrophobicContact CB-CG1 4.11Å; I305-I309 HydrophobicContact CG1-CD1 4.05Å; I305-I309 HydrophobicContact CG1-CG1 4.06Å; I305-I309 HydrophobicContact CG2-CG1 4.02Å; I305-V323 HydrophobicContact CD1-CG1 4.4Å; I305-C325 HydrophobicContact CG2-CB 3.7Å; I305-C325 WeakPolarHBondContact CG2-SG 3.23Å; I305-Y333 HydrophobicContact CD1-CE2 4.33Å; I305-Y333 WeakPolarHBondContact CD1-OH 3.34Å
306	S	90.2	Very high	95.2	Very high	74 Å²	74	38.2 Å²	38.2	52%	0.517	21%	0.212	S	C	.	.	S	Bend	trans	-59.4	-42.4	-175.9	41	0	0	0	0	113.5	C328	S306-C328 PolarHBondContact OG-SG 3.05Å
307	D	93.3	Very high	95.1	Very high	46 Å²	46	41.7 Å²	41.7	25%	0.246	24%	0.236	C	C	.	.	S	Bend	trans	-145.1	-168.5	-173.1	-155.5	-20.9	0	0	0	110.8	I305 I309 C325 R326	I305-D307 PolarHBondContact O-N 3.2Å; D307-I309 PolarHBondContact O-N 2.77Å; D307-C325 VanDerWaalsContact CA-SG 3.58Å; D307-C325 PolarHBondContact N-SG 3.2Å; D307-C325 PolarHBondContact O-SG 2.82Å; D307-R326 HydrophobicContact CB-CB 3.95Å; D307-R326 WeakPolarHBondContact OD2-CD 3.39Å
308	C	93	Very high	95	Very high	28 Å²	28	41.4 Å²	41.4	19%	0.189	24%	0.235	C	C	.	.			trans	-56.9	123.7	179.2	-61.3	0	0	0	0	111.6	C325 R326	C308-C325 WeakPolarHBondContact O-CA 3.47Å; C308-R326 HydrophobicContact CB-CB 4.37Å; C308-R326 PolarHBondContact O-N 2.75Å
309	I	96	Very high	95	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.015	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	129.5	171.9	-57.1	150.9	0	0	0	108.8	A276 V282 I305 D307 V323	A276-I309 HydrophobicContact CB-CB 4.3Å; A276-I309 HydrophobicContact CB-CD1 3.97Å; A276-I309 HydrophobicContact CB-CG2 3.87Å; V282-I309 HydrophobicContact CG2-CD1 3.55Å; V282-I309 HydrophobicContact CG2-CG1 4.23Å; I305-I309 HydrophobicContact CB-CD1 4.36Å; I305-I309 HydrophobicContact CB-CG1 4.11Å; I305-I309 HydrophobicContact CG1-CD1 4.05Å; I305-I309 HydrophobicContact CG1-CG1 4.06Å; I305-I309 HydrophobicContact CG2-CG1 4.02Å; D307-I309 PolarHBondContact O-N 2.77Å; I309-V323 HydrophobicContact CG1-CG1 4.49Å; I309-V323 HydrophobicContact CG2-CG1 4.04Å
310	Y	95.7	Very high	95	Very high	58 Å²	58	40 Å²	40	23%	0.227	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-45.7	175	-66.7	-45.8	0	0	0	112.8	M263 A324 R326 R354 T355 I356	M263-Y310 WeakPolarHBondContact CE-O 3.48Å; Y310-A324 PolarHBondContact N-O 2.94Å; Y310-R326 HydrophobicContact CE2-CB 3.79Å; Y310-R326 HydrophobicContact CE2-CG 4.32Å; Y310-R326 WeakPolarHBondContact OH-CB 3.14Å; Y310-R326 VanDerWaalsContact OH-CD 3.26Å; Y310-R326 WeakPolarHBondContact OH-CD 3.33Å; Y310-R326 WeakPolarHBondContact OH-CG 3.3Å; Y310-R354 HydrophobicContact CE2-CG 4.35Å; Y310-R354 VanDerWaalsContact OH-CZ 3.31Å; Y310-R354 PolarHBondContact OH-NE 2.7Å; Y310-R354 PolarHBondContact OH-NH2 3.14Å; Y310-T355 VanDerWaalsContact CD2-O 3.25Å; Y310-T355 WeakPolarHBondContact CD2-O 3.14Å; Y310-I356 VanDerWaalsContact CB-O 3.27Å; Y310-I356 WeakPolarHBondContact CB-O 3.35Å; Y310-I356 HydrophobicContact CD2-CD1 3.76Å; Y310-I356 HydrophobicContact CE2-CD1 3.73Å; Y310-I356 HydrophobicContact CG-CD1 4.24Å
311	D	97	Very high	95.2	Very high	13 Å²	13	37.3 Å²	37.3	7%	0.07	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	155	-174.2	-157.8	26	0	0	0	109.6	A324 S357 V358 R493	D311-A324 PolarHBondContact O-N 2.9Å; D311-S357 WeakPolarHBondContact OD2-CA 3.18Å; D311-V358 HydrophobicContact CB-CG1 4.21Å; D311-V358 PolarHBondContact OD2-N 2.69Å; D311-R493 IonicContact OD1-CZ 3.29Å; D311-R493 IonicContact OD1-NH1 3.85Å; D311-R493 PolarHBondContact OD1-NH1 3.01Å
312	F	97	Very high	95.3	Very high	11 Å²	11	36 Å²	36	5%	0.048	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	156.8	167.6	66.1	-106.8	0	0	0	109.6	M263 K265 I274 A276 A322 V323	M263-F312 HydrophobicContact CB-CE1 4.46Å; M263-F312 HydrophobicContact CG-CD1 3.94Å; M263-F312 HydrophobicContact CG-CE1 3.21Å; M263-F312 HydrophobicContact CG-CZ 3.72Å; M263-F312 HydrophobicContact SD-CD1 3.31Å; M263-F312 WeakPolarHBondContact SD-CD1 3.41Å; M263-F312 HydrophobicContact SD-CE1 3.19Å; M263-F312 WeakPolarHBondContact SD-CE1 3.26Å; M263-F312 HydrophobicContact SD-CE2 4.46Å; M263-F312 HydrophobicContact SD-CG 4.05Å; M263-F312 HydrophobicContact SD-CZ 3.79Å; K265-F312 HydrophobicContact CB-CE2 3.61Å; K265-F312 HydrophobicContact CB-CZ 4.14Å; I274-F312 HydrophobicContact CB-CD2 4.42Å; I274-F312 HydrophobicContact CB-CE2 3.79Å; I274-F312 HydrophobicContact CB-CZ 3.94Å; I274-F312 HydrophobicContact CG2-CD1 4.15Å; I274-F312 HydrophobicContact CG2-CD2 3.98Å; I274-F312 HydrophobicContact CG2-CE1 3.72Å; I274-F312 HydrophobicContact CG2-CE2 3.6Å; I274-F312 HydrophobicContact CG2-CG 4.27Å; I274-F312 HydrophobicContact CG2-CZ 3.49Å; I274-F312 VanDerWaalsContact CG2-CZ 3.49Å; A276-F312 HydrophobicContact CB-CD1 3.89Å; A276-F312 HydrophobicContact CB-CE1 3.66Å; F312-A322 CarbonylContact C-O 3.51Å; F312-A322 WeakPolarHBondContact CA-O 3.48Å; F312-A322 VanDerWaalsContact CB-O 3.26Å; F312-A322 WeakPolarHBondContact CB-O 3.29Å; F312-V323 HydrophobicContact CB-CG2 4.15Å
313	C	97.2	Very high	95.5	Very high	18 Å²	18	30.1 Å²	30.1	12%	0.122	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	142.9	176.4	66.9	0	0	0	0	111.1	F321 A322 V358 A359	C313-F321 CarbonylContact O-C 3.59Å; C313-F321 WeakPolarHBondContact O-CA 3.4Å; C313-F321 VanDerWaalsContact O-CB 3.31Å; C313-F321 WeakPolarHBondContact O-CB 3.38Å; C313-A322 PolarHBondContact N-O 2.99Å; C313-A322 PolarHBondContact O-N 3.38Å; C313-V358 HydrophobicContact CB-CG1 4.45Å; C313-A359 VanDerWaalsContact SG-CA 3.54Å
314	W	97.4	Very high	95.6	Very high	25 Å²	25	29.2 Å²	29.2	10%	0.095	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	150.1	169.3	-77.9	109.8	0	0	0	110.6	K265 N272 I274 L284 F321	K265-W314 PolarHBondContact O-NE1 3.41Å; K265-W314 VanDerWaalsContact O-NE1 3.13Å; N272-W314 HydrophobicContact CB-CH2 3.78Å; N272-W314 HydrophobicContact CB-CZ2 3.82Å; I274-W314 HydrophobicContact CB-CZ2 4.4Å; I274-W314 HydrophobicContact CD1-CD2 3.96Å; I274-W314 HydrophobicContact CD1-CE3 4.4Å; I274-W314 HydrophobicContact CD1-CH2 3.69Å; I274-W314 HydrophobicContact CD1-CZ2 3.19Å; I274-W314 HydrophobicContact CD1-CZ3 4.27Å; I274-W314 HydrophobicContact CG1-CH2 4.12Å; I274-W314 HydrophobicContact CG1-CZ2 3.36Å; L284-W314 HydrophobicContact CD1-CH2 3.89Å; L284-W314 HydrophobicContact CD1-CZ2 4.02Å; W314-F321 HydrophobicContact CD2-CB 4Å; W314-F321 HydrophobicContact CE3-CB 3.72Å; W314-F321 HydrophobicContact CE3-CD1 4.13Å; W314-F321 HydrophobicContact CE3-CG 4.37Å; W314-F321 AromaticContact CH2-CD1 3.92Å; W314-F321 HydrophobicContact CH2-CD1 3.92Å; W314-F321 HydrophobicContact CH2-CE1 4.46Å; W314-F321 HydrophobicContact CZ3-CB 4.14Å; W314-F321 AromaticContact CZ3-CD1 3.64Å; W314-F321 HydrophobicContact CZ3-CD1 3.64Å; W314-F321 HydrophobicContact CZ3-CG 4.32Å
315	S	96.1	Very high	95.6	Very high	3 Å²	3	24.3 Å²	24.3	2%	0.021	15%	0.148	C	C	.	.			trans	-69.1	152.6	163.8	70.1	0	0	0	0	110.6	S317 A318 S319 V320	S315-S317 PolarHBondContact O-N 3.03Å; S315-S317 PolarHBondContact OG-OG 2.79Å; S315-A318 PolarHBondContact O-N 2.76Å; S315-A318 PolarHBondContact OG-N 2.96Å; S315-S319 PolarHBondContact OG-N 2.9Å; S315-V320 WeakPolarHBondContact CB-O 3.2Å; S315-V320 PolarHBondContact N-O 2.83Å; S315-V320 PolarHBondContact OG-N 2.79Å; S315-V320 PolarHBondContact OG-O 3.35Å
316	P	93.5	Very high	95.5	Very high	56 Å²	56	28.4 Å²	28.4	36%	0.364	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-29.7	174.1	-21.6	30.2	0	0	0	113.3	A268 A318 D361 N362	A268-P316 VanDerWaalsContact CB-O 3.29Å; A268-P316 WeakPolarHBondContact CB-O 3.23Å; P316-A318 VanDerWaalsContact C-N 3.28Å; P316-A318 PolarHBondContact O-N 2.88Å; P316-D361 WeakPolarHBondContact CG-O 3.47Å; P316-N362 WeakPolarHBondContact CB-O 3.44Å; P316-N362 WeakPolarHBondContact CG-O 3.44Å
317	S	93.6	Very high	95.5	Very high	81 Å²	81	29.9 Å²	29.9	57%	0.566	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-4.4	176.6	59.2	0	0	0	0	114.5	S315 S319	S315-S317 PolarHBondContact O-N 3.03Å; S315-S317 PolarHBondContact OG-OG 2.79Å; S317-S319 PolarHBondContact O-N 3.06Å; S317-S319 PolarHBondContact OG-OG 2.95Å
318	A	94.3	Very high	95.5	Very high	2 Å²	2	28.9 Å²	28.9	2%	0.017	16%	0.161	C	C	.	.	S	Bend	trans	57	10.8	-172.9	0	0	0	0	0	115.7	A268 D269 S315 P316	A268-A318 HydrophobicContact CB-CB 4.23Å; D269-A318 HydrophobicContact CB-CB 3.98Å; D269-A318 WeakPolarHBondContact OD1-CB 3.39Å; S315-A318 PolarHBondContact O-N 2.76Å; S315-A318 PolarHBondContact OG-N 2.96Å; P316-A318 VanDerWaalsContact C-N 3.28Å; P316-A318 PolarHBondContact O-N 2.88Å
319	S	94.9	Very high	95.7	Very high	56 Å²	56	29 Å²	29	39%	0.392	16%	0.162	S	C	.	.	S	Bend	trans	-82.4	-29.1	-177.2	58.6	0	0	0	0	113.4	S315 S317 K335	S315-S319 PolarHBondContact OG-N 2.9Å; S317-S319 PolarHBondContact O-N 3.06Å; S317-S319 PolarHBondContact OG-OG 2.95Å; S319-K335 PolarHBondContact O-N 3.34Å
320	V	97.1	Very high	95.7	Very high	20 Å²	20	28.9 Å²	28.9	12%	0.121	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	160.8	-174.3	-55.9	0	0	0	0	110.8	S315 V332 Y333 I340 M380	S315-V320 WeakPolarHBondContact CB-O 3.2Å; S315-V320 PolarHBondContact N-O 2.83Å; S315-V320 PolarHBondContact OG-N 2.79Å; S315-V320 PolarHBondContact OG-O 3.35Å; V320-V332 HydrophobicContact CB-CG1 3.94Å; V320-V332 HydrophobicContact CG2-CG1 4.13Å; V320-Y333 CarbonylContact C-O 3.52Å; V320-Y333 WeakPolarHBondContact CA-O 3.12Å; V320-Y333 VanDerWaalsContact CB-O 3.31Å; V320-Y333 WeakPolarHBondContact CB-O 3.26Å; V320-I340 HydrophobicContact CB-CD1 4.14Å; V320-I340 HydrophobicContact CG1-CD1 3.44Å; V320-I340 VanDerWaalsContact CG1-CD1 3.44Å; V320-M380 HydrophobicContact CG2-CE 3.88Å
321	F	97.8	Very high	95.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	146	171	62.2	-88.2	0	0	0	111.4	I274 V282 L303 C313 W314 V323 V332 Y333 D334	I274-F321 HydrophobicContact CD1-CB 3.82Å; I274-F321 HydrophobicContact CD1-CD1 3.45Å; I274-F321 VanDerWaalsContact CD1-CD1 3.45Å; I274-F321 HydrophobicContact CD1-CD2 3.52Å; I274-F321 HydrophobicContact CD1-CE1 3.74Å; I274-F321 HydrophobicContact CD1-CE2 3.83Å; I274-F321 HydrophobicContact CD1-CG 3.3Å; I274-F321 HydrophobicContact CD1-CZ 3.92Å; V282-F321 HydrophobicContact CG1-CE2 4.22Å; L303-F321 HydrophobicContact CD1-CE2 4.21Å; L303-F321 HydrophobicContact CD1-CZ 3.63Å; C313-F321 CarbonylContact O-C 3.59Å; C313-F321 WeakPolarHBondContact O-CA 3.4Å; C313-F321 VanDerWaalsContact O-CB 3.31Å; C313-F321 WeakPolarHBondContact O-CB 3.38Å; W314-F321 HydrophobicContact CD2-CB 4Å; W314-F321 HydrophobicContact CE3-CB 3.72Å; W314-F321 HydrophobicContact CE3-CD1 4.13Å; W314-F321 HydrophobicContact CE3-CG 4.37Å; W314-F321 AromaticContact CH2-CD1 3.92Å; W314-F321 HydrophobicContact CH2-CD1 3.92Å; W314-F321 HydrophobicContact CH2-CE1 4.46Å; W314-F321 HydrophobicContact CZ3-CB 4.14Å; W314-F321 AromaticContact CZ3-CD1 3.64Å; W314-F321 HydrophobicContact CZ3-CD1 3.64Å; W314-F321 HydrophobicContact CZ3-CG 4.32Å; F321-V323 HydrophobicContact CD2-CG2 3.72Å; F321-V323 HydrophobicContact CE2-CG2 3.75Å; F321-V332 WeakPolarHBondContact O-CA 3.4Å; F321-Y333 HydrophobicContact CD2-CD2 4.26Å; F321-Y333 AromaticContact CE2-CD2 3.74Å; F321-Y333 HydrophobicContact CE2-CD2 3.74Å; F321-Y333 AromaticContact CE2-CG 3.97Å; F321-Y333 HydrophobicContact CE2-CG 3.97Å; F321-Y333 VanDerWaalsContact CZ-CB 3.46Å; F321-Y333 HydrophobicContact CZ-CD2 4.27Å; F321-Y333 HydrophobicContact CZ-CG 4.02Å; F321-Y333 PolarHBondContact N-O 2.86Å; F321-Y333 PolarHBondContact O-N 2.9Å; F321-D334 WeakPolarHBondContact CE1-O 3.43Å
322	A	97.9	Very high	95.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	141.4	178.4	0	0	0	0	0	110.7	F312 C313 V330 N331 V332 V358 I360 L367	F312-A322 CarbonylContact C-O 3.51Å; F312-A322 WeakPolarHBondContact CA-O 3.48Å; F312-A322 VanDerWaalsContact CB-O 3.26Å; F312-A322 WeakPolarHBondContact CB-O 3.29Å; C313-A322 PolarHBondContact N-O 2.99Å; C313-A322 PolarHBondContact O-N 3.38Å; A322-V330 HydrophobicContact CB-CG1 4.08Å; A322-N331 CarbonylContact C-O 3.58Å; A322-N331 WeakPolarHBondContact CA-O 3.25Å; A322-V332 HydrophobicContact CB-CG2 3.9Å; A322-V358 HydrophobicContact CB-CG2 3.81Å; A322-I360 HydrophobicContact CB-CD1 4.41Å; A322-L367 HydrophobicContact CB-CD1 3.7Å
323	V	98	Very high	95.9	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.012	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	124.1	-179.6	-176.3	0	0	0	0	109.6	V282 I305 I309 F312 F321 N331 Y333	V282-V323 HydrophobicContact CG2-CG1 4.17Å; V282-V323 HydrophobicContact CG2-CG2 4.32Å; I305-V323 HydrophobicContact CD1-CG1 4.4Å; I309-V323 HydrophobicContact CG1-CG1 4.49Å; I309-V323 HydrophobicContact CG2-CG1 4.04Å; F312-V323 HydrophobicContact CB-CG2 4.15Å; F321-V323 HydrophobicContact CD2-CG2 3.72Å; F321-V323 HydrophobicContact CE2-CG2 3.75Å; V323-N331 PolarHBondContact N-O 3.14Å; V323-N331 PolarHBondContact O-N 3.1Å; V323-N331 VanDerWaalsContact O-N 3.17Å; V323-Y333 HydrophobicContact CB-CE2 4.13Å; V323-Y333 HydrophobicContact CG2-CD2 3.92Å; V323-Y333 HydrophobicContact CG2-CE2 3.86Å
324	A	97.2	Very high	95.9	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.008	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.3	171.5	0	0	0	0	0	110.3	Y310 D311 T355 V358	Y310-A324 PolarHBondContact N-O 2.94Å; D311-A324 PolarHBondContact O-N 2.9Å; A324-T355 HydrophobicContact CB-CG2 3.79Å; A324-V358 HydrophobicContact CB-CB 4.16Å; A324-V358 HydrophobicContact CB-CG1 4.09Å
325	C	95.4	Very high	95.8	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.014	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	153.7	-177.5	175.8	0	0	0	0	110.6	I305 D307 C308 N327 C328	I305-C325 HydrophobicContact CG2-CB 3.7Å; I305-C325 WeakPolarHBondContact CG2-SG 3.23Å; D307-C325 VanDerWaalsContact CA-SG 3.58Å; D307-C325 PolarHBondContact N-SG 3.2Å; D307-C325 PolarHBondContact O-SG 2.82Å; C308-C325 WeakPolarHBondContact O-CA 3.47Å; C325-N327 PolarHBondContact O-N 3Å; C325-C328 HydrophobicContact CB-CB 4.03Å; C325-C328 PolarHBondContact O-N 3.37Å
326	R	94	Very high	95.7	Very high	97 Å²	97	33.6 Å²	33.6	37%	0.366	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	131.7	173.4	-171.9	175	-170.6	167.3	-2.3	111.8	D307 C308 Y310 C328	D307-R326 HydrophobicContact CB-CB 3.95Å; D307-R326 WeakPolarHBondContact OD2-CD 3.39Å; C308-R326 HydrophobicContact CB-CB 4.37Å; C308-R326 PolarHBondContact O-N 2.75Å; Y310-R326 HydrophobicContact CE2-CB 3.79Å; Y310-R326 HydrophobicContact CE2-CG 4.32Å; Y310-R326 WeakPolarHBondContact OH-CB 3.14Å; Y310-R326 VanDerWaalsContact OH-CD 3.26Å; Y310-R326 WeakPolarHBondContact OH-CD 3.33Å; Y310-R326 WeakPolarHBondContact OH-CG 3.3Å; R326-C328 PolarHBondContact O-N 2.99Å; R326-C328 PolarHBondContact O-SG 2.59Å
327	N	89	Confident	95.8	Very high	106 Å²	106	31.3 Å²	31.3	57%	0.567	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	29.8	173.9	-59.2	-16	0	0	0	114.2	C325	C325-N327 PolarHBondContact O-N 3Å
328	C	93.8	Very high	95.9	Very high	24 Å²	24	34.1 Å²	34.1	16%	0.162	18%	0.176	C	C	.	.	S	Bend	trans	-136.4	155.1	-175.5	-74.2	0	0	0	0	110.6	S306 C325 R326 M352	S306-C328 PolarHBondContact OG-SG 3.05Å; C325-C328 HydrophobicContact CB-CB 4.03Å; C325-C328 PolarHBondContact O-N 3.37Å; R326-C328 PolarHBondContact O-N 2.99Å; R326-C328 PolarHBondContact O-SG 2.59Å; C328-M352 WeakPolarHBondContact O-CE 3.41Å
329	P	96	Very high	96	Very high	32 Å²	32	39.4 Å²	39.4	21%	0.208	20%	0.198	C	C	.	.			trans	-62.1	156.9	171.2	26.7	-33.4	0	0	0	110.7	N331 H342 Y343 M352	P329-N331 PolarHBondContact O-N 3.05Å; P329-N331 VanDerWaalsContact O-N 3.11Å; P329-H342 HydrophobicContact CB-CB 4.25Å; P329-H342 HydrophobicContact CG-CB 4.35Å; P329-Y343 WeakPolarHBondContact CB-O 3.5Å; P329-M352 HydrophobicContact CB-CE 3.78Å; P329-M352 HydrophobicContact CG-CE 4.5Å
330	V	97.6	Very high	96.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	108.2	170.3	-175.4	0	0	0	0	106.6	A322 H342 Y343 T355 V358 L367 A369	A322-V330 HydrophobicContact CB-CG1 4.08Å; V330-H342 CarbonylContact O-C 3.6Å; V330-H342 WeakPolarHBondContact O-CA 3.19Å; V330-Y343 PolarHBondContact N-O 3.45Å; V330-Y343 PolarHBondContact O-N 3.34Å; V330-T355 HydrophobicContact CG2-CG2 3.81Å; V330-V358 HydrophobicContact CG1-CG2 3.74Å; V330-L367 HydrophobicContact CB-CD2 4.39Å; V330-L367 HydrophobicContact CG1-CD2 3.88Å; V330-A369 HydrophobicContact CG2-CB 4.27Å
331	N	97.3	Very high	96.1	Very high	13 Å²	13	40.9 Å²	40.9	7%	0.07	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	137.1	-179.4	-66	-44.2	0	0	0	108.9	A322 V323 P329 Y333 K339	A322-N331 CarbonylContact C-O 3.58Å; A322-N331 WeakPolarHBondContact CA-O 3.25Å; V323-N331 PolarHBondContact N-O 3.14Å; V323-N331 PolarHBondContact O-N 3.1Å; V323-N331 VanDerWaalsContact O-N 3.17Å; P329-N331 PolarHBondContact O-N 3.05Å; P329-N331 VanDerWaalsContact O-N 3.11Å; N331-Y333 HydrophobicContact CB-CD2 4.4Å; N331-Y333 HydrophobicContact CB-CE2 3.51Å; N331-K339 WeakPolarHBondContact OD1-CE 3.27Å; N331-K339 PolarHBondContact OD1-NZ 3.01Å
332	V	97.9	Very high	96	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.3	173.9	-176.7	0	0	0	0	108.8	V320 F321 A322 I340 A341 Y343 L367	V320-V332 HydrophobicContact CB-CG1 3.94Å; V320-V332 HydrophobicContact CG2-CG1 4.13Å; F321-V332 WeakPolarHBondContact O-CA 3.4Å; A322-V332 HydrophobicContact CB-CG2 3.9Å; V332-I340 HydrophobicContact CB-CG1 4.15Å; V332-I340 HydrophobicContact CG1-CD1 3.77Å; V332-I340 HydrophobicContact CG1-CG1 3.86Å; V332-I340 VanDerWaalsContact O-CG1 3.32Å; V332-I340 WeakPolarHBondContact O-CG1 3.3Å; V332-I340 PolarHBondContact O-N 3.12Å; V332-A341 HydrophobicContact CB-CB 4.33Å; V332-A341 PolarHBondContact N-O 2.91Å; V332-A341 PolarHBondContact O-N 3.01Å; V332-Y343 HydrophobicContact CB-CE2 4.31Å; V332-Y343 HydrophobicContact CG2-CD2 3.77Å; V332-Y343 HydrophobicContact CG2-CE2 3.49Å; V332-Y343 VanDerWaalsContact CG2-CE2 3.49Å; V332-L367 HydrophobicContact CG2-CD2 4.45Å
333	Y	97.8	Very high	96	Very high	20 Å²	20	45 Å²	45	8%	0.078	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	150.4	-178.9	-58.4	-94.2	0	0	0	109.5	L303 I305 V320 F321 V323 N331 E338 K339	L303-Y333 HydrophobicContact CD1-CD1 4.25Å; L303-Y333 HydrophobicContact CD1-CG 4.43Å; I305-Y333 HydrophobicContact CD1-CE2 4.33Å; I305-Y333 WeakPolarHBondContact CD1-OH 3.34Å; V320-Y333 CarbonylContact C-O 3.52Å; V320-Y333 WeakPolarHBondContact CA-O 3.12Å; V320-Y333 VanDerWaalsContact CB-O 3.31Å; V320-Y333 WeakPolarHBondContact CB-O 3.26Å; F321-Y333 HydrophobicContact CD2-CD2 4.26Å; F321-Y333 AromaticContact CE2-CD2 3.74Å; F321-Y333 HydrophobicContact CE2-CD2 3.74Å; F321-Y333 AromaticContact CE2-CG 3.97Å; F321-Y333 HydrophobicContact CE2-CG 3.97Å; F321-Y333 VanDerWaalsContact CZ-CB 3.46Å; F321-Y333 HydrophobicContact CZ-CD2 4.27Å; F321-Y333 HydrophobicContact CZ-CG 4.02Å; F321-Y333 PolarHBondContact N-O 2.86Å; F321-Y333 PolarHBondContact O-N 2.9Å; V323-Y333 HydrophobicContact CB-CE2 4.13Å; V323-Y333 HydrophobicContact CG2-CD2 3.92Å; V323-Y333 HydrophobicContact CG2-CE2 3.86Å; N331-Y333 HydrophobicContact CB-CD2 4.4Å; N331-Y333 HydrophobicContact CB-CE2 3.51Å; Y333-E338 CarbonylContact C-O 3.58Å; Y333-E338 WeakPolarHBondContact CA-O 3.01Å; Y333-K339 HydrophobicContact CD1-CB 3.86Å; Y333-K339 HydrophobicContact CD1-CG 4.45Å; Y333-K339 HydrophobicContact CE1-CB 3.75Å; Y333-K339 HydrophobicContact CE1-CG 4.16Å
334	D	96.6	Very high	96	Very high	24 Å²	24	46.4 Å²	46.4	13%	0.128	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	171.3	169	84.5	-19.9	0	0	0	111.1	F321 N336 G337 E338 I340	F321-D334 WeakPolarHBondContact CE1-O 3.43Å; D334-N336 VanDerWaalsContact CG-N 3.35Å; D334-N336 PolarHBondContact O-N 3.39Å; D334-N336 VanDerWaalsContact OD1-C 3.31Å; D334-N336 WeakPolarHBondContact OD1-CA 3.32Å; D334-N336 WeakPolarHBondContact OD1-CB 3.13Å; D334-N336 PolarHBondContact OD1-N 2.98Å; D334-N336 WeakPolarHBondContact OD2-CB 3.42Å; D334-N336 PolarHBondContact OD2-ND2 2.86Å; D334-G337 PolarHBondContact O-N 2.96Å; D334-G337 PolarHBondContact OD1-N 3.26Å; D334-E338 PolarHBondContact N-O 3.25Å; D334-E338 PolarHBondContact OD1-N 2.81Å; D334-I340 HydrophobicContact CB-CG2 4.01Å
335	K	95.4	Very high	95.9	Very high	97 Å²	97	46.4 Å²	46.4	42%	0.422	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-7.3	174.7	68.6	178.9	-179.2	-179	0	115	L284 S319	L284-K335 WeakPolarHBondContact CD2-O 3.43Å; S319-K335 PolarHBondContact O-N 3.34Å
336	N	95	Very high	96	Very high	71 Å²	71	47.1 Å²	47.1	38%	0.38	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-12.8	175.5	-55.3	-58.9	0	0	0	112.4	N300 C301 D334	N300-N336 PolarHBondContact ND2-O 3.43Å; C301-N336 PolarHBondContact SG-O 3.39Å; D334-N336 VanDerWaalsContact CG-N 3.35Å; D334-N336 PolarHBondContact O-N 3.39Å; D334-N336 VanDerWaalsContact OD1-C 3.31Å; D334-N336 WeakPolarHBondContact OD1-CA 3.32Å; D334-N336 WeakPolarHBondContact OD1-CB 3.13Å; D334-N336 PolarHBondContact OD1-N 2.98Å; D334-N336 WeakPolarHBondContact OD2-CB 3.42Å; D334-N336 PolarHBondContact OD2-ND2 2.86Å
337	G	95.2	Very high	95.9	Very high	9 Å²	9	44.4 Å²	44.4	9%	0.093	23%	0.225	C	C	.	.	S	Bend	trans	98.5	9.2	-179.5	0	0	0	0	0	114.9	L303 D334	L303-G337 WeakPolarHBondContact CD2-O 3.4Å; D334-G337 PolarHBondContact O-N 2.96Å; D334-G337 PolarHBondContact OD1-N 3.26Å
338	E	96.2	Very high	96	Very high	139 Å²	139	45.8 Å²	45.8	65%	0.65	24%	0.242	S	C	*	.			trans	-78.5	134	172.4	-62.2	-167.5	158.7	0	0	110.5	Y333 D334 I340	Y333-E338 CarbonylContact C-O 3.58Å; Y333-E338 WeakPolarHBondContact CA-O 3.01Å; D334-E338 PolarHBondContact N-O 3.25Å; D334-E338 PolarHBondContact OD1-N 2.81Å; E338-I340 PolarHBondContact O-N 2.91Å
