A0A5K4FE65_SCHMA Loading...

CUB domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FE65, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 466 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	50.7	Low	60.7	Low	201 Å²	201	104.5 Å²	104.5	99%	0.99	60%	0.603	S	S	*	*				0	-58	0	-71.2	-155.6	-89.3	0	0	112.6	S3 L4	M1-S3 PolarHBondContact O-N 3.33Å; M1-S3 VanDerWaalsContact O-N 3.14Å; M1-L4 WeakPolarHBondContact O-CB 3.35Å; M1-L4 PolarHBondContact O-N 3.42Å
2	A	47	Very low	61	Low	73 Å²	73	103.8 Å²	103.8	60%	0.603	59%	0.594	S	S	*	*	H	α-helix	trans	-47.2	-45.4	-175.1	0	0	0	0	0	115.9	L4 L5 C6	A2-L4 VanDerWaalsContact C-N 3.28Å; A2-L4 PolarHBondContact O-N 3.43Å; A2-L5 WeakPolarHBondContact O-CB 3.29Å; A2-L5 PolarHBondContact O-N 3.47Å; A2-L5 VanDerWaalsContact O-N 3.13Å; A2-C6 PolarHBondContact O-N 2.88Å; A2-C6 VanDerWaalsContact O-N 3.15Å
3	S	53.3	Low	61.3	Low	91 Å²	91	107.5 Å²	107.5	64%	0.636	60%	0.6	S	S	*	*	H	α-helix	trans	-65.1	-26	-179.5	70.5	0	0	0	0	114.5	M1 L7	M1-S3 PolarHBondContact O-N 3.33Å; M1-S3 VanDerWaalsContact O-N 3.14Å; S3-L7 PolarHBondContact O-N 2.89Å
4	L	55.4	Low	61.4	Low	126 Å²	126	103.7 Å²	103.7	66%	0.66	59%	0.589	S	S	*	*	H	α-helix	trans	-71.3	-35.7	174.5	-76.8	158.7	0	0	0	111.6	M1 A2 L7 G8	M1-L4 WeakPolarHBondContact O-CB 3.35Å; M1-L4 PolarHBondContact O-N 3.42Å; A2-L4 VanDerWaalsContact C-N 3.28Å; A2-L4 PolarHBondContact O-N 3.43Å; L4-L7 PolarHBondContact O-N 2.9Å; L4-G8 PolarHBondContact O-N 3.46Å
5	L	55.8	Low	61	Low	126 Å²	126	104.2 Å²	104.2	66%	0.66	59%	0.589	S	S	*	*	H	α-helix	trans	-66.8	-41.5	173.6	-76.8	162.5	0	0	0	111.2	A2 G8 L9	A2-L5 WeakPolarHBondContact O-CB 3.29Å; A2-L5 PolarHBondContact O-N 3.47Å; A2-L5 VanDerWaalsContact O-N 3.13Å; L5-G8 PolarHBondContact O-N 3.09Å; L5-L9 WeakPolarHBondContact O-CG 3.01Å; L5-L9 PolarHBondContact O-N 3.41Å
6	C	62.9	Low	60.7	Low	75 Å²	75	105 Å²	105	51%	0.507	59%	0.59	S	S	.	*	H	α-helix	trans	-61.7	-43.4	173.4	-62.9	0	0	0	0	112	A2 L9 I10	A2-C6 PolarHBondContact O-N 2.88Å; A2-C6 VanDerWaalsContact O-N 3.15Å; C6-L9 PolarHBondContact O-N 2.89Å; C6-I10 WeakPolarHBondContact O-CG1 3.49Å; C6-I10 PolarHBondContact O-N 3.27Å; C6-I10 VanDerWaalsContact O-N 3.08Å
7	L	69.3	Low	60.4	Low	108 Å²	108	102.8 Å²	102.8	57%	0.565	58%	0.583	S	S	*	*	H	α-helix	trans	-63.1	-43.4	178.4	-146	84.6	0	0	0	111.8	S3 L4 I10 I11	S3-L7 PolarHBondContact O-N 2.89Å; L4-L7 PolarHBondContact O-N 2.9Å; L7-I10 PolarHBondContact O-N 2.87Å; L7-I11 WeakPolarHBondContact O-CG1 3.25Å; L7-I11 PolarHBondContact O-N 3.39Å; L7-I11 VanDerWaalsContact O-N 3.12Å
8	G	59.4	Low	59.7	Low	40 Å²	40	100.6 Å²	100.6	41%	0.412	57%	0.572	S	S	.	*	H	α-helix	trans	-62.6	-40.2	176.3	0	0	0	0	0	113.3	L4 L5 I11 L12	L4-G8 PolarHBondContact O-N 3.46Å; L5-G8 PolarHBondContact O-N 3.09Å; G8-I11 PolarHBondContact O-N 3.44Å; G8-L12 WeakPolarHBondContact O-CB 3.34Å; G8-L12 PolarHBondContact O-N 3.49Å
9	L	70.3	Confident	58.8	Low	98 Å²	98	100.9 Å²	100.9	51%	0.513	57%	0.572	S	S	.	*	H	α-helix	trans	-64.8	-39.5	175.5	-80.1	164.8	0	0	0	112.7	L5 C6 L12 F13	L5-L9 WeakPolarHBondContact O-CG 3.01Å; L5-L9 PolarHBondContact O-N 3.41Å; C6-L9 PolarHBondContact O-N 2.89Å; L9-L12 PolarHBondContact O-N 3.38Å; L9-F13 PolarHBondContact O-N 2.89Å
10	I	73.8	Confident	57.9	Low	116 Å²	116	100 Å²	100	60%	0.595	57%	0.573	S	S	*	*	H	α-helix	trans	-64.1	-43.9	176.7	-68.1	163.5	0	0	0	110.7	C6 L7 L12 F13 A14	C6-I10 WeakPolarHBondContact O-CG1 3.49Å; C6-I10 PolarHBondContact O-N 3.27Å; C6-I10 VanDerWaalsContact O-N 3.08Å; L7-I10 PolarHBondContact O-N 2.87Å; I10-L12 VanDerWaalsContact C-N 3.34Å; I10-L12 PolarHBondContact O-N 3.35Å; I10-F13 PolarHBondContact O-N 2.81Å; I10-A14 WeakPolarHBondContact O-CB 3.33Å; I10-A14 PolarHBondContact O-N 3.46Å
11	I	69.5	Low	56.9	Low	95 Å²	95	102 Å²	102	49%	0.487	58%	0.575	S	S	.	*	H	α-helix	trans	-63.7	-40	177	-66.3	165	0	0	0	111.1	L7 G8 A14 L15	L7-I11 WeakPolarHBondContact O-CG1 3.25Å; L7-I11 PolarHBondContact O-N 3.39Å; L7-I11 VanDerWaalsContact O-N 3.12Å; G8-I11 PolarHBondContact O-N 3.44Å; I11-A14 PolarHBondContact O-N 3.48Å; I11-L15 HydrophobicContact CG2-CD1 4.09Å; I11-L15 WeakPolarHBondContact O-CG 3.45Å; I11-L15 PolarHBondContact O-N 2.82Å
12	L	64.6	Low	56.2	Low	96 Å²	96	96.6 Å²	96.6	50%	0.503	55%	0.553	S	S	.	*	H	α-helix	trans	-64.2	-43.3	177.5	-167.4	72.6	0	0	0	112.2	G8 L9 I10 L15 L16	G8-L12 WeakPolarHBondContact O-CB 3.34Å; G8-L12 PolarHBondContact O-N 3.49Å; L9-L12 PolarHBondContact O-N 3.38Å; I10-L12 VanDerWaalsContact C-N 3.34Å; I10-L12 PolarHBondContact O-N 3.35Å; L12-L15 PolarHBondContact O-N 3.42Å; L12-L16 HydrophobicContact CG-CD1 4.14Å; L12-L16 WeakPolarHBondContact O-CB 3.31Å; L12-L16 WeakPolarHBondContact O-CG 3.31Å; L12-L16 PolarHBondContact O-N 3.46Å; L12-L16 VanDerWaalsContact O-N 3.08Å
13	F	65.3	Low	55.7	Low	153 Å²	153	99.6 Å²	99.6	67%	0.671	56%	0.555	S	S	*	*	H	α-helix	trans	-65.2	-40	175	-98.2	-80.8	0	0	0	112.6	L9 I10 L16 S17	L9-F13 PolarHBondContact O-N 2.89Å; I10-F13 PolarHBondContact O-N 2.81Å; F13-L16 PolarHBondContact O-N 3.25Å; F13-S17 WeakPolarHBondContact O-CB 3.26Å; F13-S17 PolarHBondContact O-N 2.91Å; F13-S17 VanDerWaalsContact O-N 3.08Å
14	A	62.5	Low	54.8	Low	54 Å²	54	102.1 Å²	102.1	45%	0.446	56%	0.556	S	S	.	*	H	α-helix	trans	-59.5	-49.6	175.6	0	0	0	0	0	111	I10 I11 L16 S17	I10-A14 WeakPolarHBondContact O-CB 3.33Å; I10-A14 PolarHBondContact O-N 3.46Å; I11-A14 PolarHBondContact O-N 3.48Å; A14-L16 PolarHBondContact O-N 3.07Å; A14-S17 PolarHBondContact O-N 3.36Å; A14-S17 PolarHBondContact O-OG 2.81Å
15	L	55.6	Low	53.9	Low	111 Å²	111	100.8 Å²	100.8	58%	0.581	55%	0.549	S	S	*	.	H	α-helix	trans	-56.8	-52	177.2	-74.5	163.8	0	0	0	112.1	I11 L12 S17 T18	I11-L15 HydrophobicContact CG2-CD1 4.09Å; I11-L15 WeakPolarHBondContact O-CG 3.45Å; I11-L15 PolarHBondContact O-N 2.82Å; L12-L15 PolarHBondContact O-N 3.42Å; L15-S17 PolarHBondContact O-N 2.88Å; L15-T18 PolarHBondContact O-N 2.81Å; L15-T18 VanDerWaalsContact O-N 3.17Å; L15-T18 PolarHBondContact O-OG1 2.86Å; L15-T18 VanDerWaalsContact O-OG1 3.1Å
16	L	55.5	Low	52.8	Low	117 Å²	117	98.1 Å²	98.1	61%	0.613	54%	0.541	S	S	*	.	H	α-helix	trans	-61.8	-24.8	-179.4	-74.7	166.3	0	0	0	113.9	L12 F13 A14	L12-L16 HydrophobicContact CG-CD1 4.14Å; L12-L16 WeakPolarHBondContact O-CB 3.31Å; L12-L16 WeakPolarHBondContact O-CG 3.31Å; L12-L16 PolarHBondContact O-N 3.46Å; L12-L16 VanDerWaalsContact O-N 3.08Å; F13-L16 PolarHBondContact O-N 3.25Å; A14-L16 PolarHBondContact O-N 3.07Å
17	S	55.3	Low	51.4	Low	68 Å²	68	100.8 Å²	100.8	48%	0.476	54%	0.544	S	S	.	.	H	α-helix	trans	-77.5	-17.4	178.3	71.9	0	0	0	0	114.6	F13 A14 L15 D19 S20	F13-S17 WeakPolarHBondContact O-CB 3.26Å; F13-S17 PolarHBondContact O-N 2.91Å; F13-S17 VanDerWaalsContact O-N 3.08Å; A14-S17 PolarHBondContact O-N 3.36Å; A14-S17 PolarHBondContact O-OG 2.81Å; L15-S17 PolarHBondContact O-N 2.88Å; S17-D19 VanDerWaalsContact C-N 3.33Å; S17-D19 PolarHBondContact O-N 3.49Å; S17-S20 PolarHBondContact O-OG 2.93Å
18	T	49	Very low	49.6	Very low	63 Å²	63	101.6 Å²	101.6	39%	0.387	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-4.3	-171.6	68.2	0	0	0	0	115.4	L15 K306	L15-T18 PolarHBondContact O-N 2.81Å; L15-T18 VanDerWaalsContact O-N 3.17Å; L15-T18 PolarHBondContact O-OG1 2.86Å; L15-T18 VanDerWaalsContact O-OG1 3.1Å; T18-K306 PolarHBondContact O-NZ 3.27Å; T18-K306 PolarHBondContact OG1-NZ 2.9Å
19	D	41.9	Very low	48.1	Very low	106 Å²	106	106.5 Å²	106.5	57%	0.567	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-34.4	-178.2	-63.1	-26.2	0	0	0	111.9	S17 F21 V22 K306	S17-D19 VanDerWaalsContact C-N 3.33Å; S17-D19 PolarHBondContact O-N 3.49Å; D19-F21 VanDerWaalsContact C-N 3.27Å; D19-F21 PolarHBondContact O-N 3.3Å; D19-V22 PolarHBondContact O-N 2.88Å; D19-K306 IonicContact OD1-NZ 2.65Å
20	S	39.9	Very low	46.1	Very low	83 Å²	83	105.2 Å²	105.2	58%	0.58	56%	0.564	S	S	*	*	H	α-helix	trans	-66.5	-24.7	179.6	57.4	0	0	0	0	114.2	S17 V22	S17-S20 PolarHBondContact O-OG 2.93Å; S20-V22 VanDerWaalsContact C-N 3.34Å
21	F	38.4	Very low	43.8	Very low	143 Å²	143	105.9 Å²	105.9	63%	0.627	57%	0.569	S	S	*	*	H	α-helix	trans	-80.8	-14.1	-179	-155.9	-97.9	0	0	0	113.4	D19 I25	D19-F21 VanDerWaalsContact C-N 3.27Å; D19-F21 PolarHBondContact O-N 3.3Å; F21-I25 HydrophobicContact CD1-CD1 4.12Å; F21-I25 HydrophobicContact CE1-CD1 3.9Å
22	V	36.3	Very low	41.8	Very low	87 Å²	87	106.4 Å²	106.4	53%	0.527	58%	0.576	S	S	.	*	H	α-helix	trans	-84	-36	179.6	-177.4	0	0	0	0	111.2	D19 S20 S26	D19-V22 PolarHBondContact O-N 2.88Å; S20-V22 VanDerWaalsContact C-N 3.34Å; V22-S26 PolarHBondContact O-N 3.45Å
23	E	35.5	Very low	40	Very low	136 Å²	136	108 Å²	108	64%	0.636	59%	0.585	S	S	*	*	H	α-helix	trans	-69	-37.5	-175.4	-164.6	172.1	-163.3	0	0	112.3	S26	E23-S26 PolarHBondContact O-N 3.27Å; E23-S26 PolarHBondContact O-OG 3.33Å
24	E	34.9	Very low	38.2	Very low	143 Å²	143	108 Å²	108	67%	0.668	60%	0.597	S	S	*	*	H	α-helix	trans	-66.2	-45.6	-179	-161.6	161.5	-135.8	0	0	112.1	S26 K27	E24-S26 VanDerWaalsContact C-N 3.29Å; E24-S26 PolarHBondContact O-N 2.81Å; E24-K27 PolarHBondContact O-N 3.43Å
25	I	36.8	Very low	36.5	Very low	98 Å²	98	109.3 Å²	109.3	50%	0.503	60%	0.599	S	S	.	*	H	α-helix	trans	-64.7	-33.2	176.9	-61.4	176.2	0	0	0	111.6	F21 K27 L29	F21-I25 HydrophobicContact CD1-CD1 4.12Å; F21-I25 HydrophobicContact CE1-CD1 3.9Å; I25-K27 PolarHBondContact O-N 3.35Å; I25-L29 PolarHBondContact O-N 3.14Å
26	S	32.8	Very low	35.1	Very low	70 Å²	70	114.4 Å²	114.4	49%	0.49	61%	0.611	S	S	.	*	H	α-helix	trans	-64.5	-22.9	179	77.9	0	0	0	0	113.7	V22 E23 E24	V22-S26 PolarHBondContact O-N 3.45Å; E23-S26 PolarHBondContact O-N 3.27Å; E23-S26 PolarHBondContact O-OG 3.33Å; E24-S26 VanDerWaalsContact C-N 3.29Å; E24-S26 PolarHBondContact O-N 2.81Å
27	K	32.2	Very low	33.7	Very low	131 Å²	131	115.9 Å²	115.9	57%	0.57	62%	0.619	S	S	*	*	H	α-helix	trans	-88.3	-43.9	-176.8	-117.1	169.5	-178.2	162.6	0	113.5	E24 I25 L29 S30 D31	E24-K27 PolarHBondContact O-N 3.43Å; I25-K27 PolarHBondContact O-N 3.35Å; K27-L29 PolarHBondContact O-N 3.15Å; K27-S30 PolarHBondContact O-N 2.98Å; K27-S30 PolarHBondContact O-OG 3.2Å; K27-D31 PolarHBondContact O-N 3.11Å; K27-D31 VanDerWaalsContact O-N 3.16Å
28	D	31.7	Very low	32.4	Very low	126 Å²	126	116.2 Å²	116.2	67%	0.674	62%	0.621	S	S	*	*	H	α-helix	trans	-61	-26.5	172.7	-86.3	-6.7	0	0	0	111.7	T32	D28-T32 WeakPolarHBondContact O-CG2 3.38Å; D28-T32 PolarHBondContact O-OG1 3.29Å
29	L	28.9	Very low	31.7	Very low	143 Å²	143	114.7 Å²	114.7	75%	0.749	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-24.3	173.7	-126.2	78.4	0	0	0	114.6	I25 K27	I25-L29 PolarHBondContact O-N 3.14Å; K27-L29 PolarHBondContact O-N 3.15Å
30	S	27.9	Very low	31.3	Very low	71 Å²	71	112.4 Å²	112.4	50%	0.497	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.8	-35	177.4	58.2	0	0	0	0	112.9	K27 T32	K27-S30 PolarHBondContact O-N 2.98Å; K27-S30 PolarHBondContact O-OG 3.2Å; S30-T32 PolarHBondContact O-N 3.15Å
31	D	25.7	Very low	31	Very low	130 Å²	130	113.2 Å²	113.2	70%	0.695	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	2.3	-163	-69	16.1	0	0	0	113.5	K27	K27-D31 PolarHBondContact O-N 3.11Å; K27-D31 VanDerWaalsContact O-N 3.16Å
32	T	27.4	Very low	31.1	Very low	105 Å²	105	110.4 Å²	110.4	64%	0.644	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	-5.6	-172.2	49.4	0	0	0	0	116.5	D28 S30	D28-T32 WeakPolarHBondContact O-CG2 3.38Å; D28-T32 PolarHBondContact O-OG1 3.29Å; S30-T32 PolarHBondContact O-N 3.15Å
33	L	27.2	Very low	31	Very low	130 Å²	130	111 Å²	111	68%	0.681	61%	0.613	S	S	*	*			trans	-140.1	117.2	175.1	-111.7	105.2	0	0	0	114.3	V35	L33-V35 VanDerWaalsContact C-N 3.26Å; L33-V35 HydrophobicContact CB-CG2 3.93Å; L33-V35 HydrophobicContact CD2-CG2 3.9Å; L33-V35 PolarHBondContact O-N 3.13Å
34	V	25.8	Very low	30.8	Very low	152 Å²	152	111.8 Å²	111.8	92%	0.921	62%	0.616	S	S	*	*			trans	-78.8	78.1	164.1	-176.8	0	0	0	0	108.7	R36	V34-R36 PolarHBondContact O-N 3.26Å
35	V	27.5	Very low	30.7	Very low	83 Å²	83	115.1 Å²	115.1	50%	0.503	63%	0.629	S	S	.	*			trans	-71.5	122.1	176.4	-164.8	0	0	0	0	109.7	L33 N37	L33-V35 VanDerWaalsContact C-N 3.26Å; L33-V35 HydrophobicContact CB-CG2 3.93Å; L33-V35 HydrophobicContact CD2-CG2 3.9Å; L33-V35 PolarHBondContact O-N 3.13Å; V35-N37 WeakPolarHBondContact CB-OD1 3.44Å; V35-N37 WeakPolarHBondContact CG1-OD1 3.28Å; V35-N37 PolarHBondContact O-N 2.98Å
36	R	26.2	Very low	30.6	Very low	218 Å²	218	115.2 Å²	115.2	82%	0.823	63%	0.627	S	S	*	*			trans	-76.9	102.1	158.6	-77.1	-174.3	173.7	-176.6	-1.6	107.3	V34 S38	V34-R36 PolarHBondContact O-N 3.26Å; R36-S38 PolarHBondContact O-N 3Å
37	N	26.2	Very low	30.7	Very low	147 Å²	147	113.5 Å²	113.5	79%	0.786	61%	0.612	S	S	*	*			trans	-74.7	38.8	-173.4	-71.2	-26.7	0	0	0	114.2	V35	V35-N37 WeakPolarHBondContact CB-OD1 3.44Å; V35-N37 WeakPolarHBondContact CG1-OD1 3.28Å; V35-N37 PolarHBondContact O-N 2.98Å
38	S	29.4	Very low	31	Very low	75 Å²	75	108.5 Å²	108.5	52%	0.524	59%	0.593	S	S	.	*	S	Bend	trans	-169.7	138	-176.9	57.3	0	0	0	0	111.8	R36	R36-S38 PolarHBondContact O-N 3Å
39	C	33.4	Very low	31.5	Very low	31 Å²	31	103.3 Å²	103.3	21%	0.209	57%	0.565	C	S	.	*	P	Polyproline II helix	trans	-51.8	135.4	158.4	-48.6	0	0	0	0	107.4	S41 D163	C39-S41 PolarHBondContact O-N 3.39Å; C39-D163 VanDerWaalsContact CA-OD2 3.32Å; C39-D163 WeakPolarHBondContact CA-OD2 3.21Å; C39-D163 PolarHBondContact N-OD2 2.71Å; C39-D163 PolarHBondContact SG-OD1 2.82Å
40	P	32.4	Very low	32.2	Very low	58 Å²	58	98.2 Å²	98.2	38%	0.377	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-58.3	118.3	-179.6	23.6	-32.7	0	0	0	109.3	T42 Y146	P40-T42 PolarHBondContact O-N 2.88Å; P40-Y146 HydrophobicContact CG-CE1 4.33Å; P40-Y146 HydrophobicContact CG-CE2 4.17Å
41	S	34.8	Very low	33.2	Very low	100 Å²	100	95.6 Å²	95.6	70%	0.699	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-65.6	123.8	176.3	55.4	0	0	0	0	108.5	C39 S43	C39-S41 PolarHBondContact O-N 3.39Å; S41-S43 PolarHBondContact O-N 3.21Å; S41-S43 PolarHBondContact O-OG 3.2Å
42	T	40.7	Very low	34.2	Very low	84 Å²	84	91 Å²	91	52%	0.515	49%	0.493	S	S	.	.			trans	-73.8	51.3	-171.4	42.9	0	0	0	0	112.6	P40	P40-T42 PolarHBondContact O-N 2.88Å
43	S	32.9	Very low	35.3	Very low	101 Å²	101	86.2 Å²	86.2	71%	0.706	46%	0.463	S	S	*	.			trans	-82.4	-17.6	180	55.1	0	0	0	0	113.1	S41	S41-S43 PolarHBondContact O-N 3.21Å; S41-S43 PolarHBondContact O-OG 3.2Å
44	E	33.2	Very low	36.2	Very low	152 Å²	152	82.6 Å²	82.6	71%	0.71	45%	0.449	S	S	*	.	S	Bend	trans	-97.6	135.7	169.6	-62	-169	143.5	0	0	110.5	H46	E44-H46 VanDerWaalsContact C-N 3.31Å; E44-H46 PolarHBondContact O-N 3.08Å
45	K	31.2	Very low	37.1	Very low	213 Å²	213	76.2 Å²	76.2	93%	0.926	41%	0.411	S	S	*	.			trans	-81.4	62.7	-163.6	-66.8	-176.7	174.4	-176.4	0	114.3
46	H	35.4	Very low	37.7	Very low	100 Å²	100	77.1 Å²	77.1	46%	0.463	42%	0.417	S	S	.	.	S	Bend	trans	-96.1	144.7	164.7	-62.1	-86	0	0	0	109	E44 S48 N195	E44-H46 VanDerWaalsContact C-N 3.31Å; E44-H46 PolarHBondContact O-N 3.08Å; H46-S48 PolarHBondContact O-N 3.24Å; H46-S48 VanDerWaalsContact O-N 3.17Å; H46-N195 VanDerWaalsContact CG-OD1 3.3Å; H46-N195 PolarHBondContact ND1-OD1 3.47Å
47	L	34.8	Very low	38.2	Very low	34 Å²	34	68.5 Å²	68.5	18%	0.178	39%	0.386	C	S	.	.			trans	-59.9	124.2	173.2	-91.9	91.2	0	0	0	108.7	M70 V73 Y98 V196 P200	L47-M70 HydrophobicContact CD2-CB 4.21Å; L47-M70 HydrophobicContact CD2-SD 4.04Å; L47-V73 HydrophobicContact CD1-CG2 3.92Å; L47-V73 HydrophobicContact CG-CG2 4.18Å; L47-Y98 HydrophobicContact CD2-CE1 4.13Å; L47-V196 HydrophobicContact CB-CG2 3.4Å; L47-V196 HydrophobicContact CD2-CG2 4.4Å; L47-V196 HydrophobicContact CG-CG2 4.47Å; L47-P200 HydrophobicContact CD2-CG 4.36Å
48	S	38.3	Very low	38.7	Very low	25 Å²	25	61.8 Å²	61.8	18%	0.175	35%	0.351	C	S	.	.			trans	-124.4	117.5	-179.5	61.4	0	0	0	0	110.1	H46 Y98 V193 N194	H46-S48 PolarHBondContact O-N 3.24Å; H46-S48 VanDerWaalsContact O-N 3.17Å; S48-Y98 WeakPolarHBondContact O-CE2 3.41Å; S48-Y98 PolarHBondContact O-OH 2.91Å; S48-V193 VanDerWaalsContact CA-O 3.28Å; S48-V193 WeakPolarHBondContact CA-O 3.19Å; S48-N194 WeakPolarHBondContact CB-OD1 3.22Å
49	L	43.3	Very low	39.2	Very low	17 Å²	17	58.9 Å²	58.9	9%	0.089	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	120.2	170.5	173.6	64.3	0	0	0	108.7	I51 F66 M70 Y98 S192 V193	L49-I51 HydrophobicContact CD1-CG1 4.4Å; L49-I51 HydrophobicContact CD2-CD1 4.12Å; L49-I51 HydrophobicContact CD2-CG1 4.48Å; L49-I51 HydrophobicContact CG-CD1 4.23Å; L49-I51 HydrophobicContact CG-CG1 4.16Å; L49-F66 HydrophobicContact CD2-CD1 3.91Å; L49-F66 HydrophobicContact CD2-CE1 3.72Å; L49-F66 HydrophobicContact CD2-CZ 4.13Å; L49-M70 HydrophobicContact CB-CE 4.45Å; L49-M70 HydrophobicContact CD2-CE 4.39Å; L49-Y98 HydrophobicContact CB-CE2 4.48Å; L49-Y98 HydrophobicContact CD1-CD2 3.8Å; L49-Y98 HydrophobicContact CD1-CE2 4.06Å; L49-S192 CarbonylContact O-C 3.59Å; L49-S192 VanDerWaalsContact O-CA 3.3Å; L49-S192 WeakPolarHBondContact O-CA 3.48Å; L49-V193 HydrophobicContact CB-CB 4.27Å; L49-V193 PolarHBondContact N-O 3.21Å; L49-V193 PolarHBondContact O-N 3.1Å
50	E	41.9	Very low	39.4	Very low	36 Å²	36	57.9 Å²	57.9	17%	0.168	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.4	172.4	-170	168.1	145.2	0	0	110.9	L96 K190 I191	E50-L96 HydrophobicContact CB-CD1 3.65Å; E50-L96 HydrophobicContact CB-CG 4.19Å; E50-K190 HydrophobicContact CG-CG 4.21Å; E50-K190 VanDerWaalsContact OE1-CE 3.22Å; E50-K190 WeakPolarHBondContact OE1-CE 3.28Å; E50-K190 IonicContact OE1-NZ 3.48Å; E50-K190 PolarHBondContact OE1-NZ 3.31Å; E50-K190 VanDerWaalsContact OE2-CE 3.23Å; E50-K190 WeakPolarHBondContact OE2-CE 3.42Å; E50-K190 IonicContact OE2-NZ 3.52Å; E50-K190 PolarHBondContact OE2-NZ 3.41Å; E50-I191 CarbonylContact C-O 3.46Å; E50-I191 VanDerWaalsContact CA-O 3.32Å; E50-I191 WeakPolarHBondContact CA-O 3.39Å
51	I	50.4	Low	39.6	Very low	16 Å²	16	55.3 Å²	55.3	8%	0.082	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.7	178.2	-49	142	0	0	0	107.5	L49 I53 Y64 F66 K190 I191	L49-I51 HydrophobicContact CD1-CG1 4.4Å; L49-I51 HydrophobicContact CD2-CD1 4.12Å; L49-I51 HydrophobicContact CD2-CG1 4.48Å; L49-I51 HydrophobicContact CG-CD1 4.23Å; L49-I51 HydrophobicContact CG-CG1 4.16Å; I51-I53 HydrophobicContact CG2-CD1 4.16Å; I51-I53 HydrophobicContact CG2-CG1 3.72Å; I51-Y64 HydrophobicContact CG2-CE1 4.02Å; I51-F66 HydrophobicContact CD1-CE1 4.27Å; I51-F66 HydrophobicContact CD1-CE2 3.78Å; I51-F66 HydrophobicContact CD1-CZ 3.36Å; I51-F66 HydrophobicContact CG1-CZ 4.02Å; I51-K190 WeakPolarHBondContact O-CA 3.43Å; I51-I191 HydrophobicContact CB-CB 4.39Å; I51-I191 HydrophobicContact CD1-CB 4.18Å; I51-I191 HydrophobicContact CD1-CD1 4.39Å; I51-I191 HydrophobicContact CD1-CG2 4.27Å; I51-I191 PolarHBondContact N-O 2.86Å; I51-I191 PolarHBondContact O-N 2.75Å
52	I	45.8	Very low	39.9	Very low	33 Å²	33	50.7 Å²	50.7	17%	0.169	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	121.5	169.9	-63.1	177.3	0	0	0	108.6	I150 L189	I52-I150 HydrophobicContact CG2-CD1 3.88Å; I52-L189 WeakPolarHBondContact CA-O 3.46Å
53	I	50.5	Low	39.8	Very low	5 Å²	5	48 Å²	48	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	113.1	-177.3	-49.2	173.5	0	0	0	107.5	I51 Y64 G188 L189 I191 V211	I51-I53 HydrophobicContact CG2-CD1 4.16Å; I51-I53 HydrophobicContact CG2-CG1 3.72Å; I53-Y64 HydrophobicContact CD1-CD2 4.11Å; I53-Y64 HydrophobicContact CD1-CE1 4.31Å; I53-Y64 HydrophobicContact CD1-CE2 3.39Å; I53-Y64 HydrophobicContact CG1-CE1 4.45Å; I53-Y64 HydrophobicContact CG1-CE2 4.11Å; I53-Y64 WeakPolarHBondContact CG1-OH 3.21Å; I53-Y64 HydrophobicContact CG2-CE2 4.39Å; I53-Y64 WeakPolarHBondContact CG2-OH 3.2Å; I53-G188 CarbonylContact O-C 3.6Å; I53-G188 WeakPolarHBondContact O-CA 3.49Å; I53-L189 PolarHBondContact N-O 2.04Å; I53-L189 PolarHBondContact O-N 3.23Å; I53-I191 HydrophobicContact CD1-CD1 3.5Å; I53-I191 HydrophobicContact CD1-CG1 4.48Å; I53-V211 HydrophobicContact CD1-CG2 3.67Å; I53-V211 HydrophobicContact CG2-CB 4.38Å; I53-V211 HydrophobicContact CG2-CG1 4.17Å
54	S	46.8	Very low	40.3	Very low	55 Å²	55	44.3 Å²	44.3	39%	0.385	23%	0.226	S	C	.	.			trans	-122.3	88.3	179.5	-172.1	0	0	0	0	110.1	T56 T187	S54-T56 PolarHBondContact O-N 3.48Å; S54-T187 PolarHBondContact OG-O 2.98Å
55	P	44.2	Very low	40.3	Very low	17 Å²	17	39.8 Å²	39.8	11%	0.11	21%	0.207	C	C	.	.			trans	-75	79	172.9	31.9	-32.4	0	0	0	109.3	I57 L60 L127 T187	P55-I57 PolarHBondContact O-N 2.7Å; P55-L60 HydrophobicContact CB-CB 3.96Å; P55-L60 HydrophobicContact CB-CD2 4.15Å; P55-L127 HydrophobicContact CG-CD1 3.57Å; P55-L127 HydrophobicContact CG-CD2 4.34Å; P55-T187 WeakPolarHBondContact CD-O 3.49Å
56	T	40.7	Very low	40.8	Very low	102 Å²	102	31.1 Å²	31.1	63%	0.626	17%	0.169	S	C	*	.			trans	-63.1	-3.7	170.1	54.6	0	0	0	0	113.2	S54	S54-T56 PolarHBondContact O-N 3.48Å
57	I	36.2	Very low	40.6	Very low	37 Å²	37	31.6 Å²	31.6	19%	0.19	17%	0.174	C	C	.	.	S	Bend	trans	-125.9	125.5	-178.9	-53.4	-176.7	0	0	0	108.8	P55 H59 L60 T110 S213	P55-I57 PolarHBondContact O-N 2.7Å; I57-H59 HydrophobicContact CG2-CB 4.4Å; I57-H59 PolarHBondContact O-N 2.82Å; I57-L60 PolarHBondContact O-N 3.29Å; I57-T110 HydrophobicContact CD1-CG2 3.44Å; I57-T110 VanDerWaalsContact CD1-CG2 3.44Å; I57-S213 PolarHBondContact O-OG 2.99Å
58	S	35.8	Very low	40.4	Very low	6 Å²	6	31.4 Å²	31.4	4%	0.042	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	9	179.5	58.4	0	0	0	0	118.3	P116 S213 P254	S58-P116 VanDerWaalsContact OG-CG 3.26Å; S58-P116 WeakPolarHBondContact OG-CG 3.29Å; S58-S213 WeakPolarHBondContact CA-OG 3.28Å; S58-S213 PolarHBondContact O-OG 2.89Å; S58-P254 WeakPolarHBondContact O-CG 3.42Å
59	H	39.7	Very low	39.9	Very low	14 Å²	14	32.9 Å²	32.9	7%	0.065	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.3	2.3	-169.3	-57.5	-25.4	0	0	0	113.9	I57 S61 Y109 S213 R256	I57-H59 HydrophobicContact CG2-CB 4.4Å; I57-H59 PolarHBondContact O-N 2.82Å; H59-S61 PolarHBondContact O-N 2.95Å; H59-Y109 WeakPolarHBondContact O-CD2 3.25Å; H59-S213 PolarHBondContact N-OG 2.92Å; H59-R256 PolarHBondContact CD2-NH2 3.16Å; H59-R256 VanDerWaalsContact CD2-NH2 3.27Å; H59-R256 PolarHBondContact NE2-NH2 3.44Å
60	L	38.8	Very low	39.4	Very low	10 Å²	10	33.6 Å²	33.6	5%	0.052	19%	0.187	C	C	.	.			trans	-85.6	118.4	-173	-143.5	69.5	0	0	0	110.5	P55 I57 C62 I106 T212 S213	P55-L60 HydrophobicContact CB-CB 3.96Å; P55-L60 HydrophobicContact CB-CD2 4.15Å; I57-L60 PolarHBondContact O-N 3.29Å; L60-C62 WeakPolarHBondContact CD2-SG 3.43Å; L60-I106 HydrophobicContact CD1-CG2 3.8Å; L60-I106 HydrophobicContact CG-CG2 4.44Å; L60-T212 WeakPolarHBondContact O-CA 3.4Å; L60-S213 PolarHBondContact O-N 3.37Å
61	S	35.6	Very low	38.8	Very low	4 Å²	4	37.3 Å²	37.3	3%	0.028	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	102.6	156.2	-84.5	0	0	0	0	108.1	H59 V211 T212 L257 N264	H59-S61 PolarHBondContact O-N 2.95Å; S61-V211 WeakPolarHBondContact CA-O 3.25Å; S61-T212 PolarHBondContact OG-OG1 3.11Å; S61-L257 WeakPolarHBondContact OG-CD1 3.43Å; S61-N264 PolarHBondContact OG-OD1 3.45Å
62	C	41.6	Very low	37.7	Very low	3 Å²	3	42.5 Å²	42.5	2%	0.02	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	121.5	178.1	-79.1	0	0	0	0	110.6	L60 Y64 F104 I210 V211	L60-C62 WeakPolarHBondContact CD2-SG 3.43Å; C62-Y64 HydrophobicContact CB-CD2 4.18Å; C62-Y64 HydrophobicContact CB-CE2 3.34Å; C62-F104 HydrophobicContact CB-CE2 4.29Å; C62-F104 HydrophobicContact CB-CZ 4.31Å; C62-I210 WeakPolarHBondContact O-CA 3.39Å; C62-V211 PolarHBondContact N-O 2.94Å; C62-V211 VanDerWaalsContact N-O 3.11Å; C62-V211 PolarHBondContact O-N 2.81Å
63	I	39.6	Very low	36.8	Very low	29 Å²	29	46.2 Å²	46.2	15%	0.149	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	113.3	172.4	-68.3	165.5	0	0	0	109.1	N65 F104 H208 I210 V262	I63-N65 VanDerWaalsContact CG2-ND2 3.28Å; I63-N65 WeakPolarHBondContact CG2-ND2 3.5Å; I63-F104 VanDerWaalsContact O-CD2 3.27Å; I63-F104 WeakPolarHBondContact O-CD2 2.76Å; I63-F104 WeakPolarHBondContact O-CE2 3.37Å; I63-H208 WeakPolarHBondContact CG2-NE2 3.42Å; I63-I210 HydrophobicContact CG1-CG1 3.81Å; I63-V262 HydrophobicContact CD1-CG2 4Å
64	Y	41.8	Very low	35.7	Very low	22 Å²	22	50.2 Å²	50.2	9%	0.086	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	115.6	172.1	-63	-92.2	0	0	0	109.4	I51 I53 C62 F66 F104 H208 I209 V211	I51-Y64 HydrophobicContact CG2-CE1 4.02Å; I53-Y64 HydrophobicContact CD1-CD2 4.11Å; I53-Y64 HydrophobicContact CD1-CE1 4.31Å; I53-Y64 HydrophobicContact CD1-CE2 3.39Å; I53-Y64 HydrophobicContact CG1-CE1 4.45Å; I53-Y64 HydrophobicContact CG1-CE2 4.11Å; I53-Y64 WeakPolarHBondContact CG1-OH 3.21Å; I53-Y64 HydrophobicContact CG2-CE2 4.39Å; I53-Y64 WeakPolarHBondContact CG2-OH 3.2Å; C62-Y64 HydrophobicContact CB-CD2 4.18Å; C62-Y64 HydrophobicContact CB-CE2 3.34Å; Y64-F66 HydrophobicContact CD1-CE2 4.36Å; Y64-F66 HydrophobicContact CD1-CZ 4.1Å; Y64-F66 HydrophobicContact CG-CE2 4.34Å; Y64-F104 AromaticContact CD1-CD2 3.67Å; Y64-F104 HydrophobicContact CD1-CD2 3.67Å; Y64-F104 AromaticContact CD1-CE2 3.44Å; Y64-F104 HydrophobicContact CD1-CE2 3.44Å; Y64-F104 VanDerWaalsContact CD1-CE2 3.44Å; Y64-F104 HydrophobicContact CD1-CZ 4.12Å; Y64-F104 HydrophobicContact CD2-CE2 4.15Å; Y64-F104 AromaticContact CE1-CD2 3.81Å; Y64-F104 HydrophobicContact CE1-CD2 3.81Å; Y64-F104 HydrophobicContact CE1-CE1 4.16Å; Y64-F104 AromaticContact CE1-CE2 3.2Å; Y64-F104 HydrophobicContact CE1-CE2 3.2Å; Y64-F104 AromaticContact CE1-CZ 3.4Å; Y64-F104 HydrophobicContact CE1-CZ 3.4Å; Y64-F104 VanDerWaalsContact CE1-CZ 3.4Å; Y64-F104 AromaticContact CE2-CE2 3.95Å; Y64-F104 HydrophobicContact CE2-CE2 3.95Å; Y64-F104 HydrophobicContact CE2-CZ 4.32Å; Y64-F104 HydrophobicContact CG-CD2 4.21Å; Y64-F104 AromaticContact CG-CE2 3.89Å; Y64-F104 HydrophobicContact CG-CE2 3.89Å; Y64-F104 AromaticContact CZ-CE2 3.44Å; Y64-F104 VanDerWaalsContact CZ-CE2 3.44Å; Y64-F104 AromaticContact CZ-CZ 3.49Å; Y64-F104 VanDerWaalsContact CZ-CZ 3.49Å; Y64-F104 WeakPolarHBondContact OH-CZ 3.48Å; Y64-H208 WeakPolarHBondContact O-CA 3.04Å; Y64-I209 HydrophobicContact CD2-CG2 4.38Å; Y64-I209 PolarHBondContact N-O 3.04Å; Y64-I209 PolarHBondContact O-N 3.12Å; Y64-V211 HydrophobicContact CE2-CG2 4.33Å