339	K	96.4	Very high	96	Very high	113 Å²	113	52 Å²	52	49%	0.491	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	117.9	179.1	-175	-178	177.5	176.2	0	109.7	N331 Y333	N331-K339 WeakPolarHBondContact OD1-CE 3.27Å; N331-K339 PolarHBondContact OD1-NZ 3.01Å; Y333-K339 HydrophobicContact CD1-CB 3.86Å; Y333-K339 HydrophobicContact CD1-CG 4.45Å; Y333-K339 HydrophobicContact CE1-CB 3.75Å; Y333-K339 HydrophobicContact CE1-CG 4.16Å
340	I	95.9	Very high	95.8	Very high	97 Å²	97	55.3 Å²	55.3	50%	0.497	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-33.2	-177.9	58.5	168	0	0	0	113.2	V320 V332 D334 E338	V320-I340 HydrophobicContact CB-CD1 4.14Å; V320-I340 HydrophobicContact CG1-CD1 3.44Å; V320-I340 VanDerWaalsContact CG1-CD1 3.44Å; V332-I340 HydrophobicContact CB-CG1 4.15Å; V332-I340 HydrophobicContact CG1-CD1 3.77Å; V332-I340 HydrophobicContact CG1-CG1 3.86Å; V332-I340 VanDerWaalsContact O-CG1 3.32Å; V332-I340 WeakPolarHBondContact O-CG1 3.3Å; V332-I340 PolarHBondContact O-N 3.12Å; D334-I340 HydrophobicContact CB-CG2 4.01Å; E338-I340 PolarHBondContact O-N 2.91Å
341	A	96.8	Very high	95.7	Very high	10 Å²	10	60.3 Å²	60.3	8%	0.083	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	165.2	-173.4	0	0	0	0	0	111.7	V332 Y343 P383	V332-A341 HydrophobicContact CB-CB 4.33Å; V332-A341 PolarHBondContact N-O 2.91Å; V332-A341 PolarHBondContact O-N 3.01Å; A341-Y343 HydrophobicContact CB-CE2 3.85Å; A341-P383 HydrophobicContact CB-CB 4.11Å; A341-P383 HydrophobicContact CB-CG 3.89Å
342	H	96.8	Very high	95.5	Very high	84 Å²	84	63.1 Å²	63.1	39%	0.389	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	143.8	170.6	67.1	-83	0	0	0	110.2	P329 V330 G384	P329-H342 HydrophobicContact CB-CB 4.25Å; P329-H342 HydrophobicContact CG-CB 4.35Å; V330-H342 CarbonylContact O-C 3.6Å; V330-H342 WeakPolarHBondContact O-CA 3.19Å; H342-G384 PolarHBondContact O-N 2.8Å
343	Y	97.9	Very high	95.3	Very high	4 Å²	4	63.9 Å²	63.9	2%	0.016	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	122.1	-178.6	-60	-86.9	0	0	0	109.4	P329 V330 V332 A341 P345 L367 F378 D379 M380 G384	P329-Y343 WeakPolarHBondContact CB-O 3.5Å; V330-Y343 PolarHBondContact N-O 3.45Å; V330-Y343 PolarHBondContact O-N 3.34Å; V332-Y343 HydrophobicContact CB-CE2 4.31Å; V332-Y343 HydrophobicContact CG2-CD2 3.77Å; V332-Y343 HydrophobicContact CG2-CE2 3.49Å; V332-Y343 VanDerWaalsContact CG2-CE2 3.49Å; A341-Y343 HydrophobicContact CB-CE2 3.85Å; Y343-P345 WeakPolarHBondContact O-CD 3.4Å; Y343-L367 HydrophobicContact CD2-CD2 3.47Å; Y343-L367 VanDerWaalsContact CD2-CD2 3.47Å; Y343-L367 HydrophobicContact CE2-CD2 4.07Å; Y343-L367 HydrophobicContact CG-CD2 3.77Å; Y343-F378 HydrophobicContact CD1-CB 3.55Å; Y343-F378 AromaticContact CD1-CD1 3.67Å; Y343-F378 HydrophobicContact CD1-CD1 3.67Å; Y343-F378 AromaticContact CD1-CG 3.76Å; Y343-F378 HydrophobicContact CD1-CG 3.76Å; Y343-F378 HydrophobicContact CE1-CB 4.05Å; Y343-F378 HydrophobicContact CG-CB 4.21Å; Y343-F378 HydrophobicContact CG-CD1 4.09Å; Y343-F378 HydrophobicContact CG-CG 4.1Å; Y343-D379 WeakPolarHBondContact CE1-O 3.43Å; Y343-M380 WeakPolarHBondContact OH-CA 3.37Å; Y343-M380 PolarHBondContact OH-O 2.87Å; Y343-G384 WeakPolarHBondContact CA-O 3.49Å
344	T	96.9	Very high	95.2	Very high	31 Å²	31	68 Å²	68	19%	0.19	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	106.5	-171.7	-55.2	0	0	0	0	108.6	I346 M352 G384 Q386	T344-I346 HydrophobicContact CG2-CD1 4.06Å; T344-I346 HydrophobicContact CG2-CG1 3.77Å; T344-I346 PolarHBondContact O-N 3.28Å; T344-M352 HydrophobicContact CG2-CE 3.6Å; T344-M352 HydrophobicContact CG2-SD 4.45Å; T344-G384 PolarHBondContact N-O 3.12Å; T344-Q386 PolarHBondContact O-OE1 3.29Å
345	P	96.7	Very high	95.2	Very high	0 Å²	0	67 Å²	67	0%	0	33%	0.334	C	S	.	.			trans	-74.3	117.1	174.7	27.8	-33.2	0	0	0	109.7	Y343 M352 S353 T355 Y376 F378	Y343-P345 WeakPolarHBondContact O-CD 3.4Å; P345-M352 CarbonylContact O-C 3.48Å; P345-M352 WeakPolarHBondContact O-CA 3.46Å; P345-S353 WeakPolarHBondContact CG-O 3.15Å; P345-S353 PolarHBondContact O-N 2.91Å; P345-T355 WeakPolarHBondContact CG-OG1 3.49Å; P345-Y376 HydrophobicContact CB-CD1 3.67Å; P345-Y376 HydrophobicContact CB-CD2 3.74Å; P345-Y376 HydrophobicContact CB-CE1 4.1Å; P345-Y376 HydrophobicContact CB-CE2 4.15Å; P345-Y376 HydrophobicContact CB-CG 3.49Å; P345-Y376 VanDerWaalsContact CB-CG 3.49Å; P345-F378 HydrophobicContact CB-CZ 3.86Å; P345-F378 HydrophobicContact CG-CZ 4.44Å
346	I	95.8	Very high	95.3	Very high	18 Å²	18	63.4 Å²	63.4	9%	0.092	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-114.3	128.3	-176.4	-62.4	174.4	0	0	0	110.1	T344 D350 E351 Y376 R385 Q386	T344-I346 HydrophobicContact CG2-CD1 4.06Å; T344-I346 HydrophobicContact CG2-CG1 3.77Å; T344-I346 PolarHBondContact O-N 3.28Å; I346-D350 HydrophobicContact CG2-CB 4.46Å; I346-D350 WeakPolarHBondContact CG2-OD1 3.27Å; I346-E351 WeakPolarHBondContact CA-O 3.4Å; I346-Y376 WeakPolarHBondContact O-CE1 3.41Å; I346-R385 HydrophobicContact CD1-CG 3.89Å; I346-Q386 PolarHBondContact O-NE2 2.81Å
347	N	93.3	Very high	95.4	Very high	39 Å²	39	60 Å²	60	21%	0.209	30%	0.301	C	S	.	.			trans	-81	-179.3	179.8	71.6	17.4	0	0	0	112.4	K349 D350 E351	N347-K349 PolarHBondContact O-N 3.07Å; N347-K349 VanDerWaalsContact O-N 3.16Å; N347-K349 WeakPolarHBondContact OD1-CA 3.47Å; N347-K349 WeakPolarHBondContact OD1-CB 2.99Å; N347-K349 PolarHBondContact OD1-N 3.39Å; N347-D350 PolarHBondContact O-N 3.13Å; N347-D350 VanDerWaalsContact O-N 3.11Å; N347-D350 PolarHBondContact OD1-N 3.34Å; N347-E351 PolarHBondContact N-O 3.48Å; N347-E351 PolarHBondContact ND2-OE2 2.71Å; N347-E351 VanDerWaalsContact ND2-OE2 3.09Å; N347-E351 PolarHBondContact OD1-N 3.01Å; N347-E351 PolarHBondContact OD1-O 3.04Å
348	C	91.1	Very high	95.6	Very high	135 Å²	135	59.8 Å²	59.8	91%	0.912	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-10	178.4	58.7	0	0	0	0	114.8
349	K	93.3	Very high	95.6	Very high	154 Å²	154	53.8 Å²	53.8	67%	0.67	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	12.1	175.1	-58.2	-176.5	176.8	-173.6	0	112.5	N347 E351	N347-K349 PolarHBondContact O-N 3.07Å; N347-K349 VanDerWaalsContact O-N 3.16Å; N347-K349 WeakPolarHBondContact OD1-CA 3.47Å; N347-K349 WeakPolarHBondContact OD1-CB 2.99Å; N347-K349 PolarHBondContact OD1-N 3.39Å; K349-E351 HydrophobicContact CB-CG 4.05Å; K349-E351 PolarHBondContact O-N 3.46Å
350	D	92.8	Very high	95.6	Very high	103 Å²	103	49 Å²	49	55%	0.551	25%	0.252	S	S	*	.	S	Bend	trans	59.5	21.8	-173.6	-151.9	42.4	0	0	0	114.2	I346 N347 R385	I346-D350 HydrophobicContact CG2-CB 4.46Å; I346-D350 WeakPolarHBondContact CG2-OD1 3.27Å; N347-D350 PolarHBondContact O-N 3.13Å; N347-D350 VanDerWaalsContact O-N 3.11Å; N347-D350 PolarHBondContact OD1-N 3.34Å; D350-R385 IonicContact OD1-CZ 3.92Å; D350-R385 VanDerWaalsContact OD1-CZ 3.29Å; D350-R385 IonicContact OD1-NH1 3.99Å; D350-R385 PolarHBondContact OD1-NH1 3.04Å; D350-R385 IonicContact OD1-NH2 3.56Å; D350-R385 PolarHBondContact OD1-NH2 3.3Å; D350-R385 IonicContact OD2-NH2 2.67Å
351	E	94.1	Very high	95.5	Very high	105 Å²	105	44.7 Å²	44.7	49%	0.491	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-96.6	147.2	176.7	-55.2	164.7	155.3	0	0	110.6	I346 N347 K349 S353	I346-E351 WeakPolarHBondContact CA-O 3.4Å; N347-E351 PolarHBondContact N-O 3.48Å; N347-E351 PolarHBondContact ND2-OE2 2.71Å; N347-E351 VanDerWaalsContact ND2-OE2 3.09Å; N347-E351 PolarHBondContact OD1-N 3.01Å; N347-E351 PolarHBondContact OD1-O 3.04Å; K349-E351 HydrophobicContact CB-CG 4.05Å; K349-E351 PolarHBondContact O-N 3.46Å; E351-S353 PolarHBondContact O-N 3.03Å
352	M	93.5	Very high	95.3	Very high	71 Å²	71	47.1 Å²	47.1	35%	0.35	24%	0.242	S	C	.	.	B	Isolated β-bridge	trans	-65.2	122.4	171.4	175.8	166.9	-129.3	0	0	111.3	C328 P329 T344 P345	C328-M352 WeakPolarHBondContact O-CE 3.41Å; P329-M352 HydrophobicContact CB-CE 3.78Å; P329-M352 HydrophobicContact CG-CE 4.5Å; T344-M352 HydrophobicContact CG2-CE 3.6Å; T344-M352 HydrophobicContact CG2-SD 4.45Å; P345-M352 CarbonylContact O-C 3.48Å; P345-M352 WeakPolarHBondContact O-CA 3.46Å
353	S	94.8	Very high	95	Very high	17 Å²	17	47.8 Å²	47.8	12%	0.119	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-78.3	140.1	170.9	-68.6	0	0	0	0	111.2	P345 E351 T355 Y376	P345-S353 WeakPolarHBondContact CG-O 3.15Å; P345-S353 PolarHBondContact O-N 2.91Å; E351-S353 PolarHBondContact O-N 3.03Å; S353-T355 PolarHBondContact O-N 2.99Å; S353-Y376 PolarHBondContact OG-OH 2.83Å; S353-Y376 VanDerWaalsContact OG-OH 3.06Å
354	R	95.2	Very high	94.7	Very high	108 Å²	108	48.8 Å²	48.8	41%	0.408	26%	0.263	S	S	.	.			trans	-78.3	107	179.1	-174.3	170.2	176.5	176.2	-10.3	110.9	Y310 I356	Y310-R354 HydrophobicContact CE2-CG 4.35Å; Y310-R354 VanDerWaalsContact OH-CZ 3.31Å; Y310-R354 PolarHBondContact OH-NE 2.7Å; Y310-R354 PolarHBondContact OH-NH2 3.14Å; R354-I356 HydrophobicContact CG-CD1 3.99Å
355	T	97	Very high	94.5	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.012	27%	0.271	C	S	.	.			trans	-71.9	130	171.2	-52	0	0	0	0	110.6	Y310 A324 V330 P345 S353 S357 A369	Y310-T355 VanDerWaalsContact CD2-O 3.25Å; Y310-T355 WeakPolarHBondContact CD2-O 3.14Å; A324-T355 HydrophobicContact CB-CG2 3.79Å; V330-T355 HydrophobicContact CG2-CG2 3.81Å; P345-T355 WeakPolarHBondContact CG-OG1 3.49Å; S353-T355 PolarHBondContact O-N 2.99Å; T355-S357 WeakPolarHBondContact CG2-O 2.97Å; T355-A369 HydrophobicContact CG2-CB 3.65Å
356	I	97.1	Very high	94.5	Very high	21 Å²	21	50.8 Å²	50.8	11%	0.108	28%	0.278	C	S	.	.			trans	-112.4	-33.1	178.4	-62	-60.1	0	0	0	111.4	Y310 R354 G370 I403 Y422	Y310-I356 VanDerWaalsContact CB-O 3.27Å; Y310-I356 WeakPolarHBondContact CB-O 3.35Å; Y310-I356 HydrophobicContact CD2-CD1 3.76Å; Y310-I356 HydrophobicContact CE2-CD1 3.73Å; Y310-I356 HydrophobicContact CG-CD1 4.24Å; R354-I356 HydrophobicContact CG-CD1 3.99Å; I356-G370 PolarHBondContact N-O 2.89Å; I356-I403 HydrophobicContact CB-CG2 3.91Å; I356-I403 HydrophobicContact CG1-CG2 3.62Å; I356-I403 HydrophobicContact CG2-CG2 4.01Å; I356-Y422 HydrophobicContact CG2-CE2 3.89Å
357	S	97.6	Very high	94.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	151.3	176.9	52.7	0	0	0	0	110.7	D311 T355 G370 I404 S405 F407	D311-S357 WeakPolarHBondContact OD2-CA 3.18Å; T355-S357 WeakPolarHBondContact CG2-O 2.97Å; S357-G370 PolarHBondContact N-O 3.37Å; S357-G370 PolarHBondContact O-N 3.38Å; S357-I404 PolarHBondContact OG-O 3.48Å; S357-S405 VanDerWaalsContact CB-O 3.27Å; S357-S405 WeakPolarHBondContact CB-O 3.5Å; S357-F407 VanDerWaalsContact OG-CE2 3.26Å; S357-F407 WeakPolarHBondContact OG-CE2 3.29Å
358	V	97.7	Very high	94.7	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.024	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	137.3	-179.7	65.3	0	0	0	0	109.8	D311 C313 A322 A324 V330 L367 Y368	D311-V358 HydrophobicContact CB-CG1 4.21Å; D311-V358 PolarHBondContact OD2-N 2.69Å; C313-V358 HydrophobicContact CB-CG1 4.45Å; A322-V358 HydrophobicContact CB-CG2 3.81Å; A324-V358 HydrophobicContact CB-CB 4.16Å; A324-V358 HydrophobicContact CB-CG1 4.09Å; V330-V358 HydrophobicContact CG1-CG2 3.74Å; V358-L367 HydrophobicContact CG2-CD1 3.45Å; V358-L367 VanDerWaalsContact CG2-CD1 3.45Å; V358-L367 HydrophobicContact CG2-CG 4.24Å; V358-Y368 WeakPolarHBondContact CA-O 3.34Å
359	A	97.3	Very high	95	Very high	13 Å²	13	41.7 Å²	41.7	11%	0.107	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	145.9	174.3	0	0	0	0	0	111.1	C313 Y368 F407 F409	C313-A359 VanDerWaalsContact SG-CA 3.54Å; A359-Y368 PolarHBondContact N-O 2.98Å; A359-Y368 PolarHBondContact O-N 3.11Å; A359-F407 HydrophobicContact CB-CB 3.66Å; A359-F407 HydrophobicContact CB-CD2 3.79Å; A359-F407 HydrophobicContact CB-CG 4.02Å; A359-F409 HydrophobicContact CB-CE2 3.66Å; A359-F409 HydrophobicContact CB-CZ 4.43Å
360	I	96.1	Very high	95.3	Very high	13 Å²	13	34.4 Å²	34.4	7%	0.067	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	140.9	172.9	-64	164.6	0	0	0	107.4	A322 L367 M380 F409	A322-I360 HydrophobicContact CB-CD1 4.41Å; I360-L367 HydrophobicContact CD1-CD1 4.41Å; I360-L367 HydrophobicContact CG1-CD1 3.6Å; I360-M380 HydrophobicContact CD1-CE 4.13Å; I360-M380 HydrophobicContact CD1-SD 4.19Å; I360-M380 HydrophobicContact CG1-SD 4.04Å; I360-M380 HydrophobicContact CG2-SD 3.71Å; I360-F409 WeakPolarHBondContact O-CE2 3.49Å
361	D	93.8	Very high	95.4	Very high	6 Å²	6	29.6 Å²	29.6	3%	0.032	16%	0.163	C	C	.	.			trans	-62.4	167.1	175.1	65.1	-10.6	0	0	0	112.4	P316 V363 G364 S365 C366 Y368 F409	P316-D361 WeakPolarHBondContact CG-O 3.47Å; D361-V363 PolarHBondContact O-N 3.42Å; D361-V363 VanDerWaalsContact O-N 3.15Å; D361-G364 PolarHBondContact O-N 3Å; D361-G364 VanDerWaalsContact O-N 3.16Å; D361-G364 VanDerWaalsContact OD1-CA 3.25Å; D361-G364 WeakPolarHBondContact OD1-CA 3.4Å; D361-G364 PolarHBondContact OD1-N 3.46Å; D361-S365 PolarHBondContact OD1-N 3.05Å; D361-S365 PolarHBondContact OD2-OG 2.5Å; D361-C366 PolarHBondContact N-O 2.97Å; D361-C366 PolarHBondContact OD1-N 3.15Å; D361-C366 VanDerWaalsContact OD1-N 3.08Å; D361-C366 PolarHBondContact OD2-N 3.24Å; D361-Y368 HydrophobicContact CB-CE2 4.13Å; D361-F409 HydrophobicContact CB-CD1 4.34Å; D361-F409 HydrophobicContact CB-CE1 4.08Å; D361-F409 HydrophobicContact CB-CZ 4.41Å
362	N	91.8	Very high	95.5	Very high	61 Å²	61	28.8 Å²	28.8	33%	0.326	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-19.9	-178.2	-62.8	-40.3	0	0	0	113.9	P316 F409 Q410 K411	P316-N362 WeakPolarHBondContact CB-O 3.44Å; P316-N362 WeakPolarHBondContact CG-O 3.44Å; N362-F409 WeakPolarHBondContact ND2-CB 3.42Å; N362-Q410 VanDerWaalsContact ND2-C 3.32Å; N362-Q410 PolarHBondContact ND2-O 2.67Å; N362-K411 VanDerWaalsContact ND2-CA 3.35Å; N362-K411 WeakPolarHBondContact ND2-CA 2.97Å; N362-K411 PolarHBondContact ND2-N 3.44Å
363	V	91.3	Very high	95.6	Very high	99 Å²	99	29.3 Å²	29.3	60%	0.6	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-27.2	178.7	-176.4	0	0	0	0	111.3	D361 T414	D361-V363 PolarHBondContact O-N 3.42Å; D361-V363 VanDerWaalsContact O-N 3.15Å; V363-T414 HydrophobicContact CG2-CG2 4.15Å
364	G	92.3	Very high	95.6	Very high	24 Å²	24	32.2 Å²	32.2	25%	0.247	17%	0.173	C	C	.	.	S	Bend	trans	83.3	18.7	-170.8	0	0	0	0	0	113.8	D361	D361-G364 PolarHBondContact O-N 3Å; D361-G364 VanDerWaalsContact O-N 3.16Å; D361-G364 VanDerWaalsContact OD1-CA 3.25Å; D361-G364 WeakPolarHBondContact OD1-CA 3.4Å; D361-G364 PolarHBondContact OD1-N 3.46Å
365	S	92.8	Very high	95.7	Very high	52 Å²	52	27 Å²	27	36%	0.364	15%	0.153	S	C	.	.	S	Bend	trans	-93.9	-33.9	-177.3	78.7	0	0	0	0	112.8	D361 M380	D361-S365 PolarHBondContact OD1-N 3.05Å; D361-S365 PolarHBondContact OD2-OG 2.5Å; S365-M380 WeakPolarHBondContact O-CB 3.49Å; S365-M380 PolarHBondContact O-N 2.87Å
366	C	95.1	Very high	95.7	Very high	21 Å²	21	27.1 Å²	27.1	14%	0.142	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	133.6	-171.6	-69.6	0	0	0	0	111.3	D361 Y368 Q377 F378	D361-C366 PolarHBondContact N-O 2.97Å; D361-C366 PolarHBondContact OD1-N 3.15Å; D361-C366 VanDerWaalsContact OD1-N 3.08Å; D361-C366 PolarHBondContact OD2-N 3.24Å; C366-Y368 HydrophobicContact CB-CD2 4.4Å; C366-Y368 HydrophobicContact CB-CE2 3.63Å; C366-Q377 HydrophobicContact CB-CG 4.31Å; C366-Q377 PolarHBondContact SG-NE2 2.84Å; C366-Q377 VanDerWaalsContact SG-NE2 3.37Å; C366-F378 CarbonylContact C-O 3.58Å; C366-F378 VanDerWaalsContact CA-O 3.26Å; C366-F378 WeakPolarHBondContact CA-O 3.42Å
367	L	96.9	Very high	95.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	133.9	171.8	179.5	73.9	0	0	0	109.6	A322 V330 V332 Y343 V358 I360 Q377 F378 M380	A322-L367 HydrophobicContact CB-CD1 3.7Å; V330-L367 HydrophobicContact CB-CD2 4.39Å; V330-L367 HydrophobicContact CG1-CD2 3.88Å; V332-L367 HydrophobicContact CG2-CD2 4.45Å; Y343-L367 HydrophobicContact CD2-CD2 3.47Å; Y343-L367 VanDerWaalsContact CD2-CD2 3.47Å; Y343-L367 HydrophobicContact CE2-CD2 4.07Å; Y343-L367 HydrophobicContact CG-CD2 3.77Å; V358-L367 HydrophobicContact CG2-CD1 3.45Å; V358-L367 VanDerWaalsContact CG2-CD1 3.45Å; V358-L367 HydrophobicContact CG2-CG 4.24Å; I360-L367 HydrophobicContact CD1-CD1 4.41Å; I360-L367 HydrophobicContact CG1-CD1 3.6Å; L367-Q377 CarbonylContact O-C 3.59Å; L367-Q377 WeakPolarHBondContact O-CA 3.25Å; L367-F378 HydrophobicContact CB-CB 4.26Å; L367-F378 HydrophobicContact CD2-CD2 4.4Å; L367-F378 PolarHBondContact N-O 3.01Å; L367-F378 PolarHBondContact O-N 2.96Å; L367-M380 HydrophobicContact CB-CG 4.03Å
368	Y	97.5	Very high	95.6	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.008	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.8	178.6	-65.6	-104	0	0	0	109.7	V358 A359 D361 C366 V375 Y376 Q377 F409 F417 N431	V358-Y368 WeakPolarHBondContact CA-O 3.34Å; A359-Y368 PolarHBondContact N-O 2.98Å; A359-Y368 PolarHBondContact O-N 3.11Å; D361-Y368 HydrophobicContact CB-CE2 4.13Å; C366-Y368 HydrophobicContact CB-CD2 4.4Å; C366-Y368 HydrophobicContact CB-CE2 3.63Å; Y368-V375 HydrophobicContact CD1-CG1 3.91Å; Y368-Y376 CarbonylContact C-O 3.56Å; Y368-Y376 WeakPolarHBondContact CA-O 3.46Å; Y368-Q377 HydrophobicContact CD1-CB 4.46Å; Y368-Q377 HydrophobicContact CD1-CG 4.36Å; Y368-Q377 HydrophobicContact CE1-CB 4.35Å; Y368-Q377 HydrophobicContact CE1-CG 3.93Å; Y368-Q377 HydrophobicContact CE2-CG 4.49Å; Y368-Q377 PolarHBondContact OH-NE2 3.46Å; Y368-F409 AromaticContact CD2-CE1 3.99Å; Y368-F409 HydrophobicContact CD2-CE1 3.99Å; Y368-F409 AromaticContact CD2-CZ 3.46Å; Y368-F409 HydrophobicContact CD2-CZ 3.46Å; Y368-F409 VanDerWaalsContact CD2-CZ 3.46Å; Y368-F409 AromaticContact CE2-CE1 3.72Å; Y368-F409 HydrophobicContact CE2-CE1 3.72Å; Y368-F409 AromaticContact CE2-CZ 3.7Å; Y368-F409 HydrophobicContact CE2-CZ 3.7Å; Y368-F409 AromaticContact CG-CZ 3.99Å; Y368-F409 HydrophobicContact CG-CZ 3.99Å; Y368-F417 HydrophobicContact CD1-CE1 4.14Å; Y368-F417 HydrophobicContact CD1-CZ 4.15Å; Y368-F417 AromaticContact CE1-CD1 3.97Å; Y368-F417 HydrophobicContact CE1-CD1 3.97Å; Y368-F417 AromaticContact CE1-CE1 3.58Å; Y368-F417 HydrophobicContact CE1-CE1 3.58Å; Y368-F417 HydrophobicContact CE1-CZ 4.02Å; Y368-N431 PolarHBondContact OH-ND2 3.46Å
369	A	98.1	Very high	95.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	116.3	176.7	0	0	0	0	0	110	V330 T355 V375 Y376 F378	V330-A369 HydrophobicContact CG2-CB 4.27Å; T355-A369 HydrophobicContact CG2-CB 3.65Å; A369-V375 WeakPolarHBondContact O-CA 3.43Å; A369-Y376 PolarHBondContact N-O 3.13Å; A369-Y376 PolarHBondContact O-N 2.82Å; A369-F378 HydrophobicContact CB-CE2 3.86Å
370	G	97.6	Very high	95.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	119.8	178.3	0	0	0	0	0	111.2	I356 S357 F407	I356-G370 PolarHBondContact N-O 2.89Å; S357-G370 PolarHBondContact N-O 3.37Å; S357-G370 PolarHBondContact O-N 3.38Å; G370-F407 VanDerWaalsContact CA-CZ 3.46Å
371	C	96.8	Very high	95.4	Very high	2 Å²	2	34 Å²	34	1%	0.014	19%	0.194	C	C	.	.			trans	-120.6	-176.7	-177.7	-68.4	0	0	0	0	110.8	K373 F374 Y376 I404	C371-K373 PolarHBondContact O-N 2.98Å; C371-F374 CarbonylContact C-O 3.55Å; C371-F374 WeakPolarHBondContact CA-O 3.28Å; C371-F374 HydrophobicContact CB-CB 4.46Å; C371-F374 WeakPolarHBondContact CB-O 3.2Å; C371-F374 PolarHBondContact N-O 2.87Å; C371-Y376 HydrophobicContact CB-CD2 4.09Å; C371-Y376 HydrophobicContact CB-CE2 3.96Å; C371-I404 PolarHBondContact O-N 3.47Å
372	N	95.6	Very high	95.5	Very high	88 Å²	88	42.2 Å²	42.2	47%	0.471	22%	0.224	S	C	.	.	B	Isolated β-bridge	trans	-69.8	109.8	171.5	-172	11.6	0	0	0	110.2	F374 I403	N372-F374 WeakPolarHBondContact O-CD2 3.49Å; N372-F374 PolarHBondContact O-N 2.9Å; N372-I403 HydrophobicContact CB-CG1 4.05Å
373	K	94.7	Very high	95.6	Very high	82 Å²	82	43 Å²	43	36%	0.357	23%	0.233	S	C	.	.	S	Bend	trans	66.4	9.4	177.9	-61.2	168.3	-173	175	0	116.5	C371 T392 W393 G402	C371-K373 PolarHBondContact O-N 2.98Å; K373-T392 VanDerWaalsContact CA-OG1 3.23Å; K373-T392 WeakPolarHBondContact CA-OG1 3.48Å; K373-T392 PolarHBondContact O-N 3.17Å; K373-T392 PolarHBondContact O-OG1 2.74Å; K373-W393 HydrophobicContact CB-CB 3.85Å; K373-W393 HydrophobicContact CD-CB 4.15Å; K373-W393 HydrophobicContact CD-CG 4.19Å; K373-W393 HydrophobicContact CG-CB 3.74Å; K373-W393 HydrophobicContact CG-CG 4.24Å; K373-W393 PolarHBondContact O-N 3.21Å; K373-G402 PolarHBondContact N-O 3.44Å
374	F	95.6	Very high	95.8	Very high	78 Å²	78	39.1 Å²	39.1	34%	0.342	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	148.4	-178.9	-63.4	-80.9	0	0	0	110.5	C371 N372 Y376 I389 P391 T392	C371-F374 CarbonylContact C-O 3.55Å; C371-F374 WeakPolarHBondContact CA-O 3.28Å; C371-F374 HydrophobicContact CB-CB 4.46Å; C371-F374 WeakPolarHBondContact CB-O 3.2Å; C371-F374 PolarHBondContact N-O 2.87Å; N372-F374 WeakPolarHBondContact O-CD2 3.49Å; N372-F374 PolarHBondContact O-N 2.9Å; F374-Y376 HydrophobicContact CB-CD2 4.21Å; F374-Y376 HydrophobicContact CB-CE2 3.66Å; F374-Y376 HydrophobicContact CG-CE2 4.44Å; F374-I389 HydrophobicContact CB-CG2 4.48Å; F374-I389 HydrophobicContact CD1-CG2 3.76Å; F374-I389 HydrophobicContact CE1-CG2 4.5Å; F374-I389 HydrophobicContact CG-CG2 4.46Å; F374-P391 HydrophobicContact CD1-CB 4.16Å; F374-P391 HydrophobicContact CE1-CB 4Å; F374-T392 PolarHBondContact N-OG1 3.04Å
375	V	96.6	Very high	95.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.7	162.9	176.2	0	0	0	0	107.4	Y368 A369 I390 T392 I404 F407 F417	Y368-V375 HydrophobicContact CD1-CG1 3.91Å; A369-V375 WeakPolarHBondContact O-CA 3.43Å; V375-I390 HydrophobicContact CB-CB 4.22Å; V375-I390 PolarHBondContact N-O 2.93Å; V375-I390 PolarHBondContact O-N 2.93Å; V375-T392 HydrophobicContact CG2-CG2 3.71Å; V375-I404 HydrophobicContact CG2-CB 4.46Å; V375-I404 HydrophobicContact CG2-CG1 3.99Å; V375-I404 HydrophobicContact CG2-CG2 4.17Å; V375-F407 HydrophobicContact CB-CE1 4.47Å; V375-F407 HydrophobicContact CG1-CE1 3.82Å; V375-F407 HydrophobicContact CG1-CZ 3.9Å; V375-F407 HydrophobicContact CG2-CE1 3.74Å; V375-F407 HydrophobicContact CG2-CZ 3.95Å; V375-F417 HydrophobicContact CG1-CE2 4.5Å; V375-F417 HydrophobicContact CG1-CZ 4.41Å