65	N	33.7	Very low	34.6	Very low	58 Å²	58	55.3 Å²	55.3	31%	0.31	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	96.8	173.1	-87.6	-58	0	0	0	109.9	I63 L67 H208	I63-N65 VanDerWaalsContact CG2-ND2 3.28Å; I63-N65 WeakPolarHBondContact CG2-ND2 3.5Å; N65-L67 PolarHBondContact O-N 3.43Å; N65-H208 PolarHBondContact OD1-CD2 3.05Å; N65-H208 VanDerWaalsContact OD1-CD2 3.23Å
66	F	42.4	Very low	33.8	Very low	31 Å²	31	57.9 Å²	57.9	14%	0.136	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	113.3	174.4	-65.2	-76.7	0	0	0	110	L49 I51 Y64 T102 S206 M207	L49-F66 HydrophobicContact CD2-CD1 3.91Å; L49-F66 HydrophobicContact CD2-CE1 3.72Å; L49-F66 HydrophobicContact CD2-CZ 4.13Å; I51-F66 HydrophobicContact CD1-CE1 4.27Å; I51-F66 HydrophobicContact CD1-CE2 3.78Å; I51-F66 HydrophobicContact CD1-CZ 3.36Å; I51-F66 HydrophobicContact CG1-CZ 4.02Å; Y64-F66 HydrophobicContact CD1-CE2 4.36Å; Y64-F66 HydrophobicContact CD1-CZ 4.1Å; Y64-F66 HydrophobicContact CG-CE2 4.34Å; F66-T102 HydrophobicContact CD1-CG2 3.91Å; F66-T102 HydrophobicContact CE1-CG2 4.39Å; F66-S206 VanDerWaalsContact O-CA 3.28Å; F66-S206 WeakPolarHBondContact O-CA 3.48Å; F66-S206 VanDerWaalsContact O-CB 3.29Å; F66-S206 WeakPolarHBondContact O-CB 3.49Å; F66-M207 HydrophobicContact CB-CB 4.28Å; F66-M207 HydrophobicContact CD2-CB 3.8Å; F66-M207 HydrophobicContact CD2-CG 3.75Å; F66-M207 HydrophobicContact CD2-SD 3.8Å; F66-M207 HydrophobicContact CE2-CG 4.25Å; F66-M207 HydrophobicContact CE2-SD 3.9Å; F66-M207 HydrophobicContact CG-CB 4.45Å; F66-M207 PolarHBondContact N-O 3.15Å; F66-M207 VanDerWaalsContact N-O 3.12Å
67	L	30.4	Very low	33.1	Very low	109 Å²	109	59.5 Å²	59.5	57%	0.571	33%	0.325	S	S	*	.			trans	-143.7	61.7	-175.8	-77.2	173.3	0	0	0	109.9	N65	N65-L67 PolarHBondContact O-N 3.43Å
68	T	31.1	Very low	32.6	Very low	30 Å²	30	63.4 Å²	63.4	18%	0.184	35%	0.347	C	S	.	.			trans	-141.2	134.2	-174.9	42.6	0	0	0	0	113.6	M70 N100 S101 T102	T68-M70 PolarHBondContact O-N 3.18Å; T68-N100 HydrophobicContact CG2-CB 4.07Å; T68-S101 VanDerWaalsContact CG2-O 3.3Å; T68-S101 WeakPolarHBondContact CG2-O 3.29Å; T68-T102 HydrophobicContact CG2-CG2 3.57Å; T68-T102 VanDerWaalsContact CG2-N 3.33Å
69	P	27.8	Very low	32.1	Very low	57 Å²	57	68.4 Å²	68.4	37%	0.37	38%	0.381	S	S	.	.			trans	-75.1	106.4	167.2	31.2	-31.9	0	0	0	110	H71 N100 G201	P69-H71 PolarHBondContact O-N 3.07Å; P69-N100 PolarHBondContact O-ND2 2.68Å; P69-G201 VanDerWaalsContact CA-CA 3.43Å
70	M	32.2	Very low	31.5	Very low	32 Å²	32	74.8 Å²	74.8	16%	0.158	42%	0.415	C	S	.	.			trans	-74.5	123.2	166.8	-43.9	172.2	171.3	0	0	107.7	L47 L49 T68 V196 P200 G201	L47-M70 HydrophobicContact CD2-CB 4.21Å; L47-M70 HydrophobicContact CD2-SD 4.04Å; L49-M70 HydrophobicContact CB-CE 4.45Å; L49-M70 HydrophobicContact CD2-CE 4.39Å; T68-M70 PolarHBondContact O-N 3.18Å; M70-V196 HydrophobicContact SD-CG2 4.09Å; M70-P200 HydrophobicContact CB-CB 3.83Å; M70-P200 HydrophobicContact CB-CG 3.92Å; M70-P200 HydrophobicContact CG-CB 4.08Å; M70-P200 HydrophobicContact CG-CG 4.43Å; M70-P200 WeakPolarHBondContact O-CD 3.03Å; M70-P200 HydrophobicContact SD-CB 4.09Å; M70-P200 HydrophobicContact SD-CG 4.12Å; M70-G201 PolarHBondContact O-N 3.4Å
71	H	29.3	Very low	31	Very low	114 Å²	114	77 Å²	77	53%	0.528	43%	0.426	S	S	.	.			trans	-129.6	-13.6	-177.4	-90.8	-49.2	0	0	0	115.2	P69	P69-H71 PolarHBondContact O-N 3.07Å
72	D	27.7	Very low	30.5	Very low	125 Å²	125	83.4 Å²	83.4	67%	0.668	46%	0.46	S	S	*	.			trans	-144	150.3	179	-91.2	-59.5	0	0	0	111.8	L74	D72-L74 HydrophobicContact CB-CD1 4.34Å; D72-L74 HydrophobicContact CB-CG 4.42Å
73	V	27.5	Very low	30	Very low	111 Å²	111	85.9 Å²	85.9	67%	0.673	47%	0.473	S	S	*	.			trans	-96.3	110.1	171.4	177	0	0	0	0	108.3	L47	L47-V73 HydrophobicContact CD1-CG2 3.92Å; L47-V73 HydrophobicContact CG-CG2 4.18Å
74	L	26.6	Very low	29.4	Very low	88 Å²	88	90.9 Å²	90.9	46%	0.461	50%	0.5	S	S	.	.			trans	-120.7	113.3	-173.1	-84.5	162.2	0	0	0	112.1	D72 T76 P97	D72-L74 HydrophobicContact CB-CD1 4.34Å; D72-L74 HydrophobicContact CB-CG 4.42Å; L74-T76 PolarHBondContact O-N 2.86Å; L74-P97 WeakPolarHBondContact O-CG 3.48Å
75	N	24.7	Very low	28.8	Very low	163 Å²	163	91.3 Å²	91.3	87%	0.872	51%	0.506	S	S	*	.			trans	-76.2	98.7	166.4	-79.4	-6.2	0	0	0	109.7
76	T	25.8	Very low	28.5	Very low	70 Å²	70	97 Å²	97	43%	0.429	54%	0.537	S	S	.	.			trans	-132.8	148.5	168.8	59.7	0	0	0	0	111.2	L74 P97	L74-T76 PolarHBondContact O-N 2.86Å; T76-P97 WeakPolarHBondContact O-CG 3.44Å
77	T	27.3	Very low	27.8	Very low	137 Å²	137	97.5 Å²	97.5	84%	0.84	54%	0.54	S	S	*	.			trans	-98.5	0.7	180	44	0	0	0	0	113.7
78	D	25.9	Very low	27.7	Very low	119 Å²	119	100.6 Å²	100.6	64%	0.636	56%	0.557	S	S	*	*			trans	-103.8	118.6	-157	-59.7	-7.7	0	0	0	111.2	I80	D78-I80 PolarHBondContact O-N 2.88Å; D78-I80 VanDerWaalsContact O-N 3.14Å
79	S	25.6	Very low	27.5	Very low	110 Å²	110	103 Å²	103	77%	0.769	57%	0.568	S	S	*	*			trans	-79.2	89.8	-169.9	46.1	0	0	0	0	113.2
80	I	26	Very low	27.5	Very low	149 Å²	149	109.5 Å²	109.5	76%	0.764	59%	0.593	S	S	*	*			trans	-133.4	90.6	174.8	-48.2	179.8	0	0	0	111.4	D78	D78-I80 PolarHBondContact O-N 2.88Å; D78-I80 VanDerWaalsContact O-N 3.14Å
81	L	29.5	Very low	27.3	Very low	55 Å²	55	110.2 Å²	110.2	29%	0.288	60%	0.596	S	S	.	*			trans	-131.6	124.2	156.1	-111.2	168.1	0	0	0	108.2	L83 L95	L81-L83 PolarHBondContact O-N 3.48Å; L81-L95 HydrophobicContact CB-CD1 3.99Å; L81-L95 HydrophobicContact CD1-CD1 3.57Å; L81-L95 HydrophobicContact CD1-CD2 4.17Å; L81-L95 HydrophobicContact CG-CD1 4.41Å
82	N	25.1	Very low	27.2	Very low	139 Å²	139	111 Å²	111	74%	0.743	62%	0.615	S	S	*	*			trans	-86.3	96	-165.5	-160.7	61.2	0	0	0	111.1	N84	N82-N84 PolarHBondContact O-N 2.98Å; N82-N84 VanDerWaalsContact O-N 3.13Å
83	L	29.6	Very low	27.3	Very low	56 Å²	56	109.5 Å²	109.5	29%	0.293	60%	0.6	S	S	.	*			trans	-68	103.8	179.5	-85.3	163.7	0	0	0	111.8	L81 S85 Y93 F104 I106	L81-L83 PolarHBondContact O-N 3.48Å; L83-S85 PolarHBondContact O-N 2.87Å; L83-Y93 HydrophobicContact CD1-CD1 4.03Å; L83-Y93 HydrophobicContact CD1-CE1 3.34Å; L83-F104 HydrophobicContact CD2-CD1 3.89Å; L83-F104 HydrophobicContact CD2-CE1 4.15Å; L83-I106 HydrophobicContact CD2-CD1 3.79Å; L83-I106 HydrophobicContact CD2-CG1 4.2Å
84	N	27	Very low	27.3	Very low	134 Å²	134	110.3 Å²	110.3	72%	0.717	60%	0.596	S	S	*	*			trans	-77.1	64.1	165.3	-74	-9.5	0	0	0	110.7	N82	N82-N84 PolarHBondContact O-N 2.98Å; N82-N84 VanDerWaalsContact O-N 3.13Å
85	S	29.1	Very low	27.5	Very low	31 Å²	31	110.1 Å²	110.1	22%	0.217	60%	0.596	C	S	.	*			trans	-74.3	146.7	159.4	177.6	0	0	0	0	109.2	L83 I87	L83-S85 PolarHBondContact O-N 2.87Å; S85-I87 VanDerWaalsContact CB-O 3.31Å; S85-I87 WeakPolarHBondContact CB-O 3.43Å; S85-I87 PolarHBondContact O-N 2.96Å; S85-I87 PolarHBondContact OG-N 3.32Å; S85-I87 PolarHBondContact OG-O 2.91Å
86	N	28.6	Very low	27.8	Very low	178 Å²	178	105.4 Å²	105.4	95%	0.952	57%	0.57	S	S	*	*	S	Bend	trans	-77.1	2.2	168.4	-89.5	-27.1	0	0	0	112.9
87	I	27.3	Very low	27.9	Very low	40 Å²	40	104.4 Å²	104.4	21%	0.205	56%	0.564	C	S	.	*	S	Bend	trans	-140.8	128.4	-174.2	-51.7	172.1	0	0	0	109	S85 L89 D108 N111	S85-I87 VanDerWaalsContact CB-O 3.31Å; S85-I87 WeakPolarHBondContact CB-O 3.43Å; S85-I87 PolarHBondContact O-N 2.96Å; S85-I87 PolarHBondContact OG-N 3.32Å; S85-I87 PolarHBondContact OG-O 2.91Å; I87-L89 VanDerWaalsContact C-N 3.27Å; I87-L89 HydrophobicContact CG2-CD1 3.89Å; I87-L89 HydrophobicContact CG2-CG 3.97Å; I87-L89 PolarHBondContact O-N 2.87Å; I87-D108 HydrophobicContact CD1-CB 4.36Å; I87-N111 HydrophobicContact CD1-CB 3.89Å
88	D	27.7	Very low	28.2	Very low	174 Å²	174	101 Å²	101	93%	0.93	54%	0.537	S	S	*	.			trans	-70.2	74.6	176.2	-77.8	-46.9	0	0	0	112.1
89	L	26.8	Very low	28.3	Very low	81 Å²	81	101.8 Å²	101.8	42%	0.424	54%	0.541	S	S	.	.			trans	-125.5	119.6	173.7	-76	172.5	0	0	0	111.3	I87 F91 T110	I87-L89 VanDerWaalsContact C-N 3.27Å; I87-L89 HydrophobicContact CG2-CD1 3.89Å; I87-L89 HydrophobicContact CG2-CG 3.97Å; I87-L89 PolarHBondContact O-N 2.87Å; L89-F91 HydrophobicContact CB-CE2 4.4Å; L89-F91 WeakPolarHBondContact O-CD2 3.43Å; L89-F91 PolarHBondContact O-N 3.35Å; L89-T110 HydrophobicContact CD1-CG2 3.76Å; L89-T110 WeakPolarHBondContact CD1-OG1 3.31Å
90	H	27.6	Very low	28.6	Very low	193 Å²	193	100.4 Å²	100.4	89%	0.894	53%	0.525	S	S	*	.			trans	-78.4	101.4	175.3	-71	-67.8	0	0	0	110.7
91	F	28.6	Very low	28.9	Very low	47 Å²	47	97.7 Å²	97.7	21%	0.206	52%	0.519	C	S	.	.			trans	-74.4	142.4	164.5	-63.8	-83.8	0	0	0	110.5	L89 Y93 I106 D108	L89-F91 HydrophobicContact CB-CE2 4.4Å; L89-F91 WeakPolarHBondContact O-CD2 3.43Å; L89-F91 PolarHBondContact O-N 3.35Å; F91-Y93 HydrophobicContact CB-CD1 4.49Å; F91-Y93 WeakPolarHBondContact O-CD1 3.37Å; F91-Y93 WeakPolarHBondContact O-CE1 3.3Å; F91-Y93 PolarHBondContact O-N 2.8Å; F91-Y93 VanDerWaalsContact O-N 3.14Å; F91-I106 HydrophobicContact CD2-CD1 3.85Å; F91-I106 HydrophobicContact CE2-CD1 4.14Å; F91-I106 HydrophobicContact CE2-CG2 4.47Å; F91-I106 HydrophobicContact CG-CD1 4.49Å; F91-D108 HydrophobicContact CZ-CB 4.42Å
92	S	27.5	Very low	29	Very low	132 Å²	132	96.5 Å²	96.5	92%	0.923	51%	0.514	S	S	*	.			trans	-78.9	92.3	170.9	-61.5	0	0	0	0	110.2
93	Y	30.3	Very low	29.3	Very low	93 Å²	93	95.7 Å²	95.7	37%	0.365	51%	0.51	S	S	.	.			trans	-106.9	133.7	169.4	56.2	-89.5	0	0	0	109.9	L83 F91 L95	L83-Y93 HydrophobicContact CD1-CD1 4.03Å; L83-Y93 HydrophobicContact CD1-CE1 3.34Å; F91-Y93 HydrophobicContact CB-CD1 4.49Å; F91-Y93 WeakPolarHBondContact O-CD1 3.37Å; F91-Y93 WeakPolarHBondContact O-CE1 3.3Å; F91-Y93 PolarHBondContact O-N 2.8Å; F91-Y93 VanDerWaalsContact O-N 3.14Å; Y93-L95 HydrophobicContact CD2-CB 4.18Å; Y93-L95 HydrophobicContact CD2-CD1 3.73Å; Y93-L95 HydrophobicContact CD2-CG 4.13Å; Y93-L95 HydrophobicContact CE2-CD1 3.88Å
94	E	26.5	Very low	29.4	Very low	127 Å²	127	96.1 Å²	96.1	59%	0.593	51%	0.51	S	S	*	.			trans	-100.1	106.8	167.5	-170.7	165.3	-163.9	0	0	107.9
95	L	30.2	Very low	29.5	Very low	85 Å²	85	92.1 Å²	92.1	45%	0.445	49%	0.492	S	S	.	.	B	Isolated β-bridge	trans	-101.5	108.6	-179.7	-109.3	165.6	0	0	0	108.8	L81 Y93	L81-L95 HydrophobicContact CB-CD1 3.99Å; L81-L95 HydrophobicContact CD1-CD1 3.57Å; L81-L95 HydrophobicContact CD1-CD2 4.17Å; L81-L95 HydrophobicContact CG-CD1 4.41Å; Y93-L95 HydrophobicContact CD2-CB 4.18Å; Y93-L95 HydrophobicContact CD2-CD1 3.73Å; Y93-L95 HydrophobicContact CD2-CG 4.13Å; Y93-L95 HydrophobicContact CE2-CD1 3.88Å
96	L	31.6	Very low	29.8	Very low	63 Å²	63	91.7 Å²	91.7	33%	0.33	49%	0.487	S	S	.	.			trans	-65.5	141.5	168.1	-60.1	-166.5	0	0	0	109.4	E50 Y98	E50-L96 HydrophobicContact CB-CD1 3.65Å; E50-L96 HydrophobicContact CB-CG 4.19Å; L96-Y98 PolarHBondContact O-N 2.87Å; L96-Y98 VanDerWaalsContact O-N 3.14Å
97	P	28.2	Very low	30.1	Very low	49 Å²	49	86.1 Å²	86.1	32%	0.318	46%	0.46	S	S	.	.			trans	-73.5	108.9	-156.4	27.4	-36.8	0	0	0	113.5	L74 T76	L74-P97 WeakPolarHBondContact O-CG 3.48Å; T76-P97 WeakPolarHBondContact O-CG 3.44Å
98	Y	34.4	Very low	30.5	Very low	65 Å²	65	85.3 Å²	85.3	26%	0.255	46%	0.456	S	S	.	.			trans	-130	108	168.4	-73.2	-73.2	0	0	0	110.8	L47 S48 L49 L96 N100	L47-Y98 HydrophobicContact CD2-CE1 4.13Å; S48-Y98 WeakPolarHBondContact O-CE2 3.41Å; S48-Y98 PolarHBondContact O-OH 2.91Å; L49-Y98 HydrophobicContact CB-CE2 4.48Å; L49-Y98 HydrophobicContact CD1-CD2 3.8Å; L49-Y98 HydrophobicContact CD1-CE2 4.06Å; L96-Y98 PolarHBondContact O-N 2.87Å; L96-Y98 VanDerWaalsContact O-N 3.14Å; Y98-N100 PolarHBondContact O-N 3.15Å
99	N	27.9	Very low	30.8	Very low	136 Å²	136	79 Å²	79	73%	0.727	42%	0.419	S	S	*	.			trans	-94.9	82.8	-173.5	-170.4	10.2	0	0	0	111.8
100	N	30.8	Very low	31.1	Very low	81 Å²	81	77 Å²	77	43%	0.433	41%	0.411	S	S	.	.	S	Bend	trans	-162.1	159.8	158.4	-99.4	-28.1	0	0	0	108.6	T68 P69 Y98 T102	T68-N100 HydrophobicContact CG2-CB 4.07Å; P69-N100 PolarHBondContact O-ND2 2.68Å; Y98-N100 PolarHBondContact O-N 3.15Å; N100-T102 PolarHBondContact O-N 2.93Å