376	Y	97	Very high	96	Very high	3 Å²	3	44.4 Å²	44.4	1%	0.012	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.6	176.6	-70.5	-99	0	0	0	109	P345 I346 S353 Y368 A369 C371 F374 Q386 I389	P345-Y376 HydrophobicContact CB-CD1 3.67Å; P345-Y376 HydrophobicContact CB-CD2 3.74Å; P345-Y376 HydrophobicContact CB-CE1 4.1Å; P345-Y376 HydrophobicContact CB-CE2 4.15Å; P345-Y376 HydrophobicContact CB-CG 3.49Å; P345-Y376 VanDerWaalsContact CB-CG 3.49Å; I346-Y376 WeakPolarHBondContact O-CE1 3.41Å; S353-Y376 PolarHBondContact OG-OH 2.83Å; S353-Y376 VanDerWaalsContact OG-OH 3.06Å; Y368-Y376 CarbonylContact C-O 3.56Å; Y368-Y376 WeakPolarHBondContact CA-O 3.46Å; A369-Y376 PolarHBondContact N-O 3.13Å; A369-Y376 PolarHBondContact O-N 2.82Å; C371-Y376 HydrophobicContact CB-CD2 4.09Å; C371-Y376 HydrophobicContact CB-CE2 3.96Å; F374-Y376 HydrophobicContact CB-CD2 4.21Å; F374-Y376 HydrophobicContact CB-CE2 3.66Å; F374-Y376 HydrophobicContact CG-CE2 4.44Å; Y376-Q386 HydrophobicContact CD1-CB 4.01Å; Y376-Q386 HydrophobicContact CD1-CG 3.79Å; Y376-Q386 HydrophobicContact CE1-CG 4.35Å; Y376-I389 HydrophobicContact CD1-CD1 4.41Å; Y376-I389 HydrophobicContact CD1-CG1 3.91Å; Y376-I389 HydrophobicContact CE1-CD1 3.82Å; Y376-I389 HydrophobicContact CE1-CG1 3.79Å; Y376-I389 HydrophobicContact CE1-CG2 4.24Å
377	Q	96.3	Very high	96	Very high	27 Å²	27	47.8 Å²	47.8	13%	0.126	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	135.4	177.2	-171.3	-173.8	1.7	0	0	109.5	C366 L367 Y368 T387 S388	C366-Q377 HydrophobicContact CB-CG 4.31Å; C366-Q377 PolarHBondContact SG-NE2 2.84Å; C366-Q377 VanDerWaalsContact SG-NE2 3.37Å; L367-Q377 CarbonylContact O-C 3.59Å; L367-Q377 WeakPolarHBondContact O-CA 3.25Å; Y368-Q377 HydrophobicContact CD1-CB 4.46Å; Y368-Q377 HydrophobicContact CD1-CG 4.36Å; Y368-Q377 HydrophobicContact CE1-CB 4.35Å; Y368-Q377 HydrophobicContact CE1-CG 3.93Å; Y368-Q377 HydrophobicContact CE2-CG 4.49Å; Y368-Q377 PolarHBondContact OH-NE2 3.46Å; Q377-T387 PolarHBondContact O-N 2.99Å; Q377-S388 VanDerWaalsContact CB-OG 3.27Å; Q377-S388 WeakPolarHBondContact CB-OG 3.32Å; Q377-S388 PolarHBondContact N-O 3.03Å; Q377-S388 PolarHBondContact O-N 2.95Å; Q377-S388 PolarHBondContact OE1-OG 2.62Å
378	F	97	Very high	95.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	138.4	176.5	-54.2	-97.1	0	0	0	109.8	Y343 P345 C366 L367 A369 Q386	Y343-F378 HydrophobicContact CD1-CB 3.55Å; Y343-F378 AromaticContact CD1-CD1 3.67Å; Y343-F378 HydrophobicContact CD1-CD1 3.67Å; Y343-F378 AromaticContact CD1-CG 3.76Å; Y343-F378 HydrophobicContact CD1-CG 3.76Å; Y343-F378 HydrophobicContact CE1-CB 4.05Å; Y343-F378 HydrophobicContact CG-CB 4.21Å; Y343-F378 HydrophobicContact CG-CD1 4.09Å; Y343-F378 HydrophobicContact CG-CG 4.1Å; P345-F378 HydrophobicContact CB-CZ 3.86Å; P345-F378 HydrophobicContact CG-CZ 4.44Å; C366-F378 CarbonylContact C-O 3.58Å; C366-F378 VanDerWaalsContact CA-O 3.26Å; C366-F378 WeakPolarHBondContact CA-O 3.42Å; L367-F378 HydrophobicContact CB-CB 4.26Å; L367-F378 HydrophobicContact CD2-CD2 4.4Å; L367-F378 PolarHBondContact N-O 3.01Å; L367-F378 PolarHBondContact O-N 2.96Å; A369-F378 HydrophobicContact CB-CE2 3.86Å; F378-Q386 HydrophobicContact CD1-CB 3.99Å; F378-Q386 VanDerWaalsContact CE1-CA 3.43Å; F378-Q386 HydrophobicContact CE1-CB 3.66Å; F378-Q386 VanDerWaalsContact CE1-N 3.33Å; F378-Q386 HydrophobicContact CZ-CB 3.99Å
379	D	95.9	Very high	95.7	Very high	45 Å²	45	52.9 Å²	52.9	24%	0.241	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	120.5	163.9	-179.5	-12.1	0	0	0	109.2	Y343 S381 R382 T387	Y343-D379 WeakPolarHBondContact CE1-O 3.43Å; D379-S381 PolarHBondContact O-N 3.01Å; D379-S381 WeakPolarHBondContact OD1-CB 3.19Å; D379-S381 PolarHBondContact OD1-N 2.81Å; D379-S381 PolarHBondContact OD1-OG 3.02Å; D379-S381 PolarHBondContact OD2-OG 2.78Å; D379-S381 VanDerWaalsContact OD2-OG 3.06Å; D379-R382 CarbonylContact O-C 3.55Å; D379-R382 PolarHBondContact O-N 2.92Å; D379-R382 IonicContact OD2-NE 2.8Å; D379-T387 PolarHBondContact N-OG1 2.82Å
380	M	95.2	Very high	95.5	Very high	34 Å²	34	54 Å²	54	17%	0.167	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-21.2	-178.3	-70.6	-169.4	63.5	0	0	112.8	V320 Y343 I360 S365 L367 R382	V320-M380 HydrophobicContact CG2-CE 3.88Å; Y343-M380 WeakPolarHBondContact OH-CA 3.37Å; Y343-M380 PolarHBondContact OH-O 2.87Å; I360-M380 HydrophobicContact CD1-CE 4.13Å; I360-M380 HydrophobicContact CD1-SD 4.19Å; I360-M380 HydrophobicContact CG1-SD 4.04Å; I360-M380 HydrophobicContact CG2-SD 3.71Å; S365-M380 WeakPolarHBondContact O-CB 3.49Å; S365-M380 PolarHBondContact O-N 2.87Å; L367-M380 HydrophobicContact CB-CG 4.03Å; M380-R382 PolarHBondContact O-N 2.89Å
381	S	95	Very high	95.3	Very high	89 Å²	89	56.4 Å²	56.4	62%	0.622	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-15	174.8	72.2	0	0	0	0	113.6	D379	D379-S381 PolarHBondContact O-N 3.01Å; D379-S381 WeakPolarHBondContact OD1-CB 3.19Å; D379-S381 PolarHBondContact OD1-N 2.81Å; D379-S381 PolarHBondContact OD1-OG 3.02Å; D379-S381 PolarHBondContact OD2-OG 2.78Å; D379-S381 VanDerWaalsContact OD2-OG 3.06Å
382	R	95.3	Very high	95.1	Very high	179 Å²	179	56.4 Å²	56.4	68%	0.675	29%	0.29	S	S	*	.	S	Bend	trans	-127.7	88.7	-174.4	-62.9	177.6	-171.5	-167.6	0.5	111	D379 M380	D379-R382 CarbonylContact O-C 3.55Å; D379-R382 PolarHBondContact O-N 2.92Å; D379-R382 IonicContact OD2-NE 2.8Å; M380-R382 PolarHBondContact O-N 2.89Å
383	P	95.7	Very high	94.8	Very high	78 Å²	78	56.6 Å²	56.6	51%	0.506	29%	0.285	S	S	.	.			trans	-56.5	152.5	173.9	-24.4	34.8	0	0	0	112.8	A341	A341-P383 HydrophobicContact CB-CB 4.11Å; A341-P383 HydrophobicContact CB-CG 3.89Å
384	G	94.8	Very high	94.4	Very high	18 Å²	18	56.9 Å²	56.9	19%	0.186	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	114.2	-123.4	176.9	0	0	0	0	0	114.1	H342 Y343 T344	H342-G384 PolarHBondContact O-N 2.8Å; Y343-G384 WeakPolarHBondContact CA-O 3.49Å; T344-G384 PolarHBondContact N-O 3.12Å
385	R	94.8	Very high	93.6	Very high	144 Å²	144	62.2 Å²	62.2	54%	0.543	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	158.9	-173.8	-68.4	-162.5	177.4	-128.8	-2.1	112.2	I346 D350	I346-R385 HydrophobicContact CD1-CG 3.89Å; D350-R385 IonicContact OD1-CZ 3.92Å; D350-R385 VanDerWaalsContact OD1-CZ 3.29Å; D350-R385 IonicContact OD1-NH1 3.99Å; D350-R385 PolarHBondContact OD1-NH1 3.04Å; D350-R385 IonicContact OD1-NH2 3.56Å; D350-R385 PolarHBondContact OD1-NH2 3.3Å; D350-R385 IonicContact OD2-NH2 2.67Å
386	Q	95.2	Very high	92.6	Very high	42 Å²	42	74.3 Å²	74.3	20%	0.196	36%	0.356	C	S	.	.			trans	-63.3	149	177.8	67.8	-86	3.1	0	0	113.2	T344 I346 Y376 F378 I389	T344-Q386 PolarHBondContact O-OE1 3.29Å; I346-Q386 PolarHBondContact O-NE2 2.81Å; Y376-Q386 HydrophobicContact CD1-CB 4.01Å; Y376-Q386 HydrophobicContact CD1-CG 3.79Å; Y376-Q386 HydrophobicContact CE1-CG 4.35Å; F378-Q386 HydrophobicContact CD1-CB 3.99Å; F378-Q386 VanDerWaalsContact CE1-CA 3.43Å; F378-Q386 HydrophobicContact CE1-CB 3.66Å; F378-Q386 VanDerWaalsContact CE1-N 3.33Å; F378-Q386 HydrophobicContact CZ-CB 3.99Å; Q386-I389 HydrophobicContact CG-CD1 4.36Å; Q386-I389 HydrophobicContact CG-CG1 3.83Å
387	T	94.3	Very high	91.8	Very high	93 Å²	93	76.2 Å²	76.2	57%	0.571	37%	0.372	S	S	*	.	S	Bend	trans	-83.6	-39.5	172.1	-49.8	0	0	0	0	110.8	Q377 D379	Q377-T387 PolarHBondContact O-N 2.99Å; D379-T387 PolarHBondContact N-OG1 2.82Å
388	S	93.5	Very high	91.1	Very high	37 Å²	37	78.7 Å²	78.7	26%	0.259	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	158.2	179.6	88.7	0	0	0	0	111.6	Q377	Q377-S388 VanDerWaalsContact CB-OG 3.27Å; Q377-S388 WeakPolarHBondContact CB-OG 3.32Å; Q377-S388 PolarHBondContact N-O 3.03Å; Q377-S388 PolarHBondContact O-N 2.95Å; Q377-S388 PolarHBondContact OE1-OG 2.62Å
389	I	94.2	Very high	90.7	Very high	72 Å²	72	79.3 Å²	79.3	37%	0.369	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.6	174.6	-53.9	174.8	0	0	0	107.8	F374 Y376 Q386 P391	F374-I389 HydrophobicContact CB-CG2 4.48Å; F374-I389 HydrophobicContact CD1-CG2 3.76Å; F374-I389 HydrophobicContact CE1-CG2 4.5Å; F374-I389 HydrophobicContact CG-CG2 4.46Å; Y376-I389 HydrophobicContact CD1-CD1 4.41Å; Y376-I389 HydrophobicContact CD1-CG1 3.91Å; Y376-I389 HydrophobicContact CE1-CD1 3.82Å; Y376-I389 HydrophobicContact CE1-CG1 3.79Å; Y376-I389 HydrophobicContact CE1-CG2 4.24Å; Q386-I389 HydrophobicContact CG-CD1 4.36Å; Q386-I389 HydrophobicContact CG-CG1 3.83Å; I389-P391 WeakPolarHBondContact O-CD 3.31Å
390	I	94.1	Very high	90.6	Very high	24 Å²	24	77.1 Å²	77.1	12%	0.123	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	105	177.1	-56.4	169.9	0	0	0	107.7	V375 T392 F417 Y429	V375-I390 HydrophobicContact CB-CB 4.22Å; V375-I390 PolarHBondContact N-O 2.93Å; V375-I390 PolarHBondContact O-N 2.93Å; I390-T392 PolarHBondContact O-N 3.45Å; I390-F417 HydrophobicContact CD1-CE1 3.99Å; I390-F417 HydrophobicContact CD1-CZ 3.74Å; I390-Y429 HydrophobicContact CG2-CD1 3.96Å; I390-Y429 HydrophobicContact CG2-CE1 4.2Å
391	P	93.4	Very high	90.4	Very high	49 Å²	49	77.1 Å²	77.1	32%	0.318	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	117.5	175.9	28.1	-32.7	0	0	0	109.8	F374 I389	F374-P391 HydrophobicContact CD1-CB 4.16Å; F374-P391 HydrophobicContact CE1-CB 4Å; I389-P391 WeakPolarHBondContact O-CD 3.31Å
392	T	92.9	Very high	90.4	Very high	2 Å²	2	73.8 Å²	73.8	1%	0.012	37%	0.372	C	S	.	.			trans	-87.5	-23.1	179.9	65.4	0	0	0	0	112.5	K373 F374 V375 I390 S399 Q400 I404 Y429	K373-T392 VanDerWaalsContact CA-OG1 3.23Å; K373-T392 WeakPolarHBondContact CA-OG1 3.48Å; K373-T392 PolarHBondContact O-N 3.17Å; K373-T392 PolarHBondContact O-OG1 2.74Å; F374-T392 PolarHBondContact N-OG1 3.04Å; V375-T392 HydrophobicContact CG2-CG2 3.71Å; I390-T392 PolarHBondContact O-N 3.45Å; T392-S399 CarbonylContact O-C 3.58Å; T392-S399 VanDerWaalsContact O-CB 3.26Å; T392-S399 WeakPolarHBondContact O-CB 3.33Å; T392-Q400 CarbonylContact C-O 3.58Å; T392-Q400 CarbonylContact O-C 3.59Å; T392-Q400 WeakPolarHBondContact O-CA 3.42Å; T392-Q400 PolarHBondContact O-N 2.66Å; T392-Q400 VanDerWaalsContact O-O 3.07Å; T392-I404 HydrophobicContact CG2-CD1 3.96Å; T392-I404 HydrophobicContact CG2-CG1 4.04Å; T392-Y429 VanDerWaalsContact CB-OH 3.23Å; T392-Y429 WeakPolarHBondContact CB-OH 3.15Å; T392-Y429 HydrophobicContact CG2-CE1 4.41Å; T392-Y429 HydrophobicContact CG2-CE2 4.36Å; T392-Y429 WeakPolarHBondContact CG2-OH 3.32Å
393	W	90.3	Very high	90.4	Very high	93 Å²	93	68 Å²	68	35%	0.352	35%	0.354	S	S	.	.			trans	-122.6	132.2	176.9	175.1	-99.5	0	0	0	112.6	K373 S399 P401	K373-W393 HydrophobicContact CB-CB 3.85Å; K373-W393 HydrophobicContact CD-CB 4.15Å; K373-W393 HydrophobicContact CD-CG 4.19Å; K373-W393 HydrophobicContact CG-CB 3.74Å; K373-W393 HydrophobicContact CG-CG 4.24Å; K373-W393 PolarHBondContact O-N 3.21Å; W393-S399 VanDerWaalsContact CE3-OG 3.23Å; W393-P401 HydrophobicContact CD2-CB 4.27Å; W393-P401 HydrophobicContact CE3-CB 3.6Å; W393-P401 HydrophobicContact CE3-CG 4.37Å; W393-P401 HydrophobicContact CZ3-CB 3.74Å; W393-P401 HydrophobicContact CZ3-CG 4.23Å
394	Q	85.1	Confident	90.5	Very high	88 Å²	88	64.3 Å²	64.3	41%	0.411	33%	0.33	S	S	.	.			trans	-138.7	127.5	173.4	-64.2	179.9	-2.4	0	0	109.2	R396 A397 S399	Q394-R396 PolarHBondContact O-N 2.85Å; Q394-A397 HydrophobicContact CB-CB 4.07Å; Q394-A397 PolarHBondContact O-N 3.45Å; Q394-A397 VanDerWaalsContact O-N 3.15Å; Q394-A397 VanDerWaalsContact O-O 3.07Å; Q394-S399 PolarHBondContact N-OG 3.33Å; Q394-S399 PolarHBondContact O-OG 2.73Å; Q394-S399 VanDerWaalsContact O-OG 3.07Å
395	K	78.9	Confident	90.7	Very high	190 Å²	190	63.6 Å²	63.6	83%	0.826	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-30.4	-172.1	-72.7	-177.2	178.9	178.9	0	114.7
396	R	76.3	Confident	90.8	Very high	254 Å²	254	56.9 Å²	56.9	96%	0.958	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	6.2	-173.7	-62.8	-178.1	-176.3	159	-0.7	113.6	Q394	Q394-R396 PolarHBondContact O-N 2.85Å
397	A	80.2	Confident	90.9	Very high	42 Å²	42	55.9 Å²	55.9	35%	0.347	29%	0.292	S	S	.	.	S	Bend	trans	-123.8	149.6	178.8	0	0	0	0	0	110.7	Q394 S399	Q394-A397 HydrophobicContact CB-CB 4.07Å; Q394-A397 PolarHBondContact O-N 3.45Å; Q394-A397 VanDerWaalsContact O-N 3.15Å; Q394-A397 VanDerWaalsContact O-O 3.07Å; A397-S399 WeakPolarHBondContact O-CB 3.5Å; A397-S399 PolarHBondContact O-N 2.95Å; A397-S399 PolarHBondContact O-OG 2.82Å
398	A	81.1	Confident	91	Very high	80 Å²	80	51.9 Å²	51.9	66%	0.661	27%	0.268	S	S	*	.			trans	-63.2	106.3	168.4	0	0	0	0	0	107.9
399	S	88.8	Confident	90.9	Very high	12 Å²	12	51 Å²	51	8%	0.084	26%	0.26	C	S	.	.			trans	-147.9	155.9	-166.7	61.5	0	0	0	0	109.2	T392 W393 Q394 A397 P401 L439	T392-S399 CarbonylContact O-C 3.58Å; T392-S399 VanDerWaalsContact O-CB 3.26Å; T392-S399 WeakPolarHBondContact O-CB 3.33Å; W393-S399 VanDerWaalsContact CE3-OG 3.23Å; Q394-S399 PolarHBondContact N-OG 3.33Å; Q394-S399 PolarHBondContact O-OG 2.73Å; Q394-S399 VanDerWaalsContact O-OG 3.07Å; A397-S399 WeakPolarHBondContact O-CB 3.5Å; A397-S399 PolarHBondContact O-N 2.95Å; A397-S399 PolarHBondContact O-OG 2.82Å; S399-P401 VanDerWaalsContact O-CD 3.24Å; S399-P401 WeakPolarHBondContact O-CD 3.4Å; S399-L439 WeakPolarHBondContact O-CD2 3.19Å
400	Q	92.8	Very high	90.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.245	C	C	.	.			trans	-80	110.2	-174.7	-173.5	-179.1	23.6	0	0	110.8	T392 I404 A419 W425 A427 Y429 L439	T392-Q400 CarbonylContact C-O 3.58Å; T392-Q400 CarbonylContact O-C 3.59Å; T392-Q400 WeakPolarHBondContact O-CA 3.42Å; T392-Q400 PolarHBondContact O-N 2.66Å; T392-Q400 VanDerWaalsContact O-O 3.07Å; Q400-I404 HydrophobicContact CG-CD1 4.35Å; Q400-A419 PolarHBondContact NE2-O 3.36Å; Q400-W425 HydrophobicContact CG-CB 4Å; Q400-W425 PolarHBondContact NE2-O 2.64Å; Q400-A427 HydrophobicContact CB-CB 4.17Å; Q400-A427 HydrophobicContact CG-CB 4.42Å; Q400-Y429 WeakPolarHBondContact CB-OH 3.26Å; Q400-Y429 PolarHBondContact OE1-OH 3.06Å; Q400-L439 HydrophobicContact CB-CD1 3.8Å; Q400-L439 HydrophobicContact CG-CD1 4.21Å
401	P	92.2	Very high	89.7	Confident	33 Å²	33	53.1 Å²	53.1	21%	0.214	27%	0.266	C	S	.	.			trans	-75.5	157.7	179	30.6	-32.6	0	0	0	111.6	W393 S399 S421 S423 W425	W393-P401 HydrophobicContact CD2-CB 4.27Å; W393-P401 HydrophobicContact CE3-CB 3.6Å; W393-P401 HydrophobicContact CE3-CG 4.37Å; W393-P401 HydrophobicContact CZ3-CB 3.74Å; W393-P401 HydrophobicContact CZ3-CG 4.23Å; S399-P401 VanDerWaalsContact O-CD 3.24Å; S399-P401 WeakPolarHBondContact O-CD 3.4Å; P401-S421 PolarHBondContact O-OG 3.5Å; P401-S423 VanDerWaalsContact O-CB 3.3Å; P401-S423 WeakPolarHBondContact O-CB 3.12Å; P401-S423 PolarHBondContact O-OG 3.28Å; P401-W425 HydrophobicContact CG-CG 4.38Å
402	G	93.6	Very high	88.5	Confident	19 Å²	19	55 Å²	55	20%	0.196	28%	0.278	C	S	.	.	S	Bend	trans	90.7	-166.1	165	0	0	0	0	0	115.3	K373	K373-G402 PolarHBondContact N-O 3.44Å
403	I	96.8	Very high	87.6	Confident	58 Å²	58	55.4 Å²	55.4	30%	0.297	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-84.7	131.6	-176.4	-61.2	170.1	0	0	0	109.4	I356 N372 S405 S421 Y422	I356-I403 HydrophobicContact CB-CG2 3.91Å; I356-I403 HydrophobicContact CG1-CG2 3.62Å; I356-I403 HydrophobicContact CG2-CG2 4.01Å; N372-I403 HydrophobicContact CB-CG1 4.05Å; I403-S405 PolarHBondContact O-N 3.29Å; I403-S421 PolarHBondContact N-OG 2.79Å; I403-S421 WeakPolarHBondContact O-CA 3.43Å; I403-S421 WeakPolarHBondContact O-CB 3.35Å; I403-S421 PolarHBondContact O-OG 3.36Å; I403-Y422 HydrophobicContact CB-CD2 3.99Å; I403-Y422 HydrophobicContact CG2-CD2 3.98Å; I403-Y422 HydrophobicContact CG2-CE2 4.29Å; I403-Y422 PolarHBondContact O-N 2.81Å
404	I	98	Very high	86.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	114.9	175.3	-54.3	-54.1	0	0	0	109.5	S357 C371 V375 T392 Q400 F407 A419 G420	S357-I404 PolarHBondContact OG-O 3.48Å; C371-I404 PolarHBondContact O-N 3.47Å; V375-I404 HydrophobicContact CG2-CB 4.46Å; V375-I404 HydrophobicContact CG2-CG1 3.99Å; V375-I404 HydrophobicContact CG2-CG2 4.17Å; T392-I404 HydrophobicContact CG2-CD1 3.96Å; T392-I404 HydrophobicContact CG2-CG1 4.04Å; Q400-I404 HydrophobicContact CG-CD1 4.35Å; I404-F407 HydrophobicContact CG2-CD1 4.49Å; I404-F407 HydrophobicContact CG2-CE1 3.74Å; I404-F407 HydrophobicContact CG2-CE2 4.22Å; I404-F407 HydrophobicContact CG2-CZ 3.59Å; I404-A419 HydrophobicContact CG2-CB 3.94Å; I404-G420 CarbonylContact C-O 3.28Å; I404-G420 WeakPolarHBondContact CA-O 3.23Å
405	S	97.4	Very high	86.8	Confident	4 Å²	4	51.6 Å²	51.6	3%	0.028	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	-18.2	-167.6	56.2	0	0	0	0	114.2	S357 I403 G420 Y422 I447	S357-S405 VanDerWaalsContact CB-O 3.27Å; S357-S405 WeakPolarHBondContact CB-O 3.5Å; I403-S405 PolarHBondContact O-N 3.29Å; S405-G420 PolarHBondContact N-O 3.08Å; S405-G420 PolarHBondContact OG-O 3.07Å; S405-Y422 VanDerWaalsContact CB-CE1 3.44Å; S405-I447 VanDerWaalsContact CB-O 3.31Å; S405-I447 WeakPolarHBondContact CB-O 3.3Å; S405-I447 PolarHBondContact OG-O 2.84Å
406	C	97.4	Very high	87.4	Confident	3 Å²	3	42.9 Å²	42.9	2%	0.02	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	160.3	179.6	51.7	0	0	0	0	111.3	A419 G420	C406-A419 WeakPolarHBondContact O-CA 3.16Å; C406-G420 PolarHBondContact O-N 3.48Å
407	F	97.4	Very high	88.3	Confident	21 Å²	21	30.8 Å²	30.8	9%	0.092	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	155.5	176.7	-61.1	-81.6	0	0	0	110.8	S357 A359 G370 V375 I404 F409 F417 F418 A419	S357-F407 VanDerWaalsContact OG-CE2 3.26Å; S357-F407 WeakPolarHBondContact OG-CE2 3.29Å; A359-F407 HydrophobicContact CB-CB 3.66Å; A359-F407 HydrophobicContact CB-CD2 3.79Å; A359-F407 HydrophobicContact CB-CG 4.02Å; G370-F407 VanDerWaalsContact CA-CZ 3.46Å; V375-F407 HydrophobicContact CB-CE1 4.47Å; V375-F407 HydrophobicContact CG1-CE1 3.82Å; V375-F407 HydrophobicContact CG1-CZ 3.9Å; V375-F407 HydrophobicContact CG2-CE1 3.74Å; V375-F407 HydrophobicContact CG2-CZ 3.95Å; I404-F407 HydrophobicContact CG2-CD1 4.49Å; I404-F407 HydrophobicContact CG2-CE1 3.74Å; I404-F407 HydrophobicContact CG2-CE2 4.22Å; I404-F407 HydrophobicContact CG2-CZ 3.59Å; F407-F409 HydrophobicContact CB-CE2 4.46Å; F407-F417 AromaticContact CD1-CD2 3.98Å; F407-F417 HydrophobicContact CD1-CD2 3.98Å; F407-F417 HydrophobicContact CD1-CE2 4.16Å; F407-F417 HydrophobicContact CE1-CD2 4.41Å; F407-F417 HydrophobicContact CE1-CE2 4.11Å; F407-F418 CarbonylContact C-O 3.53Å; F407-F418 VanDerWaalsContact CA-O 3.26Å; F407-F418 WeakPolarHBondContact CA-O 3.43Å; F407-A419 HydrophobicContact CD1-CB 3.92Å; F407-A419 HydrophobicContact CE1-CB 3.94Å
408	A	95.8	Very high	89	Confident	8 Å²	8	28.8 Å²	28.8	7%	0.066	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	128.9	164.6	0	0	0	0	0	110.2	F418 I450 T452	A408-F418 HydrophobicContact CB-CB 4.44Å; A408-F418 PolarHBondContact N-O 3.35Å; A408-F418 PolarHBondContact O-N 2.97Å; A408-I450 HydrophobicContact CB-CB 4.1Å; A408-I450 HydrophobicContact CB-CG2 3.6Å; A408-T452 HydrophobicContact CB-CG2 3.9Å
409	F	93.2	Very high	89.8	Confident	19 Å²	19	25 Å²	25	8%	0.083	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	146.7	177.5	-65.5	-88.7	0	0	0	110.6	A359 I360 D361 N362 Y368 F407 F417 T452	A359-F409 HydrophobicContact CB-CE2 3.66Å; A359-F409 HydrophobicContact CB-CZ 4.43Å; I360-F409 WeakPolarHBondContact O-CE2 3.49Å; D361-F409 HydrophobicContact CB-CD1 4.34Å; D361-F409 HydrophobicContact CB-CE1 4.08Å; D361-F409 HydrophobicContact CB-CZ 4.41Å; N362-F409 WeakPolarHBondContact ND2-CB 3.42Å; Y368-F409 AromaticContact CD2-CE1 3.99Å; Y368-F409 HydrophobicContact CD2-CE1 3.99Å; Y368-F409 AromaticContact CD2-CZ 3.46Å; Y368-F409 HydrophobicContact CD2-CZ 3.46Å; Y368-F409 VanDerWaalsContact CD2-CZ 3.46Å; Y368-F409 AromaticContact CE2-CE1 3.72Å; Y368-F409 HydrophobicContact CE2-CE1 3.72Å; Y368-F409 AromaticContact CE2-CZ 3.7Å; Y368-F409 HydrophobicContact CE2-CZ 3.7Å; Y368-F409 AromaticContact CG-CZ 3.99Å; Y368-F409 HydrophobicContact CG-CZ 3.99Å; F407-F409 HydrophobicContact CB-CE2 4.46Å; F409-F417 HydrophobicContact CD1-CB 3.54Å; F409-F417 HydrophobicContact CE1-CB 3.53Å; F409-F417 HydrophobicContact CE1-CD1 4.35Å; F409-F417 HydrophobicContact CE1-CG 4.07Å; F409-F417 HydrophobicContact CG-CB 4.3Å; F409-F417 HydrophobicContact CZ-CB 4.29Å; F409-T452 PolarHBondContact O-OG1 3Å
410	Q	84.7	Confident	90.2	Very high	11 Å²	11	24.4 Å²	24.4	5%	0.051	14%	0.14	C	C	.	.			trans	-86.7	117.9	170.2	-65.5	-177.6	-69.6	0	0	108.1	N362 P412 S413 F418 T452 G456	N362-Q410 VanDerWaalsContact ND2-C 3.32Å; N362-Q410 PolarHBondContact ND2-O 2.67Å; Q410-P412 VanDerWaalsContact C-N 3.3Å; Q410-S413 PolarHBondContact O-N 3.04Å; Q410-F418 HydrophobicContact CG-CD2 4.26Å; Q410-F418 HydrophobicContact CG-CE2 3.77Å; Q410-T452 HydrophobicContact CG-CG2 4.38Å; Q410-G456 PolarHBondContact NE2-O 2.86Å
411	K	77.6	Confident	90.5	Very high	130 Å²	130	24.4 Å²	24.4	57%	0.565	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.1	-42.5	177.2	-70.9	-173.1	-179.6	-176	0	115.1	N362 S413 T454	N362-K411 VanDerWaalsContact ND2-CA 3.35Å; N362-K411 WeakPolarHBondContact ND2-CA 2.97Å; N362-K411 PolarHBondContact ND2-N 3.44Å; K411-S413 VanDerWaalsContact C-N 3.3Å; K411-S413 PolarHBondContact O-N 3.07Å; K411-T454 HydrophobicContact CD-CG2 3.85Å
412	P	68.9	Low	90.7	Very high	88 Å²	88	26.9 Å²	26.9	57%	0.571	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-14.4	179.7	27.8	-35.1	0	0	0	114.6	Q410	Q410-P412 VanDerWaalsContact C-N 3.3Å