101	S	31.8	Very low	31.4	Very low	93 Å²	93	73.7 Å²	73.7	65%	0.65	40%	0.399	S	S	*	.			trans	-73.4	89	-166.9	58.8	0	0	0	0	114.8	T68	T68-S101 VanDerWaalsContact CG2-O 3.3Å; T68-S101 WeakPolarHBondContact CG2-O 3.29Å
102	T	32.7	Very low	31.6	Very low	29 Å²	29	76.4 Å²	76.4	18%	0.178	42%	0.416	C	S	.	.			trans	-74.5	120.2	163.6	36.1	0	0	0	0	110.2	F66 T68 N100 F104	F66-T102 HydrophobicContact CD1-CG2 3.91Å; F66-T102 HydrophobicContact CE1-CG2 4.39Å; T68-T102 HydrophobicContact CG2-CG2 3.57Å; T68-T102 VanDerWaalsContact CG2-N 3.33Å; N100-T102 PolarHBondContact O-N 2.93Å; T102-F104 VanDerWaalsContact C-N 3.34Å; T102-F104 PolarHBondContact O-N 3.26Å
103	N	30.6	Very low	31.7	Very low	122 Å²	122	77.8 Å²	77.8	65%	0.652	41%	0.413	S	S	*	.			trans	-77.7	84.9	172.2	-81.8	-11.4	0	0	0	109.9
104	F	31.7	Very low	31.8	Very low	65 Å²	65	81.8 Å²	81.8	29%	0.285	43%	0.432	S	S	.	.			trans	-88.7	138.3	171.1	-178.8	-134.9	0	0	0	111.3	C62 I63 Y64 L83 T102 I106	C62-F104 HydrophobicContact CB-CE2 4.29Å; C62-F104 HydrophobicContact CB-CZ 4.31Å; I63-F104 VanDerWaalsContact O-CD2 3.27Å; I63-F104 WeakPolarHBondContact O-CD2 2.76Å; I63-F104 WeakPolarHBondContact O-CE2 3.37Å; Y64-F104 AromaticContact CD1-CD2 3.67Å; Y64-F104 HydrophobicContact CD1-CD2 3.67Å; Y64-F104 AromaticContact CD1-CE2 3.44Å; Y64-F104 HydrophobicContact CD1-CE2 3.44Å; Y64-F104 VanDerWaalsContact CD1-CE2 3.44Å; Y64-F104 HydrophobicContact CD1-CZ 4.12Å; Y64-F104 HydrophobicContact CD2-CE2 4.15Å; Y64-F104 AromaticContact CE1-CD2 3.81Å; Y64-F104 HydrophobicContact CE1-CD2 3.81Å; Y64-F104 HydrophobicContact CE1-CE1 4.16Å; Y64-F104 AromaticContact CE1-CE2 3.2Å; Y64-F104 HydrophobicContact CE1-CE2 3.2Å; Y64-F104 AromaticContact CE1-CZ 3.4Å; Y64-F104 HydrophobicContact CE1-CZ 3.4Å; Y64-F104 VanDerWaalsContact CE1-CZ 3.4Å; Y64-F104 AromaticContact CE2-CE2 3.95Å; Y64-F104 HydrophobicContact CE2-CE2 3.95Å; Y64-F104 HydrophobicContact CE2-CZ 4.32Å; Y64-F104 HydrophobicContact CG-CD2 4.21Å; Y64-F104 AromaticContact CG-CE2 3.89Å; Y64-F104 HydrophobicContact CG-CE2 3.89Å; Y64-F104 AromaticContact CZ-CE2 3.44Å; Y64-F104 VanDerWaalsContact CZ-CE2 3.44Å; Y64-F104 AromaticContact CZ-CZ 3.49Å; Y64-F104 VanDerWaalsContact CZ-CZ 3.49Å; Y64-F104 WeakPolarHBondContact OH-CZ 3.48Å; L83-F104 HydrophobicContact CD2-CD1 3.89Å; L83-F104 HydrophobicContact CD2-CE1 4.15Å; T102-F104 VanDerWaalsContact C-N 3.34Å; T102-F104 PolarHBondContact O-N 3.26Å; F104-I106 HydrophobicContact CD1-CG1 4.19Å; F104-I106 HydrophobicContact CE1-CD1 3.76Å; F104-I106 HydrophobicContact CE1-CG1 3.37Å; F104-I106 HydrophobicContact CE2-CG1 4.38Å; F104-I106 HydrophobicContact CZ-CD1 4.19Å; F104-I106 HydrophobicContact CZ-CG1 3.48Å; F104-I106 VanDerWaalsContact CZ-CG1 3.48Å
105	S	30.2	Very low	32.1	Very low	50 Å²	50	81.8 Å²	81.8	35%	0.35	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	110.5	179.1	52.8	0	0	0	0	110.9
106	I	34.8	Very low	32.2	Very low	23 Å²	23	79.1 Å²	79.1	12%	0.118	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	118.8	165.3	-52.6	178.5	0	0	0	107.8	L60 L83 F91 F104 D108	L60-I106 HydrophobicContact CD1-CG2 3.8Å; L60-I106 HydrophobicContact CG-CG2 4.44Å; L83-I106 HydrophobicContact CD2-CD1 3.79Å; L83-I106 HydrophobicContact CD2-CG1 4.2Å; F91-I106 HydrophobicContact CD2-CD1 3.85Å; F91-I106 HydrophobicContact CE2-CD1 4.14Å; F91-I106 HydrophobicContact CE2-CG2 4.47Å; F91-I106 HydrophobicContact CG-CD1 4.49Å; F104-I106 HydrophobicContact CD1-CG1 4.19Å; F104-I106 HydrophobicContact CE1-CD1 3.76Å; F104-I106 HydrophobicContact CE1-CG1 3.37Å; F104-I106 HydrophobicContact CE2-CG1 4.38Å; F104-I106 HydrophobicContact CZ-CD1 4.19Å; F104-I106 HydrophobicContact CZ-CG1 3.48Å; F104-I106 VanDerWaalsContact CZ-CG1 3.48Å; I106-D108 HydrophobicContact CG2-CB 4.29Å; I106-D108 PolarHBondContact O-N 3.35Å
107	T	33.9	Very low	32.5	Very low	61 Å²	61	79.7 Å²	79.7	37%	0.374	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	95.2	162.5	-51.8	0	0	0	0	107.5	Y109	T107-Y109 HydrophobicContact CG2-CD2 4.17Å; T107-Y109 HydrophobicContact CG2-CE1 4.2Å; T107-Y109 HydrophobicContact CG2-CE2 3.46Å; T107-Y109 VanDerWaalsContact CG2-CE2 3.46Å; T107-Y109 WeakPolarHBondContact O-CD2 3.31Å
108	D	35.7	Very low	32.9	Very low	23 Å²	23	82.5 Å²	82.5	12%	0.123	44%	0.438	C	S	.	.			trans	-83.5	135.7	178.8	-173	20.8	0	0	0	112	I87 F91 I106 T110	I87-D108 HydrophobicContact CD1-CB 4.36Å; F91-D108 HydrophobicContact CZ-CB 4.42Å; I106-D108 HydrophobicContact CG2-CB 4.29Å; I106-D108 PolarHBondContact O-N 3.35Å; D108-T110 VanDerWaalsContact CG-OG1 3.25Å; D108-T110 WeakPolarHBondContact OD1-CG2 3.44Å; D108-T110 PolarHBondContact OD1-N 3.4Å; D108-T110 PolarHBondContact OD1-OG1 3.02Å; D108-T110 WeakPolarHBondContact OD2-CB 3.15Å; D108-T110 WeakPolarHBondContact OD2-CG2 3.5Å; D108-T110 PolarHBondContact OD2-OG1 3.23Å
109	Y	34.8	Very low	33	Very low	41 Å²	41	83.1 Å²	83.1	16%	0.161	45%	0.452	C	S	.	.			trans	-122.7	11.7	-176.2	-68.3	-78.8	0	0	0	112	H59 T107 N111 R256 L257	H59-Y109 WeakPolarHBondContact O-CD2 3.25Å; T107-Y109 HydrophobicContact CG2-CD2 4.17Å; T107-Y109 HydrophobicContact CG2-CE1 4.2Å; T107-Y109 HydrophobicContact CG2-CE2 3.46Å; T107-Y109 VanDerWaalsContact CG2-CE2 3.46Å; T107-Y109 WeakPolarHBondContact O-CD2 3.31Å; Y109-N111 PolarHBondContact O-N 2.72Å; Y109-R256 HydrophobicContact CD1-CB 3.91Å; Y109-R256 VanDerWaalsContact CD1-CD 3.49Å; Y109-R256 HydrophobicContact CD1-CG 4.37Å; Y109-R256 HydrophobicContact CE1-CB 3.58Å; Y109-R256 HydrophobicContact CE1-CG 4.47Å; Y109-R256 PolarHBondContact O-NH1 3.37Å; Y109-R256 PolarHBondContact O-NH2 3.48Å; Y109-R256 PolarHBondContact OH-O 2.96Å; Y109-L257 HydrophobicContact CE2-CD2 3.94Å
110	T	33.8	Very low	33.6	Very low	40 Å²	40	79.3 Å²	79.3	25%	0.245	43%	0.434	C	S	.	.			trans	-50.7	-34.2	173.4	49.9	0	0	0	0	115	I57 L89 D108 L112	I57-T110 HydrophobicContact CD1-CG2 3.44Å; I57-T110 VanDerWaalsContact CD1-CG2 3.44Å; L89-T110 HydrophobicContact CD1-CG2 3.76Å; L89-T110 WeakPolarHBondContact CD1-OG1 3.31Å; D108-T110 VanDerWaalsContact CG-OG1 3.25Å; D108-T110 WeakPolarHBondContact OD1-CG2 3.44Å; D108-T110 PolarHBondContact OD1-N 3.4Å; D108-T110 PolarHBondContact OD1-OG1 3.02Å; D108-T110 WeakPolarHBondContact OD2-CB 3.15Å; D108-T110 WeakPolarHBondContact OD2-CG2 3.5Å; D108-T110 PolarHBondContact OD2-OG1 3.23Å; T110-L112 PolarHBondContact O-N 3.22Å
111	N	33.5	Very low	34.3	Very low	122 Å²	122	76.7 Å²	76.7	65%	0.652	42%	0.418	S	S	*	.	S	Bend	trans	-76.8	29.9	-160.4	-130.2	-14.2	0	0	0	115.8	I87 Y109	I87-N111 HydrophobicContact CD1-CB 3.89Å; Y109-N111 PolarHBondContact O-N 2.72Å
112	L	33	Very low	35	Very low	105 Å²	105	76.4 Å²	76.4	55%	0.55	41%	0.409	S	S	.	.	S	Bend	trans	-142	129.1	-175.6	-94.2	165.4	0	0	0	111.8	T110 F114 R256	T110-L112 PolarHBondContact O-N 3.22Å; L112-F114 PolarHBondContact O-N 3.37Å; L112-R256 VanDerWaalsContact CD1-NH1 3.34Å
113	N	28.7	Very low	35.9	Very low	161 Å²	161	79.7 Å²	79.7	86%	0.861	43%	0.426	S	S	*	.	S	Bend	trans	-69.6	25	-165.1	-62	-13.6	0	0	0	116.9
114	F	32.8	Very low	37.3	Very low	177 Å²	177	78.5 Å²	78.5	78%	0.776	41%	0.412	S	S	*	.			trans	-119.8	77.1	173.9	-85.6	-91.7	0	0	0	109.7	L112 P116	L112-F114 PolarHBondContact O-N 3.37Å; F114-P116 VanDerWaalsContact O-CD 3.32Å; F114-P116 WeakPolarHBondContact O-CD 3.31Å
115	L	32	Very low	38.7	Very low	127 Å²	127	76 Å²	76	67%	0.665	40%	0.403	S	S	*	.			trans	-74.6	115.8	162.6	-77	168.7	0	0	0	108.3
116	P	33.7	Very low	40.5	Very low	28 Å²	28	73.8 Å²	73.8	18%	0.182	39%	0.387	C	S	.	.			trans	-66.5	134.5	171.8	28.3	-33.8	0	0	0	109.7	S58 F114 L118 W121 F228	S58-P116 VanDerWaalsContact OG-CG 3.26Å; S58-P116 WeakPolarHBondContact OG-CG 3.29Å; F114-P116 VanDerWaalsContact O-CD 3.32Å; F114-P116 WeakPolarHBondContact O-CD 3.31Å; P116-L118 PolarHBondContact O-N 3.24Å; P116-L118 VanDerWaalsContact O-N 3.07Å; P116-W121 HydrophobicContact CB-CZ2 4.32Å; P116-W121 HydrophobicContact CG-CZ2 3.8Å; P116-W121 PolarHBondContact O-NE1 3.12Å; P116-F228 HydrophobicContact CB-CE2 4.13Å; P116-F228 HydrophobicContact CB-CZ 4.44Å; P116-F228 HydrophobicContact CG-CE2 4.18Å; P116-F228 HydrophobicContact CG-CZ 4.07Å
117	D	37.4	Very low	42	Very low	76 Å²	76	72.8 Å²	72.8	41%	0.406	38%	0.382	S	S	.	.			trans	-48	111.3	-172.6	-179.1	-12.8	0	0	0	112.9	S119 V120 W121	D117-S119 PolarHBondContact O-N 3.09Å; D117-S119 VanDerWaalsContact O-N 3.11Å; D117-S119 VanDerWaalsContact OD1-CB 3.3Å; D117-S119 WeakPolarHBondContact OD1-CB 3.45Å; D117-S119 PolarHBondContact OD1-N 3.16Å; D117-S119 PolarHBondContact OD1-OG 3.45Å; D117-S119 PolarHBondContact OD2-OG 3.44Å; D117-V120 HydrophobicContact CB-CG2 4.09Å; D117-V120 WeakPolarHBondContact O-CB 3.35Å; D117-V120 PolarHBondContact O-N 3.49Å; D117-W121 VanDerWaalsContact O-CD1 3.31Å
118	L	36.6	Very low	43.7	Very low	107 Å²	107	70 Å²	70	56%	0.56	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-59	-23.2	-175.8	-68.7	174.3	0	0	0	113.4	P116 V120 W121	P116-L118 PolarHBondContact O-N 3.24Å; P116-L118 VanDerWaalsContact O-N 3.07Å; L118-V120 PolarHBondContact O-N 3.02Å; L118-W121 PolarHBondContact O-N 3.43Å; L118-W121 VanDerWaalsContact O-N 3.15Å
119	S	36.5	Very low	45.4	Very low	79 Å²	79	68.9 Å²	68.9	55%	0.552	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-62.8	-25	173.7	69.9	0	0	0	0	112.9	D117	D117-S119 PolarHBondContact O-N 3.09Å; D117-S119 VanDerWaalsContact O-N 3.11Å; D117-S119 VanDerWaalsContact OD1-CB 3.3Å; D117-S119 WeakPolarHBondContact OD1-CB 3.45Å; D117-S119 PolarHBondContact OD1-N 3.16Å; D117-S119 PolarHBondContact OD1-OG 3.45Å; D117-S119 PolarHBondContact OD2-OG 3.44Å
120	V	39.8	Very low	46.9	Very low	55 Å²	55	67 Å²	67	33%	0.333	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-88.9	-11.7	180	-160.1	0	0	0	0	112.1	D117 L118 Y215	D117-V120 HydrophobicContact CB-CG2 4.09Å; D117-V120 WeakPolarHBondContact O-CB 3.35Å; D117-V120 PolarHBondContact O-N 3.49Å; L118-V120 PolarHBondContact O-N 3.02Å; V120-Y215 HydrophobicContact CG1-CE2 3.99Å
121	W	46.7	Very low	48.4	Very low	26 Å²	26	65.1 Å²	65.1	10%	0.098	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-35.9	-178.4	-77.6	79.1	0	0	0	113.7	P116 D117 L118 D123 R124 S125 F228	P116-W121 HydrophobicContact CB-CZ2 4.32Å; P116-W121 HydrophobicContact CG-CZ2 3.8Å; P116-W121 PolarHBondContact O-NE1 3.12Å; D117-W121 VanDerWaalsContact O-CD1 3.31Å; L118-W121 PolarHBondContact O-N 3.43Å; L118-W121 VanDerWaalsContact O-N 3.15Å; W121-D123 VanDerWaalsContact C-N 3.27Å; W121-D123 PolarHBondContact O-N 3.42Å; W121-R124 PolarHBondContact O-N 3.34Å; W121-S125 WeakPolarHBondContact O-CB 3.27Å; W121-S125 PolarHBondContact O-N 3.08Å; W121-S125 PolarHBondContact O-OG 3.36Å; W121-F228 AromaticContact CH2-CE1 3.93Å; W121-F228 HydrophobicContact CH2-CE1 3.93Å; W121-F228 AromaticContact CH2-CZ 3.98Å; W121-F228 HydrophobicContact CH2-CZ 3.98Å; W121-F228 HydrophobicContact CZ2-CE1 4.02Å; W121-F228 AromaticContact CZ2-CZ 3.62Å; W121-F228 HydrophobicContact CZ2-CZ 3.62Å
122	N	45.4	Very low	49.7	Very low	88 Å²	88	60.7 Å²	60.7	47%	0.471	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-37.4	-173.7	-73.3	-9.9	0	0	0	113.2	N152 L185	N122-N152 PolarHBondContact OD1-ND2 2.75Å; N122-L185 WeakPolarHBondContact O-CD2 3.49Å
123	D	51.8	Low	50.9	Low	98 Å²	98	61.1 Å²	61.1	52%	0.524	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-6	-172.1	-59.6	-0.1	0	0	0	113.8	W121 L185	W121-D123 VanDerWaalsContact C-N 3.27Å; W121-D123 PolarHBondContact O-N 3.42Å; D123-L185 WeakPolarHBondContact O-CD2 3.34Å
124	R	60.1	Low	52.4	Low	96 Å²	96	53.6 Å²	53.6	36%	0.362	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.2	-4.1	-165.5	-62.3	-177.1	-175.4	172.1	3.3	115.8	W121 Y215 R216	W121-R124 PolarHBondContact O-N 3.34Å; R124-Y215 HydrophobicContact CB-CD2 3.82Å; R124-Y215 HydrophobicContact CB-CE2 3.41Å; R124-Y215 VanDerWaalsContact CB-CE2 3.41Å; R124-Y215 VanDerWaalsContact CD-OH 3.26Å; R124-Y215 WeakPolarHBondContact CD-OH 3.5Å; R124-Y215 HydrophobicContact CG-CE2 4.18Å; R124-Y215 PolarHBondContact NH1-OH 3.37Å; R124-R216 PolarHBondContact O-N 3.04Å
125	S	62.1	Low	53.6	Low	14 Å²	14	49 Å²	49	10%	0.098	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	139.9	169.5	46.1	0	0	0	0	110.7	W121 L185	W121-S125 WeakPolarHBondContact O-CB 3.27Å; W121-S125 PolarHBondContact O-N 3.08Å; W121-S125 PolarHBondContact O-OG 3.36Å; S125-L185 PolarHBondContact O-N 3.38Å
126	I	67.6	Low	54.9	Low	3 Å²	3	44 Å²	44	2%	0.015	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	140.3	163.2	52.9	166.3	0	0	0	108.3	I128 M182 P184 G214 R216 I251	I126-I128 HydrophobicContact CD1-CD1 4.01Å; I126-I128 HydrophobicContact CD1-CG1 4.09Å; I126-I128 HydrophobicContact CG1-CG1 4.47Å; I126-M182 HydrophobicContact CB-CG 4.39Å; I126-M182 HydrophobicContact CD1-CE 4.09Å; I126-M182 HydrophobicContact CD1-SD 4.01Å; I126-M182 HydrophobicContact CG2-CG 4.47Å; I126-P184 HydrophobicContact CG2-CB 4.26Å; I126-P184 HydrophobicContact CG2-CG 4.36Å; I126-G214 WeakPolarHBondContact CG1-O 3.16Å; I126-G214 PolarHBondContact N-O 3.01Å; I126-G214 PolarHBondContact O-N 3.08Å; I126-R216 HydrophobicContact CG2-CB 3.79Å; I126-I251 HydrophobicContact CD1-CB 4.31Å; I126-I251 HydrophobicContact CD1-CD1 3.54Å; I126-I251 HydrophobicContact CD1-CG1 3.61Å; I126-I251 HydrophobicContact CD1-CG2 3.87Å
127	L	66.9	Low	55.7	Low	2 Å²	2	44.3 Å²	44.3	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	118.5	171.1	-167.9	46.6	0	0	0	108	P55 F183 A186 G188 L189 V211	P55-L127 HydrophobicContact CG-CD1 3.57Å; P55-L127 HydrophobicContact CG-CD2 4.34Å; L127-F183 HydrophobicContact CB-CB 4.38Å; L127-F183 PolarHBondContact N-O 3.42Å; L127-F183 PolarHBondContact O-N 2.76Å; L127-A186 HydrophobicContact CB-CB 4.01Å; L127-A186 HydrophobicContact CD2-CB 4.11Å; L127-G188 VanDerWaalsContact CD2-C 3.48Å; L127-L189 HydrophobicContact CD2-CD1 4.37Å; L127-L189 HydrophobicContact CD2-CD2 4Å; L127-L189 HydrophobicContact CD2-CG 3.69Å; L127-L189 HydrophobicContact CG-CD1 4.32Å; L127-L189 HydrophobicContact CG-CD2 4.35Å; L127-L189 HydrophobicContact CG-CG 4.13Å; L127-V211 HydrophobicContact CD1-CG1 3.58Å; L127-V211 HydrophobicContact CG-CG1 4.26Å
128	I	68.7	Low	56.5	Low	2 Å²	2	41.2 Å²	41.2	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.6	179.7	-53.4	-177.7	0	0	0	107.5	I126 F180 M182 V211 T212 I251 L253 P266	I126-I128 HydrophobicContact CD1-CD1 4.01Å; I126-I128 HydrophobicContact CD1-CG1 4.09Å; I126-I128 HydrophobicContact CG1-CG1 4.47Å; I128-F180 HydrophobicContact CG2-CD1 3.99Å; I128-M182 HydrophobicContact CD1-CE 4.12Å; I128-M182 HydrophobicContact CG1-CE 4.03Å; I128-V211 WeakPolarHBondContact O-CA 3.33Å; I128-T212 PolarHBondContact N-O 3.45Å; I128-T212 PolarHBondContact O-N 2.91Å; I128-I251 HydrophobicContact CD1-CD1 4.44Å; I128-I251 HydrophobicContact CD1-CG2 4.15Å; I128-L253 HydrophobicContact CD1-CD2 4.1Å; I128-P266 HydrophobicContact CD1-CG 4.22Å; I128-P266 HydrophobicContact CG2-CB 4.1Å
129	F	70.7	Confident	57.3	Low	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	118.8	-178.3	170.1	-95	0	0	0	108.7	T131 V147 F180 F181 F183 L189 I191 I209 V211	F129-T131 HydrophobicContact CD1-CG2 4.32Å; F129-T131 HydrophobicContact CE1-CG2 3.39Å; F129-T131 HydrophobicContact CZ-CG2 3.62Å; F129-V147 HydrophobicContact CD1-CG1 4.21Å; F129-V147 HydrophobicContact CD2-CG1 4.36Å; F129-V147 HydrophobicContact CE1-CB 4.39Å; F129-V147 HydrophobicContact CE1-CG1 4.01Å; F129-V147 HydrophobicContact CE1-CG2 3.7Å; F129-V147 HydrophobicContact CE2-CG1 4.16Å; F129-V147 HydrophobicContact CE2-CG2 4.35Å; F129-V147 HydrophobicContact CG-CG1 4.38Å; F129-V147 HydrophobicContact CZ-CB 4.41Å; F129-V147 HydrophobicContact CZ-CG1 4Å; F129-V147 HydrophobicContact CZ-CG2 3.53Å; F129-F180 CarbonylContact O-C 3.55Å; F129-F180 WeakPolarHBondContact O-CA 3.36Å; F129-F181 HydrophobicContact CB-CB 4.32Å; F129-F181 HydrophobicContact CD1-CB 4.07Å; F129-F181 AromaticContact CD1-CD2 3.66Å; F129-F181 HydrophobicContact CD1-CD2 3.66Å; F129-F181 HydrophobicContact CD1-CE2 4.46Å; F129-F181 HydrophobicContact CD1-CG 4.17Å; F129-F181 HydrophobicContact CE1-CD2 4.02Å; F129-F181 HydrophobicContact CE1-CE2 4.38Å; F129-F181 PolarHBondContact N-O 3.5Å; F129-F181 PolarHBondContact O-N 3Å; F129-F183 HydrophobicContact CB-CD2 4.47Å; F129-F183 HydrophobicContact CB-CE2 3.85Å; F129-F183 HydrophobicContact CG-CE2 4.42Å; F129-L189 HydrophobicContact CB-CD1 3.79Å; F129-L189 HydrophobicContact CD2-CD1 3.47Å; F129-L189 VanDerWaalsContact CD2-CD1 3.47Å; F129-L189 HydrophobicContact CE2-CD1 4.38Å; F129-L189 HydrophobicContact CG-CD1 3.96Å; F129-I191 HydrophobicContact CE2-CD1 3.71Å; F129-I191 HydrophobicContact CE2-CG1 4.06Å; F129-I209 HydrophobicContact CD2-CG2 3.9Å; F129-I209 HydrophobicContact CE2-CD1 3.85Å; F129-I209 HydrophobicContact CE2-CG1 4.34Å; F129-I209 HydrophobicContact CE2-CG2 3.51Å; F129-I209 HydrophobicContact CZ-CD1 3.82Å; F129-I209 HydrophobicContact CZ-CG1 4.36Å; F129-I209 HydrophobicContact CZ-CG2 4.29Å; F129-V211 HydrophobicContact CD2-CG2 3.95Å
130	A	66.4	Low	58	Low	2 Å²	2	44.5 Å²	44.5	2%	0.017	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	116.5	-176.5	0	0	0	0	0	110.1	Y179 F180 I209 I210	A130-Y179 WeakPolarHBondContact CA-O 3.42Å; A130-F180 HydrophobicContact CB-CD1 3.49Å; A130-F180 VanDerWaalsContact CB-CD1 3.49Å; A130-F180 HydrophobicContact CB-CE1 3.36Å; A130-F180 HydrophobicContact CB-CG 4.39Å; A130-F180 HydrophobicContact CB-CZ 4.15Å; A130-I209 WeakPolarHBondContact O-CA 3.48Å; A130-I210 HydrophobicContact CB-CB 4.34Å; A130-I210 PolarHBondContact N-O 2.81Å; A130-I210 PolarHBondContact O-N 3.4Å
131	T	66.5	Low	58.8	Low	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	105.2	168.1	60.6	0	0	0	0	108.3	F129 L134 P178 Y179 I209	F129-T131 HydrophobicContact CD1-CG2 4.32Å; F129-T131 HydrophobicContact CE1-CG2 3.39Å; F129-T131 HydrophobicContact CZ-CG2 3.62Å; T131-L134 HydrophobicContact CG2-CD1 4.27Å; T131-P178 WeakPolarHBondContact O-CA 3.48Å; T131-Y179 PolarHBondContact N-O 2.87Å; T131-Y179 PolarHBondContact O-N 2.64Å; T131-I209 HydrophobicContact CG2-CG1 4.24Å
132	H	60.7	Low	59.3	Low	29 Å²	29	45.3 Å²	45.3	13%	0.134	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-36.4	-176.7	-85.9	-119.8	0	0	0	113.4	H208 I210	H132-H208 HydrophobicContact CB-CB 4.39Å; H132-H208 VanDerWaalsContact CB-ND1 3.29Å; H132-H208 WeakPolarHBondContact CB-ND1 3.35Å; H132-H208 AromaticContact CG-ND1 3.94Å; H132-H208 PolarHBondContact N-O 2.89Å; H132-I210 VanDerWaalsContact CD2-CD1 3.45Å; H132-I210 WeakPolarHBondContact CD2-CD1 3.34Å; H132-I210 WeakPolarHBondContact NE2-CD1 3.4Å
133	R	57.9	Low	59.9	Low	113 Å²	113	41.3 Å²	41.3	43%	0.426	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	125.2	173.4	-159.4	178	-172.9	-176.5	3.6	109.8	E174 I175 M207 H208	R133-E174 IonicContact CZ-OE1 2.66Å; R133-E174 VanDerWaalsContact CZ-OE1 3.25Å; R133-E174 IonicContact NE-OE1 2.67Å; R133-E174 PolarHBondContact NE-OE1 3.03Å; R133-E174 IonicContact NH2-OE1 3.03Å; R133-E174 PolarHBondContact NH2-OE1 3.16Å; R133-I175 VanDerWaalsContact CA-O 3.3Å; R133-I175 WeakPolarHBondContact CA-O 3.21Å; R133-M207 WeakPolarHBondContact O-CA 3.44Å; R133-H208 HydrophobicContact CB-CB 3.96Å; R133-H208 PolarHBondContact N-O 3.48Å; R133-H208 PolarHBondContact O-N 2.77Å
134	L	60.4	Low	60.3	Low	4 Å²	4	39.5 Å²	39.5	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	114.3	165	-64.2	175	0	0	0	107.1	T131 F136 V167 I175 M207	T131-L134 HydrophobicContact CG2-CD1 4.27Å; L134-F136 HydrophobicContact CB-CD2 4.44Å; L134-F136 HydrophobicContact CB-CE2 4.03Å; L134-F136 HydrophobicContact CD2-CE2 4.17Å; L134-F136 HydrophobicContact CD2-CZ 4.25Å; L134-V167 HydrophobicContact CD1-CG1 3.47Å; L134-V167 VanDerWaalsContact CD1-CG1 3.47Å; L134-I175 HydrophobicContact CB-CB 4.28Å; L134-I175 HydrophobicContact CD1-CD1 4.12Å; L134-I175 PolarHBondContact N-O 3.42Å; L134-I175 PolarHBondContact O-N 3.39Å; L134-M207 HydrophobicContact CD2-CB 3.9Å; L134-M207 HydrophobicContact CD2-CE 3.57Å; L134-M207 HydrophobicContact CD2-CG 3.73Å
135	Y	57.1	Low	60.3	Low	80 Å²	80	34.9 Å²	34.9	31%	0.314	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	119.2	173.5	178.3	-82.9	0	0	0	108.4	S137 E174 N204 N205 S206	Y135-S137 WeakPolarHBondContact OH-CB 3.27Å; Y135-E174 HydrophobicContact CD2-CG 4.34Å; Y135-N204 WeakPolarHBondContact CD1-O 3.45Å; Y135-N204 HydrophobicContact CE1-CB 4.19Å; Y135-N205 CarbonylContact O-C 3.51Å; Y135-N205 WeakPolarHBondContact O-CA 3.46Å; Y135-S206 PolarHBondContact N-O 3.18Å; Y135-S206 PolarHBondContact O-N 2.82Å
136	F	59	Low	60.3	Low	23 Å²	23	36.5 Å²	36.5	10%	0.101	18%	0.183	C	C	.	.			trans	-137.1	124.9	177.4	-58.2	-72.3	0	0	0	109.3	L134 P143 V145 V193 N205 M207	L134-F136 HydrophobicContact CB-CD2 4.44Å; L134-F136 HydrophobicContact CB-CE2 4.03Å; L134-F136 HydrophobicContact CD2-CE2 4.17Å; L134-F136 HydrophobicContact CD2-CZ 4.25Å; F136-P143 HydrophobicContact CB-CG 3.43Å; F136-P143 VanDerWaalsContact CB-CG 3.43Å; F136-P143 HydrophobicContact CD1-CB 4.24Å; F136-P143 HydrophobicContact CD1-CG 3.37Å; F136-P143 HydrophobicContact CD2-CG 3.62Å; F136-P143 HydrophobicContact CE1-CB 4.28Å; F136-P143 HydrophobicContact CE1-CG 3.85Å; F136-P143 HydrophobicContact CE2-CG 4.06Å; F136-P143 HydrophobicContact CG-CB 4.41Å; F136-P143 HydrophobicContact CG-CG 3.21Å; F136-P143 HydrophobicContact CZ-CB 4.49Å; F136-P143 HydrophobicContact CZ-CG 4.15Å; F136-V145 HydrophobicContact CE2-CG2 3.94Å; F136-V145 HydrophobicContact CZ-CG2 3.78Å; F136-V193 HydrophobicContact CE1-CG1 4.33Å; F136-V193 HydrophobicContact CZ-CG1 4.27Å; F136-N205 WeakPolarHBondContact CA-OD1 3.43Å; F136-N205 HydrophobicContact CD1-CB 4.37Å; F136-M207 HydrophobicContact CZ-CE 4.05Å
137	S	52.2	Low	60	Low	34 Å²	34	36.3 Å²	36.3	24%	0.238	18%	0.183	C	C	.	.			trans	-124.5	61.9	-172.3	66.7	0	0	0	0	113.8	Y135 H203 N205	Y135-S137 WeakPolarHBondContact OH-CB 3.27Å; S137-H203 PolarHBondContact O-CE1 2.85Å; S137-H203 VanDerWaalsContact O-CG 3.3Å; S137-H203 PolarHBondContact O-ND1 3.44Å; S137-H203 WeakPolarHBondContact OG-CB 3.43Å; S137-N205 PolarHBondContact N-OD1 3.29Å
138	S	53.6	Low	59.8	Low	11 Å²	11	36.4 Å²	36.4	8%	0.077	18%	0.183	C	C	.	.			trans	-146.7	100.6	175.7	57.9	0	0	0	0	113.5	C171	S138-C171 PolarHBondContact O-SG 3.04Å; S138-C171 VanDerWaalsContact O-SG 3.34Å
139	K	53.3	Low	59.5	Low	131 Å²	131	36.6 Å²	36.6	57%	0.57	19%	0.185	S	C	*	.	S	Bend	trans	-71.9	149.4	153.9	-78	175.7	175.7	168	0	108.8	C171 E172	K139-C171 HydrophobicContact CG-CB 3.73Å; K139-E172 WeakPolarHBondContact CE-OE1 3.34Å; K139-E172 WeakPolarHBondContact CE-OE2 3.45Å; K139-E172 IonicContact NZ-OE1 2.66Å; K139-E172 PolarHBondContact NZ-OE1 2.97Å; K139-E172 IonicContact NZ-OE2 2.68Å; K139-E172 PolarHBondContact NZ-OE2 3.14Å
140	P	52.3	Low	58.8	Low	124 Å²	124	37.3 Å²	37.3	81%	0.805	19%	0.189	S	C	*	.	S	Bend	cis	-92.8	-20	14.9	35.2	-35.7	0	0	0	115.8
141	T	55.3	Low	58.2	Low	57 Å²	57	38.9 Å²	38.9	35%	0.35	20%	0.199	S	C	.	.	S	Bend	trans	-103.1	115.9	-178.1	51.8	0	0	0	0	110.3
142	C	58	Low	57.5	Low	41 Å²	41	41.6 Å²	41.6	28%	0.277	21%	0.213	S	C	.	.			trans	-79.3	137.7	176.5	-43.6	0	0	0	0	109.2	C171 N195	C142-C171 WeakPolarHBondContact CA-SG 3.45Å; C142-C171 HydrophobicContact CB-CB 4.13Å; C142-C171 WeakPolarHBondContact CB-SG 3.41Å; C142-C171 PolarHBondContact N-SG 3.11Å; C142-C171 WeakPolarHBondContact SG-CB 3.47Å; C142-C171 PolarHBondContact SG-N 2.99Å; C142-C171 CovalentContact SG-SG 2.05Å; C142-C171 PolarHBondContact SG-SG 2.85Å; C142-N195 WeakPolarHBondContact O-CB 3.49Å
143	P	57.7	Low	56.7	Low	3 Å²	3	44 Å²	44	2%	0.019	23%	0.227	C	C	.	.			trans	-68.9	141.1	179.9	24.5	-31.2	0	0	0	112.2	F136 V193 N194 V196	F136-P143 HydrophobicContact CB-CG 3.43Å; F136-P143 VanDerWaalsContact CB-CG 3.43Å; F136-P143 HydrophobicContact CD1-CB 4.24Å; F136-P143 HydrophobicContact CD1-CG 3.37Å; F136-P143 HydrophobicContact CD2-CG 3.62Å; F136-P143 HydrophobicContact CE1-CB 4.28Å; F136-P143 HydrophobicContact CE1-CG 3.85Å; F136-P143 HydrophobicContact CE2-CG 4.06Å; F136-P143 HydrophobicContact CG-CB 4.41Å; F136-P143 HydrophobicContact CG-CG 3.21Å; F136-P143 HydrophobicContact CZ-CB 4.49Å; F136-P143 HydrophobicContact CZ-CG 4.15Å; P143-V193 HydrophobicContact CB-CG1 4.24Å; P143-N194 CarbonylContact C-O 3.59Å; P143-N194 WeakPolarHBondContact CA-O 3.38Å; P143-N194 WeakPolarHBondContact CB-O 2.75Å; P143-V196 HydrophobicContact CB-CG1 4.07Å
144	E	59.4	Low	55.7	Low	60 Å²	60	42.4 Å²	42.4	28%	0.28	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	116	-175.5	-68	158.2	-168.8	0	0	108.6	Y146 V193 N194 N195	E144-Y146 HydrophobicContact CB-CD2 4.23Å; E144-Y146 HydrophobicContact CB-CE2 3.58Å; E144-Y146 PolarHBondContact OE2-OH 3.41Å; E144-V193 WeakPolarHBondContact O-CA 3.39Å; E144-N194 HydrophobicContact CB-CB 4.4Å; E144-N194 PolarHBondContact N-O 3.48Å; E144-N194 PolarHBondContact O-N 3.31Å; E144-N195 PolarHBondContact OE1-ND2 3.08Å; E144-N195 PolarHBondContact OE2-ND2 3.49Å
145	V	61.3	Low	54.5	Low	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	103.7	178.3	-176.1	0	0	0	0	109.3	F136 V147 V167 I191 V193 M207	F136-V145 HydrophobicContact CE2-CG2 3.94Å; F136-V145 HydrophobicContact CZ-CG2 3.78Å; V145-V147 HydrophobicContact CG1-CG2 4.1Å; V145-V167 HydrophobicContact CB-CB 4.19Å; V145-V167 PolarHBondContact O-N 3.01Å; V145-I191 HydrophobicContact CG1-CG2 4.21Å; V145-V193 HydrophobicContact CG1-CG2 4.49Å; V145-V193 HydrophobicContact CG2-CG1 4.15Å; V145-V193 HydrophobicContact CG2-CG2 4.34Å; V145-M207 HydrophobicContact CB-CE 4.37Å; V145-M207 HydrophobicContact CG1-CE 3.79Å; V145-M207 HydrophobicContact CG2-CE 3.57Å