413	S	73.9	Confident	90.7	Very high	11 Å²	11	27.7 Å²	27.7	8%	0.077	15%	0.148	C	C	.	.			trans	-108.8	133.6	-179.5	-178.1	0	0	0	0	110.9	Q410 K411 S415 S416	Q410-S413 PolarHBondContact O-N 3.04Å; K411-S413 VanDerWaalsContact C-N 3.3Å; K411-S413 PolarHBondContact O-N 3.07Å; S413-S415 PolarHBondContact OG-N 3.25Å; S413-S416 WeakPolarHBondContact OG-CB 3.34Å; S413-S416 PolarHBondContact OG-N 2.95Å; S413-S416 PolarHBondContact OG-OG 3.3Å
414	T	74.4	Confident	90.7	Very high	90 Å²	90	25 Å²	25	55%	0.552	13%	0.134	S	C	*	.	S	Bend	trans	-87.8	-21.7	173.7	55.2	0	0	0	0	112.7	V363	V363-T414 HydrophobicContact CG2-CG2 4.15Å
415	S	83.7	Confident	90.6	Very high	11 Å²	11	28.2 Å²	28.2	8%	0.077	15%	0.146	C	C	.	.	S	Bend	trans	-111.7	-13.2	-172.5	64.1	0	0	0	0	114.8	S413 D430 N431	S413-S415 PolarHBondContact OG-N 3.25Å; S415-D430 VanDerWaalsContact CB-OD1 3.3Å; S415-D430 WeakPolarHBondContact CB-OD1 3.5Å; S415-D430 WeakPolarHBondContact O-CA 3.3Å; S415-D430 PolarHBondContact OG-OD1 3.45Å; S415-D430 PolarHBondContact OG-OD2 3.15Å; S415-N431 PolarHBondContact O-N 2.79Å
416	S	90.9	Very high	90.6	Very high	6 Å²	6	28 Å²	28	4%	0.042	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	136.9	-173.9	-30.8	0	0	0	0	112.5	S413 Y429 D430	S413-S416 WeakPolarHBondContact OG-CB 3.34Å; S413-S416 PolarHBondContact OG-N 2.95Å; S413-S416 PolarHBondContact OG-OG 3.3Å; S416-Y429 CarbonylContact C-O 3.55Å; S416-Y429 WeakPolarHBondContact CA-O 3.43Å; S416-D430 PolarHBondContact OG-OD2 3.21Å
417	F	94.9	Very high	90.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	148.7	179.7	66.1	-89.3	0	0	0	112.2	Y368 V375 I390 F407 F409 A419 Y429	Y368-F417 HydrophobicContact CD1-CE1 4.14Å; Y368-F417 HydrophobicContact CD1-CZ 4.15Å; Y368-F417 AromaticContact CE1-CD1 3.97Å; Y368-F417 HydrophobicContact CE1-CD1 3.97Å; Y368-F417 AromaticContact CE1-CE1 3.58Å; Y368-F417 HydrophobicContact CE1-CE1 3.58Å; Y368-F417 HydrophobicContact CE1-CZ 4.02Å; V375-F417 HydrophobicContact CG1-CE2 4.5Å; V375-F417 HydrophobicContact CG1-CZ 4.41Å; I390-F417 HydrophobicContact CD1-CE1 3.99Å; I390-F417 HydrophobicContact CD1-CZ 3.74Å; F407-F417 AromaticContact CD1-CD2 3.98Å; F407-F417 HydrophobicContact CD1-CD2 3.98Å; F407-F417 HydrophobicContact CD1-CE2 4.16Å; F407-F417 HydrophobicContact CE1-CD2 4.41Å; F407-F417 HydrophobicContact CE1-CE2 4.11Å; F409-F417 HydrophobicContact CD1-CB 3.54Å; F409-F417 HydrophobicContact CE1-CB 3.53Å; F409-F417 HydrophobicContact CE1-CD1 4.35Å; F409-F417 HydrophobicContact CE1-CG 4.07Å; F409-F417 HydrophobicContact CG-CB 4.3Å; F409-F417 HydrophobicContact CZ-CB 4.29Å; F417-A419 HydrophobicContact CD2-CB 4.49Å; F417-A419 HydrophobicContact CE2-CB 4.31Å; F417-Y429 HydrophobicContact CD2-CD2 4.3Å; F417-Y429 AromaticContact CE2-CD2 3.67Å; F417-Y429 HydrophobicContact CE2-CD2 3.67Å; F417-Y429 HydrophobicContact CE2-CG 4.05Å; F417-Y429 HydrophobicContact CZ-CD2 4.06Å; F417-Y429 AromaticContact CZ-CG 3.96Å; F417-Y429 HydrophobicContact CZ-CG 3.96Å; F417-Y429 PolarHBondContact N-O 3.35Å; F417-Y429 PolarHBondContact O-N 3.09Å
418	F	96.5	Very high	90.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	138.7	169.5	-67.7	-81.4	0	0	0	110	F407 A408 Q410 V426 A427 L428 I450 T452 L459 V474	F407-F418 CarbonylContact C-O 3.53Å; F407-F418 VanDerWaalsContact CA-O 3.26Å; F407-F418 WeakPolarHBondContact CA-O 3.43Å; A408-F418 HydrophobicContact CB-CB 4.44Å; A408-F418 PolarHBondContact N-O 3.35Å; A408-F418 PolarHBondContact O-N 2.97Å; Q410-F418 HydrophobicContact CG-CD2 4.26Å; Q410-F418 HydrophobicContact CG-CE2 3.77Å; F418-V426 HydrophobicContact CB-CG1 4.4Å; F418-V426 HydrophobicContact CD1-CG1 3.86Å; F418-A427 CarbonylContact C-O 3.57Å; F418-A427 WeakPolarHBondContact CA-O 3.42Å; F418-L428 HydrophobicContact CD1-CB 4.03Å; F418-L428 HydrophobicContact CD1-CD1 4.1Å; F418-L428 HydrophobicContact CD2-CD1 4.26Å; F418-L428 HydrophobicContact CE1-CB 3.8Å; F418-L428 HydrophobicContact CE1-CD1 3.91Å; F418-L428 HydrophobicContact CE1-CD2 4.42Å; F418-L428 HydrophobicContact CE1-CG 4.25Å; F418-L428 HydrophobicContact CE2-CD1 4.06Å; F418-L428 HydrophobicContact CG-CD1 4.28Å; F418-L428 HydrophobicContact CZ-CD1 3.88Å; F418-L428 HydrophobicContact CZ-CD2 4.4Å; F418-L428 HydrophobicContact CZ-CG 4.49Å; F418-I450 HydrophobicContact CB-CG2 4.43Å; F418-T452 HydrophobicContact CD2-CG2 3.83Å; F418-T452 HydrophobicContact CE2-CG2 4.08Å; F418-L459 HydrophobicContact CB-CD1 4.42Å; F418-L459 HydrophobicContact CD1-CD1 4.4Å; F418-L459 HydrophobicContact CD1-CD2 3.98Å; F418-L459 HydrophobicContact CD2-CD1 3.73Å; F418-L459 HydrophobicContact CE1-CD2 4.08Å; F418-L459 HydrophobicContact CE2-CD1 4.03Å; F418-L459 HydrophobicContact CG-CD1 3.92Å; F418-L459 HydrophobicContact CG-CD2 4.31Å; F418-L459 HydrophobicContact CZ-CD1 4.48Å; F418-L459 HydrophobicContact CZ-CD2 4.5Å; F418-V474 HydrophobicContact CE2-CG1 4.49Å; F418-V474 HydrophobicContact CE2-CG2 4.4Å; F418-V474 HydrophobicContact CZ-CG1 3.85Å; F418-V474 HydrophobicContact CZ-CG2 4.02Å
419	A	97.6	Very high	90.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.3	168.7	0	0	0	0	0	109.8	Q400 I404 C406 F407 F417 V426 A427 Y429	Q400-A419 PolarHBondContact NE2-O 3.36Å; I404-A419 HydrophobicContact CG2-CB 3.94Å; C406-A419 WeakPolarHBondContact O-CA 3.16Å; F407-A419 HydrophobicContact CD1-CB 3.92Å; F407-A419 HydrophobicContact CE1-CB 3.94Å; F417-A419 HydrophobicContact CD2-CB 4.49Å; F417-A419 HydrophobicContact CE2-CB 4.31Å; A419-V426 WeakPolarHBondContact O-CA 3.21Å; A419-A427 PolarHBondContact N-O 2.84Å; A419-A427 PolarHBondContact O-N 2.79Å; A419-Y429 HydrophobicContact CB-CD2 4.11Å; A419-Y429 HydrophobicContact CB-CE2 3.83Å
420	G	97.5	Very high	90.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	147.9	174.4	0	0	0	0	0	111.5	I404 S405 C406 I450	I404-G420 CarbonylContact C-O 3.28Å; I404-G420 WeakPolarHBondContact CA-O 3.23Å; S405-G420 PolarHBondContact N-O 3.08Å; S405-G420 PolarHBondContact OG-O 3.07Å; C406-G420 PolarHBondContact O-N 3.48Å; G420-I450 VanDerWaalsContact CA-CD1 3.43Å
421	S	97.4	Very high	90.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	150.7	176	-178	0	0	0	0	113.1	P401 I403 S423 G424 W425 I447	P401-S421 PolarHBondContact O-OG 3.5Å; I403-S421 PolarHBondContact N-OG 2.79Å; I403-S421 WeakPolarHBondContact O-CA 3.43Å; I403-S421 WeakPolarHBondContact O-CB 3.35Å; I403-S421 PolarHBondContact O-OG 3.36Å; S421-S423 VanDerWaalsContact CB-OG 3.32Å; S421-S423 WeakPolarHBondContact CB-OG 3.44Å; S421-S423 PolarHBondContact O-N 3.27Å; S421-S423 VanDerWaalsContact O-N 3.1Å; S421-S423 PolarHBondContact OG-N 3.25Å; S421-S423 VanDerWaalsContact OG-N 3.17Å; S421-S423 PolarHBondContact OG-OG 3.29Å; S421-G424 PolarHBondContact O-N 2.95Å; S421-W425 PolarHBondContact N-O 3.38Å; S421-I447 WeakPolarHBondContact O-CB 3.36Å; S421-I447 WeakPolarHBondContact O-CG1 3.27Å; S421-I447 PolarHBondContact O-N 3.46Å
422	Y	96.5	Very high	90.7	Very high	86 Å²	86	30.3 Å²	30.3	34%	0.337	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-8.9	166.4	-71.1	-39.4	0	0	0	114.6	I356 I403 S405 G424 G446 I447	I356-Y422 HydrophobicContact CG2-CE2 3.89Å; I403-Y422 HydrophobicContact CB-CD2 3.99Å; I403-Y422 HydrophobicContact CG2-CD2 3.98Å; I403-Y422 HydrophobicContact CG2-CE2 4.29Å; I403-Y422 PolarHBondContact O-N 2.81Å; S405-Y422 VanDerWaalsContact CB-CE1 3.44Å; Y422-G424 VanDerWaalsContact C-N 3.25Å; Y422-G446 WeakPolarHBondContact O-CA 3.32Å; Y422-I447 VanDerWaalsContact CD1-O 3.32Å; Y422-I447 WeakPolarHBondContact CD1-O 3.17Å; Y422-I447 WeakPolarHBondContact CE1-O 3.42Å
423	S	95.3	Very high	91.5	Very high	36 Å²	36	29.3 Å²	29.3	25%	0.252	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-4.3	169.6	63.7	0	0	0	0	114	P401 S421	P401-S423 VanDerWaalsContact O-CB 3.3Å; P401-S423 WeakPolarHBondContact O-CB 3.12Å; P401-S423 PolarHBondContact O-OG 3.28Å; S421-S423 VanDerWaalsContact CB-OG 3.32Å; S421-S423 WeakPolarHBondContact CB-OG 3.44Å; S421-S423 PolarHBondContact O-N 3.27Å; S421-S423 VanDerWaalsContact O-N 3.1Å; S421-S423 PolarHBondContact OG-N 3.25Å; S421-S423 VanDerWaalsContact OG-N 3.17Å; S421-S423 PolarHBondContact OG-OG 3.29Å
424	G	95.5	Very high	91.9	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	88.6	9.1	-179.5	0	0	0	0	0	114.9	S421 Y422 T442 N443	S421-G424 PolarHBondContact O-N 2.95Å; Y422-G424 VanDerWaalsContact C-N 3.25Å; G424-T442 PolarHBondContact O-N 3.28Å; G424-N443 WeakPolarHBondContact CA-O 3.24Å
425	W	96.4	Very high	92.5	Very high	68 Å²	68	32.9 Å²	32.9	26%	0.258	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	139.8	-179.3	-67.6	79.9	0	0	0	112.1	Q400 P401 S421 L439 F440 E441 I447	Q400-W425 HydrophobicContact CG-CB 4Å; Q400-W425 PolarHBondContact NE2-O 2.64Å; P401-W425 HydrophobicContact CG-CG 4.38Å; S421-W425 PolarHBondContact N-O 3.38Å; W425-L439 HydrophobicContact CB-CD1 4.16Å; W425-L439 HydrophobicContact CD2-CD1 4.31Å; W425-L439 HydrophobicContact CE3-CD1 3.64Å; W425-L439 HydrophobicContact CE3-CD2 4.15Å; W425-L439 HydrophobicContact CE3-CG 3.58Å; W425-L439 HydrophobicContact CZ3-CD1 4.43Å; W425-L439 HydrophobicContact CZ3-CD2 4.22Å; W425-L439 HydrophobicContact CZ3-CG 3.87Å; W425-F440 WeakPolarHBondContact CA-O 3.49Å; W425-E441 HydrophobicContact CD2-CB 4.1Å; W425-E441 HydrophobicContact CE3-CB 4.08Å; W425-E441 HydrophobicContact CH2-CB 4.04Å; W425-E441 HydrophobicContact CZ2-CB 4.02Å; W425-E441 HydrophobicContact CZ2-CG 4.32Å; W425-E441 HydrophobicContact CZ3-CB 4.07Å; W425-I447 WeakPolarHBondContact O-CD1 3.37Å
426	V	96.8	Very high	92.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.8	165.7	179	0	0	0	0	108.8	F418 A419 L439 F440 T442 I447 I450 L459 T461	F418-V426 HydrophobicContact CB-CG1 4.4Å; F418-V426 HydrophobicContact CD1-CG1 3.86Å; A419-V426 WeakPolarHBondContact O-CA 3.21Å; V426-L439 WeakPolarHBondContact O-CA 3.42Å; V426-F440 HydrophobicContact CB-CD1 4.22Å; V426-F440 HydrophobicContact CB-CE1 3.55Å; V426-F440 HydrophobicContact CB-CE2 4.06Å; V426-F440 HydrophobicContact CB-CZ 3.45Å; V426-F440 VanDerWaalsContact CB-CZ 3.45Å; V426-F440 HydrophobicContact CG1-CE1 3.59Å; V426-F440 HydrophobicContact CG1-CZ 3.66Å; V426-F440 HydrophobicContact CG2-CE2 4.28Å; V426-F440 HydrophobicContact CG2-CZ 3.95Å; V426-F440 PolarHBondContact N-O 3.31Å; V426-F440 PolarHBondContact O-N 3.19Å; V426-T442 HydrophobicContact CG2-CG2 3.63Å; V426-I447 HydrophobicContact CB-CD1 4.37Å; V426-I447 HydrophobicContact CG2-CD1 3.19Å; V426-I450 HydrophobicContact CG1-CD1 4.06Å; V426-I450 HydrophobicContact CG2-CD1 3.77Å; V426-L459 HydrophobicContact CG1-CD2 4.16Å; V426-T461 HydrophobicContact CG2-CG2 4.03Å
427	A	95.8	Very high	92.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.3	168.7	0	0	0	0	0	111.1	Q400 F418 A419 Y429 M438 L439	Q400-A427 HydrophobicContact CB-CB 4.17Å; Q400-A427 HydrophobicContact CG-CB 4.42Å; F418-A427 CarbonylContact C-O 3.57Å; F418-A427 WeakPolarHBondContact CA-O 3.42Å; A419-A427 PolarHBondContact N-O 2.84Å; A419-A427 PolarHBondContact O-N 2.79Å; A427-Y429 HydrophobicContact CB-CD2 4.25Å; A427-Y429 HydrophobicContact CB-CE2 3.48Å; A427-Y429 VanDerWaalsContact CB-CE2 3.48Å; A427-M438 CarbonylContact C-O 3.57Å; A427-M438 WeakPolarHBondContact CA-O 3.19Å; A427-M438 WeakPolarHBondContact CB-O 3.31Å; A427-L439 HydrophobicContact CB-CD1 4.03Å
428	L	94.8	Very high	92.5	Very high	12 Å²	12	35 Å²	35	6%	0.063	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127.2	166	178.6	61.5	0	0	0	107.6	F418 S436 C437 M438	F418-L428 HydrophobicContact CD1-CB 4.03Å; F418-L428 HydrophobicContact CD1-CD1 4.1Å; F418-L428 HydrophobicContact CD2-CD1 4.26Å; F418-L428 HydrophobicContact CE1-CB 3.8Å; F418-L428 HydrophobicContact CE1-CD1 3.91Å; F418-L428 HydrophobicContact CE1-CD2 4.42Å; F418-L428 HydrophobicContact CE1-CG 4.25Å; F418-L428 HydrophobicContact CE2-CD1 4.06Å; F418-L428 HydrophobicContact CG-CD1 4.28Å; F418-L428 HydrophobicContact CZ-CD1 3.88Å; F418-L428 HydrophobicContact CZ-CD2 4.4Å; F418-L428 HydrophobicContact CZ-CG 4.49Å; L428-S436 CarbonylContact O-C 3.48Å; L428-S436 WeakPolarHBondContact O-CA 3.47Å; L428-C437 HydrophobicContact CB-CB 4.49Å; L428-C437 HydrophobicContact CD2-CB 4.42Å; L428-C437 HydrophobicContact CG-CB 4.32Å; L428-C437 PolarHBondContact O-N 2.94Å; L428-C437 PolarHBondContact O-SG 3.02Å; L428-M438 HydrophobicContact CB-CB 4.07Å; L428-M438 PolarHBondContact N-O 2.81Å
429	Y	93.8	Very high	92.4	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.016	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	152.6	173.5	-63.6	-83.8	0	0	0	109.5	I390 T392 Q400 S416 F417 A419 A427	I390-Y429 HydrophobicContact CG2-CD1 3.96Å; I390-Y429 HydrophobicContact CG2-CE1 4.2Å; T392-Y429 VanDerWaalsContact CB-OH 3.23Å; T392-Y429 WeakPolarHBondContact CB-OH 3.15Å; T392-Y429 HydrophobicContact CG2-CE1 4.41Å; T392-Y429 HydrophobicContact CG2-CE2 4.36Å; T392-Y429 WeakPolarHBondContact CG2-OH 3.32Å; Q400-Y429 WeakPolarHBondContact CB-OH 3.26Å; Q400-Y429 PolarHBondContact OE1-OH 3.06Å; S416-Y429 CarbonylContact C-O 3.55Å; S416-Y429 WeakPolarHBondContact CA-O 3.43Å; F417-Y429 HydrophobicContact CD2-CD2 4.3Å; F417-Y429 AromaticContact CE2-CD2 3.67Å; F417-Y429 HydrophobicContact CE2-CD2 3.67Å; F417-Y429 HydrophobicContact CE2-CG 4.05Å; F417-Y429 HydrophobicContact CZ-CD2 4.06Å; F417-Y429 AromaticContact CZ-CG 3.96Å; F417-Y429 HydrophobicContact CZ-CG 3.96Å; F417-Y429 PolarHBondContact N-O 3.35Å; F417-Y429 PolarHBondContact O-N 3.09Å; A419-Y429 HydrophobicContact CB-CD2 4.11Å; A419-Y429 HydrophobicContact CB-CE2 3.83Å; A427-Y429 HydrophobicContact CB-CD2 4.25Å; A427-Y429 HydrophobicContact CB-CE2 3.48Å; A427-Y429 VanDerWaalsContact CB-CE2 3.48Å
430	D	91.4	Very high	92.2	Very high	13 Å²	13	36.6 Å²	36.6	7%	0.07	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	130.4	167	-163.9	-47.3	0	0	0	107.4	S415 S416 R432 M433 C437	S415-D430 VanDerWaalsContact CB-OD1 3.3Å; S415-D430 WeakPolarHBondContact CB-OD1 3.5Å; S415-D430 WeakPolarHBondContact O-CA 3.3Å; S415-D430 PolarHBondContact OG-OD1 3.45Å; S415-D430 PolarHBondContact OG-OD2 3.15Å; S416-D430 PolarHBondContact OG-OD2 3.21Å; D430-R432 PolarHBondContact O-N 2.99Å; D430-R432 WeakPolarHBondContact OD1-CB 3.44Å; D430-R432 WeakPolarHBondContact OD1-CG 3.5Å; D430-R432 PolarHBondContact OD1-N 3.47Å; D430-M433 HydrophobicContact CB-CB 4.39Å; D430-M433 HydrophobicContact CB-CE 3.52Å; D430-M433 HydrophobicContact CB-CG 4.49Å; D430-M433 PolarHBondContact O-N 3.44Å; D430-C437 PolarHBondContact N-SG 3.03Å; D430-C437 VanDerWaalsContact N-SG 3.44Å
431	N	85.9	Confident	92.1	Very high	61 Å²	61	40.1 Å²	40.1	33%	0.326	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-18.9	179.2	-67.7	-23.4	0	0	0	113.3	Y368 S415	Y368-N431 PolarHBondContact OH-ND2 3.46Å; S415-N431 PolarHBondContact O-N 2.79Å
432	R	86.3	Confident	91.9	Very high	151 Å²	151	40.9 Å²	40.9	57%	0.57	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-15.3	177.4	-58.3	171.8	-174.6	173.4	3.8	113.2	D430	D430-R432 PolarHBondContact O-N 2.99Å; D430-R432 WeakPolarHBondContact OD1-CB 3.44Å; D430-R432 WeakPolarHBondContact OD1-CG 3.5Å; D430-R432 PolarHBondContact OD1-N 3.47Å
433	M	86.1	Confident	91.7	Very high	66 Å²	66	36.8 Å²	36.8	33%	0.325	19%	0.194	S	C	.	.	S	Bend	trans	-115.1	151.6	-174.1	-70.2	-169.1	-84.2	0	0	111.9	V18 D430 C437	V18-M433 HydrophobicContact CB-CE 4.45Å; V18-M433 HydrophobicContact CG1-CE 3.94Å; V18-M433 HydrophobicContact CG2-CE 3.6Å; V18-M433 HydrophobicContact CG2-SD 4.3Å; D430-M433 HydrophobicContact CB-CB 4.39Å; D430-M433 HydrophobicContact CB-CE 3.52Å; D430-M433 HydrophobicContact CB-CG 4.49Å; D430-M433 PolarHBondContact O-N 3.44Å; M433-C437 HydrophobicContact CE-CB 3.95Å; M433-C437 WeakPolarHBondContact CE-SG 3.35Å
434	V	83.3	Confident	91.5	Very high	151 Å²	151	44.9 Å²	44.9	92%	0.915	22%	0.219	S	C	*	.	S	Bend	trans	-88.5	120.5	174.2	-178.4	0	0	0	0	109.2
435	G	85.3	Confident	91.4	Very high	26 Å²	26	48.8 Å²	48.8	27%	0.268	24%	0.24	S	C	.	.	S	Bend	trans	83	-170.4	179.8	0	0	0	0	0	113.5
436	S	89	Confident	91.3	Very high	31 Å²	31	45.6 Å²	45.6	22%	0.217	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	130.2	-179.1	58.5	0	0	0	0	111.4	L428 M438	L428-S436 CarbonylContact O-C 3.48Å; L428-S436 WeakPolarHBondContact O-CA 3.47Å; S436-M438 PolarHBondContact O-N 2.83Å
437	C	89.5	Confident	91.3	Very high	19 Å²	19	45.6 Å²	45.6	13%	0.128	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	-32.6	171.9	-37.4	0	0	0	0	111.2	L428 D430 M433	L428-C437 HydrophobicContact CB-CB 4.49Å; L428-C437 HydrophobicContact CD2-CB 4.42Å; L428-C437 HydrophobicContact CG-CB 4.32Å; L428-C437 PolarHBondContact O-N 2.94Å; L428-C437 PolarHBondContact O-SG 3.02Å; D430-C437 PolarHBondContact N-SG 3.03Å; D430-C437 VanDerWaalsContact N-SG 3.44Å; M433-C437 HydrophobicContact CE-CB 3.95Å; M433-C437 WeakPolarHBondContact CE-SG 3.35Å
438	M	91.1	Very high	91.4	Very high	12 Å²	12	45.8 Å²	45.8	6%	0.059	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	145.9	-179.4	-178.9	-160.2	-64.2	0	0	109.6	I15 A427 L428 S436 F440 M477	I15-M438 HydrophobicContact CD1-CE 3.39Å; I15-M438 HydrophobicContact CG1-CE 4.14Å; A427-M438 CarbonylContact C-O 3.57Å; A427-M438 WeakPolarHBondContact CA-O 3.19Å; A427-M438 WeakPolarHBondContact CB-O 3.31Å; L428-M438 HydrophobicContact CB-CB 4.07Å; L428-M438 PolarHBondContact N-O 2.81Å; S436-M438 PolarHBondContact O-N 2.83Å; M438-F440 HydrophobicContact CG-CD1 4.28Å; M438-F440 HydrophobicContact SD-CD1 3.86Å; M438-F440 HydrophobicContact SD-CE1 4.04Å; M438-M477 HydrophobicContact CE-CB 3.25Å; M438-M477 HydrophobicContact CE-CG 3.53Å; M438-M477 HydrophobicContact CG-CB 4.46Å; M438-M477 HydrophobicContact SD-CB 3.2Å; M438-M477 WeakPolarHBondContact SD-CB 3.11Å; M438-M477 HydrophobicContact SD-CE 4.19Å; M438-M477 HydrophobicContact SD-CG 3.54Å; M438-M477 VanDerWaalsContact SD-CG 3.54Å
439	L	94.1	Very high	91.5	Very high	25 Å²	25	46 Å²	46	13%	0.131	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	128.2	176.6	177.5	67.7	0	0	0	109.5	S399 Q400 W425 V426 A427	S399-L439 WeakPolarHBondContact O-CD2 3.19Å; Q400-L439 HydrophobicContact CB-CD1 3.8Å; Q400-L439 HydrophobicContact CG-CD1 4.21Å; W425-L439 HydrophobicContact CB-CD1 4.16Å; W425-L439 HydrophobicContact CD2-CD1 4.31Å; W425-L439 HydrophobicContact CE3-CD1 3.64Å; W425-L439 HydrophobicContact CE3-CD2 4.15Å; W425-L439 HydrophobicContact CE3-CG 3.58Å; W425-L439 HydrophobicContact CZ3-CD1 4.43Å; W425-L439 HydrophobicContact CZ3-CD2 4.22Å; W425-L439 HydrophobicContact CZ3-CG 3.87Å; V426-L439 WeakPolarHBondContact O-CA 3.42Å; A427-L439 HydrophobicContact CB-CD1 4.03Å
440	F	94.6	Very high	91.6	Very high	8 Å²	8	46.3 Å²	46.3	4%	0.035	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	153.3	176.3	66.9	-79.2	0	0	0	112.3	W425 V426 M438 T442 L459 W472 M477 P478	W425-F440 WeakPolarHBondContact CA-O 3.49Å; V426-F440 HydrophobicContact CB-CD1 4.22Å; V426-F440 HydrophobicContact CB-CE1 3.55Å; V426-F440 HydrophobicContact CB-CE2 4.06Å; V426-F440 HydrophobicContact CB-CZ 3.45Å; V426-F440 VanDerWaalsContact CB-CZ 3.45Å; V426-F440 HydrophobicContact CG1-CE1 3.59Å; V426-F440 HydrophobicContact CG1-CZ 3.66Å; V426-F440 HydrophobicContact CG2-CE2 4.28Å; V426-F440 HydrophobicContact CG2-CZ 3.95Å; V426-F440 PolarHBondContact N-O 3.31Å; V426-F440 PolarHBondContact O-N 3.19Å; M438-F440 HydrophobicContact CG-CD1 4.28Å; M438-F440 HydrophobicContact SD-CD1 3.86Å; M438-F440 HydrophobicContact SD-CE1 4.04Å; F440-T442 HydrophobicContact CE2-CG2 4.38Å; F440-L459 HydrophobicContact CZ-CD2 3.96Å; F440-W472 AromaticContact CE2-CD2 4Å; F440-W472 HydrophobicContact CE2-CD2 4Å; F440-W472 HydrophobicContact CE2-CE3 4.36Å; F440-W472 HydrophobicContact CE2-CG 4.33Å; F440-W472 HydrophobicContact CE2-CZ2 4.43Å; F440-M477 HydrophobicContact CD1-CE 4.12Å; F440-M477 HydrophobicContact CE1-CE 3.29Å; F440-M477 HydrophobicContact CE2-CE 3.96Å; F440-M477 HydrophobicContact CZ-CE 3.19Å; F440-P478 HydrophobicContact CB-CB 3.91Å; F440-P478 HydrophobicContact CB-CG 4.35Å; F440-P478 HydrophobicContact CD2-CB 4.26Å; F440-P478 HydrophobicContact CG-CB 4.17Å
441	E	94.6	Very high	91.9	Very high	73 Å²	73	46.4 Å²	46.4	34%	0.341	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	135.8	177.9	-169.3	179.2	-177.4	0	0	109.3	R6 W425	R6-E441 IonicContact NH1-OE2 2.79Å; W425-E441 HydrophobicContact CD2-CB 4.1Å; W425-E441 HydrophobicContact CE3-CB 4.08Å; W425-E441 HydrophobicContact CH2-CB 4.04Å; W425-E441 HydrophobicContact CZ2-CB 4.02Å; W425-E441 HydrophobicContact CZ2-CG 4.32Å; W425-E441 HydrophobicContact CZ3-CB 4.07Å
442	T	93	Very high	92.3	Very high	16 Å²	16	44.7 Å²	44.7	10%	0.098	23%	0.226	C	C	.	.			trans	-131.4	-106.7	-179.9	174.4	0	0	0	0	109.8	G424 V426 F440 R444 I447 T461 F470 W472	G424-T442 PolarHBondContact O-N 3.28Å; V426-T442 HydrophobicContact CG2-CG2 3.63Å; F440-T442 HydrophobicContact CE2-CG2 4.38Å; T442-R444 PolarHBondContact O-N 3.34Å; T442-I447 HydrophobicContact CG2-CD1 3.43Å; T442-I447 VanDerWaalsContact CG2-CD1 3.43Å; T442-I447 HydrophobicContact CG2-CG1 4.06Å; T442-T461 HydrophobicContact CG2-CG2 4.3Å; T442-T461 PolarHBondContact OG1-OG1 2.99Å; T442-F470 WeakPolarHBondContact OG1-CD2 3.42Å; T442-W472 VanDerWaalsContact OG1-CZ2 3.26Å; T442-W472 WeakPolarHBondContact OG1-CZ2 3.2Å
443	N	92.6	Very high	92.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.			trans	-66.1	98.8	179.5	-53.3	90	0	0	0	112	G424 N445 G446 I447 T461 G463 D466 F470	G424-N443 WeakPolarHBondContact CA-O 3.24Å; N443-N445 PolarHBondContact O-N 2.85Å; N443-N445 VanDerWaalsContact O-N 3.13Å; N443-G446 PolarHBondContact O-N 2.81Å; N443-I447 HydrophobicContact CB-CG1 4.25Å; N443-T461 WeakPolarHBondContact OD1-CB 3.14Å; N443-T461 PolarHBondContact OD1-OG1 2.81Å; N443-G463 PolarHBondContact ND2-N 2.8Å; N443-D466 VanDerWaalsContact CB-OD2 3.3Å; N443-D466 WeakPolarHBondContact CB-OD2 3.34Å; N443-D466 PolarHBondContact ND2-OD2 2.9Å; N443-F470 WeakPolarHBondContact ND2-CD2 3.19Å; N443-F470 WeakPolarHBondContact ND2-CE2 3Å
444	R	91.7	Very high	92.7	Very high	207 Å²	207	37.7 Å²	37.7	78%	0.781	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-33.2	-175.1	-67.2	-178.2	-179.3	176.1	3.3	114.6	T442 G446	T442-R444 PolarHBondContact O-N 3.34Å; R444-G446 PolarHBondContact O-N 2.79Å
445	N	92.8	Very high	92.9	Very high	82 Å²	82	33.9 Å²	33.9	44%	0.439	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	0.8	-179.3	-70.3	-10.2	0	0	0	113.1	N443 R464 M465	N443-N445 PolarHBondContact O-N 2.85Å; N443-N445 VanDerWaalsContact O-N 3.13Å; N445-R464 WeakPolarHBondContact CB-O 3.35Å; N445-R464 PolarHBondContact O-NH1 2.86Å; N445-R464 PolarHBondContact O-NH2 3.31Å; N445-M465 PolarHBondContact ND2-O 3.33Å
446	G	95.2	Very high	93.1	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.			trans	100.1	137.3	178.4	0	0	0	0	0	112.3	Y422 N443 R444 G463 R464	Y422-G446 WeakPolarHBondContact O-CA 3.32Å; N443-G446 PolarHBondContact O-N 2.81Å; R444-G446 PolarHBondContact O-N 2.79Å; G446-G463 CarbonylContact O-C 3.55Å; G446-G463 WeakPolarHBondContact O-CA 3.31Å; G446-R464 PolarHBondContact O-N 2.93Å
447	I	97.2	Very high	93.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	134.3	-173.7	-52.2	178.4	0	0	0	109.2	S405 S421 Y422 W425 V426 T442 N443 I450 G462	S405-I447 VanDerWaalsContact CB-O 3.31Å; S405-I447 WeakPolarHBondContact CB-O 3.3Å; S405-I447 PolarHBondContact OG-O 2.84Å; S421-I447 WeakPolarHBondContact O-CB 3.36Å; S421-I447 WeakPolarHBondContact O-CG1 3.27Å; S421-I447 PolarHBondContact O-N 3.46Å; Y422-I447 VanDerWaalsContact CD1-O 3.32Å; Y422-I447 WeakPolarHBondContact CD1-O 3.17Å; Y422-I447 WeakPolarHBondContact CE1-O 3.42Å; W425-I447 WeakPolarHBondContact O-CD1 3.37Å; V426-I447 HydrophobicContact CB-CD1 4.37Å; V426-I447 HydrophobicContact CG2-CD1 3.19Å; T442-I447 HydrophobicContact CG2-CD1 3.43Å; T442-I447 VanDerWaalsContact CG2-CD1 3.43Å; T442-I447 HydrophobicContact CG2-CG1 4.06Å; N443-I447 HydrophobicContact CB-CG1 4.25Å; I447-I450 HydrophobicContact CG2-CD1 4.19Å; I447-I450 HydrophobicContact CG2-CG1 3.76Å; I447-G462 WeakPolarHBondContact CA-O 3.45Å; I447-G462 WeakPolarHBondContact CG2-O 3.43Å
448	T	96.4	Very high	93.5	Very high	4 Å²	4	38.5 Å²	38.5	3%	0.025	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-28.4	175.8	53.8	0	0	0	0	112.4	G462 G463 R464 R493	T448-G462 PolarHBondContact N-O 2.83Å; T448-G462 PolarHBondContact OG1-O 3.03Å; T448-G463 PolarHBondContact OG1-O 3.26Å; T448-R464 HydrophobicContact CG2-CB 4.17Å; T448-R464 HydrophobicContact CG2-CG 3.11Å; T448-R493 VanDerWaalsContact O-CZ 3.31Å; T448-R493 PolarHBondContact O-NE 2.83Å; T448-R493 PolarHBondContact O-NH2 2.81Å
449	Q	97	Very high	93.7	Very high	18 Å²	18	38 Å²	38	8%	0.084	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	145.4	-176.5	-168.9	174.5	14.5	0	0	111.1	G462 S495 F496	Q449-G462 PolarHBondContact N-O 3.31Å; Q449-G462 PolarHBondContact O-N 2.89Å; Q449-S495 VanDerWaalsContact OE1-CA 3.24Å; Q449-F496 HydrophobicContact CB-CD1 4.4Å; Q449-F496 HydrophobicContact CB-CE1 3.74Å; Q449-F496 HydrophobicContact CB-CZ 4.12Å; Q449-F496 VanDerWaalsContact CD-O 3.3Å; Q449-F496 HydrophobicContact CG-CE1 4.04Å; Q449-F496 HydrophobicContact CG-CZ 4.08Å; Q449-F496 PolarHBondContact NE2-O 3.15Å; Q449-F496 PolarHBondContact OE1-O 3.01Å
450	I	97.1	Very high	93.9	Very high	9 Å²	9	36.8 Å²	36.8	5%	0.046	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	140.3	172.6	-62.2	176.3	0	0	0	107.2	A408 F418 G420 V426 I447 L459 F460 T461	A408-I450 HydrophobicContact CB-CB 4.1Å; A408-I450 HydrophobicContact CB-CG2 3.6Å; F418-I450 HydrophobicContact CB-CG2 4.43Å; G420-I450 VanDerWaalsContact CA-CD1 3.43Å; V426-I450 HydrophobicContact CG1-CD1 4.06Å; V426-I450 HydrophobicContact CG2-CD1 3.77Å; I447-I450 HydrophobicContact CG2-CD1 4.19Å; I447-I450 HydrophobicContact CG2-CG1 3.76Å; I450-L459 HydrophobicContact CG2-CD1 3.28Å; I450-L459 HydrophobicContact CG2-CD2 4.3Å; I450-L459 HydrophobicContact CG2-CG 3.88Å; I450-F460 VanDerWaalsContact CA-O 3.27Å; I450-F460 WeakPolarHBondContact CA-O 2.75Å; I450-T461 HydrophobicContact CG1-CG2 4.29Å
451	A	96.1	Very high	94.1	Very high	16 Å²	16	36.4 Å²	36.4	13%	0.132	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	138.2	170.3	0	0	0	0	0	110.2	F460 F496 W498	A451-F460 PolarHBondContact N-O 3.41Å; A451-F460 PolarHBondContact O-N 2.87Å; A451-F496 HydrophobicContact CB-CD2 4.4Å; A451-F496 HydrophobicContact CB-CE2 3.74Å; A451-W498 HydrophobicContact CB-CB 4.18Å
452	T	94.7	Very high	94.2	Very high	24 Å²	24	32.9 Å²	32.9	15%	0.147	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	145.9	173.9	47.6	0	0	0	0	109.7	A408 F409 Q410 F418 L459	A408-T452 HydrophobicContact CB-CG2 3.9Å; F409-T452 PolarHBondContact O-OG1 3Å; Q410-T452 HydrophobicContact CG-CG2 4.38Å; F418-T452 HydrophobicContact CD2-CG2 3.83Å; F418-T452 HydrophobicContact CE2-CG2 4.08Å; T452-L459 HydrophobicContact CG2-CD1 3.55Å
453	T	93.6	Very high	94.3	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.012	16%	0.157	C	C	.	.			trans	-66.9	150.9	167	48.7	0	0	0	0	111	C455 G456 R457 Y458 F460 W498 Y519	T453-C455 PolarHBondContact O-N 2.96Å; T453-C455 VanDerWaalsContact O-N 3.16Å; T453-C455 PolarHBondContact OG1-SG 2.98Å; T453-G456 WeakPolarHBondContact O-CA 3.35Å; T453-G456 PolarHBondContact O-N 2.96Å; T453-R457 PolarHBondContact OG1-N 3.07Å; T453-Y458 HydrophobicContact CG2-CD2 4.24Å; T453-Y458 HydrophobicContact CG2-CG 4.49Å; T453-Y458 PolarHBondContact N-O 3Å; T453-Y458 PolarHBondContact OG1-N 3.04Å; T453-Y458 PolarHBondContact OG1-O 3.2Å; T453-F460 HydrophobicContact CG2-CE2 3.7Å; T453-F460 HydrophobicContact CG2-CZ 4.41Å; T453-W498 HydrophobicContact CG2-CD2 4.15Å; T453-W498 HydrophobicContact CG2-CG 4.46Å; T453-W498 HydrophobicContact CG2-CZ2 3.98Å; T453-Y519 HydrophobicContact CG2-CD1 4.3Å; T453-Y519 HydrophobicContact CG2-CE1 4.43Å
454	T	88.5	Confident	94.4	Very high	69 Å²	69	34.6 Å²	34.6	42%	0.423	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-35.7	177.8	-53.6	0	0	0	0	112.3	K411 G456	K411-T454 HydrophobicContact CD-CG2 3.85Å; T454-G456 VanDerWaalsContact C-N 3.26Å; T454-G456 PolarHBondContact O-N 2.73Å
455	C	87.3	Confident	94.5	Very high	70 Å²	70	29.5 Å²	29.5	47%	0.473	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-5	176.9	63	0	0	0	0	114.2	T453 R457	T453-C455 PolarHBondContact O-N 2.96Å; T453-C455 VanDerWaalsContact O-N 3.16Å; T453-C455 PolarHBondContact OG1-SG 2.98Å; C455-R457 HydrophobicContact CB-CG 4.32Å; C455-R457 PolarHBondContact O-N 3.5Å; C455-R457 VanDerWaalsContact O-N 3.15Å
456	G	88.7	Confident	94.6	Very high	7 Å²	7	26.8 Å²	26.8	7%	0.072	14%	0.137	C	C	.	.	S	Bend	trans	68.7	5.7	-179.4	0	0	0	0	0	115.4	Q410 T453 T454	Q410-G456 PolarHBondContact NE2-O 2.86Å; T453-G456 WeakPolarHBondContact O-CA 3.35Å; T453-G456 PolarHBondContact O-N 2.96Å; T454-G456 VanDerWaalsContact C-N 3.26Å; T454-G456 PolarHBondContact O-N 2.73Å
457	R	91.5	Very high	94.7	Very high	131 Å²	131	29.3 Å²	29.3	49%	0.494	15%	0.151	S	C	.	.	S	Bend	trans	-83.5	-31.3	-175.1	-65.1	-174.4	-179.7	179.1	1.8	113.5	T453 C455 V474	T453-R457 PolarHBondContact OG1-N 3.07Å; C455-R457 HydrophobicContact CB-CG 4.32Å; C455-R457 PolarHBondContact O-N 3.5Å; C455-R457 VanDerWaalsContact O-N 3.15Å; R457-V474 WeakPolarHBondContact O-CB 3.48Å; R457-V474 PolarHBondContact O-N 2.82Å
458	Y	95.2	Very high	94.6	Very high	36 Å²	36	30.5 Å²	30.5	14%	0.141	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	146.5	-178.5	-51.7	-77	0	0	0	112.2	T453 W472 D473 V481 Y519	T453-Y458 HydrophobicContact CG2-CD2 4.24Å; T453-Y458 HydrophobicContact CG2-CG 4.49Å; T453-Y458 PolarHBondContact N-O 3Å; T453-Y458 PolarHBondContact OG1-N 3.04Å; T453-Y458 PolarHBondContact OG1-O 3.2Å; Y458-W472 VanDerWaalsContact CA-O 3.23Å; Y458-W472 WeakPolarHBondContact CA-O 3.48Å; Y458-D473 HydrophobicContact CD1-CB 4.44Å; Y458-D473 HydrophobicContact CE1-CB 4.39Å; Y458-V481 HydrophobicContact CD1-CG2 4.14Å; Y458-V481 HydrophobicContact CE1-CG2 4.11Å; Y458-Y519 AromaticContact CD2-CD1 3.89Å; Y458-Y519 HydrophobicContact CD2-CD1 3.89Å; Y458-Y519 AromaticContact CD2-CD2 3.8Å; Y458-Y519 HydrophobicContact CD2-CD2 3.8Å; Y458-Y519 HydrophobicContact CD2-CE2 4.46Å; Y458-Y519 AromaticContact CD2-CG 3.49Å; Y458-Y519 HydrophobicContact CD2-CG 3.49Å; Y458-Y519 VanDerWaalsContact CD2-CG 3.49Å; Y458-Y519 HydrophobicContact CE2-CD1 4.25Å; Y458-Y519 AromaticContact CE2-CD2 3.29Å; Y458-Y519 HydrophobicContact CE2-CD2 3.29Å; Y458-Y519 AromaticContact CE2-CE2 3.95Å; Y458-Y519 HydrophobicContact CE2-CE2 3.95Å; Y458-Y519 AromaticContact CE2-CG 3.49Å; Y458-Y519 HydrophobicContact CE2-CG 3.49Å; Y458-Y519 VanDerWaalsContact CE2-CG 3.49Å; Y458-Y519 HydrophobicContact CG-CD1 4.5Å; Y458-Y519 HydrophobicContact CG-CG 4.07Å; Y458-Y519 AromaticContact CZ-CD2 3.85Å
459	L	96.4	Very high	94.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	130.6	178.9	-173	75.8	0	0	0	109.6	F418 V426 F440 I450 T452 T461 C471 W472 V474 M477	F418-L459 HydrophobicContact CB-CD1 4.42Å; F418-L459 HydrophobicContact CD1-CD1 4.4Å; F418-L459 HydrophobicContact CD1-CD2 3.98Å; F418-L459 HydrophobicContact CD2-CD1 3.73Å; F418-L459 HydrophobicContact CE1-CD2 4.08Å; F418-L459 HydrophobicContact CE2-CD1 4.03Å; F418-L459 HydrophobicContact CG-CD1 3.92Å; F418-L459 HydrophobicContact CG-CD2 4.31Å; F418-L459 HydrophobicContact CZ-CD1 4.48Å; F418-L459 HydrophobicContact CZ-CD2 4.5Å; V426-L459 HydrophobicContact CG1-CD2 4.16Å; F440-L459 HydrophobicContact CZ-CD2 3.96Å; I450-L459 HydrophobicContact CG2-CD1 3.28Å; I450-L459 HydrophobicContact CG2-CD2 4.3Å; I450-L459 HydrophobicContact CG2-CG 3.88Å; T452-L459 HydrophobicContact CG2-CD1 3.55Å; L459-T461 HydrophobicContact CD2-CG2 4.04Å; L459-T461 HydrophobicContact CG-CG2 4.25Å; L459-C471 CarbonylContact O-C 3.5Å; L459-C471 WeakPolarHBondContact O-CA 3.32Å; L459-W472 HydrophobicContact CB-CB 4.34Å; L459-W472 PolarHBondContact N-O 3.12Å; L459-W472 PolarHBondContact O-N 3.22Å; L459-V474 HydrophobicContact CB-CG2 3.94Å; L459-M477 HydrophobicContact CD2-CE 4.01Å
460	F	97.9	Very high	94.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	134.8	172.2	-62	-74.8	0	0	0	110.3	I450 A451 T453 I469 F470 C471 L484 F496 W498 L503 P518 Y519	I450-F460 VanDerWaalsContact CA-O 3.27Å; I450-F460 WeakPolarHBondContact CA-O 2.75Å; A451-F460 PolarHBondContact N-O 3.41Å; A451-F460 PolarHBondContact O-N 2.87Å; T453-F460 HydrophobicContact CG2-CE2 3.7Å; T453-F460 HydrophobicContact CG2-CZ 4.41Å; F460-I469 HydrophobicContact CB-CG2 4.02Å; F460-I469 HydrophobicContact CD1-CG2 4.22Å; F460-F470 CarbonylContact C-O 3.59Å; F460-F470 VanDerWaalsContact CA-O 3.25Å; F460-F470 WeakPolarHBondContact CA-O 3.17Å; F460-C471 HydrophobicContact CD1-CB 3.84Å; F460-C471 HydrophobicContact CE1-CB 3.62Å; F460-C471 WeakPolarHBondContact CE1-SG 3.44Å; F460-L484 HydrophobicContact CD1-CD1 4.36Å; F460-L484 HydrophobicContact CE1-CD1 4.18Å; F460-F496 HydrophobicContact CB-CE2 3.74Å; F460-F496 HydrophobicContact CB-CZ 4.24Å; F460-W498 HydrophobicContact CD2-CB 4.26Å; F460-W498 HydrophobicContact CD2-CD2 4.36Å; F460-W498 HydrophobicContact CD2-CE3 4.28Å; F460-W498 HydrophobicContact CD2-CG 4.32Å; F460-W498 HydrophobicContact CE2-CB 4.37Å; F460-W498 AromaticContact CE2-CD2 3.61Å; F460-W498 HydrophobicContact CE2-CD2 3.61Å; F460-W498 AromaticContact CE2-CE3 3.41Å; F460-W498 HydrophobicContact CE2-CE3 3.41Å; F460-W498 VanDerWaalsContact CE2-CE3 3.41Å; F460-W498 HydrophobicContact CE2-CG 4Å; F460-W498 HydrophobicContact CE2-CZ3 4Å; F460-W498 HydrophobicContact CZ-CD2 4.39Å; F460-W498 AromaticContact CZ-CE3 3.79Å; F460-W498 HydrophobicContact CZ-CE3 3.79Å; F460-W498 AromaticContact CZ-CZ3 3.95Å; F460-W498 HydrophobicContact CZ-CZ3 3.95Å; F460-L503 HydrophobicContact CD1-CD2 4.45Å; F460-L503 HydrophobicContact CD2-CD1 4.11Å; F460-L503 HydrophobicContact CE2-CD1 4.36Å; F460-L503 HydrophobicContact CG-CD1 4.19Å; F460-P518 HydrophobicContact CE1-CG 3.93Å; F460-P518 HydrophobicContact CZ-CG 3.89Å; F460-Y519 HydrophobicContact CZ-CD1 4.42Å
461	T	98.1	Very high	94.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	128.2	178	66.8	0	0	0	0	110.6	V426 T442 N443 I450 L459 I469 F470 W472	V426-T461 HydrophobicContact CG2-CG2 4.03Å; T442-T461 HydrophobicContact CG2-CG2 4.3Å; T442-T461 PolarHBondContact OG1-OG1 2.99Å; N443-T461 WeakPolarHBondContact OD1-CB 3.14Å; N443-T461 PolarHBondContact OD1-OG1 2.81Å; I450-T461 HydrophobicContact CG1-CG2 4.29Å; L459-T461 HydrophobicContact CD2-CG2 4.04Å; L459-T461 HydrophobicContact CG-CG2 4.25Å; T461-I469 WeakPolarHBondContact O-CA 3.29Å; T461-F470 PolarHBondContact N-O 3.41Å; T461-F470 PolarHBondContact O-N 3.44Å; T461-W472 PolarHBondContact OG1-NE1 3.13Å; T461-W472 VanDerWaalsContact OG1-NE1 3.1Å
462	G	97.2	Very high	94.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	144.2	173.5	0	0	0	0	0	112.2	I447 T448 Q449	I447-G462 WeakPolarHBondContact CA-O 3.45Å; I447-G462 WeakPolarHBondContact CG2-O 3.43Å; T448-G462 PolarHBondContact N-O 2.83Å; T448-G462 PolarHBondContact OG1-O 3.03Å; Q449-G462 PolarHBondContact N-O 3.31Å; Q449-G462 PolarHBondContact O-N 2.89Å
463	G	95.6	Very high	94.7	Very high	2 Å²	2	30.7 Å²	30.7	2%	0.021	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	176.3	-178.8	0	0	0	0	0	114.7	N443 G446 T448	N443-G463 PolarHBondContact ND2-N 2.8Å; G446-G463 CarbonylContact O-C 3.55Å; G446-G463 WeakPolarHBondContact O-CA 3.31Å; T448-G463 PolarHBondContact OG1-O 3.26Å
464	R	93.4	Very high	94.7	Very high	49 Å²	49	30.9 Å²	30.9	19%	0.185	16%	0.155	C	C	.	.	S	Bend	trans	-84	144.4	162.3	-63.2	-173.6	-75.4	99.9	-0.6	109.3	N445 G446 T448 D466 Q491	N445-R464 WeakPolarHBondContact CB-O 3.35Å; N445-R464 PolarHBondContact O-NH1 2.86Å; N445-R464 PolarHBondContact O-NH2 3.31Å; G446-R464 PolarHBondContact O-N 2.93Å; T448-R464 HydrophobicContact CG2-CB 4.17Å; T448-R464 HydrophobicContact CG2-CG 3.11Å; R464-D466 PolarHBondContact O-N 2.86Å; R464-D466 VanDerWaalsContact O-N 3.14Å; R464-Q491 VanDerWaalsContact CD-NE2 3.28Å; R464-Q491 VanDerWaalsContact CZ-NE2 3.28Å
465	M	94.9	Very high	94.8	Very high	100 Å²	100	33.4 Å²	33.4	49%	0.493	16%	0.157	S	C	.	.	S	Bend	trans	45.5	45.3	-179.5	-63.6	-167.7	177.3	0	0	111.5	N445 A488 T490 Q491	N445-M465 PolarHBondContact ND2-O 3.33Å; M465-A488 CarbonylContact C-O 3.46Å; M465-A488 WeakPolarHBondContact CA-O 3.13Å; M465-A488 PolarHBondContact N-O 2.88Å; M465-T490 WeakPolarHBondContact CG-O 3.48Å; M465-T490 PolarHBondContact N-O 2.94Å; M465-T490 VanDerWaalsContact N-O 3.1Å; M465-Q491 HydrophobicContact CE-CB 4.12Å
466	D	95.1	Very high	94.9	Very high	25 Å²	25	34 Å²	34	13%	0.134	16%	0.158	C	C	.	.			trans	-138.5	103.2	-172.2	-164.6	-16.7	0	0	0	108.7	N443 R464 S468 A488	N443-D466 VanDerWaalsContact CB-OD2 3.3Å; N443-D466 WeakPolarHBondContact CB-OD2 3.34Å; N443-D466 PolarHBondContact ND2-OD2 2.9Å; R464-D466 PolarHBondContact O-N 2.86Å; R464-D466 VanDerWaalsContact O-N 3.14Å; D466-S468 PolarHBondContact O-N 2.66Å; D466-S468 PolarHBondContact OD1-N 3.32Å; D466-A488 PolarHBondContact N-O 3.04Å; D466-A488 VanDerWaalsContact N-O 3.08Å; D466-A488 WeakPolarHBondContact O-CB 3.45Å
467	D	95.9	Very high	94.9	Very high	54 Å²	54	34.2 Å²	34.2	29%	0.289	16%	0.157	S	C	.	.	S	Bend	trans	-74.7	23.5	-174.5	-74.1	-0.6	0	0	0	112.5	R486 A488 R489	D467-R486 CarbonylContact C-O 3.58Å; D467-R486 WeakPolarHBondContact CA-O 3.19Å; D467-R486 WeakPolarHBondContact CB-O 3.36Å; D467-R486 PolarHBondContact O-N 2.82Å; D467-R486 VanDerWaalsContact O-N 3.09Å; D467-R486 VanDerWaalsContact O-O 3.06Å; D467-A488 VanDerWaalsContact OD1-C 3.28Å; D467-A488 PolarHBondContact OD1-N 3.05Å; D467-R489 VanDerWaalsContact OD1-CG 3.25Å; D467-R489 WeakPolarHBondContact OD1-CG 3.46Å; D467-R489 IonicContact OD2-CZ 3.09Å; D467-R489 IonicContact OD2-NE 3.87Å; D467-R489 PolarHBondContact OD2-NE 3.29Å; D467-R489 VanDerWaalsContact OD2-NE 3.11Å; D467-R489 IonicContact OD2-NH2 3.95Å
468	S	95.6	Very high	94.8	Very high	24 Å²	24	32.2 Å²	32.2	17%	0.168	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	132.7	-173.4	-72.2	0	0	0	0	112.2	D466 T483 L484	D466-S468 PolarHBondContact O-N 2.66Å; D466-S468 PolarHBondContact OD1-N 3.32Å; S468-T483 WeakPolarHBondContact OG-CG2 3.45Å; S468-L484 CarbonylContact C-O 3.53Å; S468-L484 WeakPolarHBondContact CA-O 3.26Å
469	I	97.8	Very high	94.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	126	161.7	-58.3	174.4	0	0	0	107.4	F460 T461 L484 R486 F496 L503	F460-I469 HydrophobicContact CB-CG2 4.02Å; F460-I469 HydrophobicContact CD1-CG2 4.22Å; T461-I469 WeakPolarHBondContact O-CA 3.29Å; I469-L484 HydrophobicContact CB-CB 4.19Å; I469-L484 HydrophobicContact CB-CD1 4.44Å; I469-L484 HydrophobicContact CG2-CD1 4.45Å; I469-L484 PolarHBondContact N-O 2.87Å; I469-L484 PolarHBondContact O-N 2.91Å; I469-R486 HydrophobicContact CD1-CG 4.42Å; I469-R486 HydrophobicContact CG1-CG 4.19Å; I469-R486 VanDerWaalsContact CG1-NE 3.27Å; I469-F496 HydrophobicContact CD1-CB 3.82Å; I469-F496 HydrophobicContact CD1-CD1 3.72Å; I469-F496 HydrophobicContact CD1-CD2 4.33Å; I469-F496 HydrophobicContact CD1-CE1 4.37Å; I469-F496 HydrophobicContact CD1-CG 3.69Å; I469-F496 HydrophobicContact CG1-CD1 4.25Å; I469-F496 HydrophobicContact CG1-CE1 4.5Å; I469-F496 HydrophobicContact CG2-CZ 4.4Å; I469-L503 HydrophobicContact CD1-CD2 3.98Å; I469-L503 HydrophobicContact CG2-CD2 4.4Å
470	F	97.7	Very high	94.7	Very high	39 Å²	39	39.5 Å²	39.5	17%	0.171	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	136.7	177.2	-60.6	-60.2	0	0	0	111	T442 N443 F460 T461 W472 L480 T483	T442-F470 WeakPolarHBondContact OG1-CD2 3.42Å; N443-F470 WeakPolarHBondContact ND2-CD2 3.19Å; N443-F470 WeakPolarHBondContact ND2-CE2 3Å; F460-F470 CarbonylContact C-O 3.59Å; F460-F470 VanDerWaalsContact CA-O 3.25Å; F460-F470 WeakPolarHBondContact CA-O 3.17Å; T461-F470 PolarHBondContact N-O 3.41Å; T461-F470 PolarHBondContact O-N 3.44Å; F470-W472 HydrophobicContact CB-CZ2 3.86Å; F470-W472 VanDerWaalsContact CB-NE1 3.31Å; F470-W472 HydrophobicContact CD2-CZ2 4.38Å; F470-W472 HydrophobicContact CG-CZ2 4.15Å; F470-L480 HydrophobicContact CB-CD1 3.74Å; F470-L480 HydrophobicContact CD1-CD1 3.8Å; F470-L480 HydrophobicContact CG-CD1 4.11Å; F470-T483 HydrophobicContact CD1-CG2 3.95Å; F470-T483 HydrophobicContact CE1-CG2 3.75Å
471	C	97.5	Very high	94.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	127.4	171.7	-173.5	0	0	0	0	110.2	L459 F460 V481 C482	L459-C471 CarbonylContact O-C 3.5Å; L459-C471 WeakPolarHBondContact O-CA 3.32Å; F460-C471 HydrophobicContact CD1-CB 3.84Å; F460-C471 HydrophobicContact CE1-CB 3.62Å; F460-C471 WeakPolarHBondContact CE1-SG 3.44Å; C471-V481 HydrophobicContact CB-CB 4.42Å; C471-V481 PolarHBondContact O-N 3.08Å; C471-C482 WeakPolarHBondContact CB-SG 3.23Å; C471-C482 PolarHBondContact N-O 2.77Å
472	W	97	Very high	94.5	Very high	25 Å²	25	40.9 Å²	40.9	10%	0.095	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	142.7	-176.1	-52.2	87.5	0	0	0	111.5	F440 T442 Y458 L459 T461 F470 M477 P478 K479 L480	F440-W472 AromaticContact CE2-CD2 4Å; F440-W472 HydrophobicContact CE2-CD2 4Å; F440-W472 HydrophobicContact CE2-CE3 4.36Å; F440-W472 HydrophobicContact CE2-CG 4.33Å; F440-W472 HydrophobicContact CE2-CZ2 4.43Å; T442-W472 VanDerWaalsContact OG1-CZ2 3.26Å; T442-W472 WeakPolarHBondContact OG1-CZ2 3.2Å; Y458-W472 VanDerWaalsContact CA-O 3.23Å; Y458-W472 WeakPolarHBondContact CA-O 3.48Å; L459-W472 HydrophobicContact CB-CB 4.34Å; L459-W472 PolarHBondContact N-O 3.12Å; L459-W472 PolarHBondContact O-N 3.22Å; T461-W472 PolarHBondContact OG1-NE1 3.13Å; T461-W472 VanDerWaalsContact OG1-NE1 3.1Å; F470-W472 HydrophobicContact CB-CZ2 3.86Å; F470-W472 VanDerWaalsContact CB-NE1 3.31Å; F470-W472 HydrophobicContact CD2-CZ2 4.38Å; F470-W472 HydrophobicContact CG-CZ2 4.15Å; W472-M477 HydrophobicContact CB-CE 3.74Å; W472-M477 HydrophobicContact CB-SD 3.56Å; W472-M477 VanDerWaalsContact CB-SD 3.56Å; W472-M477 HydrophobicContact CG-CE 4.29Å; W472-M477 HydrophobicContact CG-SD 4.45Å; W472-P478 HydrophobicContact CE3-CB 4.5Å; W472-P478 HydrophobicContact CZ3-CB 4.26Å; W472-K479 WeakPolarHBondContact CA-O 3.34Å; W472-L480 HydrophobicContact CD2-CD1 4.29Å; W472-L480 HydrophobicContact CE3-CB 4.16Å; W472-L480 HydrophobicContact CE3-CD1 4.37Å; W472-L480 HydrophobicContact CH2-CB 4.33Å; W472-L480 HydrophobicContact CH2-CD1 4.15Å; W472-L480 HydrophobicContact CZ2-CD1 4.04Å; W472-L480 HydrophobicContact CZ3-CB 3.88Å; W472-L480 HydrophobicContact CZ3-CD1 4.31Å
473	D	94.7	Very high	94.6	Very high	11 Å²	11	41.8 Å²	41.8	6%	0.059	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	109.8	171.6	-174.1	-22.8	0	0	0	110.1	Y458 R475 V476 M477 K479 V481	Y458-D473 HydrophobicContact CD1-CB 4.44Å; Y458-D473 HydrophobicContact CE1-CB 4.39Å; D473-R475 PolarHBondContact O-N 3.16Å; D473-R475 WeakPolarHBondContact OD1-CB 3.12Å; D473-R475 PolarHBondContact OD1-N 2.97Å; D473-R475 IonicContact OD1-NE 3.12Å; D473-R475 PolarHBondContact OD1-NE 3Å; D473-R475 IonicContact OD2-NE 3.07Å; D473-R475 IonicContact OD2-NH2 3.11Å; D473-R475 PolarHBondContact OD2-NH2 3.05Å; D473-V476 CarbonylContact O-C 3.38Å; D473-V476 VanDerWaalsContact O-C 3.28Å; D473-V476 PolarHBondContact O-N 2.88Å; D473-V476 VanDerWaalsContact O-N 3.12Å; D473-M477 WeakPolarHBondContact O-CG 3.31Å; D473-M477 PolarHBondContact O-N 3.27Å; D473-K479 PolarHBondContact N-O 2.69Å; D473-V481 HydrophobicContact CB-CG2 3.85Å