146	Y	61.3	Low	53.6	Low	47 Å²	47	54.2 Å²	54.2	18%	0.184	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	133.6	171.4	-66	-84.5	0	0	0	110	P40 E144 I191 S192 N194	P40-Y146 HydrophobicContact CG-CE1 4.33Å; P40-Y146 HydrophobicContact CG-CE2 4.17Å; E144-Y146 HydrophobicContact CB-CD2 4.23Å; E144-Y146 HydrophobicContact CB-CE2 3.58Å; E144-Y146 PolarHBondContact OE2-OH 3.41Å; Y146-I191 CarbonylContact O-C 3.41Å; Y146-I191 WeakPolarHBondContact O-CA 3.32Å; Y146-S192 PolarHBondContact N-O 2.59Å; Y146-S192 PolarHBondContact O-N 2.86Å; Y146-N194 WeakPolarHBondContact CE2-ND2 3.46Å
147	V	62.6	Low	52.4	Low	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	118.2	177.6	-172.4	0	0	0	0	108.5	F129 V145 L164 G165 F183	F129-V147 HydrophobicContact CD1-CG1 4.21Å; F129-V147 HydrophobicContact CD2-CG1 4.36Å; F129-V147 HydrophobicContact CE1-CB 4.39Å; F129-V147 HydrophobicContact CE1-CG1 4.01Å; F129-V147 HydrophobicContact CE1-CG2 3.7Å; F129-V147 HydrophobicContact CE2-CG1 4.16Å; F129-V147 HydrophobicContact CE2-CG2 4.35Å; F129-V147 HydrophobicContact CG-CG1 4.38Å; F129-V147 HydrophobicContact CZ-CB 4.41Å; F129-V147 HydrophobicContact CZ-CG1 4Å; F129-V147 HydrophobicContact CZ-CG2 3.53Å; V145-V147 HydrophobicContact CG1-CG2 4.1Å; V147-L164 PolarHBondContact O-N 2.97Å; V147-G165 PolarHBondContact N-O 3.08Å; V147-G165 WeakPolarHBondContact O-CA 3.28Å; V147-G165 PolarHBondContact O-N 3.48Å; V147-F183 HydrophobicContact CG1-CE2 4.31Å; V147-F183 HydrophobicContact CG1-CZ 4.07Å
148	C	61.1	Low	51.9	Low	3 Å²	3	58.2 Å²	58.2	2%	0.02	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	139.7	-178.3	168.6	0	0	0	0	110.4	C160 T162 L189 K190	C148-C160 HydrophobicContact CB-CB 4.12Å; C148-C160 WeakPolarHBondContact CB-SG 3.43Å; C148-C160 WeakPolarHBondContact SG-CB 3.33Å; C148-C160 CovalentContact SG-SG 2.01Å; C148-C160 PolarHBondContact SG-SG 2.84Å; C148-T162 PolarHBondContact SG-O 3.48Å; C148-L189 WeakPolarHBondContact O-CA 3.48Å; C148-K190 PolarHBondContact N-O 2.87Å; C148-K190 PolarHBondContact O-N 2.94Å
149	A	62	Low	51.3	Low	7 Å²	7	60.8 Å²	60.8	6%	0.058	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.1	-179	0	0	0	0	0	111.4	P151 T162 F183 A186 L189	A149-P151 WeakPolarHBondContact O-CD 3.38Å; A149-T162 PolarHBondContact N-O 2.7Å; A149-F183 HydrophobicContact CB-CB 3.93Å; A149-F183 HydrophobicContact CB-CD1 3.75Å; A149-F183 HydrophobicContact CB-CE1 4.44Å; A149-F183 HydrophobicContact CB-CG 3.88Å; A149-A186 HydrophobicContact CB-CB 4.03Å; A149-L189 HydrophobicContact CB-CD2 4.41Å
150	I	56.8	Low	50.8	Low	15 Å²	15	56 Å²	56	8%	0.077	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	110.1	170.9	-54.9	175.2	0	0	0	106.6	I52 A186 T187 G188	I52-I150 HydrophobicContact CG2-CD1 3.88Å; I150-A186 CarbonylContact O-C 3.54Å; I150-A186 VanDerWaalsContact O-CA 3.29Å; I150-A186 WeakPolarHBondContact O-CA 3.42Å; I150-T187 PolarHBondContact O-N 3.16Å; I150-T187 PolarHBondContact O-OG1 2.87Å; I150-G188 PolarHBondContact N-O 3.07Å; I150-G188 PolarHBondContact O-N 2.81Å
151	P	54.6	Low	50.4	Low	34 Å²	34	55 Å²	55	22%	0.221	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	159.6	-179.1	32.9	-37.1	0	0	0	111.6	A149 N153 H161 T187	A149-P151 WeakPolarHBondContact O-CD 3.38Å; P151-N153 PolarHBondContact O-N 3.11Å; P151-H161 HydrophobicContact CG-CB 4.06Å; P151-T187 PolarHBondContact O-OG1 3.34Å
152	N	51.1	Low	49.9	Very low	58 Å²	58	54.4 Å²	54.4	31%	0.31	32%	0.315	S	S	.	.			trans	-72.7	52.9	171.2	-160.2	6.3	0	0	0	113.4	N122 G154 L185 T187	N122-N152 PolarHBondContact OD1-ND2 2.75Å; N152-G154 PolarHBondContact O-N 3.32Å; N152-L185 PolarHBondContact N-O 3.08Å; N152-T187 HydrophobicContact CB-CG2 3.68Å
153	N	43.7	Very low	49.1	Very low	79 Å²	79	54.8 Å²	54.8	42%	0.422	31%	0.314	S	S	.	.			trans	-76.1	115.3	169	-68.7	-8.3	0	0	0	107.2	P151 H155 H161	P151-N153 PolarHBondContact O-N 3.11Å; N153-H155 PolarHBondContact O-N 3.27Å; N153-H161 PolarHBondContact ND2-CD2 3.41Å; N153-H161 VanDerWaalsContact ND2-CD2 3.25Å; N153-H161 PolarHBondContact ND2-NE2 3.07Å
154	G	36.2	Very low	48.6	Very low	79 Å²	79	56 Å²	56	81%	0.814	32%	0.321	S	S	*	.	S	Bend	trans	-65.6	16.5	-175.1	0	0	0	0	0	117.1	N152	N152-G154 PolarHBondContact O-N 3.32Å
155	H	36.4	Very low	47.8	Very low	154 Å²	154	53.3 Å²	53.3	71%	0.713	31%	0.308	S	S	*	.	S	Bend	trans	-94.7	148.9	165.4	-62.9	-82	0	0	0	108.8	N153 S157	N153-H155 PolarHBondContact O-N 3.27Å; H155-S157 PolarHBondContact O-N 2.83Å
156	N	37.1	Very low	47	Very low	178 Å²	178	57.8 Å²	57.8	95%	0.952	33%	0.329	S	S	*	.	S	Bend	trans	-71.6	36.4	178	-64.7	-9.1	0	0	0	113.7
157	S	35.3	Very low	46.3	Very low	53 Å²	53	56.2 Å²	56.2	37%	0.371	33%	0.325	S	S	.	.			trans	-98.9	105.6	-175.7	-161.3	0	0	0	0	109.6	H155 T159	H155-S157 PolarHBondContact O-N 2.83Å; S157-T159 WeakPolarHBondContact CB-OG1 3.18Å; S157-T159 PolarHBondContact O-N 3.41Å; S157-T159 VanDerWaalsContact OG-CG2 3.27Å; S157-T159 WeakPolarHBondContact OG-CG2 3.49Å; S157-T159 PolarHBondContact OG-OG1 2.86Å
158	T	40.3	Very low	45.5	Very low	88 Å²	88	59.7 Å²	59.7	54%	0.54	35%	0.349	S	S	.	.			trans	-69.9	12.9	170.4	50.1	0	0	0	0	113	C160	T158-C160 PolarHBondContact O-N 3.4Å
159	T	41.3	Very low	44.8	Very low	66 Å²	66	60 Å²	60	41%	0.405	35%	0.353	S	S	.	.			trans	-60.2	117	179.4	40	0	0	0	0	110.9	S157 H161	S157-T159 WeakPolarHBondContact CB-OG1 3.18Å; S157-T159 PolarHBondContact O-N 3.41Å; S157-T159 VanDerWaalsContact OG-CG2 3.27Å; S157-T159 WeakPolarHBondContact OG-CG2 3.49Å; S157-T159 PolarHBondContact OG-OG1 2.86Å; T159-H161 PolarHBondContact O-CD2 3.35Å; T159-H161 PolarHBondContact O-N 3.17Å; T159-H161 VanDerWaalsContact O-N 3.09Å; T159-H161 PolarHBondContact OG1-NE2 2.81Å
160	C	42.5	Very low	44.2	Very low	30 Å²	30	62.1 Å²	62.1	20%	0.203	37%	0.368	C	S	.	.			trans	-75.8	104.5	-178.7	-141	0	0	0	0	110	C148 T158 K190	C148-C160 HydrophobicContact CB-CB 4.12Å; C148-C160 WeakPolarHBondContact CB-SG 3.43Å; C148-C160 WeakPolarHBondContact SG-CB 3.33Å; C148-C160 CovalentContact SG-SG 2.01Å; C148-C160 PolarHBondContact SG-SG 2.84Å; T158-C160 PolarHBondContact O-N 3.4Å; C160-K190 HydrophobicContact CB-CD 4.19Å
161	H	45.5	Very low	44	Very low	103 Å²	103	61.9 Å²	61.9	48%	0.477	37%	0.367	S	S	.	.			trans	-86.5	-10.6	-166.9	-77.9	-72.3	0	0	0	114.6	P151 N153 T159	P151-H161 HydrophobicContact CG-CB 4.06Å; N153-H161 PolarHBondContact ND2-CD2 3.41Å; N153-H161 VanDerWaalsContact ND2-CD2 3.25Å; N153-H161 PolarHBondContact ND2-NE2 3.07Å; T159-H161 PolarHBondContact O-CD2 3.35Å; T159-H161 PolarHBondContact O-N 3.17Å; T159-H161 VanDerWaalsContact O-N 3.09Å; T159-H161 PolarHBondContact OG1-NE2 2.81Å
162	T	43.4	Very low	43.9	Very low	45 Å²	45	67 Å²	67	28%	0.276	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	113.3	175.6	27.6	0	0	0	0	113.1	C148 A149 L164 R241	C148-T162 PolarHBondContact SG-O 3.48Å; A149-T162 PolarHBondContact N-O 2.7Å; T162-L164 HydrophobicContact CG2-CD1 4.29Å; T162-L164 PolarHBondContact O-N 3.38Å; T162-R241 PolarHBondContact OG1-NH2 3.29Å
163	D	42.3	Very low	43.9	Very low	48 Å²	48	68.4 Å²	68.4	26%	0.257	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	106.2	165.2	-71	-55.2	0	0	0	110.2	C39	C39-D163 VanDerWaalsContact CA-OD2 3.32Å; C39-D163 WeakPolarHBondContact CA-OD2 3.21Å; C39-D163 PolarHBondContact N-OD2 2.71Å; C39-D163 PolarHBondContact SG-OD1 2.82Å
164	L	46.3	Very low	44.4	Very low	30 Å²	30	68.3 Å²	68.3	16%	0.157	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	19.9	-175	-67.6	168	0	0	0	113	V147 T162 F183 R240	V147-L164 PolarHBondContact O-N 2.97Å; T162-L164 HydrophobicContact CG2-CD1 4.29Å; T162-L164 PolarHBondContact O-N 3.38Å; L164-F183 HydrophobicContact CB-CD1 4.27Å; L164-F183 HydrophobicContact CB-CE1 3.75Å; L164-R240 HydrophobicContact CD2-CB 3.68Å; L164-R240 VanDerWaalsContact O-CD 3.23Å; L164-R240 WeakPolarHBondContact O-CD 3.06Å; L164-R240 PolarHBondContact O-NE 2.94Å
165	G	43.8	Very low	45.5	Very low	2 Å²	2	66.7 Å²	66.7	2%	0.021	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	117.7	167.9	0	0	0	0	0	110.3	V147	V147-G165 PolarHBondContact N-O 3.08Å; V147-G165 WeakPolarHBondContact O-CA 3.28Å; V147-G165 PolarHBondContact O-N 3.48Å
166	E	43.1	Very low	46.5	Very low	94 Å²	94	63.6 Å²	63.6	44%	0.439	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	120.3	151.9	-175.4	-167.8	138.6	0	0	104	S168 R240	E166-S168 VanDerWaalsContact OE1-CB 3.23Å; E166-S168 WeakPolarHBondContact OE1-CB 3.35Å; E166-S168 PolarHBondContact OE1-OG 3.39Å; E166-R240 PolarHBondContact O-NH2 3.21Å
167	V	46.8	Very low	47.7	Very low	14 Å²	14	61.6 Å²	61.6	9%	0.085	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	75.2	172.9	-176.6	0	0	0	0	106.3	L134 V145 G169 I175 F181	L134-V167 HydrophobicContact CD1-CG1 3.47Å; L134-V167 VanDerWaalsContact CD1-CG1 3.47Å; V145-V167 HydrophobicContact CB-CB 4.19Å; V145-V167 PolarHBondContact O-N 3.01Å; V167-G169 PolarHBondContact O-N 3.48Å; V167-I175 HydrophobicContact CG1-CD1 4.25Å; V167-F181 HydrophobicContact CG2-CE2 3.49Å; V167-F181 VanDerWaalsContact CG2-CE2 3.49Å; V167-F181 HydrophobicContact CG2-CZ 3.46Å; V167-F181 VanDerWaalsContact CG2-CZ 3.46Å
168	S	46	Very low	49	Very low	73 Å²	73	61.1 Å²	61.1	51%	0.51	34%	0.339	S	S	.	.			trans	-81	92.6	174.8	30	0	0	0	0	109.9	E166	E166-S168 VanDerWaalsContact OE1-CB 3.23Å; E166-S168 WeakPolarHBondContact OE1-CB 3.35Å; E166-S168 PolarHBondContact OE1-OG 3.39Å
169	G	46.5	Very low	50.3	Low	11 Å²	11	61.8 Å²	61.8	11%	0.113	33%	0.332	C	S	.	.			trans	-78.8	140.2	159.6	0	0	0	0	0	109.7	V167	V167-G169 PolarHBondContact O-N 3.48Å
170	S	49.5	Very low	51.8	Low	51 Å²	51	59.9 Å²	59.9	36%	0.357	32%	0.318	S	S	.	.			trans	-72.7	165.9	167.3	82	0	0	0	0	110.5	E172 D173	S170-E172 PolarHBondContact O-N 3.49Å; S170-D173 WeakPolarHBondContact CA-OD2 3.44Å; S170-D173 WeakPolarHBondContact CB-OD2 3.43Å; S170-D173 PolarHBondContact N-OD2 3.42Å; S170-D173 PolarHBondContact O-N 3.36Å; S170-D173 VanDerWaalsContact O-N 3.08Å; S170-D173 PolarHBondContact OG-OD2 3.38Å
171	C	52.3	Low	53.1	Low	10 Å²	10	58.9 Å²	58.9	7%	0.068	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-2.1	-179.5	-62.3	0	0	0	0	114.9	S138 K139 C142	S138-C171 PolarHBondContact O-SG 3.04Å; S138-C171 VanDerWaalsContact O-SG 3.34Å; K139-C171 HydrophobicContact CG-CB 3.73Å; C142-C171 WeakPolarHBondContact CA-SG 3.45Å; C142-C171 HydrophobicContact CB-CB 4.13Å; C142-C171 WeakPolarHBondContact CB-SG 3.41Å; C142-C171 PolarHBondContact N-SG 3.11Å; C142-C171 WeakPolarHBondContact SG-CB 3.47Å; C142-C171 PolarHBondContact SG-N 2.99Å; C142-C171 CovalentContact SG-SG 2.05Å; C142-C171 PolarHBondContact SG-SG 2.85Å
172	E	52.4	Low	54.3	Low	142 Å²	142	54.4 Å²	54.4	66%	0.664	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.3	2.2	-176.6	-67.5	173.3	154.2	0	0	112.1	K139 S170	K139-E172 WeakPolarHBondContact CE-OE1 3.34Å; K139-E172 WeakPolarHBondContact CE-OE2 3.45Å; K139-E172 IonicContact NZ-OE1 2.66Å; K139-E172 PolarHBondContact NZ-OE1 2.97Å; K139-E172 IonicContact NZ-OE2 2.68Å; K139-E172 PolarHBondContact NZ-OE2 3.14Å; S170-E172 PolarHBondContact O-N 3.49Å
173	D	51.1	Low	55.4	Low	86 Å²	86	52.7 Å²	52.7	46%	0.46	28%	0.278	S	S	.	.			trans	-89.2	107.2	175.7	-67	-49.8	0	0	0	110.8	S170 I175	S170-D173 WeakPolarHBondContact CA-OD2 3.44Å; S170-D173 WeakPolarHBondContact CB-OD2 3.43Å; S170-D173 PolarHBondContact N-OD2 3.42Å; S170-D173 PolarHBondContact O-N 3.36Å; S170-D173 VanDerWaalsContact O-N 3.08Å; S170-D173 PolarHBondContact OG-OD2 3.38Å; D173-I175 PolarHBondContact O-N 3.31Å
174	E	54.9	Low	56.4	Low	77 Å²	77	53 Å²	53	36%	0.36	28%	0.283	S	S	.	.			trans	-83.2	100.5	162.9	-169.5	179.8	-138.6	0	0	109.3	R133 Y135 N176	R133-E174 IonicContact CZ-OE1 2.66Å; R133-E174 VanDerWaalsContact CZ-OE1 3.25Å; R133-E174 IonicContact NE-OE1 2.67Å; R133-E174 PolarHBondContact NE-OE1 3.03Å; R133-E174 IonicContact NH2-OE1 3.03Å; R133-E174 PolarHBondContact NH2-OE1 3.16Å; Y135-E174 HydrophobicContact CD2-CG 4.34Å; E174-N176 VanDerWaalsContact CD-ND2 3.26Å; E174-N176 VanDerWaalsContact CG-ND2 3.35Å; E174-N176 WeakPolarHBondContact CG-ND2 3.47Å; E174-N176 PolarHBondContact O-N 3.44Å; E174-N176 PolarHBondContact O-ND2 3.45Å; E174-N176 PolarHBondContact OE2-ND2 2.87Å; E174-N176 PolarHBondContact OE2-OD1 2.83Å
175	I	59.2	Low	57.1	Low	45 Å²	45	53.8 Å²	53.8	23%	0.231	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-73.9	97.2	172.6	-60.6	175.5	0	0	0	107	R133 L134 V167 D173	R133-I175 VanDerWaalsContact CA-O 3.3Å; R133-I175 WeakPolarHBondContact CA-O 3.21Å; L134-I175 HydrophobicContact CB-CB 4.28Å; L134-I175 HydrophobicContact CD1-CD1 4.12Å; L134-I175 PolarHBondContact N-O 3.42Å; L134-I175 PolarHBondContact O-N 3.39Å; V167-I175 HydrophobicContact CG1-CD1 4.25Å; D173-I175 PolarHBondContact O-N 3.31Å