474	V	92.3	Very high	94.7	Very high	6 Å²	6	41.7 Å²	41.7	4%	0.036	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-60.7	-29.6	-176.4	175.7	0	0	0	0	112.6	F418 R457 L459 V476 M477	F418-V474 HydrophobicContact CE2-CG1 4.49Å; F418-V474 HydrophobicContact CE2-CG2 4.4Å; F418-V474 HydrophobicContact CZ-CG1 3.85Å; F418-V474 HydrophobicContact CZ-CG2 4.02Å; R457-V474 WeakPolarHBondContact O-CB 3.48Å; R457-V474 PolarHBondContact O-N 2.82Å; L459-V474 HydrophobicContact CB-CG2 3.94Å; V474-V476 VanDerWaalsContact C-N 3.33Å; V474-M477 WeakPolarHBondContact O-CG 3.44Å
475	R	90.7	Very high	94.8	Very high	123 Å²	123	45.2 Å²	45.2	46%	0.464	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-74.9	-26.8	-179.1	-59.8	175.5	-62.8	171.5	4	112.1	L19 D473	L19-R475 HydrophobicContact CD1-CG 4.45Å; D473-R475 PolarHBondContact O-N 3.16Å; D473-R475 WeakPolarHBondContact OD1-CB 3.12Å; D473-R475 PolarHBondContact OD1-N 2.97Å; D473-R475 IonicContact OD1-NE 3.12Å; D473-R475 PolarHBondContact OD1-NE 3Å; D473-R475 IonicContact OD2-NE 3.07Å; D473-R475 IonicContact OD2-NH2 3.11Å; D473-R475 PolarHBondContact OD2-NH2 3.05Å
476	V	90.4	Very high	94.9	Very high	82 Å²	82	40.5 Å²	40.5	50%	0.497	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-129	60.1	-175.3	-167.5	0	0	0	0	109.2	D473 V474 K479	D473-V476 CarbonylContact O-C 3.38Å; D473-V476 VanDerWaalsContact O-C 3.28Å; D473-V476 PolarHBondContact O-N 2.88Å; D473-V476 VanDerWaalsContact O-N 3.12Å; V474-V476 VanDerWaalsContact C-N 3.33Å; V476-K479 HydrophobicContact CB-CB 4.4Å; V476-K479 HydrophobicContact CB-CD 4.33Å; V476-K479 HydrophobicContact CG1-CB 4.4Å; V476-K479 HydrophobicContact CG1-CD 4.26Å; V476-K479 WeakPolarHBondContact O-CB 3.39Å; V476-K479 PolarHBondContact O-N 3.45Å
477	M	88.8	Confident	94.9	Very high	12 Å²	12	40.2 Å²	40.2	6%	0.059	20%	0.199	C	C	.	.	S	Bend	trans	-86.5	149	-178.5	-67.4	-71.2	-104.6	0	0	113	M438 F440 L459 W472 D473 V474	M438-M477 HydrophobicContact CE-CB 3.25Å; M438-M477 HydrophobicContact CE-CG 3.53Å; M438-M477 HydrophobicContact CG-CB 4.46Å; M438-M477 HydrophobicContact SD-CB 3.2Å; M438-M477 WeakPolarHBondContact SD-CB 3.11Å; M438-M477 HydrophobicContact SD-CE 4.19Å; M438-M477 HydrophobicContact SD-CG 3.54Å; M438-M477 VanDerWaalsContact SD-CG 3.54Å; F440-M477 HydrophobicContact CD1-CE 4.12Å; F440-M477 HydrophobicContact CE1-CE 3.29Å; F440-M477 HydrophobicContact CE2-CE 3.96Å; F440-M477 HydrophobicContact CZ-CE 3.19Å; L459-M477 HydrophobicContact CD2-CE 4.01Å; W472-M477 HydrophobicContact CB-CE 3.74Å; W472-M477 HydrophobicContact CB-SD 3.56Å; W472-M477 VanDerWaalsContact CB-SD 3.56Å; W472-M477 HydrophobicContact CG-CE 4.29Å; W472-M477 HydrophobicContact CG-SD 4.45Å; D473-M477 WeakPolarHBondContact O-CG 3.31Å; D473-M477 PolarHBondContact O-N 3.27Å; V474-M477 WeakPolarHBondContact O-CG 3.44Å
478	P	88.7	Confident	94.8	Very high	89 Å²	89	37.8 Å²	37.8	58%	0.578	19%	0.186	S	C	*	.	S	Bend	cis	-86	102.2	-8.7	32.4	-30.5	0	0	0	110.8	F440 W472	F440-P478 HydrophobicContact CB-CB 3.91Å; F440-P478 HydrophobicContact CB-CG 4.35Å; F440-P478 HydrophobicContact CD2-CB 4.26Å; F440-P478 HydrophobicContact CG-CB 4.17Å; W472-P478 HydrophobicContact CE3-CB 4.5Å; W472-P478 HydrophobicContact CZ3-CB 4.26Å
479	K	93.1	Very high	94.6	Very high	112 Å²	112	44.9 Å²	44.9	49%	0.487	21%	0.21	S	C	.	.			trans	-115	112.6	171.2	-177.7	-179.3	179.4	-173.6	0	109.1	W472 D473 V476	W472-K479 WeakPolarHBondContact CA-O 3.34Å; D473-K479 PolarHBondContact N-O 2.69Å; V476-K479 HydrophobicContact CB-CB 4.4Å; V476-K479 HydrophobicContact CB-CD 4.33Å; V476-K479 HydrophobicContact CG1-CB 4.4Å; V476-K479 HydrophobicContact CG1-CD 4.26Å; V476-K479 WeakPolarHBondContact O-CB 3.39Å; V476-K479 PolarHBondContact O-N 3.45Å
480	L	95.5	Very high	94.2	Very high	77 Å²	77	46.6 Å²	46.6	40%	0.403	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	125.8	170.3	-175	69.5	0	0	0	108.6	F470 W472	F470-L480 HydrophobicContact CB-CD1 3.74Å; F470-L480 HydrophobicContact CD1-CD1 3.8Å; F470-L480 HydrophobicContact CG-CD1 4.11Å; W472-L480 HydrophobicContact CD2-CD1 4.29Å; W472-L480 HydrophobicContact CE3-CB 4.16Å; W472-L480 HydrophobicContact CE3-CD1 4.37Å; W472-L480 HydrophobicContact CH2-CB 4.33Å; W472-L480 HydrophobicContact CH2-CD1 4.15Å; W472-L480 HydrophobicContact CZ2-CD1 4.04Å; W472-L480 HydrophobicContact CZ3-CB 3.88Å; W472-L480 HydrophobicContact CZ3-CD1 4.31Å
481	V	96.1	Very high	93.9	Very high	27 Å²	27	49.4 Å²	49.4	16%	0.164	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-57.2	176.7	177.9	0	0	0	0	109.1	Y458 C471 D473 S522	Y458-V481 HydrophobicContact CD1-CG2 4.14Å; Y458-V481 HydrophobicContact CE1-CG2 4.11Å; C471-V481 HydrophobicContact CB-CB 4.42Å; C471-V481 PolarHBondContact O-N 3.08Å; D473-V481 HydrophobicContact CB-CG2 3.85Å; V481-S522 WeakPolarHBondContact O-CA 3.42Å
482	C	96.9	Very high	93.6	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	164	179.7	68.1	0	0	0	0	111.6	C471 P518 G523 L525	C471-C482 WeakPolarHBondContact CB-SG 3.23Å; C471-C482 PolarHBondContact N-O 2.77Å; C482-P518 PolarHBondContact SG-O 3.05Å; C482-G523 CarbonylContact C-O 3.5Å; C482-G523 VanDerWaalsContact CA-O 3.24Å; C482-G523 WeakPolarHBondContact CA-O 3.11Å; C482-G523 WeakPolarHBondContact CB-O 3.21Å; C482-L525 HydrophobicContact CB-CD1 4Å; C482-L525 HydrophobicContact CB-CG 4.23Å
483	T	97.9	Very high	93.4	Very high	19 Å²	19	53 Å²	53	12%	0.117	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.3	174	-57.8	0	0	0	0	108.7	S468 F470 G523 T524 L525	S468-T483 WeakPolarHBondContact OG-CG2 3.45Å; F470-T483 HydrophobicContact CD1-CG2 3.95Å; F470-T483 HydrophobicContact CE1-CG2 3.75Å; T483-G523 PolarHBondContact N-O 2.89Å; T483-T524 CarbonylContact O-C 3.57Å; T483-T524 VanDerWaalsContact O-CA 3.3Å; T483-T524 WeakPolarHBondContact O-CA 3.45Å; T483-L525 PolarHBondContact O-N 2.85Å
484	L	98.1	Very high	93.5	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.2	-179.2	-45.4	178	0	0	0	108.9	F460 S468 I469 L503 W515 P518 L525	F460-L484 HydrophobicContact CD1-CD1 4.36Å; F460-L484 HydrophobicContact CE1-CD1 4.18Å; S468-L484 CarbonylContact C-O 3.53Å; S468-L484 WeakPolarHBondContact CA-O 3.26Å; I469-L484 HydrophobicContact CB-CB 4.19Å; I469-L484 HydrophobicContact CB-CD1 4.44Å; I469-L484 HydrophobicContact CG2-CD1 4.45Å; I469-L484 PolarHBondContact N-O 2.87Å; I469-L484 PolarHBondContact O-N 2.91Å; L484-L503 HydrophobicContact CD1-CD2 3.19Å; L484-W515 HydrophobicContact CB-CD2 4.35Å; L484-W515 HydrophobicContact CB-CZ2 4.04Å; L484-W515 HydrophobicContact CD1-CD2 4.28Å; L484-W515 HydrophobicContact CD1-CG 4.4Å; L484-W515 HydrophobicContact CD2-CG 4.4Å; L484-P518 HydrophobicContact CD1-CB 4Å; L484-P518 HydrophobicContact CD1-CG 4.07Å; L484-P518 HydrophobicContact CD2-CB 3.57Å; L484-P518 HydrophobicContact CG-CB 4.42Å; L484-L525 HydrophobicContact CD2-CB 3.86Å; L484-L525 HydrophobicContact CD2-CD1 3.63Å; L484-L525 HydrophobicContact CD2-CG 4.05Å
485	R	97.1	Very high	93.6	Very high	123 Å²	123	52.9 Å²	52.9	46%	0.464	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	123.9	-177.6	-80.3	173.6	178.1	-77.1	0.2	111.3	W515 T524 L525 E526	R485-W515 WeakPolarHBondContact O-CZ2 3.45Å; R485-T524 HydrophobicContact CG-CG2 3.57Å; R485-L525 PolarHBondContact N-O 2.93Å; R485-L525 VanDerWaalsContact N-O 3.09Å; R485-E526 WeakPolarHBondContact CD-OE1 3.45Å; R485-E526 WeakPolarHBondContact CD-OE2 3.45Å; R485-E526 IonicContact NE-OE1 3.44Å; R485-E526 PolarHBondContact NE-OE1 3.17Å
486	R	95.3	Very high	94	Very high	2 Å²	2	47 Å²	47	1%	0.008	23%	0.227	C	C	.	.			trans	-143.3	138.3	171.1	66.8	169.9	-175.1	154.6	7.5	109.6	D467 I469 A488 I494 S505 T507 Y513 W515	D467-R486 CarbonylContact C-O 3.58Å; D467-R486 WeakPolarHBondContact CA-O 3.19Å; D467-R486 WeakPolarHBondContact CB-O 3.36Å; D467-R486 PolarHBondContact O-N 2.82Å; D467-R486 VanDerWaalsContact O-N 3.09Å; D467-R486 VanDerWaalsContact O-O 3.06Å; I469-R486 HydrophobicContact CD1-CG 4.42Å; I469-R486 HydrophobicContact CG1-CG 4.19Å; I469-R486 VanDerWaalsContact CG1-NE 3.27Å; R486-A488 PolarHBondContact O-N 2.86Å; R486-I494 PolarHBondContact NH1-O 2.83Å; R486-I494 PolarHBondContact NH2-O 2.85Å; R486-S505 WeakPolarHBondContact CD-OG 3.15Å; R486-S505 PolarHBondContact NH1-OG 3.49Å; R486-T507 HydrophobicContact CB-CG2 4.35Å; R486-Y513 HydrophobicContact CB-CD2 4.24Å; R486-W515 HydrophobicContact CB-CH2 4.07Å
487	P	94.9	Very high	94.2	Very high	19 Å²	19	43.9 Å²	43.9	12%	0.123	21%	0.207	C	C	.	.			trans	-65.3	117.8	170.4	-26	36.9	0	0	0	111.3	T507 S508 D509 Y513	P487-T507 CarbonylContact O-C 3.58Å; P487-T507 WeakPolarHBondContact O-CA 3.41Å; P487-T507 VanDerWaalsContact O-CB 3.32Å; P487-T507 WeakPolarHBondContact O-CB 3.43Å; P487-S508 PolarHBondContact O-N 2.88Å; P487-S508 PolarHBondContact O-OG 2.74Å; P487-D509 WeakPolarHBondContact CG-OD2 3.26Å; P487-Y513 VanDerWaalsContact CD-CE2 3.49Å; P487-Y513 WeakPolarHBondContact CD-OH 3.42Å
488	A	94.7	Very high	94.5	Very high	2 Å²	2	44.4 Å²	44.4	2%	0.017	21%	0.208	C	C	.	.			trans	-144.4	64.5	175.5	0	0	0	0	0	109.7	M465 D466 D467 R486 T490 I494	M465-A488 CarbonylContact C-O 3.46Å; M465-A488 WeakPolarHBondContact CA-O 3.13Å; M465-A488 PolarHBondContact N-O 2.88Å; D466-A488 PolarHBondContact N-O 3.04Å; D466-A488 VanDerWaalsContact N-O 3.08Å; D466-A488 WeakPolarHBondContact O-CB 3.45Å; D467-A488 VanDerWaalsContact OD1-C 3.28Å; D467-A488 PolarHBondContact OD1-N 3.05Å; R486-A488 PolarHBondContact O-N 2.86Å; A488-T490 PolarHBondContact O-N 2.74Å; A488-I494 HydrophobicContact CB-CB 4.45Å; A488-I494 HydrophobicContact CB-CG1 4.18Å
489	R	91.7	Very high	94.6	Very high	174 Å²	174	41.6 Å²	41.6	66%	0.657	19%	0.189	S	C	*	.			trans	-90.3	4.4	-169.2	-60.1	179.5	-178.1	163.9	3.7	114.6	D467 S508	D467-R489 VanDerWaalsContact OD1-CG 3.25Å; D467-R489 WeakPolarHBondContact OD1-CG 3.46Å; D467-R489 IonicContact OD2-CZ 3.09Å; D467-R489 IonicContact OD2-NE 3.87Å; D467-R489 PolarHBondContact OD2-NE 3.29Å; D467-R489 VanDerWaalsContact OD2-NE 3.11Å; D467-R489 IonicContact OD2-NH2 3.95Å; R489-S508 PolarHBondContact N-OG 3.3Å; R489-S508 VanDerWaalsContact N-OG 3.08Å
490	T	90.1	Very high	94.3	Very high	35 Å²	35	42.5 Å²	42.5	22%	0.215	19%	0.19	C	C	.	.	S	Bend	trans	-105.1	165.3	180	72.2	0	0	0	0	110.8	M465 A488 Q492	M465-T490 WeakPolarHBondContact CG-O 3.48Å; M465-T490 PolarHBondContact N-O 2.94Å; M465-T490 VanDerWaalsContact N-O 3.1Å; A488-T490 PolarHBondContact O-N 2.74Å; T490-Q492 PolarHBondContact O-N 2.92Å; T490-Q492 PolarHBondContact OG1-N 2.92Å
491	Q	91.2	Very high	94	Very high	99 Å²	99	39.2 Å²	39.2	46%	0.463	17%	0.174	S	C	.	.	S	Bend	trans	-73.5	-14.5	172.5	-178.9	58.9	10.6	0	0	112.9	R464 M465	R464-Q491 VanDerWaalsContact CD-NE2 3.28Å; R464-Q491 VanDerWaalsContact CZ-NE2 3.28Å; M465-Q491 HydrophobicContact CE-CB 4.12Å
492	Q	90.3	Very high	93.8	Very high	42 Å²	42	38.2 Å²	38.2	20%	0.196	17%	0.168	C	C	.	.	S	Bend	trans	-72.3	158.6	-175.4	-61	176.9	-56.9	0	0	111.2	T490 I494	T490-Q492 PolarHBondContact O-N 2.92Å; T490-Q492 PolarHBondContact OG1-N 2.92Å; Q492-I494 PolarHBondContact O-N 2.84Å
493	R	92.8	Very high	93.8	Very high	59 Å²	59	38.2 Å²	38.2	22%	0.223	17%	0.168	C	C	.	.			trans	-74.1	119	173	-179	179.5	-148.9	179.1	8.7	108.1	D311 T448 N539	D311-R493 IonicContact OD1-CZ 3.29Å; D311-R493 IonicContact OD1-NH1 3.85Å; D311-R493 PolarHBondContact OD1-NH1 3.01Å; T448-R493 VanDerWaalsContact O-CZ 3.31Å; T448-R493 PolarHBondContact O-NE 2.83Å; T448-R493 PolarHBondContact O-NH2 2.81Å; R493-N539 WeakPolarHBondContact O-CA 3.26Å
494	I	95.8	Very high	93.7	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.01	16%	0.163	C	C	.	.			trans	-101.6	107.3	169.5	-55.6	-57.5	0	0	0	107.6	R486 A488 Q492 G506 A537 N539	R486-I494 PolarHBondContact NH1-O 2.83Å; R486-I494 PolarHBondContact NH2-O 2.85Å; A488-I494 HydrophobicContact CB-CB 4.45Å; A488-I494 HydrophobicContact CB-CG1 4.18Å; Q492-I494 PolarHBondContact O-N 2.84Å; I494-G506 WeakPolarHBondContact CG2-O 3.22Å; I494-A537 HydrophobicContact CD1-CB 4.35Å; I494-N539 WeakPolarHBondContact CD1-OD1 3.23Å
495	S	96.3	Very high	93.7	Very high	11 Å²	11	37.3 Å²	37.3	8%	0.077	16%	0.163	C	C	.	.			trans	-69.9	142.9	-176.1	-171.4	0	0	0	0	112.1	Q449 G506 N539	Q449-S495 VanDerWaalsContact OE1-CA 3.24Å; S495-G506 PolarHBondContact O-N 3.31Å; S495-N539 WeakPolarHBondContact CB-O 3.27Å; S495-N539 PolarHBondContact N-O 2.88Å
496	F	97.7	Very high	93.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	156.6	162.3	63.6	-93	0	0	0	109.8	Q449 A451 F460 I469 L503 V504	Q449-F496 HydrophobicContact CB-CD1 4.4Å; Q449-F496 HydrophobicContact CB-CE1 3.74Å; Q449-F496 HydrophobicContact CB-CZ 4.12Å; Q449-F496 VanDerWaalsContact CD-O 3.3Å; Q449-F496 HydrophobicContact CG-CE1 4.04Å; Q449-F496 HydrophobicContact CG-CZ 4.08Å; Q449-F496 PolarHBondContact NE2-O 3.15Å; Q449-F496 PolarHBondContact OE1-O 3.01Å; A451-F496 HydrophobicContact CB-CD2 4.4Å; A451-F496 HydrophobicContact CB-CE2 3.74Å; F460-F496 HydrophobicContact CB-CE2 3.74Å; F460-F496 HydrophobicContact CB-CZ 4.24Å; I469-F496 HydrophobicContact CD1-CB 3.82Å; I469-F496 HydrophobicContact CD1-CD1 3.72Å; I469-F496 HydrophobicContact CD1-CD2 4.33Å; I469-F496 HydrophobicContact CD1-CE1 4.37Å; I469-F496 HydrophobicContact CD1-CG 3.69Å; I469-F496 HydrophobicContact CG1-CD1 4.25Å; I469-F496 HydrophobicContact CG1-CE1 4.5Å; I469-F496 HydrophobicContact CG2-CZ 4.4Å; F496-L503 HydrophobicContact CD2-CD1 3.85Å; F496-L503 HydrophobicContact CE2-CD1 4.49Å; F496-V504 CarbonylContact C-O 3.07Å; F496-V504 WeakPolarHBondContact CA-O 3.48Å; F496-V504 WeakPolarHBondContact CB-O 3.26Å
497	E	95.9	Very high	93.7	Very high	17 Å²	17	31.4 Å²	31.4	8%	0.079	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	134.8	179.5	-165.6	167.2	111	0	0	110.6	K265 L503 V504 S542 L543	K265-E497 IonicContact NZ-OE2 2.95Å; K265-E497 PolarHBondContact NZ-OE2 3.49Å; E497-L503 WeakPolarHBondContact O-CA 3.48Å; E497-V504 PolarHBondContact N-O 3.39Å; E497-V504 PolarHBondContact O-N 3.22Å; E497-S542 WeakPolarHBondContact OE2-CA 3.39Å; E497-S542 PolarHBondContact OE2-OG 3.35Å; E497-L543 PolarHBondContact OE1-N 3.1Å
498	W	94.4	Very high	93.6	Very high	23 Å²	23	31.4 Å²	31.4	9%	0.087	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124	174.8	171.8	-92.4	0	0	0	110.1	A451 T453 F460 G501 I502 L503 P518 Y519	A451-W498 HydrophobicContact CB-CB 4.18Å; T453-W498 HydrophobicContact CG2-CD2 4.15Å; T453-W498 HydrophobicContact CG2-CG 4.46Å; T453-W498 HydrophobicContact CG2-CZ2 3.98Å; F460-W498 HydrophobicContact CD2-CB 4.26Å; F460-W498 HydrophobicContact CD2-CD2 4.36Å; F460-W498 HydrophobicContact CD2-CE3 4.28Å; F460-W498 HydrophobicContact CD2-CG 4.32Å; F460-W498 HydrophobicContact CE2-CB 4.37Å; F460-W498 AromaticContact CE2-CD2 3.61Å; F460-W498 HydrophobicContact CE2-CD2 3.61Å; F460-W498 AromaticContact CE2-CE3 3.41Å; F460-W498 HydrophobicContact CE2-CE3 3.41Å; F460-W498 VanDerWaalsContact CE2-CE3 3.41Å; F460-W498 HydrophobicContact CE2-CG 4Å; F460-W498 HydrophobicContact CE2-CZ3 4Å; F460-W498 HydrophobicContact CZ-CD2 4.39Å; F460-W498 AromaticContact CZ-CE3 3.79Å; F460-W498 HydrophobicContact CZ-CE3 3.79Å; F460-W498 AromaticContact CZ-CZ3 3.95Å; F460-W498 HydrophobicContact CZ-CZ3 3.95Å; W498-G501 WeakPolarHBondContact CH2-O 3.35Å; W498-I502 CarbonylContact C-O 3.5Å; W498-I502 WeakPolarHBondContact CA-O 3.25Å; W498-I502 VanDerWaalsContact CE3-C 3.48Å; W498-I502 VanDerWaalsContact CZ3-C 3.45Å; W498-L503 HydrophobicContact CB-CD1 3.9Å; W498-L503 HydrophobicContact CE3-CB 3.85Å; W498-L503 HydrophobicContact CE3-CD1 3.91Å; W498-L503 HydrophobicContact CZ3-CB 4.12Å; W498-P518 HydrophobicContact CZ3-CG 4.12Å; W498-Y519 AromaticContact CH2-CD1 3.84Å; W498-Y519 HydrophobicContact CH2-CD1 3.84Å; W498-Y519 AromaticContact CH2-CE1 3.3Å; W498-Y519 HydrophobicContact CH2-CE1 3.3Å; W498-Y519 HydrophobicContact CZ2-CD1 4.26Å; W498-Y519 AromaticContact CZ2-CE1 3.52Å; W498-Y519 HydrophobicContact CZ2-CE1 3.52Å; W498-Y519 HydrophobicContact CZ3-CD1 4.48Å; W498-Y519 HydrophobicContact CZ3-CE1 4.32Å
499	T	90.1	Very high	93.5	Very high	29 Å²	29	34.6 Å²	34.6	18%	0.178	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	127.7	-177.9	-69	0	0	0	0	111.2	G501 I502 L545	T499-G501 VanDerWaalsContact C-N 3.33Å; T499-G501 PolarHBondContact O-N 3.25Å; T499-G501 VanDerWaalsContact O-N 3.09Å; T499-I502 PolarHBondContact N-O 2.9Å; T499-I502 WeakPolarHBondContact O-CA 3.46Å; T499-I502 WeakPolarHBondContact O-CB 3.49Å; T499-I502 PolarHBondContact O-N 2.9Å; T499-L545 HydrophobicContact CG2-CD1 3.06Å; T499-L545 HydrophobicContact CG2-CD2 4Å; T499-L545 HydrophobicContact CG2-CG 3.49Å; T499-L545 VanDerWaalsContact CG2-CG 3.49Å
500	R	86.4	Confident	93.6	Very high	132 Å²	132	26.3 Å²	26.3	50%	0.498	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	40.8	45	175.2	-64.1	-167.3	-169.7	161.9	4.6	116.6	L232 I502 L545 D546	L232-R500 HydrophobicContact CD2-CB 4.42Å; R500-I502 VanDerWaalsContact C-N 3.35Å; R500-L545 HydrophobicContact CB-CD1 4.03Å; R500-L545 HydrophobicContact CG-CD1 3.48Å; R500-L545 VanDerWaalsContact CG-CD1 3.48Å; R500-D546 IonicContact NH2-OD1 3.52Å
501	G	90.1	Very high	93.8	Very high	8 Å²	8	24.9 Å²	24.9	8%	0.082	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.9	-10.3	178.7	0	0	0	0	0	113.6	W498 T499 E517	W498-G501 WeakPolarHBondContact CH2-O 3.35Å; T499-G501 VanDerWaalsContact C-N 3.33Å; T499-G501 PolarHBondContact O-N 3.25Å; T499-G501 VanDerWaalsContact O-N 3.09Å; G501-E517 PolarHBondContact O-N 3.23Å
502	I	92.2	Very high	94.1	Very high	6 Å²	6	20.2 Å²	20.2	3%	0.031	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	139	177.3	-71.6	-175.3	0	0	0	111.3	Y236 W498 T499 R500 V504 L514 W515 L543	Y236-I502 HydrophobicContact CD1-CD1 3.54Å; Y236-I502 HydrophobicContact CD2-CD1 3.47Å; Y236-I502 VanDerWaalsContact CD2-CD1 3.47Å; Y236-I502 HydrophobicContact CD2-CG1 4.49Å; Y236-I502 HydrophobicContact CE1-CD1 3.32Å; Y236-I502 HydrophobicContact CE1-CG1 4.45Å; Y236-I502 HydrophobicContact CE2-CD1 3.26Å; Y236-I502 HydrophobicContact CE2-CG1 3.97Å; Y236-I502 HydrophobicContact CG-CD1 3.59Å; W498-I502 CarbonylContact C-O 3.5Å; W498-I502 WeakPolarHBondContact CA-O 3.25Å; W498-I502 VanDerWaalsContact CE3-C 3.48Å; W498-I502 VanDerWaalsContact CZ3-C 3.45Å; T499-I502 PolarHBondContact N-O 2.9Å; T499-I502 WeakPolarHBondContact O-CA 3.46Å; T499-I502 WeakPolarHBondContact O-CB 3.49Å; T499-I502 PolarHBondContact O-N 2.9Å; R500-I502 VanDerWaalsContact C-N 3.35Å; I502-V504 HydrophobicContact CG2-CG2 3.49Å; I502-V504 VanDerWaalsContact CG2-CG2 3.49Å; I502-L514 HydrophobicContact CD1-CD1 4.26Å; I502-L514 HydrophobicContact CG2-CD1 3.36Å; I502-W515 WeakPolarHBondContact CA-O 3.46Å; I502-L543 HydrophobicContact CG2-CD1 4.27Å
503	L	96	Very high	94.4	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.4	158.9	-165.7	80.5	0	0	0	109	F460 I469 L484 F496 E497 W498 W515	F460-L503 HydrophobicContact CD1-CD2 4.45Å; F460-L503 HydrophobicContact CD2-CD1 4.11Å; F460-L503 HydrophobicContact CE2-CD1 4.36Å; F460-L503 HydrophobicContact CG-CD1 4.19Å; I469-L503 HydrophobicContact CD1-CD2 3.98Å; I469-L503 HydrophobicContact CG2-CD2 4.4Å; L484-L503 HydrophobicContact CD1-CD2 3.19Å; F496-L503 HydrophobicContact CD2-CD1 3.85Å; F496-L503 HydrophobicContact CE2-CD1 4.49Å; E497-L503 WeakPolarHBondContact O-CA 3.48Å; W498-L503 HydrophobicContact CB-CD1 3.9Å; W498-L503 HydrophobicContact CE3-CB 3.85Å; W498-L503 HydrophobicContact CE3-CD1 3.91Å; W498-L503 HydrophobicContact CZ3-CB 4.12Å; L503-W515 HydrophobicContact CB-CB 4.35Å; L503-W515 HydrophobicContact CB-CE3 4.26Å; L503-W515 HydrophobicContact CD2-CE3 3.96Å; L503-W515 HydrophobicContact CD2-CZ3 4.39Å; L503-W515 HydrophobicContact CG-CE3 4.38Å; L503-W515 PolarHBondContact N-O 2.8Å; L503-W515 PolarHBondContact O-N 3.4Å
504	V	96.2	Very high	94.5	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.006	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.3	169.5	-165.9	0	0	0	0	108.7	F496 E497 I502 V512 Y513 L514 V541 L543	F496-V504 CarbonylContact C-O 3.07Å; F496-V504 WeakPolarHBondContact CA-O 3.48Å; F496-V504 WeakPolarHBondContact CB-O 3.26Å; E497-V504 PolarHBondContact N-O 3.39Å; E497-V504 PolarHBondContact O-N 3.22Å; I502-V504 HydrophobicContact CG2-CG2 3.49Å; I502-V504 VanDerWaalsContact CG2-CG2 3.49Å; V504-V512 HydrophobicContact CG1-CG1 3.24Å; V504-Y513 CarbonylContact C-O 3.53Å; V504-Y513 WeakPolarHBondContact CA-O 3.44Å; V504-L514 HydrophobicContact CG2-CD1 3.79Å; V504-V541 HydrophobicContact CB-CG1 3.99Å; V504-V541 HydrophobicContact CG1-CG1 3.57Å; V504-L543 HydrophobicContact CG2-CD1 3.5Å; V504-L543 HydrophobicContact CG2-CD2 4.17Å; V504-L543 HydrophobicContact CG2-CG 3.97Å
505	S	97.5	Very high	94.5	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	140.8	175.3	-175.8	0	0	0	0	111.3	R486 V512 Y513	R486-S505 WeakPolarHBondContact CD-OG 3.15Å; R486-S505 PolarHBondContact NH1-OG 3.49Å; S505-V512 CarbonylContact O-C 3.55Å; S505-V512 WeakPolarHBondContact O-CA 3.18Å; S505-Y513 PolarHBondContact N-O 2.9Å; S505-Y513 PolarHBondContact O-N 3.22Å
506	G	96.6	Very high	94.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	172.3	158.8	0	0	0	0	0	110.7	I494 S495 V541	I494-G506 WeakPolarHBondContact CG2-O 3.22Å; S495-G506 PolarHBondContact O-N 3.31Å; G506-V541 VanDerWaalsContact N-CG2 3.33Å
507	T	96.2	Very high	94.1	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.102	C	C	.	.			trans	-141.1	163.4	177.5	57	0	0	0	0	111	R486 P487 D509 S511 Y513 I538	R486-T507 HydrophobicContact CB-CG2 4.35Å; P487-T507 CarbonylContact O-C 3.58Å; P487-T507 WeakPolarHBondContact O-CA 3.41Å; P487-T507 VanDerWaalsContact O-CB 3.32Å; P487-T507 WeakPolarHBondContact O-CB 3.43Å; T507-D509 WeakPolarHBondContact CB-OD1 3.3Å; T507-D509 PolarHBondContact O-N 2.89Å; T507-D509 PolarHBondContact OG1-OD1 3.04Å; T507-S511 PolarHBondContact N-O 3.37Å; T507-S511 VanDerWaalsContact OG1-C 3.31Å; T507-S511 WeakPolarHBondContact OG1-CA 3.4Å; T507-S511 WeakPolarHBondContact OG1-CB 3.42Å; T507-S511 PolarHBondContact OG1-N 3.43Å; T507-S511 PolarHBondContact OG1-O 3.34Å; T507-Y513 HydrophobicContact CG2-CD1 3.46Å; T507-Y513 VanDerWaalsContact CG2-CD1 3.46Å; T507-Y513 HydrophobicContact CG2-CD2 4.32Å; T507-Y513 HydrophobicContact CG2-CE1 3.61Å; T507-Y513 HydrophobicContact CG2-CE2 4.44Å; T507-Y513 HydrophobicContact CG2-CG 3.87Å; T507-I538 PolarHBondContact O-N 3.16Å
508	S	94	Very high	94	Very high	20 Å²	20	20.1 Å²	20.1	14%	0.14	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-12.3	175.8	53.1	0	0	0	0	114.3	P487 R489	P487-S508 PolarHBondContact O-N 2.88Å; P487-S508 PolarHBondContact O-OG 2.74Å; R489-S508 PolarHBondContact N-OG 3.3Å; R489-S508 VanDerWaalsContact N-OG 3.08Å
509	D	92.3	Very high	93.9	Very high	69 Å²	69	21 Å²	21	37%	0.369	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	1.8	-179.7	60.7	7.2	0	0	0	113.9	P487 T507 S511	P487-D509 WeakPolarHBondContact CG-OD2 3.26Å; T507-D509 WeakPolarHBondContact CB-OD1 3.3Å; T507-D509 PolarHBondContact O-N 2.89Å; T507-D509 PolarHBondContact OG1-OD1 3.04Å; D509-S511 WeakPolarHBondContact OD1-CB 3.31Å; D509-S511 PolarHBondContact OD1-N 3.07Å
510	G	93.2	Very high	94	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.121	C	C	.	.	S	Bend	trans	91.7	9.1	177.2	0	0	0	0	0	115.3	V533 S534 S536	G510-V533 VanDerWaalsContact O-CG2 3.29Å; G510-V533 WeakPolarHBondContact O-CG2 3.25Å; G510-V533 PolarHBondContact O-N 3.3Å; G510-S534 CarbonylContact C-O 3.54Å; G510-S534 VanDerWaalsContact CA-O 3.31Å; G510-S534 WeakPolarHBondContact CA-O 3.45Å; G510-S534 PolarHBondContact O-N 3.06Å; G510-S536 WeakPolarHBondContact CA-O 3.26Å
511	S	95.3	Very high	94.3	Very high	5 Å²	5	23.5 Å²	23.5	4%	0.035	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	164.3	173.8	-68.4	0	0	0	0	113.8	T507 D509 E530 T531 I538	T507-S511 PolarHBondContact N-O 3.37Å; T507-S511 VanDerWaalsContact OG1-C 3.31Å; T507-S511 WeakPolarHBondContact OG1-CA 3.4Å; T507-S511 WeakPolarHBondContact OG1-CB 3.42Å; T507-S511 PolarHBondContact OG1-N 3.43Å; T507-S511 PolarHBondContact OG1-O 3.34Å; D509-S511 WeakPolarHBondContact OD1-CB 3.31Å; D509-S511 PolarHBondContact OD1-N 3.07Å; S511-E530 PolarHBondContact OG-OE1 2.86Å; S511-E530 VanDerWaalsContact OG-OE1 3.13Å; S511-T531 CarbonylContact C-O 3.6Å; S511-T531 VanDerWaalsContact CA-O 3.3Å; S511-T531 WeakPolarHBondContact CA-O 3.31Å; S511-I538 WeakPolarHBondContact O-CG1 3.27Å
512	V	96.3	Very high	94.4	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.3	167.3	178.5	0	0	0	0	108.2	W238 V504 S505 T531 V533 I538 L550 T552	W238-V512 HydrophobicContact CH2-CG1 3.83Å; W238-V512 HydrophobicContact CZ2-CG1 4.25Å; V504-V512 HydrophobicContact CG1-CG1 3.24Å; S505-V512 CarbonylContact O-C 3.55Å; S505-V512 WeakPolarHBondContact O-CA 3.18Å; V512-T531 PolarHBondContact N-O 2.87Å; V512-T531 PolarHBondContact O-N 3.09Å; V512-V533 HydrophobicContact CG2-CG1 4.24Å; V512-V533 HydrophobicContact CG2-CG2 3.72Å; V512-I538 HydrophobicContact CG2-CG2 4.42Å; V512-L550 HydrophobicContact CG1-CD2 4.34Å; V512-T552 HydrophobicContact CG2-CG2 3.9Å
513	Y	96.5	Very high	94.5	Very high	20 Å²	20	29.6 Å²	29.6	8%	0.078	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	141.2	-176.4	-77.8	31.9	0	0	0	109.9	R486 P487 V504 S505 T507 W515 P527 S529 E530	R486-Y513 HydrophobicContact CB-CD2 4.24Å; P487-Y513 VanDerWaalsContact CD-CE2 3.49Å; P487-Y513 WeakPolarHBondContact CD-OH 3.42Å; V504-Y513 CarbonylContact C-O 3.53Å; V504-Y513 WeakPolarHBondContact CA-O 3.44Å; S505-Y513 PolarHBondContact N-O 2.9Å; S505-Y513 PolarHBondContact O-N 3.22Å; T507-Y513 HydrophobicContact CG2-CD1 3.46Å; T507-Y513 VanDerWaalsContact CG2-CD1 3.46Å; T507-Y513 HydrophobicContact CG2-CD2 4.32Å; T507-Y513 HydrophobicContact CG2-CE1 3.61Å; T507-Y513 HydrophobicContact CG2-CE2 4.44Å; T507-Y513 HydrophobicContact CG2-CG 3.87Å; Y513-W515 AromaticContact CD2-CH2 3.75Å; Y513-W515 HydrophobicContact CD2-CH2 3.75Å; Y513-W515 AromaticContact CD2-CZ2 3.95Å; Y513-W515 HydrophobicContact CD2-CZ2 3.95Å; Y513-W515 HydrophobicContact CG-CH2 4.03Å; Y513-P527 HydrophobicContact CD2-CB 3.72Å; Y513-P527 HydrophobicContact CD2-CG 3.51Å; Y513-P527 HydrophobicContact CE2-CB 4.41Å; Y513-P527 HydrophobicContact CE2-CG 3.68Å; Y513-P527 HydrophobicContact CG-CB 4.06Å; Y513-P527 HydrophobicContact CG-CG 4.17Å; Y513-S529 WeakPolarHBondContact CA-O 3.32Å; Y513-E530 HydrophobicContact CD1-CB 4.25Å; Y513-E530 HydrophobicContact CD1-CG 4.03Å; Y513-E530 HydrophobicContact CE1-CB 4.04Å; Y513-E530 HydrophobicContact CE1-CG 3.5Å; Y513-E530 VanDerWaalsContact CE1-OE1 3.25Å; Y513-E530 WeakPolarHBondContact CE1-OE1 3.4Å; Y513-E530 PolarHBondContact OH-OE1 2.66Å; Y513-E530 VanDerWaalsContact OH-OE1 3.07Å; Y513-E530 PolarHBondContact OH-OE2 2.81Å
514	L	95.5	Very high	94.6	Very high	12 Å²	12	33.3 Å²	33.3	6%	0.063	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	133	-176.3	-175.7	73.8	0	0	0	111.4	W238 I502 V504 I528 S529	W238-L514 HydrophobicContact CD2-CD2 3.86Å; W238-L514 HydrophobicContact CE3-CD2 4.11Å; W238-L514 HydrophobicContact CG-CD2 4.03Å; W238-L514 HydrophobicContact CZ2-CB 4.37Å; I502-L514 HydrophobicContact CD1-CD1 4.26Å; I502-L514 HydrophobicContact CG2-CD1 3.36Å; V504-L514 HydrophobicContact CG2-CD1 3.79Å; L514-I528 PolarHBondContact O-N 3.06Å; L514-S529 PolarHBondContact N-O 2.77Å
515	W	95.6	Very high	94.6	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.015	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	144.6	165.9	-60.1	-95.1	0	0	0	110.8	L484 R485 R486 I502 L503 Y513 P518 E526 P527	L484-W515 HydrophobicContact CB-CD2 4.35Å; L484-W515 HydrophobicContact CB-CZ2 4.04Å; L484-W515 HydrophobicContact CD1-CD2 4.28Å; L484-W515 HydrophobicContact CD1-CG 4.4Å; L484-W515 HydrophobicContact CD2-CG 4.4Å; R485-W515 WeakPolarHBondContact O-CZ2 3.45Å; R486-W515 HydrophobicContact CB-CH2 4.07Å; I502-W515 WeakPolarHBondContact CA-O 3.46Å; L503-W515 HydrophobicContact CB-CB 4.35Å; L503-W515 HydrophobicContact CB-CE3 4.26Å; L503-W515 HydrophobicContact CD2-CE3 3.96Å; L503-W515 HydrophobicContact CD2-CZ3 4.39Å; L503-W515 HydrophobicContact CG-CE3 4.38Å; L503-W515 PolarHBondContact N-O 2.8Å; L503-W515 PolarHBondContact O-N 3.4Å; Y513-W515 AromaticContact CD2-CH2 3.75Å; Y513-W515 HydrophobicContact CD2-CH2 3.75Å; Y513-W515 AromaticContact CD2-CZ2 3.95Å; Y513-W515 HydrophobicContact CD2-CZ2 3.95Å; Y513-W515 HydrophobicContact CG-CH2 4.03Å; W515-P518 HydrophobicContact CB-CB 4.26Å; W515-P518 HydrophobicContact CB-CG 4.21Å; W515-E526 PolarHBondContact NE1-O 3.11Å; W515-E526 VanDerWaalsContact NE1-O 3.12Å; W515-P527 HydrophobicContact CZ2-CB 3.91Å
516	T	93.4	Very high	94.5	Very high	44 Å²	44	40.4 Å²	40.4	27%	0.27	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.3	173.8	-55.6	0	0	0	0	108.7	P518	T516-P518 VanDerWaalsContact C-CD 3.44Å; T516-P518 VanDerWaalsContact C-N 3.33Å
517	E	92.8	Very high	94.4	Very high	47 Å²	47	41.7 Å²	41.7	22%	0.22	24%	0.235	C	C	.	.	S	Bend	trans	43.7	50.7	177.8	-58.3	179.2	136.7	0	0	113.3	K234 G501 Y519 L520 H521	K234-E517 IonicContact NZ-OE2 3.34Å; K234-E517 PolarHBondContact NZ-OE2 3.06Å; K234-E517 VanDerWaalsContact NZ-OE2 3.09Å; G501-E517 PolarHBondContact O-N 3.23Å; E517-Y519 PolarHBondContact O-N 2.84Å; E517-Y519 VanDerWaalsContact O-N 3.07Å; E517-L520 HydrophobicContact CB-CD1 3.62Å; E517-L520 HydrophobicContact CB-CG 3.99Å; E517-L520 HydrophobicContact CG-CD1 4.37Å; E517-L520 WeakPolarHBondContact O-CB 3.37Å; E517-L520 PolarHBondContact O-N 3.32Å; E517-H521 PolarHBondContact O-ND1 3Å
518	P	94.2	Very high	94.3	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.013	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-58	-30.8	-174.1	20.9	-31.8	0	0	0	113	F460 C482 L484 W498 W515 T516 L520 H521 L525	F460-P518 HydrophobicContact CE1-CG 3.93Å; F460-P518 HydrophobicContact CZ-CG 3.89Å; C482-P518 PolarHBondContact SG-O 3.05Å; L484-P518 HydrophobicContact CD1-CB 4Å; L484-P518 HydrophobicContact CD1-CG 4.07Å; L484-P518 HydrophobicContact CD2-CB 3.57Å; L484-P518 HydrophobicContact CG-CB 4.42Å; W498-P518 HydrophobicContact CZ3-CG 4.12Å; W515-P518 HydrophobicContact CB-CB 4.26Å; W515-P518 HydrophobicContact CB-CG 4.21Å; T516-P518 VanDerWaalsContact C-CD 3.44Å; T516-P518 VanDerWaalsContact C-N 3.33Å; P518-L520 PolarHBondContact O-N 2.91Å; P518-L520 VanDerWaalsContact O-N 3.15Å; P518-H521 PolarHBondContact O-N 3.34Å; P518-L525 HydrophobicContact CB-CD1 3.97Å
519	Y	91.6	Very high	94.2	Very high	42 Å²	42	47.7 Å²	47.7	17%	0.165	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-66.4	-10.2	179.2	58.1	-106.7	0	0	0	114.6	T453 Y458 F460 W498 E517 H521	T453-Y519 HydrophobicContact CG2-CD1 4.3Å; T453-Y519 HydrophobicContact CG2-CE1 4.43Å; Y458-Y519 AromaticContact CD2-CD1 3.89Å; Y458-Y519 HydrophobicContact CD2-CD1 3.89Å; Y458-Y519 AromaticContact CD2-CD2 3.8Å; Y458-Y519 HydrophobicContact CD2-CD2 3.8Å; Y458-Y519 HydrophobicContact CD2-CE2 4.46Å; Y458-Y519 AromaticContact CD2-CG 3.49Å; Y458-Y519 HydrophobicContact CD2-CG 3.49Å; Y458-Y519 VanDerWaalsContact CD2-CG 3.49Å; Y458-Y519 HydrophobicContact CE2-CD1 4.25Å; Y458-Y519 AromaticContact CE2-CD2 3.29Å; Y458-Y519 HydrophobicContact CE2-CD2 3.29Å; Y458-Y519 AromaticContact CE2-CE2 3.95Å; Y458-Y519 HydrophobicContact CE2-CE2 3.95Å; Y458-Y519 AromaticContact CE2-CG 3.49Å; Y458-Y519 HydrophobicContact CE2-CG 3.49Å; Y458-Y519 VanDerWaalsContact CE2-CG 3.49Å; Y458-Y519 HydrophobicContact CG-CD1 4.5Å; Y458-Y519 HydrophobicContact CG-CG 4.07Å; Y458-Y519 AromaticContact CZ-CD2 3.85Å; F460-Y519 HydrophobicContact CZ-CD1 4.42Å; W498-Y519 AromaticContact CH2-CD1 3.84Å; W498-Y519 HydrophobicContact CH2-CD1 3.84Å; W498-Y519 AromaticContact CH2-CE1 3.3Å; W498-Y519 HydrophobicContact CH2-CE1 3.3Å; W498-Y519 HydrophobicContact CZ2-CD1 4.26Å; W498-Y519 AromaticContact CZ2-CE1 3.52Å; W498-Y519 HydrophobicContact CZ2-CE1 3.52Å; W498-Y519 HydrophobicContact CZ3-CD1 4.48Å; W498-Y519 HydrophobicContact CZ3-CE1 4.32Å; E517-Y519 PolarHBondContact O-N 2.84Å; E517-Y519 VanDerWaalsContact O-N 3.07Å; Y519-H521 VanDerWaalsContact C-N 3.28Å
520	L	92.4	Very high	94.2	Very high	107 Å²	107	49 Å²	49	56%	0.56	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-80.7	-13.5	172.6	-63.7	179.7	0	0	0	112.5	E517 P518	E517-L520 HydrophobicContact CB-CD1 3.62Å; E517-L520 HydrophobicContact CB-CG 3.99Å; E517-L520 HydrophobicContact CG-CD1 4.37Å; E517-L520 WeakPolarHBondContact O-CB 3.37Å; E517-L520 PolarHBondContact O-N 3.32Å; P518-L520 PolarHBondContact O-N 2.91Å; P518-L520 VanDerWaalsContact O-N 3.15Å
521	H	92.9	Very high	94.3	Very high	106 Å²	106	50 Å²	50	49%	0.491	28%	0.277	S	S	.	.	S	Bend	trans	-111.3	169.3	-176	-51.9	90.2	0	0	0	110.5	E517 P518 Y519 L525	E517-H521 PolarHBondContact O-ND1 3Å; P518-H521 PolarHBondContact O-N 3.34Å; Y519-H521 VanDerWaalsContact C-N 3.28Å; H521-L525 HydrophobicContact CB-CD1 3.77Å; H521-L525 HydrophobicContact CB-CD2 3.74Å; H521-L525 HydrophobicContact CB-CG 4.41Å
522	S	92.9	Very high	94.2	Very high	102 Å²	102	54.4 Å²	54.4	71%	0.713	31%	0.306	S	S	*	.			trans	-131.5	156	179.5	65.9	0	0	0	0	111.6	V481	V481-S522 WeakPolarHBondContact O-CA 3.42Å
523	G	94.4	Very high	94	Very high	41 Å²	41	54.9 Å²	54.9	42%	0.423	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	85.7	-154.6	-178.4	0	0	0	0	0	112.1	C482 T483	C482-G523 CarbonylContact C-O 3.5Å; C482-G523 VanDerWaalsContact CA-O 3.24Å; C482-G523 WeakPolarHBondContact CA-O 3.11Å; C482-G523 WeakPolarHBondContact CB-O 3.21Å; T483-G523 PolarHBondContact N-O 2.89Å
524	T	96.7	Very high	93.8	Very high	77 Å²	77	54.2 Å²	54.2	47%	0.472	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	122.9	-178.3	-53.9	0	0	0	0	109.8	T483 R485	T483-T524 CarbonylContact O-C 3.57Å; T483-T524 VanDerWaalsContact O-CA 3.3Å; T483-T524 WeakPolarHBondContact O-CA 3.45Å; R485-T524 HydrophobicContact CG-CG2 3.57Å
525	L	96.7	Very high	93.4	Very high	31 Å²	31	61.9 Å²	61.9	16%	0.162	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	131.4	-176.1	-48.2	179	0	0	0	110.3	C482 T483 L484 R485 P518 H521	C482-L525 HydrophobicContact CB-CD1 4Å; C482-L525 HydrophobicContact CB-CG 4.23Å; T483-L525 PolarHBondContact O-N 2.85Å; L484-L525 HydrophobicContact CD2-CB 3.86Å; L484-L525 HydrophobicContact CD2-CD1 3.63Å; L484-L525 HydrophobicContact CD2-CG 4.05Å; R485-L525 PolarHBondContact N-O 2.93Å; R485-L525 VanDerWaalsContact N-O 3.09Å; P518-L525 HydrophobicContact CB-CD1 3.97Å; H521-L525 HydrophobicContact CB-CD1 3.77Å; H521-L525 HydrophobicContact CB-CD2 3.74Å; H521-L525 HydrophobicContact CB-CG 4.41Å
526	E	96.1	Very high	93.2	Very high	119 Å²	119	62.1 Å²	62.1	56%	0.556	34%	0.343	S	S	*	.			trans	-77.4	155.7	165.8	-60.7	-55.3	157.7	0	0	110.1	R485 W515	R485-E526 WeakPolarHBondContact CD-OE1 3.45Å; R485-E526 WeakPolarHBondContact CD-OE2 3.45Å; R485-E526 IonicContact NE-OE1 3.44Å; R485-E526 PolarHBondContact NE-OE1 3.17Å; W515-E526 PolarHBondContact NE1-O 3.11Å; W515-E526 VanDerWaalsContact NE1-O 3.12Å
527	P	94.3	Very high	93.1	Very high	28 Å²	28	60 Å²	60	18%	0.182	33%	0.33	C	S	.	.			trans	-60.6	145.8	172.3	29.8	-38.8	0	0	0	111.2	Y513 W515 S529	Y513-P527 HydrophobicContact CD2-CB 3.72Å; Y513-P527 HydrophobicContact CD2-CG 3.51Å; Y513-P527 HydrophobicContact CE2-CB 4.41Å; Y513-P527 HydrophobicContact CE2-CG 3.68Å; Y513-P527 HydrophobicContact CG-CB 4.06Å; Y513-P527 HydrophobicContact CG-CG 4.17Å; W515-P527 HydrophobicContact CZ2-CB 3.91Å; P527-S529 VanDerWaalsContact C-N 3.28Å
528	I	92.7	Very high	93.3	Very high	113 Å²	113	57.8 Å²	57.8	58%	0.579	32%	0.319	S	S	*	.	S	Bend	trans	-70.1	-35.3	170.9	-61.1	177.8	0	0	0	109.6	L514	L514-I528 PolarHBondContact O-N 3.06Å
529	S	91.8	Very high	93.3	Very high	33 Å²	33	57.9 Å²	57.9	23%	0.231	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	145.9	173.8	-165	0	0	0	0	111.9	W238 Y513 L514 P527	W238-S529 PolarHBondContact NE1-OG 2.8Å; Y513-S529 WeakPolarHBondContact CA-O 3.32Å; L514-S529 PolarHBondContact N-O 2.77Å; P527-S529 VanDerWaalsContact C-N 3.28Å
530	E	93.7	Very high	93.5	Very high	97 Å²	97	55.9 Å²	55.9	45%	0.453	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	133	173.8	169.1	170.8	-158.9	0	0	108	S511 Y513	S511-E530 PolarHBondContact OG-OE1 2.86Å; S511-E530 VanDerWaalsContact OG-OE1 3.13Å; Y513-E530 HydrophobicContact CD1-CB 4.25Å; Y513-E530 HydrophobicContact CD1-CG 4.03Å; Y513-E530 HydrophobicContact CE1-CB 4.04Å; Y513-E530 HydrophobicContact CE1-CG 3.5Å; Y513-E530 VanDerWaalsContact CE1-OE1 3.25Å; Y513-E530 WeakPolarHBondContact CE1-OE1 3.4Å; Y513-E530 PolarHBondContact OH-OE1 2.66Å; Y513-E530 VanDerWaalsContact OH-OE1 3.07Å; Y513-E530 PolarHBondContact OH-OE2 2.81Å
531	T	94.3	Very high	93.7	Very high	21 Å²	21	50.8 Å²	50.8	13%	0.129	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	113.9	175.5	-56	0	0	0	0	109.8	W238 P239 P240 S511 V512 V533	W238-T531 PolarHBondContact NE1-OG1 3Å; P239-T531 HydrophobicContact CB-CG2 4.26Å; P240-T531 HydrophobicContact CG-CG2 3.99Å; S511-T531 CarbonylContact C-O 3.6Å; S511-T531 VanDerWaalsContact CA-O 3.3Å; S511-T531 WeakPolarHBondContact CA-O 3.31Å; V512-T531 PolarHBondContact N-O 2.87Å; V512-T531 PolarHBondContact O-N 3.09Å; T531-V533 HydrophobicContact CG2-CG1 4.08Å; T531-V533 PolarHBondContact O-N 3.28Å
532	C	93.6	Very high	93.9	Very high	96 Å²	96	45.8 Å²	45.8	65%	0.649	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	117.7	173.5	-173.9	0	0	0	0	109.4
533	V	92	Very high	94	Very high	11 Å²	11	41.9 Å²	41.9	7%	0.067	23%	0.233	C	C	.	.			trans	-118.5	-15.6	-174.8	-65.7	0	0	0	0	113.5	G510 V512 T531 I538 K585 W587	G510-V533 VanDerWaalsContact O-CG2 3.29Å; G510-V533 WeakPolarHBondContact O-CG2 3.25Å; G510-V533 PolarHBondContact O-N 3.3Å; V512-V533 HydrophobicContact CG2-CG1 4.24Å; V512-V533 HydrophobicContact CG2-CG2 3.72Å; T531-V533 HydrophobicContact CG2-CG1 4.08Å; T531-V533 PolarHBondContact O-N 3.28Å; V533-I538 HydrophobicContact CG2-CD1 3.59Å; V533-I538 HydrophobicContact CG2-CG1 3.89Å; V533-K585 PolarHBondContact O-NZ 3.04Å; V533-W587 HydrophobicContact CB-CH2 3.6Å; V533-W587 HydrophobicContact CB-CZ2 3.49Å; V533-W587 VanDerWaalsContact CB-CZ2 3.49Å; V533-W587 HydrophobicContact CG1-CH2 3.59Å; V533-W587 HydrophobicContact CG1-CZ2 3.65Å; V533-W587 HydrophobicContact CG1-CZ3 4.05Å; V533-W587 HydrophobicContact CG2-CZ2 4.44Å
534	S	91.4	Very high	94	Very high	6 Å²	6	40.2 Å²	40.2	4%	0.042	22%	0.215	C	C	.	.			trans	-152.9	162.3	179.3	-173.2	0	0	0	0	110.5	G510 S536 S554 D581	G510-S534 CarbonylContact C-O 3.54Å; G510-S534 VanDerWaalsContact CA-O 3.31Å; G510-S534 WeakPolarHBondContact CA-O 3.45Å; G510-S534 PolarHBondContact O-N 3.06Å; S534-S536 PolarHBondContact OG-N 2.98Å; S534-S536 VanDerWaalsContact OG-N 3.13Å; S534-S554 VanDerWaalsContact OG-CB 3.3Å; S534-S554 WeakPolarHBondContact OG-CB 3.35Å; S534-D581 WeakPolarHBondContact CA-OD2 3.45Å; S534-D581 WeakPolarHBondContact CB-OD2 3.43Å; S534-D581 PolarHBondContact OG-O 3.06Å; S534-D581 PolarHBondContact OG-OD2 2.78Å
535	K	88.7	Confident	93.5	Very high	172 Å²	172	38.4 Å²	38.4	75%	0.748	20%	0.202	S	C	*	.	S	Bend	trans	-83.4	-14.6	166.2	-61.7	177.1	-175.7	172.1	0	112.8	D581	K535-D581 PolarHBondContact N-OD2 3.38Å
536	S	89.8	Confident	93	Very high	10 Å²	10	41.8 Å²	41.8	7%	0.07	22%	0.22	C	C	.	.	S	Bend	trans	-105.7	156.5	-177.9	-61.9	0	0	0	0	111.1	G510 S534 I538	G510-S536 WeakPolarHBondContact CA-O 3.26Å; S534-S536 PolarHBondContact OG-N 2.98Å; S534-S536 VanDerWaalsContact OG-N 3.13Å; S536-I538 PolarHBondContact O-N 2.87Å
537	A	93	Very high	92.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.			trans	-51.7	137.1	177.1	0	0	0	0	0	113.6	I494 N539 S554 G555 E556	I494-A537 HydrophobicContact CD1-CB 4.35Å; A537-N539 PolarHBondContact O-N 3.34Å; A537-S554 CarbonylContact O-C 3.44Å; A537-S554 WeakPolarHBondContact O-CA 3.34Å; A537-G555 PolarHBondContact O-N 3.11Å; A537-E556 HydrophobicContact CB-CB 4.49Å
538	I	95.9	Very high	92.5	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	93.6	175.8	-52.7	-52.9	0	0	0	109.5	T507 S511 V512 V533 S536 G540 V541	T507-I538 PolarHBondContact O-N 3.16Å; S511-I538 WeakPolarHBondContact O-CG1 3.27Å; V512-I538 HydrophobicContact CG2-CG2 4.42Å; V533-I538 HydrophobicContact CG2-CD1 3.59Å; V533-I538 HydrophobicContact CG2-CG1 3.89Å; S536-I538 PolarHBondContact O-N 2.87Å; I538-G540 WeakPolarHBondContact CG2-O 3.17Å; I538-V541 HydrophobicContact CG2-CG2 3.54Å
539	N	94.9	Very high	92.6	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.016	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-26	-177.9	-62.7	-32.4	0	0	0	113.2	L261 K262 R493 I494 S495 A537 S553 G555	L261-N539 PolarHBondContact O-ND2 3.22Å; K262-N539 WeakPolarHBondContact O-CB 3.48Å; R493-N539 WeakPolarHBondContact O-CA 3.26Å; I494-N539 WeakPolarHBondContact CD1-OD1 3.23Å; S495-N539 WeakPolarHBondContact CB-O 3.27Å; S495-N539 PolarHBondContact N-O 2.88Å; A537-N539 PolarHBondContact O-N 3.34Å; N539-S553 PolarHBondContact N-O 2.96Å; N539-G555 PolarHBondContact ND2-O 3.21Å
540	G	95.4	Very high	92.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.5	-175.6	0	0	0	0	0	111.3	I538 T552 S553	I538-G540 WeakPolarHBondContact CG2-O 3.17Å; G540-T552 CarbonylContact O-C 3.56Å; G540-T552 WeakPolarHBondContact O-CA 3.38Å; G540-S553 WeakPolarHBondContact CA-OG 3.32Å; G540-S553 PolarHBondContact N-O 2.84Å; G540-S553 PolarHBondContact N-OG 3.31Å; G540-S553 PolarHBondContact O-N 3.36Å
541	V	96.7	Very high	93	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	128.7	173.9	178.7	0	0	0	0	106.6	V504 G506 I538 L550 A551	V504-V541 HydrophobicContact CB-CG1 3.99Å; V504-V541 HydrophobicContact CG1-CG1 3.57Å; G506-V541 VanDerWaalsContact N-CG2 3.33Å; I538-V541 HydrophobicContact CG2-CG2 3.54Å; V541-L550 HydrophobicContact CG1-CD1 3.51Å; V541-A551 WeakPolarHBondContact CA-O 3.4Å
542	S	97	Very high	93.2	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.014	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	131.8	176.6	-166.1	0	0	0	0	110.4	W266 E497 L550 A551	W266-S542 PolarHBondContact N-OG 3.4Å; W266-S542 PolarHBondContact NE1-O 3.42Å; E497-S542 WeakPolarHBondContact OE2-CA 3.39Å; E497-S542 PolarHBondContact OE2-OG 3.35Å; S542-L550 WeakPolarHBondContact O-CD1 3.36Å; S542-A551 PolarHBondContact N-O 3.16Å; S542-A551 PolarHBondContact O-N 2.92Å
543	L	95.2	Very high	93.3	Very high	20 Å²	20	25 Å²	25	11%	0.105	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	142.9	179	-75.2	170.8	0	0	0	110.2	E497 I502 V504 L550 V589	E497-L543 PolarHBondContact OE1-N 3.1Å; I502-L543 HydrophobicContact CG2-CD1 4.27Å; V504-L543 HydrophobicContact CG2-CD1 3.5Å; V504-L543 HydrophobicContact CG2-CD2 4.17Å; V504-L543 HydrophobicContact CG2-CG 3.97Å; L543-L550 HydrophobicContact CD2-CB 4.2Å; L543-L550 HydrophobicContact CD2-CD1 3.83Å; L543-L550 HydrophobicContact CG-CD1 4.27Å; L543-V589 HydrophobicContact CD2-CG2 4.32Å
544	N	94.1	Very high	93.4	Very high	6 Å²	6	24.6 Å²	24.6	3%	0.032	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	95.8	171	178.8	-3.2	0	0	0	107.8	W266 G270 Y547 S548 L549	W266-N544 HydrophobicContact CD2-CB 3.81Å; W266-N544 HydrophobicContact CE3-CB 4.44Å; W266-N544 HydrophobicContact CG-CB 3.81Å; W266-N544 HydrophobicContact CZ2-CB 4.42Å; G270-N544 WeakPolarHBondContact CA-ND2 2.87Å; G270-N544 PolarHBondContact O-ND2 3.5Å; N544-Y547 WeakPolarHBondContact ND2-CD2 3.35Å; N544-Y547 WeakPolarHBondContact OD1-CD2 3.48Å; N544-S548 WeakPolarHBondContact O-CA 3.39Å; N544-S548 PolarHBondContact O-N 3.48Å; N544-L549 HydrophobicContact CB-CB 4.18Å; N544-L549 PolarHBondContact N-O 3.39Å; N544-L549 PolarHBondContact O-N 3.19Å