176	N	57.6	Low	57.8	Low	89 Å²	89	54 Å²	54	48%	0.476	29%	0.289	S	S	.	.			trans	-95	-21.6	179	-78.4	-58.4	0	0	0	113.6	E174	E174-N176 VanDerWaalsContact CD-ND2 3.26Å; E174-N176 VanDerWaalsContact CG-ND2 3.35Å; E174-N176 WeakPolarHBondContact CG-ND2 3.47Å; E174-N176 PolarHBondContact O-N 3.44Å; E174-N176 PolarHBondContact O-ND2 3.45Å; E174-N176 PolarHBondContact OE2-ND2 2.87Å; E174-N176 PolarHBondContact OE2-OD1 2.83Å
177	D	61.7	Low	58.4	Low	136 Å²	136	51.6 Å²	51.6	73%	0.727	28%	0.281	S	S	*	.	S	Bend	trans	-86.4	136.5	177.5	-69.7	-43.1	0	0	0	110.2	Y179	D177-Y179 PolarHBondContact O-N 3.25Å; D177-Y179 VanDerWaalsContact O-N 3.15Å
178	P	63.6	Low	58.9	Low	44 Å²	44	51 Å²	51	29%	0.286	28%	0.277	S	S	.	.			trans	-69.2	112.6	-178.7	29.5	-35.6	0	0	0	110.9	T131 F180 L263	T131-P178 WeakPolarHBondContact O-CA 3.48Å; P178-F180 HydrophobicContact CB-CE2 3.76Å; P178-F180 HydrophobicContact CB-CZ 4.08Å; P178-F180 HydrophobicContact CG-CE2 4.02Å; P178-F180 WeakPolarHBondContact O-CD2 3.28Å; P178-L263 HydrophobicContact CB-CD1 4.45Å; P178-L263 HydrophobicContact CG-CD1 3.89Å
179	Y	67.7	Low	59.5	Low	102 Å²	102	47.5 Å²	47.5	40%	0.4	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	119.8	177.7	-165.8	-70.8	0	0	0	110.4	A130 T131 D177 F181 N238	A130-Y179 WeakPolarHBondContact CA-O 3.42Å; T131-Y179 PolarHBondContact N-O 2.87Å; T131-Y179 PolarHBondContact O-N 2.64Å; D177-Y179 PolarHBondContact O-N 3.25Å; D177-Y179 VanDerWaalsContact O-N 3.15Å; Y179-F181 AromaticContact CD1-CD2 3.66Å; Y179-F181 HydrophobicContact CD1-CD2 3.66Å; Y179-F181 AromaticContact CD1-CE2 3.23Å; Y179-F181 HydrophobicContact CD1-CE2 3.23Å; Y179-F181 AromaticContact CD1-CZ 3.82Å; Y179-F181 HydrophobicContact CD1-CZ 3.82Å; Y179-F181 HydrophobicContact CE1-CD1 4.46Å; Y179-F181 AromaticContact CE1-CD2 3.84Å; Y179-F181 HydrophobicContact CE1-CD2 3.84Å; Y179-F181 HydrophobicContact CE1-CE1 4Å; Y179-F181 AromaticContact CE1-CE2 3.32Å; Y179-F181 HydrophobicContact CE1-CE2 3.32Å; Y179-F181 HydrophobicContact CE1-CG 4.4Å; Y179-F181 AromaticContact CE1-CZ 3.41Å; Y179-F181 HydrophobicContact CE1-CZ 3.41Å; Y179-F181 VanDerWaalsContact CE1-CZ 3.41Å; Y179-F181 HydrophobicContact CG-CE2 4.39Å; Y179-N238 PolarHBondContact OH-ND2 3.33Å
180	F	71.2	Confident	60.1	Low	25 Å²	25	49 Å²	49	11%	0.11	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	131.9	-175.3	-65.5	-88.6	0	0	0	113	I128 F129 A130 P178 L263 P266	I128-F180 HydrophobicContact CG2-CD1 3.99Å; F129-F180 CarbonylContact O-C 3.55Å; F129-F180 WeakPolarHBondContact O-CA 3.36Å; A130-F180 HydrophobicContact CB-CD1 3.49Å; A130-F180 VanDerWaalsContact CB-CD1 3.49Å; A130-F180 HydrophobicContact CB-CE1 3.36Å; A130-F180 HydrophobicContact CB-CG 4.39Å; A130-F180 HydrophobicContact CB-CZ 4.15Å; P178-F180 HydrophobicContact CB-CE2 3.76Å; P178-F180 HydrophobicContact CB-CZ 4.08Å; P178-F180 HydrophobicContact CG-CE2 4.02Å; P178-F180 WeakPolarHBondContact O-CD2 3.28Å; F180-L263 VanDerWaalsContact CE1-O 3.29Å; F180-L263 WeakPolarHBondContact CE1-O 3.34Å; F180-L263 HydrophobicContact CZ-CB 4.13Å; F180-L263 WeakPolarHBondContact CZ-O 3.2Å; F180-P266 HydrophobicContact CB-CB 3.8Å; F180-P266 VanDerWaalsContact CD1-CA 3.48Å; F180-P266 HydrophobicContact CD1-CB 3.68Å; F180-P266 HydrophobicContact CD2-CB 4.41Å; F180-P266 WeakPolarHBondContact CD2-O 3.38Å; F180-P266 HydrophobicContact CE1-CB 4.32Å; F180-P266 HydrophobicContact CG-CB 3.72Å; F180-P266 WeakPolarHBondContact CG-O 3.45Å
181	F	69.5	Low	60.7	Low	9 Å²	9	46.6 Å²	46.6	4%	0.039	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	153.5	166.8	-65.6	-103.4	0	0	0	110.1	F129 V167 Y179 F183	F129-F181 HydrophobicContact CB-CB 4.32Å; F129-F181 HydrophobicContact CD1-CB 4.07Å; F129-F181 AromaticContact CD1-CD2 3.66Å; F129-F181 HydrophobicContact CD1-CD2 3.66Å; F129-F181 HydrophobicContact CD1-CE2 4.46Å; F129-F181 HydrophobicContact CD1-CG 4.17Å; F129-F181 HydrophobicContact CE1-CD2 4.02Å; F129-F181 HydrophobicContact CE1-CE2 4.38Å; F129-F181 PolarHBondContact N-O 3.5Å; F129-F181 PolarHBondContact O-N 3Å; V167-F181 HydrophobicContact CG2-CE2 3.49Å; V167-F181 VanDerWaalsContact CG2-CE2 3.49Å; V167-F181 HydrophobicContact CG2-CZ 3.46Å; V167-F181 VanDerWaalsContact CG2-CZ 3.46Å; Y179-F181 AromaticContact CD1-CD2 3.66Å; Y179-F181 HydrophobicContact CD1-CD2 3.66Å; Y179-F181 AromaticContact CD1-CE2 3.23Å; Y179-F181 HydrophobicContact CD1-CE2 3.23Å; Y179-F181 AromaticContact CD1-CZ 3.82Å; Y179-F181 HydrophobicContact CD1-CZ 3.82Å; Y179-F181 HydrophobicContact CE1-CD1 4.46Å; Y179-F181 AromaticContact CE1-CD2 3.84Å; Y179-F181 HydrophobicContact CE1-CD2 3.84Å; Y179-F181 HydrophobicContact CE1-CE1 4Å; Y179-F181 AromaticContact CE1-CE2 3.32Å; Y179-F181 HydrophobicContact CE1-CE2 3.32Å; Y179-F181 HydrophobicContact CE1-CG 4.4Å; Y179-F181 AromaticContact CE1-CZ 3.41Å; Y179-F181 HydrophobicContact CE1-CZ 3.41Å; Y179-F181 VanDerWaalsContact CE1-CZ 3.41Å; Y179-F181 HydrophobicContact CG-CE2 4.39Å; F181-F183 HydrophobicContact CB-CE1 4.45Å; F181-F183 HydrophobicContact CB-CE2 3.69Å; F181-F183 HydrophobicContact CB-CZ 3.61Å; F181-F183 HydrophobicContact CD1-CZ 4.31Å; F181-F183 HydrophobicContact CG-CZ 4.24Å
182	M	70.9	Confident	60.9	Low	10 Å²	10	46.7 Å²	46.7	5%	0.049	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	129.6	-179.1	-165.1	158.9	-71.1	0	0	110.9	I126 I128 F234 I237 Y249 I251 P266	I126-M182 HydrophobicContact CB-CG 4.39Å; I126-M182 HydrophobicContact CD1-CE 4.09Å; I126-M182 HydrophobicContact CD1-SD 4.01Å; I126-M182 HydrophobicContact CG2-CG 4.47Å; I128-M182 HydrophobicContact CD1-CE 4.12Å; I128-M182 HydrophobicContact CG1-CE 4.03Å; M182-F234 HydrophobicContact CE-CZ 4.22Å; M182-I237 HydrophobicContact CB-CG2 3.99Å; M182-I237 HydrophobicContact CE-CD1 3.48Å; M182-I237 VanDerWaalsContact CE-CD1 3.48Å; M182-I237 HydrophobicContact SD-CD1 4.32Å; M182-Y249 HydrophobicContact SD-CD1 4.07Å; M182-Y249 HydrophobicContact SD-CE1 4.42Å; M182-I251 HydrophobicContact CE-CD1 3.19Å; M182-I251 HydrophobicContact SD-CD1 3.81Å; M182-P266 HydrophobicContact CE-CB 4.23Å; M182-P266 HydrophobicContact CE-CG 3.71Å
183	F	66.6	Low	61.4	Low	8 Å²	8	40.2 Å²	40.2	4%	0.035	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	93.2	-178.8	-50.2	-75.4	0	0	0	109.4	L127 F129 V147 A149 L164 F181 A186 L189	L127-F183 HydrophobicContact CB-CB 4.38Å; L127-F183 PolarHBondContact N-O 3.42Å; L127-F183 PolarHBondContact O-N 2.76Å; F129-F183 HydrophobicContact CB-CD2 4.47Å; F129-F183 HydrophobicContact CB-CE2 3.85Å; F129-F183 HydrophobicContact CG-CE2 4.42Å; V147-F183 HydrophobicContact CG1-CE2 4.31Å; V147-F183 HydrophobicContact CG1-CZ 4.07Å; A149-F183 HydrophobicContact CB-CB 3.93Å; A149-F183 HydrophobicContact CB-CD1 3.75Å; A149-F183 HydrophobicContact CB-CE1 4.44Å; A149-F183 HydrophobicContact CB-CG 3.88Å; L164-F183 HydrophobicContact CB-CD1 4.27Å; L164-F183 HydrophobicContact CB-CE1 3.75Å; F181-F183 HydrophobicContact CB-CE1 4.45Å; F181-F183 HydrophobicContact CB-CE2 3.69Å; F181-F183 HydrophobicContact CB-CZ 3.61Å; F181-F183 HydrophobicContact CD1-CZ 4.31Å; F181-F183 HydrophobicContact CG-CZ 4.24Å; F183-A186 HydrophobicContact CB-CB 3.66Å; F183-L189 HydrophobicContact CD2-CD2 3.48Å; F183-L189 VanDerWaalsContact CD2-CD2 3.48Å; F183-L189 HydrophobicContact CE2-CD2 3.61Å; F183-L189 HydrophobicContact CG-CD2 4.16Å; F183-L189 HydrophobicContact CZ-CD2 4.41Å
184	P	64.8	Low	61.8	Low	56 Å²	56	36.9 Å²	36.9	36%	0.364	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	139.3	171.8	-21.7	33.5	0	0	0	111.7	I126 A186 E239	I126-P184 HydrophobicContact CG2-CB 4.26Å; I126-P184 HydrophobicContact CG2-CG 4.36Å; P184-A186 PolarHBondContact O-N 2.89Å; P184-E239 WeakPolarHBondContact CG-OE1 3.49Å
185	L	60.3	Low	62	Low	45 Å²	45	34.4 Å²	34.4	24%	0.236	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	18.3	177	-39.6	179.3	0	0	0	114.7	N122 D123 S125 N152 F313	N122-L185 WeakPolarHBondContact O-CD2 3.49Å; D123-L185 WeakPolarHBondContact O-CD2 3.34Å; S125-L185 PolarHBondContact O-N 3.38Å; N152-L185 PolarHBondContact N-O 3.08Å; L185-F313 HydrophobicContact CD1-CD1 4.35Å; L185-F313 HydrophobicContact CD1-CE1 3.57Å; L185-F313 HydrophobicContact CD1-CZ 4.25Å
186	A	59.4	Low	61.8	Low	7 Å²	7	32.7 Å²	32.7	6%	0.058	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.8	173.5	0	0	0	0	0	110.5	L127 A149 I150 F183 P184 G188	L127-A186 HydrophobicContact CB-CB 4.01Å; L127-A186 HydrophobicContact CD2-CB 4.11Å; A149-A186 HydrophobicContact CB-CB 4.03Å; I150-A186 CarbonylContact O-C 3.54Å; I150-A186 VanDerWaalsContact O-CA 3.29Å; I150-A186 WeakPolarHBondContact O-CA 3.42Å; F183-A186 HydrophobicContact CB-CB 3.66Å; P184-A186 PolarHBondContact O-N 2.89Å; A186-G188 VanDerWaalsContact C-N 3.35Å
187	T	55.8	Low	61.4	Low	44 Å²	44	29.3 Å²	29.3	27%	0.27	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-15.1	170.9	36.4	0	0	0	0	112.5	S54 P55 I150 P151 N152	S54-T187 PolarHBondContact OG-O 2.98Å; P55-T187 WeakPolarHBondContact CD-O 3.49Å; I150-T187 PolarHBondContact O-N 3.16Å; I150-T187 PolarHBondContact O-OG1 2.87Å; P151-T187 PolarHBondContact O-OG1 3.34Å; N152-T187 HydrophobicContact CB-CG2 3.68Å
188	G	56.2	Low	60.6	Low	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	178.3	176.4	0	0	0	0	0	115	I53 L127 I150 A186	I53-G188 CarbonylContact O-C 3.6Å; I53-G188 WeakPolarHBondContact O-CA 3.49Å; L127-G188 VanDerWaalsContact CD2-C 3.48Å; I150-G188 PolarHBondContact N-O 3.07Å; I150-G188 PolarHBondContact O-N 2.81Å; A186-G188 VanDerWaalsContact C-N 3.35Å
189	L	59	Low	59.9	Low	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.4	174.3	-59.3	174.1	0	0	0	109.9	I52 I53 L127 F129 C148 A149 F183 V211	I52-L189 WeakPolarHBondContact CA-O 3.46Å; I53-L189 PolarHBondContact N-O 2.04Å; I53-L189 PolarHBondContact O-N 3.23Å; L127-L189 HydrophobicContact CD2-CD1 4.37Å; L127-L189 HydrophobicContact CD2-CD2 4Å; L127-L189 HydrophobicContact CD2-CG 3.69Å; L127-L189 HydrophobicContact CG-CD1 4.32Å; L127-L189 HydrophobicContact CG-CD2 4.35Å; L127-L189 HydrophobicContact CG-CG 4.13Å; F129-L189 HydrophobicContact CB-CD1 3.79Å; F129-L189 HydrophobicContact CD2-CD1 3.47Å; F129-L189 VanDerWaalsContact CD2-CD1 3.47Å; F129-L189 HydrophobicContact CE2-CD1 4.38Å; F129-L189 HydrophobicContact CG-CD1 3.96Å; C148-L189 WeakPolarHBondContact O-CA 3.48Å; A149-L189 HydrophobicContact CB-CD2 4.41Å; F183-L189 HydrophobicContact CD2-CD2 3.48Å; F183-L189 VanDerWaalsContact CD2-CD2 3.48Å; F183-L189 HydrophobicContact CE2-CD2 3.61Å; F183-L189 HydrophobicContact CG-CD2 4.16Å; F183-L189 HydrophobicContact CZ-CD2 4.41Å; L189-V211 HydrophobicContact CD1-CG1 3.82Å; L189-V211 HydrophobicContact CD1-CG2 4.07Å
190	K	58.7	Low	58.7	Low	43 Å²	43	30.9 Å²	30.9	19%	0.187	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	121.3	159.1	172.3	173.1	168.7	136.7	0	107.6	E50 I51 C148 C160 S192	E50-K190 HydrophobicContact CG-CG 4.21Å; E50-K190 VanDerWaalsContact OE1-CE 3.22Å; E50-K190 WeakPolarHBondContact OE1-CE 3.28Å; E50-K190 IonicContact OE1-NZ 3.48Å; E50-K190 PolarHBondContact OE1-NZ 3.31Å; E50-K190 VanDerWaalsContact OE2-CE 3.23Å; E50-K190 WeakPolarHBondContact OE2-CE 3.42Å; E50-K190 IonicContact OE2-NZ 3.52Å; E50-K190 PolarHBondContact OE2-NZ 3.41Å; I51-K190 WeakPolarHBondContact O-CA 3.43Å; C148-K190 PolarHBondContact N-O 2.87Å; C148-K190 PolarHBondContact O-N 2.94Å; C160-K190 HydrophobicContact CB-CD 4.19Å; K190-S192 WeakPolarHBondContact CE-OG 3.4Å
191	I	61.7	Low	57.3	Low	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.6	171.9	-54.7	163.4	0	0	0	106.8	E50 I51 I53 F129 V145 Y146 V193 I209	E50-I191 CarbonylContact C-O 3.46Å; E50-I191 VanDerWaalsContact CA-O 3.32Å; E50-I191 WeakPolarHBondContact CA-O 3.39Å; I51-I191 HydrophobicContact CB-CB 4.39Å; I51-I191 HydrophobicContact CD1-CB 4.18Å; I51-I191 HydrophobicContact CD1-CD1 4.39Å; I51-I191 HydrophobicContact CD1-CG2 4.27Å; I51-I191 PolarHBondContact N-O 2.86Å; I51-I191 PolarHBondContact O-N 2.75Å; I53-I191 HydrophobicContact CD1-CD1 3.5Å; I53-I191 HydrophobicContact CD1-CG1 4.48Å; F129-I191 HydrophobicContact CE2-CD1 3.71Å; F129-I191 HydrophobicContact CE2-CG1 4.06Å; V145-I191 HydrophobicContact CG1-CG2 4.21Å; Y146-I191 CarbonylContact O-C 3.41Å; Y146-I191 WeakPolarHBondContact O-CA 3.32Å; I191-V193 HydrophobicContact CG2-CG2 4.29Å; I191-I209 HydrophobicContact CD1-CD1 4.09Å; I191-I209 HydrophobicContact CD1-CG2 4.49Å