545	L	85.8	Confident	93.3	Very high	39 Å²	39	24.3 Å²	24.3	20%	0.204	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-31	-172.1	-70.1	-176.7	0	0	0	113.8	T499 R500 Y547 S548	T499-L545 HydrophobicContact CG2-CD1 3.06Å; T499-L545 HydrophobicContact CG2-CD2 4Å; T499-L545 HydrophobicContact CG2-CG 3.49Å; T499-L545 VanDerWaalsContact CG2-CG 3.49Å; R500-L545 HydrophobicContact CB-CD1 4.03Å; R500-L545 HydrophobicContact CG-CD1 3.48Å; R500-L545 VanDerWaalsContact CG-CD1 3.48Å; L545-Y547 PolarHBondContact O-N 3.37Å; L545-S548 PolarHBondContact O-N 3Å
546	D	87	Confident	93.2	Very high	101 Å²	101	19.2 Å²	19.2	54%	0.54	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-27.7	-175.7	-62.3	-24.1	0	0	0	110.8	R500	R500-D546 IonicContact NH2-OD1 3.52Å
547	Y	89.1	Confident	93	Very high	88 Å²	88	28.1 Å²	28.1	35%	0.345	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	2.9	177.2	-58.3	-78.5	0	0	0	113.7	L287 Y295 N544 L545 L549	L287-Y547 HydrophobicContact CD2-CD1 4.22Å; L287-Y547 HydrophobicContact CD2-CD2 3.71Å; L287-Y547 HydrophobicContact CD2-CE2 4.06Å; L287-Y547 HydrophobicContact CD2-CG 3.78Å; Y295-Y547 AromaticContact CE1-CD1 3.74Å; Y295-Y547 HydrophobicContact CE1-CD1 3.74Å; Y295-Y547 HydrophobicContact CE1-CE1 4.35Å; Y295-Y547 AromaticContact CZ-CD1 3.74Å; N544-Y547 WeakPolarHBondContact ND2-CD2 3.35Å; N544-Y547 WeakPolarHBondContact OD1-CD2 3.48Å; L545-Y547 PolarHBondContact O-N 3.37Å; Y547-L549 WeakPolarHBondContact O-CG 3.48Å; Y547-L549 PolarHBondContact O-N 3.41Å
548	S	90.9	Very high	92.1	Very high	65 Å²	65	29.9 Å²	29.9	46%	0.455	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	52.8	-174.7	-53	0	0	0	0	112.8	N544 L545 V589	N544-S548 WeakPolarHBondContact O-CA 3.39Å; N544-S548 PolarHBondContact O-N 3.48Å; L545-S548 PolarHBondContact O-N 3Å; S548-V589 VanDerWaalsContact C-CG2 3.5Å; S548-V589 WeakPolarHBondContact CB-O 3.44Å; S548-V589 WeakPolarHBondContact O-CG2 3.41Å; S548-V589 PolarHBondContact O-N 3.28Å
549	L	94.6	Very high	90.6	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	150.5	-178.1	-61.8	171.8	0	0	0	111.9	L243 L287 Y295 N544 Y547 L586 W587	L243-L549 HydrophobicContact CD1-CD2 3.54Å; L287-L549 HydrophobicContact CD1-CD1 3.78Å; L287-L549 HydrophobicContact CD2-CD1 3.78Å; L287-L549 HydrophobicContact CG-CD1 4.43Å; Y295-L549 HydrophobicContact CD2-CD1 4.04Å; Y295-L549 HydrophobicContact CD2-CD2 3.95Å; Y295-L549 HydrophobicContact CD2-CG 4.29Å; Y295-L549 HydrophobicContact CG-CD1 3.89Å; Y295-L549 HydrophobicContact CG-CD2 4.4Å; N544-L549 HydrophobicContact CB-CB 4.18Å; N544-L549 PolarHBondContact N-O 3.39Å; N544-L549 PolarHBondContact O-N 3.19Å; Y547-L549 WeakPolarHBondContact O-CG 3.48Å; Y547-L549 PolarHBondContact O-N 3.41Å; L549-L586 HydrophobicContact CB-CD1 4.26Å; L549-L586 HydrophobicContact CD1-CD1 4.3Å; L549-L586 HydrophobicContact CD2-CD1 4.47Å; L549-W587 CarbonylContact C-O 3.59Å; L549-W587 VanDerWaalsContact CA-O 3.29Å; L549-W587 WeakPolarHBondContact CA-O 3.35Å; L549-W587 WeakPolarHBondContact CD2-O 3.06Å
550	L	95.9	Very high	88.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	134.8	169.2	173	65.2	0	0	0	108.9	W238 V512 V541 S542 L543 T552 W587 V589	W238-L550 HydrophobicContact CH2-CD2 4.16Å; W238-L550 HydrophobicContact CZ3-CD2 4.29Å; V512-L550 HydrophobicContact CG1-CD2 4.34Å; V541-L550 HydrophobicContact CG1-CD1 3.51Å; S542-L550 WeakPolarHBondContact O-CD1 3.36Å; L543-L550 HydrophobicContact CD2-CB 4.2Å; L543-L550 HydrophobicContact CD2-CD1 3.83Å; L543-L550 HydrophobicContact CG-CD1 4.27Å; L550-T552 HydrophobicContact CD1-CG2 4.47Å; L550-T552 HydrophobicContact CD2-CG2 4.04Å; L550-T552 HydrophobicContact CG-CG2 4.02Å; L550-W587 HydrophobicContact CB-CB 4.23Å; L550-W587 PolarHBondContact N-O 3.42Å; L550-W587 VanDerWaalsContact O-CD1 3.31Å; L550-W587 PolarHBondContact O-N 2.88Å; L550-V589 HydrophobicContact CB-CG1 3.73Å; L550-V589 HydrophobicContact CB-CG2 4.34Å; L550-V589 HydrophobicContact CD2-CG1 4.33Å
551	A	97.5	Very high	86.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.1	168.4	0	0	0	0	0	109.6	W266 L273 V541 S542	W266-A551 HydrophobicContact CZ2-CB 4.16Å; W266-A551 VanDerWaalsContact NE1-CB 3.32Å; L273-A551 HydrophobicContact CD1-CB 3.79Å; L273-A551 HydrophobicContact CD2-CB 3.84Å; V541-A551 WeakPolarHBondContact CA-O 3.4Å; S542-A551 PolarHBondContact N-O 3.16Å; S542-A551 PolarHBondContact O-N 2.92Å
552	T	97.6	Very high	84	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.012	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	134.9	176.3	62.3	0	0	0	0	110.4	V512 G540 L550 K585 W587	V512-T552 HydrophobicContact CG2-CG2 3.9Å; G540-T552 CarbonylContact O-C 3.56Å; G540-T552 WeakPolarHBondContact O-CA 3.38Å; L550-T552 HydrophobicContact CD1-CG2 4.47Å; L550-T552 HydrophobicContact CD2-CG2 4.04Å; L550-T552 HydrophobicContact CG-CG2 4.02Å; T552-K585 PolarHBondContact N-O 3.49Å; T552-K585 PolarHBondContact O-N 3.06Å; T552-W587 PolarHBondContact OG1-NE1 3.43Å
553	S	96.2	Very high	81.5	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119.3	171	66.4	0	0	0	0	110.6	N539 G540	N539-S553 PolarHBondContact N-O 2.96Å; G540-S553 WeakPolarHBondContact CA-OG 3.32Å; G540-S553 PolarHBondContact N-O 2.84Å; G540-S553 PolarHBondContact N-OG 3.31Å; G540-S553 PolarHBondContact O-N 3.36Å
554	S	94.5	Very high	79	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.007	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	145.7	174.4	55.6	0	0	0	0	111.5	L261 S534 A537 D581 N582 A583	L261-S554 WeakPolarHBondContact CD1-O 3.43Å; S534-S554 VanDerWaalsContact OG-CB 3.3Å; S534-S554 WeakPolarHBondContact OG-CB 3.35Å; A537-S554 CarbonylContact O-C 3.44Å; A537-S554 WeakPolarHBondContact O-CA 3.34Å; S554-D581 WeakPolarHBondContact CB-O 3.11Å; S554-D581 PolarHBondContact OG-O 3.39Å; S554-N582 WeakPolarHBondContact O-CA 3.37Å; S554-A583 PolarHBondContact N-O 3.12Å; S554-A583 PolarHBondContact OG-N 2.94Å; S554-A583 PolarHBondContact OG-O 2.76Å
555	G	89.5	Confident	76.4	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	37%	0.372	C	S	.	.			trans	157.4	159.7	158.4	0	0	0	0	0	114.7	A537 N539 N582	A537-G555 PolarHBondContact O-N 3.11Å; N539-G555 PolarHBondContact ND2-O 3.21Å; G555-N582 WeakPolarHBondContact CA-OD1 3.32Å
556	E	87.3	Confident	74.1	Confident	66 Å²	66	78.1 Å²	78.1	31%	0.308	39%	0.391	S	S	.	.			trans	-148.6	159.7	-179.2	58.5	175.7	-152.8	0	0	112.1	N258 A537 M558	N258-E556 PolarHBondContact ND2-O 2.95Å; N258-E556 VanDerWaalsContact ND2-O 3.15Å; A537-E556 HydrophobicContact CB-CB 4.49Å; E556-M558 PolarHBondContact O-N 2.84Å
557	R	83.8	Confident	72	Confident	196 Å²	196	81.6 Å²	81.6	74%	0.74	41%	0.408	S	S	*	.			trans	-76.5	94.3	172.3	-167.2	178.3	-167.9	-165.2	2.7	108.9	N258 F260 S559	N258-R557 WeakPolarHBondContact ND2-CA 3.27Å; F260-R557 HydrophobicContact CD1-CB 4.43Å; F260-R557 HydrophobicContact CE1-CB 3.85Å; F260-R557 HydrophobicContact CE1-CG 4.16Å; F260-R557 HydrophobicContact CZ-CB 4.16Å; R557-S559 PolarHBondContact O-N 3.5Å
558	M	75.3	Confident	69.5	Low	38 Å²	38	84.7 Å²	84.7	19%	0.187	43%	0.426	C	S	.	.			trans	-60.7	121	166.4	-65	-167.4	-72.2	0	0	110.1	N258 E556 H577 G578	N258-M558 PolarHBondContact ND2-N 3.03Å; E556-M558 PolarHBondContact O-N 2.84Å; M558-H577 HydrophobicContact CE-CB 3.81Å; M558-G578 VanDerWaalsContact CE-O 3.26Å; M558-G578 WeakPolarHBondContact CE-O 3.44Å
559	S	64.3	Low	67	Low	107 Å²	107	90.4 Å²	90.4	75%	0.748	44%	0.443	S	S	*	.			trans	-72.1	134.2	165	-170.3	0	0	0	0	108.2	R557 R561	R557-S559 PolarHBondContact O-N 3.5Å; S559-R561 PolarHBondContact O-N 3.43Å
560	L	58.3	Low	64.4	Low	90 Å²	90	100.2 Å²	100.2	47%	0.471	49%	0.489	S	S	.	.			trans	-60.8	114.4	166.2	-60.8	174.3	0	0	0	106.5	L562 L575	L560-L562 PolarHBondContact O-N 3.32Å; L560-L575 HydrophobicContact CD1-CD1 4.39Å; L560-L575 HydrophobicContact CD2-CD1 4.5Å; L560-L575 HydrophobicContact CD2-CD2 4.32Å
561	R	45.9	Very low	61.5	Low	225 Å²	225	102 Å²	102	85%	0.849	50%	0.503	S	S	*	.			trans	-72.1	108.5	161.7	-71.6	-173.6	177.4	170.8	0.5	104.9	S559 V563	S559-R561 PolarHBondContact O-N 3.43Å; R561-V563 VanDerWaalsContact C-N 3.32Å; R561-V563 PolarHBondContact O-N 3.39Å
562	L	43.9	Very low	58.4	Low	143 Å²	143	109.9 Å²	109.9	75%	0.749	54%	0.542	S	S	*	.			trans	-58.3	107.5	158.5	-72.2	162.9	0	0	0	104.5	L560 D564	L560-L562 PolarHBondContact O-N 3.32Å; L562-D564 VanDerWaalsContact C-N 3.3Å; L562-D564 PolarHBondContact O-N 3.38Å
563	V	44.2	Very low	55.6	Low	107 Å²	107	115.1 Å²	115.1	65%	0.648	57%	0.574	S	S	*	*			trans	-71.3	100.7	167.6	178.2	0	0	0	0	103.9	R561 D565	R561-V563 VanDerWaalsContact C-N 3.32Å; R561-V563 PolarHBondContact O-N 3.39Å; V563-D565 HydrophobicContact CG1-CB 4.2Å; V563-D565 PolarHBondContact O-N 3.04Å
564	D	43.9	Very low	52.9	Low	142 Å²	142	121.4 Å²	121.4	76%	0.759	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-1	-178.8	-92.7	-20.5	0	0	0	113.4	L562 M566	L562-D564 VanDerWaalsContact C-N 3.3Å; L562-D564 PolarHBondContact O-N 3.38Å; D564-M566 PolarHBondContact O-N 3.28Å
565	D	38.8	Very low	50.2	Low	148 Å²	148	124 Å²	124	79%	0.791	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	21.1	-170	-72.9	-17	0	0	0	115.8	V563	V563-D565 HydrophobicContact CG1-CB 4.2Å; V563-D565 PolarHBondContact O-N 3.04Å
566	M	38.3	Very low	47.6	Very low	121 Å²	121	132.8 Å²	132.8	60%	0.596	66%	0.658	S	S	*	*			trans	-119.4	38.7	-177.5	-65.2	-122.6	67.4	0	0	114.9	D564 E568 A571	D564-M566 PolarHBondContact O-N 3.28Å; M566-E568 PolarHBondContact O-N 3.42Å; M566-A571 HydrophobicContact CB-CB 4.4Å; M566-A571 HydrophobicContact CE-CB 4.04Å; M566-A571 HydrophobicContact SD-CB 3.85Å
567	L	41.3	Very low	45.7	Very low	173 Å²	173	132 Å²	132	91%	0.906	65%	0.654	S	S	*	*			trans	-67.6	5.7	171.1	-95.4	169.9	0	0	0	115.1
568	E	38.4	Very low	44	Very low	154 Å²	154	125 Å²	125	72%	0.72	64%	0.643	S	S	*	*	S	Bend	trans	-129.5	117.1	177.9	-66.9	-170.4	174.9	0	0	112	M566	M566-E568 PolarHBondContact O-N 3.42Å
569	K	37.9	Very low	43.1	Very low	185 Å²	185	131.4 Å²	131.4	80%	0.804	67%	0.672	S	S	*	*	S	Bend	trans	75.7	94.4	164.9	-58.5	176.7	-179.9	174	0	116.2	A571	K569-A571 WeakPolarHBondContact O-CA 3.39Å; K569-A571 PolarHBondContact O-N 3.37Å
570	E	38.9	Very low	43.2	Very low	206 Å²	206	127.6 Å²	127.6	96%	0.963	65%	0.646	S	S	*	*			trans	35	38.6	152.7	-64.6	-174	161.3	0	0	115.8	M572	E570-M572 PolarHBondContact O-N 3.45Å
571	A	35.8	Very low	44.2	Very low	37 Å²	37	124.8 Å²	124.8	31%	0.306	63%	0.631	S	S	.	*			trans	-77	105.5	-172.2	0	0	0	0	0	106.7	M566 K569 V573	M566-A571 HydrophobicContact CB-CB 4.4Å; M566-A571 HydrophobicContact CE-CB 4.04Å; M566-A571 HydrophobicContact SD-CB 3.85Å; K569-A571 WeakPolarHBondContact O-CA 3.39Å; K569-A571 PolarHBondContact O-N 3.37Å; A571-V573 PolarHBondContact O-N 3.38Å
572	M	33.2	Very low	46.3	Very low	167 Å²	167	114.1 Å²	114.1	82%	0.823	59%	0.591	S	S	*	*			trans	-37.3	113.2	149.5	-96.3	-166.5	171.6	0	0	106.3	E570 I574	E570-M572 PolarHBondContact O-N 3.45Å; M572-I574 HydrophobicContact CB-CG1 4.38Å; M572-I574 PolarHBondContact O-N 3.39Å
573	V	38.5	Very low	48.6	Very low	111 Å²	111	107.3 Å²	107.3	67%	0.673	56%	0.556	S	S	*	*			trans	-66.9	87.9	176.7	-168.1	0	0	0	0	105.2	A571 L575	A571-V573 PolarHBondContact O-N 3.38Å; V573-L575 HydrophobicContact CB-CG 4.27Å; V573-L575 HydrophobicContact CG1-CD1 4.38Å; V573-L575 HydrophobicContact CG1-CD2 3.41Å; V573-L575 VanDerWaalsContact CG1-CD2 3.41Å; V573-L575 HydrophobicContact CG1-CG 3.55Å; V573-L575 PolarHBondContact O-N 3.43Å
574	I	38.2	Very low	51.1	Low	133 Å²	133	102.2 Å²	102.2	68%	0.682	53%	0.525	S	S	*	.			trans	-72.6	80.5	172	-55.6	177.6	0	0	0	104.3	M572 K576	M572-I574 HydrophobicContact CB-CG1 4.38Å; M572-I574 PolarHBondContact O-N 3.39Å; I574-K576 HydrophobicContact CG2-CG 4.02Å; I574-K576 PolarHBondContact O-N 2.81Å
575	L	39	Very low	53.6	Low	55 Å²	55	96.4 Å²	96.4	29%	0.288	49%	0.493	S	S	.	.			trans	-65.2	74.7	171.9	-67	170	0	0	0	107.5	L256 L560 V573 H577	L256-L575 HydrophobicContact CD2-CB 4.41Å; L256-L575 HydrophobicContact CD2-CD1 3.56Å; L560-L575 HydrophobicContact CD1-CD1 4.39Å; L560-L575 HydrophobicContact CD2-CD1 4.5Å; L560-L575 HydrophobicContact CD2-CD2 4.32Å; V573-L575 HydrophobicContact CB-CG 4.27Å; V573-L575 HydrophobicContact CG1-CD1 4.38Å; V573-L575 HydrophobicContact CG1-CD2 3.41Å; V573-L575 VanDerWaalsContact CG1-CD2 3.41Å; V573-L575 HydrophobicContact CG1-CG 3.55Å; V573-L575 PolarHBondContact O-N 3.43Å; L575-H577 PolarHBondContact O-N 2.8Å; L575-H577 PolarHBondContact O-ND1 3.31Å
576	K	35.4	Very low	56.4	Low	185 Å²	185	89.4 Å²	89.4	80%	0.804	46%	0.455	S	S	*	.			trans	-64.6	91.7	164.5	-76.2	-170.8	178.5	179.9	0	105.9	I574 G578	I574-K576 HydrophobicContact CG2-CG 4.02Å; I574-K576 PolarHBondContact O-N 2.81Å; K576-G578 PolarHBondContact O-N 3.38Å
577	H	46.4	Very low	59.1	Low	50 Å²	50	84.5 Å²	84.5	23%	0.231	43%	0.43	C	S	.	.			trans	-48.6	133.1	158.5	-71.3	61.8	0	0	0	105.7	M558 L575 E579	M558-H577 HydrophobicContact CE-CB 3.81Å; L575-H577 PolarHBondContact O-N 2.8Å; L575-H577 PolarHBondContact O-ND1 3.31Å; H577-E579 PolarHBondContact O-N 3.44Å
578	G	49.1	Very low	61.5	Low	49 Å²	49	78 Å²	78	51%	0.505	40%	0.399	S	S	.	.			trans	-48.2	142.5	168.3	0	0	0	0	0	108.2	M558 K576 S580	M558-G578 VanDerWaalsContact CE-O 3.26Å; M558-G578 WeakPolarHBondContact CE-O 3.44Å; K576-G578 PolarHBondContact O-N 3.38Å; G578-S580 PolarHBondContact O-N 3.18Å
579	E	56.3	Low	63.9	Low	171 Å²	171	71.5 Å²	71.5	80%	0.799	37%	0.37	S	S	*	.			trans	-47.3	106.7	-178.5	-68.4	176.4	163.4	0	0	109.6	H577 D581	H577-E579 PolarHBondContact O-N 3.44Å; E579-D581 PolarHBondContact O-N 3.39Å; E579-D581 VanDerWaalsContact O-N 3.09Å
580	S	64.7	Low	65.2	Low	28 Å²	28	65.9 Å²	65.9	20%	0.196	35%	0.348	C	S	.	.			trans	-75.1	102.8	-176.7	63.7	0	0	0	0	108.2	H251 G578 N582	H251-S580 PolarHBondContact CE1-O 3.1Å; H251-S580 VanDerWaalsContact CE1-O 3.3Å; H251-S580 PolarHBondContact CE1-OG 2.96Å; H251-S580 PolarHBondContact ND1-OG 3.17Å; G578-S580 PolarHBondContact O-N 3.18Å; S580-N582 PolarHBondContact O-N 3.16Å
581	D	80.6	Confident	66.6	Low	31 Å²	31	58.5 Å²	58.5	17%	0.166	32%	0.316	C	S	.	.			trans	-79	43.2	172.6	-175.9	21.8	0	0	0	110.5	S534 K535 S554 E579 A583 K585	S534-D581 WeakPolarHBondContact CA-OD2 3.45Å; S534-D581 WeakPolarHBondContact CB-OD2 3.43Å; S534-D581 PolarHBondContact OG-O 3.06Å; S534-D581 PolarHBondContact OG-OD2 2.78Å; K535-D581 PolarHBondContact N-OD2 3.38Å; S554-D581 WeakPolarHBondContact CB-O 3.11Å; S554-D581 PolarHBondContact OG-O 3.39Å; E579-D581 PolarHBondContact O-N 3.39Å; E579-D581 VanDerWaalsContact O-N 3.09Å; D581-A583 PolarHBondContact O-N 3.19Å; D581-K585 IonicContact OD1-NZ 3.97Å; D581-K585 PolarHBondContact OD1-NZ 3.12Å; D581-K585 VanDerWaalsContact OD1-NZ 3.12Å; D581-K585 IonicContact OD2-NZ 3.4Å
582	N	88.8	Confident	68.3	Low	1 Å²	1	59.7 Å²	59.7	1%	0.005	32%	0.316	C	S	.	.			trans	-81.2	105.4	-179.9	-64.6	-14.5	0	0	0	108.1	N259 L261 S554 G555 S580	N259-N582 PolarHBondContact O-ND2 3.31Å; L261-N582 HydrophobicContact CD1-CB 4.47Å; S554-N582 WeakPolarHBondContact O-CA 3.37Å; G555-N582 WeakPolarHBondContact CA-OD1 3.32Å; S580-N582 PolarHBondContact O-N 3.16Å
583	A	93	Very high	70.4	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.287	C	S	.	.			trans	-144	152.2	-171.4	0	0	0	0	0	111.3	I246 E247 S554 D581 K585	I246-A583 WeakPolarHBondContact O-CA 3.38Å; E247-A583 HydrophobicContact CG-CB 3.55Å; S554-A583 PolarHBondContact N-O 3.12Å; S554-A583 PolarHBondContact OG-N 2.94Å; S554-A583 PolarHBondContact OG-O 2.76Å; D581-A583 PolarHBondContact O-N 3.19Å; A583-K585 HydrophobicContact CB-CD 4.49Å; A583-K585 HydrophobicContact CB-CG 4.06Å
584	L	96.7	Very high	72.3	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	117.4	157.7	177.4	66.3	0	0	0	108.3	I246 F250 L261 C264 L273 T275 F285 L297	I246-L584 HydrophobicContact CB-CB 4.35Å; I246-L584 HydrophobicContact CD1-CD2 4.44Å; I246-L584 PolarHBondContact N-O 2.9Å; I246-L584 PolarHBondContact O-N 3.36Å; F250-L584 HydrophobicContact CE2-CB 3.66Å; F250-L584 HydrophobicContact CZ-CB 4.05Å; L261-L584 HydrophobicContact CD2-CB 4.24Å; C264-L584 HydrophobicContact CB-CD1 4.17Å; L273-L584 HydrophobicContact CD2-CD1 4.03Å; L273-L584 HydrophobicContact CD2-CD2 3.86Å; L273-L584 HydrophobicContact CD2-CG 4.39Å; T275-L584 HydrophobicContact CG2-CD1 3.9Å; T275-L584 HydrophobicContact CG2-CD2 3.79Å; T275-L584 HydrophobicContact CG2-CG 4.36Å; F285-L584 HydrophobicContact CD1-CD2 4.45Å; F285-L584 HydrophobicContact CD2-CD2 3.75Å; F285-L584 HydrophobicContact CE1-CD2 4.25Å; F285-L584 HydrophobicContact CE2-CD2 3.51Å; F285-L584 HydrophobicContact CG-CD2 4.22Å; F285-L584 HydrophobicContact CZ-CD2 3.79Å; L297-L584 HydrophobicContact CD1-CD2 3.98Å; L297-L584 HydrophobicContact CD1-CG 4.42Å
585	K	96.5	Very high	74.6	Confident	20 Å²	20	44.2 Å²	44.2	9%	0.087	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.2	179.4	-61.9	177.4	-173.4	175	0	110.1	L242 Q244 V533 T552 D581 A583 W587	L242-K585 HydrophobicContact CD1-CB 3.99Å; L242-K585 HydrophobicContact CD1-CD 4.5Å; L242-K585 HydrophobicContact CD1-CG 4.35Å; Q244-K585 WeakPolarHBondContact O-CA 3.44Å; V533-K585 PolarHBondContact O-NZ 3.04Å; T552-K585 PolarHBondContact N-O 3.49Å; T552-K585 PolarHBondContact O-N 3.06Å; D581-K585 IonicContact OD1-NZ 3.97Å; D581-K585 PolarHBondContact OD1-NZ 3.12Å; D581-K585 VanDerWaalsContact OD1-NZ 3.12Å; D581-K585 IonicContact OD2-NZ 3.4Å; A583-K585 HydrophobicContact CB-CD 4.49Å; A583-K585 HydrophobicContact CB-CG 4.06Å; K585-W587 HydrophobicContact CB-CZ2 3.51Å; K585-W587 HydrophobicContact CD-CH2 4.12Å; K585-W587 HydrophobicContact CD-CZ2 3.58Å; K585-W587 HydrophobicContact CG-CZ2 4.12Å; K585-W587 PolarHBondContact O-NE1 3.48Å
586	L	96.8	Very high	77.2	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.3	175.6	-178.1	72.9	0	0	0	109.3	L243 Q244 W266 L297 L549	L243-L586 HydrophobicContact CB-CD2 4.27Å; L243-L586 HydrophobicContact CB-CG 4.39Å; L243-L586 HydrophobicContact CD1-CD2 4.13Å; L243-L586 HydrophobicContact CD1-CG 4.29Å; L243-L586 PolarHBondContact N-O 2.92Å; Q244-L586 HydrophobicContact CB-CB 4.31Å; Q244-L586 PolarHBondContact N-O 3.43Å; Q244-L586 PolarHBondContact O-N 3.44Å; W266-L586 HydrophobicContact CH2-CD1 4.17Å; W266-L586 HydrophobicContact CZ2-CD1 3.63Å; L297-L586 HydrophobicContact CD1-CB 4.19Å; L297-L586 HydrophobicContact CD1-CD1 4.28Å; L297-L586 HydrophobicContact CG-CD1 4.46Å; L297-L586 HydrophobicContact CG-CD2 4.24Å; L549-L586 HydrophobicContact CB-CD1 4.26Å; L549-L586 HydrophobicContact CD1-CD1 4.3Å; L549-L586 HydrophobicContact CD2-CD1 4.47Å
587	W	95.3	Very high	80.4	Confident	18 Å²	18	32.5 Å²	32.5	7%	0.068	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	147.1	-177.1	-40.4	79.8	0	0	0	111	P240 K241 L242 V533 L549 L550 T552 K585	P240-W587 HydrophobicContact CB-CB 3.76Å; P240-W587 HydrophobicContact CB-CD2 4.39Å; P240-W587 HydrophobicContact CB-CE3 4.23Å; P240-W587 HydrophobicContact CB-CG 4.2Å; P240-W587 HydrophobicContact CG-CE3 4.49Å; K241-W587 CarbonylContact O-C 3.53Å; K241-W587 VanDerWaalsContact O-CA 3.25Å; K241-W587 WeakPolarHBondContact O-CA 3.44Å; L242-W587 HydrophobicContact CB-CE3 3.78Å; L242-W587 HydrophobicContact CB-CH2 4.34Å; L242-W587 HydrophobicContact CB-CZ3 3.63Å; L242-W587 HydrophobicContact CD1-CD2 4.1Å; L242-W587 HydrophobicContact CD1-CE3 4Å; L242-W587 HydrophobicContact CD1-CH2 3.83Å; L242-W587 HydrophobicContact CD1-CZ2 3.93Å; L242-W587 HydrophobicContact CD1-CZ3 3.88Å; L242-W587 HydrophobicContact CG-CZ3 4.26Å; V533-W587 HydrophobicContact CB-CH2 3.6Å; V533-W587 HydrophobicContact CB-CZ2 3.49Å; V533-W587 VanDerWaalsContact CB-CZ2 3.49Å; V533-W587 HydrophobicContact CG1-CH2 3.59Å; V533-W587 HydrophobicContact CG1-CZ2 3.65Å; V533-W587 HydrophobicContact CG1-CZ3 4.05Å; V533-W587 HydrophobicContact CG2-CZ2 4.44Å; L549-W587 CarbonylContact C-O 3.59Å; L549-W587 VanDerWaalsContact CA-O 3.29Å; L549-W587 WeakPolarHBondContact CA-O 3.35Å; L549-W587 WeakPolarHBondContact CD2-O 3.06Å; L550-W587 HydrophobicContact CB-CB 4.23Å; L550-W587 PolarHBondContact N-O 3.42Å; L550-W587 VanDerWaalsContact O-CD1 3.31Å; L550-W587 PolarHBondContact O-N 2.88Å; T552-W587 PolarHBondContact OG1-NE1 3.43Å; K585-W587 HydrophobicContact CB-CZ2 3.51Å; K585-W587 HydrophobicContact CD-CH2 4.12Å; K585-W587 HydrophobicContact CD-CZ2 3.58Å; K585-W587 HydrophobicContact CG-CZ2 4.12Å; K585-W587 PolarHBondContact O-NE1 3.48Å
588	S	92.3	Very high	83.2	Confident	37 Å²	37	31.1 Å²	31.1	26%	0.259	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	135.1	163	59.4	0	0	0	0	109.6	P240 K241	P240-S588 WeakPolarHBondContact CA-O 3.25Å; K241-S588 WeakPolarHBondContact CB-OG 3.26Å; K241-S588 PolarHBondContact N-O 3.49Å; K241-S588 PolarHBondContact O-N 3.21Å; K241-S588 PolarHBondContact O-OG 3.03Å
589	V	88.6	Confident	86.3	Confident	17 Å²	17	29.5 Å²	29.5	10%	0.103	15%	0.153	C	C	.	.			trans	-126.4	0	179.6	-72.5	0	0	0	0	112	N237 W238 P240 L543 S548 L550	N237-V589 WeakPolarHBondContact CA-OXT 3.38Å; N237-V589 PolarHBondContact N-OXT 3.33Å; W238-V589 HydrophobicContact CE3-CG1 4.13Å; W238-V589 HydrophobicContact CZ3-CG1 3.86Å; P240-V589 HydrophobicContact CB-CG1 3.76Å; L543-V589 HydrophobicContact CD2-CG2 4.32Å; S548-V589 VanDerWaalsContact C-CG2 3.5Å; S548-V589 WeakPolarHBondContact CB-O 3.44Å; S548-V589 WeakPolarHBondContact O-CG2 3.41Å; S548-V589 PolarHBondContact O-N 3.28Å; L550-V589 HydrophobicContact CB-CG1 3.73Å; L550-V589 HydrophobicContact CB-CG2 4.34Å; L550-V589 HydrophobicContact CD2-CG1 4.33Å

Retrieved 589 of 589 residues in 1979.5 ms (Link to these results)

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