192	S	57.6	Low	56.2	Low	13 Å²	13	35.6 Å²	35.6	9%	0.091	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	114.9	175.9	-63.6	0	0	0	0	109.7	L49 Y146 K190	L49-S192 CarbonylContact O-C 3.59Å; L49-S192 VanDerWaalsContact O-CA 3.3Å; L49-S192 WeakPolarHBondContact O-CA 3.48Å; Y146-S192 PolarHBondContact N-O 2.59Å; Y146-S192 PolarHBondContact O-N 2.86Å; K190-S192 WeakPolarHBondContact CE-OG 3.4Å
193	V	61.8	Low	55.2	Low	5 Å²	5	38 Å²	38	3%	0.03	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	106.5	178.1	-169.2	0	0	0	0	109.2	S48 L49 F136 P143 E144 V145 I191 V196 M207	S48-V193 VanDerWaalsContact CA-O 3.28Å; S48-V193 WeakPolarHBondContact CA-O 3.19Å; L49-V193 HydrophobicContact CB-CB 4.27Å; L49-V193 PolarHBondContact N-O 3.21Å; L49-V193 PolarHBondContact O-N 3.1Å; F136-V193 HydrophobicContact CE1-CG1 4.33Å; F136-V193 HydrophobicContact CZ-CG1 4.27Å; P143-V193 HydrophobicContact CB-CG1 4.24Å; E144-V193 WeakPolarHBondContact O-CA 3.39Å; V145-V193 HydrophobicContact CG1-CG2 4.49Å; V145-V193 HydrophobicContact CG2-CG1 4.15Å; V145-V193 HydrophobicContact CG2-CG2 4.34Å; I191-V193 HydrophobicContact CG2-CG2 4.29Å; V193-V196 HydrophobicContact CG1-CG1 3.75Å; V193-M207 HydrophobicContact CG2-CE 3.61Å; V193-M207 HydrophobicContact CG2-SD 4.14Å
194	N	59.3	Low	54.7	Low	17 Å²	17	44 Å²	44	9%	0.091	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	173.7	177.2	-64.3	-21.6	0	0	0	110.9	S48 P143 E144 Y146 V196	S48-N194 WeakPolarHBondContact CB-OD1 3.22Å; P143-N194 CarbonylContact C-O 3.59Å; P143-N194 WeakPolarHBondContact CA-O 3.38Å; P143-N194 WeakPolarHBondContact CB-O 2.75Å; E144-N194 HydrophobicContact CB-CB 4.4Å; E144-N194 PolarHBondContact N-O 3.48Å; E144-N194 PolarHBondContact O-N 3.31Å; Y146-N194 WeakPolarHBondContact CE2-ND2 3.46Å; N194-V196 VanDerWaalsContact C-N 3.29Å; N194-V196 PolarHBondContact O-N 3.41Å; N194-V196 VanDerWaalsContact O-N 3.15Å
195	N	59.9	Low	54.1	Low	25 Å²	25	42.6 Å²	42.6	13%	0.134	22%	0.221	C	C	.	.			trans	58.2	27.6	167.4	-68.9	-16.2	0	0	0	116.5	H46 C142 E144 G197	H46-N195 VanDerWaalsContact CG-OD1 3.3Å; H46-N195 PolarHBondContact ND1-OD1 3.47Å; C142-N195 WeakPolarHBondContact O-CB 3.49Å; E144-N195 PolarHBondContact OE1-ND2 3.08Å; E144-N195 PolarHBondContact OE2-ND2 3.49Å; N195-G197 PolarHBondContact O-N 3.24Å
196	V	54.9	Low	53.9	Low	8 Å²	8	41.5 Å²	41.5	5%	0.048	22%	0.217	C	C	.	.			trans	-67	3.8	178.6	-60.1	0	0	0	0	115.8	L47 M70 P143 V193 N194 P200	L47-V196 HydrophobicContact CB-CG2 3.4Å; L47-V196 HydrophobicContact CD2-CG2 4.4Å; L47-V196 HydrophobicContact CG-CG2 4.47Å; M70-V196 HydrophobicContact SD-CG2 4.09Å; P143-V196 HydrophobicContact CB-CG1 4.07Å; V193-V196 HydrophobicContact CG1-CG1 3.75Å; N194-V196 VanDerWaalsContact C-N 3.29Å; N194-V196 PolarHBondContact O-N 3.41Å; N194-V196 VanDerWaalsContact O-N 3.15Å; V196-P200 HydrophobicContact CB-CG 4.3Å; V196-P200 HydrophobicContact CG2-CG 3.83Å; V196-P200 WeakPolarHBondContact O-CG 3.38Å
197	G	48.8	Very low	53.9	Low	19 Å²	19	41.4 Å²	41.4	20%	0.196	22%	0.215	C	C	.	.			trans	86	168.5	179.3	0	0	0	0	0	114.7	N195 Y199	N195-G197 PolarHBondContact O-N 3.24Å; G197-Y199 VanDerWaalsContact C-N 3.3Å
198	E	45.1	Very low	54.1	Low	168 Å²	168	41.6 Å²	41.6	79%	0.785	21%	0.213	S	C	*	.	S	Bend	trans	-75.8	-17.4	177	-64.7	-174.9	137.4	0	0	113.2
199	Y	48.5	Very low	54.5	Low	140 Å²	140	41.6 Å²	41.6	55%	0.549	21%	0.213	S	C	.	.			trans	-132.6	57.4	-177.4	-54.7	-69.7	0	0	0	113.9	G197 G201 I202 H203	G197-Y199 VanDerWaalsContact C-N 3.3Å; Y199-G201 PolarHBondContact O-N 3.1Å; Y199-G201 VanDerWaalsContact O-N 3.07Å; Y199-I202 HydrophobicContact CD1-CD1 4.35Å; Y199-I202 HydrophobicContact CG-CD1 3.95Å; Y199-I202 PolarHBondContact O-N 3.31Å; Y199-H203 PolarHBondContact O-CD2 3.39Å; Y199-H203 VanDerWaalsContact O-CD2 3.32Å
200	P	43.2	Very low	54.7	Low	7 Å²	7	41.7 Å²	41.7	5%	0.045	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-58	-30.6	-175.5	-20.3	31.7	0	0	0	113	L47 M70 V196 I202 H203	L47-P200 HydrophobicContact CD2-CG 4.36Å; M70-P200 HydrophobicContact CB-CB 3.83Å; M70-P200 HydrophobicContact CB-CG 3.92Å; M70-P200 HydrophobicContact CG-CB 4.08Å; M70-P200 HydrophobicContact CG-CG 4.43Å; M70-P200 WeakPolarHBondContact O-CD 3.03Å; M70-P200 HydrophobicContact SD-CB 4.09Å; M70-P200 HydrophobicContact SD-CG 4.12Å; V196-P200 HydrophobicContact CB-CG 4.3Å; V196-P200 HydrophobicContact CG2-CG 3.83Å; V196-P200 WeakPolarHBondContact O-CG 3.38Å; P200-I202 VanDerWaalsContact C-N 3.28Å; P200-I202 PolarHBondContact O-N 3.17Å; P200-H203 PolarHBondContact O-N 3.47Å; P200-H203 VanDerWaalsContact O-N 3.11Å
201	G	42.1	Very low	54.9	Low	19 Å²	19	39.7 Å²	39.7	20%	0.196	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-71.3	-4.2	176	0	0	0	0	0	118.1	P69 M70 Y199 H203	P69-G201 VanDerWaalsContact CA-CA 3.43Å; M70-G201 PolarHBondContact O-N 3.4Å; Y199-G201 PolarHBondContact O-N 3.1Å; Y199-G201 VanDerWaalsContact O-N 3.07Å; G201-H203 VanDerWaalsContact C-N 3.27Å
202	I	45.1	Very low	55.2	Low	114 Å²	114	39.8 Å²	39.8	59%	0.585	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-82.5	-11.3	168.1	-63.4	-179.1	0	0	0	111	Y199 P200	Y199-I202 HydrophobicContact CD1-CD1 4.35Å; Y199-I202 HydrophobicContact CG-CD1 3.95Å; Y199-I202 PolarHBondContact O-N 3.31Å; P200-I202 VanDerWaalsContact C-N 3.28Å; P200-I202 PolarHBondContact O-N 3.17Å
203	H	51	Low	55.6	Low	59 Å²	59	39.5 Å²	39.5	27%	0.273	20%	0.204	S	C	.	.	S	Bend	trans	-123.2	141.9	-165	-59.6	-55.7	0	0	0	111.9	S137 Y199 P200 G201 N205	S137-H203 PolarHBondContact O-CE1 2.85Å; S137-H203 VanDerWaalsContact O-CG 3.3Å; S137-H203 PolarHBondContact O-ND1 3.44Å; S137-H203 WeakPolarHBondContact OG-CB 3.43Å; Y199-H203 PolarHBondContact O-CD2 3.39Å; Y199-H203 VanDerWaalsContact O-CD2 3.32Å; P200-H203 PolarHBondContact O-N 3.47Å; P200-H203 VanDerWaalsContact O-N 3.11Å; G201-H203 VanDerWaalsContact C-N 3.27Å; H203-N205 WeakPolarHBondContact CB-OD1 3.35Å; H203-N205 PolarHBondContact O-N 3.01Å
204	N	54.7	Low	56.1	Low	136 Å²	136	39.3 Å²	39.3	73%	0.727	20%	0.202	S	C	*	.			trans	-76.3	37.1	176.7	-69.9	-10.8	0	0	0	112	Y135 S206	Y135-N204 WeakPolarHBondContact CD1-O 3.45Å; Y135-N204 HydrophobicContact CE1-CB 4.19Å; N204-S206 PolarHBondContact O-N 3.21Å; N204-S206 PolarHBondContact O-OG 3.22Å
205	N	53.6	Low	56.8	Low	25 Å²	25	39.3 Å²	39.3	13%	0.134	20%	0.201	C	C	.	.			trans	-56.4	121.1	-177.6	-72.3	-6.2	0	0	0	109.1	Y135 F136 S137 H203	Y135-N205 CarbonylContact O-C 3.51Å; Y135-N205 WeakPolarHBondContact O-CA 3.46Å; F136-N205 WeakPolarHBondContact CA-OD1 3.43Å; F136-N205 HydrophobicContact CD1-CB 4.37Å; S137-N205 PolarHBondContact N-OD1 3.29Å; H203-N205 WeakPolarHBondContact CB-OD1 3.35Å; H203-N205 PolarHBondContact O-N 3.01Å
206	S	55.5	Low	57.6	Low	22 Å²	22	40 Å²	40	15%	0.154	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	141.6	-177.4	51.2	0	0	0	0	111.7	F66 Y135 N204	F66-S206 VanDerWaalsContact O-CA 3.28Å; F66-S206 WeakPolarHBondContact O-CA 3.48Å; F66-S206 VanDerWaalsContact O-CB 3.29Å; F66-S206 WeakPolarHBondContact O-CB 3.49Å; Y135-S206 PolarHBondContact N-O 3.18Å; Y135-S206 PolarHBondContact O-N 2.82Å; N204-S206 PolarHBondContact O-N 3.21Å; N204-S206 PolarHBondContact O-OG 3.22Å
207	M	59.3	Low	58.6	Low	6 Å²	6	39.9 Å²	39.9	3%	0.03	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	119.8	-178.3	160.7	-177.1	-80.3	0	0	106.3	F66 R133 L134 F136 V145 V193 I209	F66-M207 HydrophobicContact CB-CB 4.28Å; F66-M207 HydrophobicContact CD2-CB 3.8Å; F66-M207 HydrophobicContact CD2-CG 3.75Å; F66-M207 HydrophobicContact CD2-SD 3.8Å; F66-M207 HydrophobicContact CE2-CG 4.25Å; F66-M207 HydrophobicContact CE2-SD 3.9Å; F66-M207 HydrophobicContact CG-CB 4.45Å; F66-M207 PolarHBondContact N-O 3.15Å; F66-M207 VanDerWaalsContact N-O 3.12Å; R133-M207 WeakPolarHBondContact O-CA 3.44Å; L134-M207 HydrophobicContact CD2-CB 3.9Å; L134-M207 HydrophobicContact CD2-CE 3.57Å; L134-M207 HydrophobicContact CD2-CG 3.73Å; F136-M207 HydrophobicContact CZ-CE 4.05Å; V145-M207 HydrophobicContact CB-CE 4.37Å; V145-M207 HydrophobicContact CG1-CE 3.79Å; V145-M207 HydrophobicContact CG2-CE 3.57Å; V193-M207 HydrophobicContact CG2-CE 3.61Å; V193-M207 HydrophobicContact CG2-SD 4.14Å; M207-I209 HydrophobicContact CE-CD1 4Å; M207-I209 HydrophobicContact CG-CD1 3.54Å; M207-I209 HydrophobicContact CG-CG1 3.71Å; M207-I209 HydrophobicContact SD-CD1 3.39Å; M207-I209 WeakPolarHBondContact SD-CD1 3.42Å; M207-I209 HydrophobicContact SD-CG1 4.26Å
208	H	60.5	Low	59.6	Low	47 Å²	47	40.7 Å²	40.7	22%	0.218	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	107.4	174.1	-174	-129.5	0	0	0	108.6	I63 Y64 N65 H132 R133	I63-H208 WeakPolarHBondContact CG2-NE2 3.42Å; Y64-H208 WeakPolarHBondContact O-CA 3.04Å; N65-H208 PolarHBondContact OD1-CD2 3.05Å; N65-H208 VanDerWaalsContact OD1-CD2 3.23Å; H132-H208 HydrophobicContact CB-CB 4.39Å; H132-H208 VanDerWaalsContact CB-ND1 3.29Å; H132-H208 WeakPolarHBondContact CB-ND1 3.35Å; H132-H208 AromaticContact CG-ND1 3.94Å; H132-H208 PolarHBondContact N-O 2.89Å; R133-H208 HydrophobicContact CB-CB 3.96Å; R133-H208 PolarHBondContact N-O 3.48Å; R133-H208 PolarHBondContact O-N 2.77Å
209	I	63.8	Low	60.7	Low	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	135.6	-178.6	-71.3	175.5	0	0	0	109.2	Y64 F129 A130 T131 I191 M207 V211	Y64-I209 HydrophobicContact CD2-CG2 4.38Å; Y64-I209 PolarHBondContact N-O 3.04Å; Y64-I209 PolarHBondContact O-N 3.12Å; F129-I209 HydrophobicContact CD2-CG2 3.9Å; F129-I209 HydrophobicContact CE2-CD1 3.85Å; F129-I209 HydrophobicContact CE2-CG1 4.34Å; F129-I209 HydrophobicContact CE2-CG2 3.51Å; F129-I209 HydrophobicContact CZ-CD1 3.82Å; F129-I209 HydrophobicContact CZ-CG1 4.36Å; F129-I209 HydrophobicContact CZ-CG2 4.29Å; A130-I209 WeakPolarHBondContact O-CA 3.48Å; T131-I209 HydrophobicContact CG2-CG1 4.24Å; I191-I209 HydrophobicContact CD1-CD1 4.09Å; I191-I209 HydrophobicContact CD1-CG2 4.49Å; M207-I209 HydrophobicContact CE-CD1 4Å; M207-I209 HydrophobicContact CG-CD1 3.54Å; M207-I209 HydrophobicContact CG-CG1 3.71Å; M207-I209 HydrophobicContact SD-CD1 3.39Å; M207-I209 WeakPolarHBondContact SD-CD1 3.42Å; M207-I209 HydrophobicContact SD-CG1 4.26Å; I209-V211 HydrophobicContact CG2-CG2 3.76Å
210	I	63.5	Low	61.7	Low	2 Å²	2	27.8 Å²	27.8	1%	0.01	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132.4	166.5	-72.3	123.7	0	0	0	109	C62 I63 A130 H132 V262	C62-I210 WeakPolarHBondContact O-CA 3.39Å; I63-I210 HydrophobicContact CG1-CG1 3.81Å; A130-I210 HydrophobicContact CB-CB 4.34Å; A130-I210 PolarHBondContact N-O 2.81Å; A130-I210 PolarHBondContact O-N 3.4Å; H132-I210 VanDerWaalsContact CD2-CD1 3.45Å; H132-I210 WeakPolarHBondContact CD2-CD1 3.34Å; H132-I210 WeakPolarHBondContact NE2-CD1 3.4Å; I210-V262 HydrophobicContact CB-CG1 4.28Å; I210-V262 HydrophobicContact CD1-CG1 3.47Å; I210-V262 VanDerWaalsContact CD1-CG1 3.47Å; I210-V262 HydrophobicContact CG1-CG1 3.57Å; I210-V262 HydrophobicContact CG2-CG1 3.89Å
211	V	63.7	Low	63.4	Low	2 Å²	2	30.3 Å²	30.3	1%	0.012	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	116.9	174.1	-176.5	0	0	0	0	108.6	I53 S61 C62 Y64 L127 I128 F129 L189 I209	I53-V211 HydrophobicContact CD1-CG2 3.67Å; I53-V211 HydrophobicContact CG2-CB 4.38Å; I53-V211 HydrophobicContact CG2-CG1 4.17Å; S61-V211 WeakPolarHBondContact CA-O 3.25Å; C62-V211 PolarHBondContact N-O 2.94Å; C62-V211 VanDerWaalsContact N-O 3.11Å; C62-V211 PolarHBondContact O-N 2.81Å; Y64-V211 HydrophobicContact CE2-CG2 4.33Å; L127-V211 HydrophobicContact CD1-CG1 3.58Å; L127-V211 HydrophobicContact CG-CG1 4.26Å; I128-V211 WeakPolarHBondContact O-CA 3.33Å; F129-V211 HydrophobicContact CD2-CG2 3.95Å; L189-V211 HydrophobicContact CD1-CG1 3.82Å; L189-V211 HydrophobicContact CD1-CG2 4.07Å; I209-V211 HydrophobicContact CG2-CG2 3.76Å
212	T	67.1	Low	65.4	Low	2 Å²	2	30 Å²	30	1%	0.012	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	127.8	-173.2	-58.4	0	0	0	0	110.7	L60 S61 I128 L253 L257 N264	L60-T212 WeakPolarHBondContact O-CA 3.4Å; S61-T212 PolarHBondContact OG-OG1 3.11Å; I128-T212 PolarHBondContact N-O 3.45Å; I128-T212 PolarHBondContact O-N 2.91Å; T212-L253 HydrophobicContact CG2-CD1 4.38Å; T212-L253 HydrophobicContact CG2-CD2 3.96Å; T212-L257 HydrophobicContact CG2-CD1 3.47Å; T212-L257 VanDerWaalsContact CG2-CD1 3.47Å; T212-N264 HydrophobicContact CG2-CB 4.21Å; T212-N264 PolarHBondContact OG1-OD1 3.28Å
213	S	67.3	Low	67.3	Low	7 Å²	7	28.4 Å²	28.4	5%	0.049	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	132.3	168.3	58.9	0	0	0	0	111.5	I57 S58 H59 L60	I57-S213 PolarHBondContact O-OG 2.99Å; S58-S213 WeakPolarHBondContact CA-OG 3.28Å; S58-S213 PolarHBondContact O-OG 2.89Å; H59-S213 PolarHBondContact N-OG 2.92Å; L60-S213 PolarHBondContact O-N 3.37Å
214	G	70.9	Confident	68.9	Low	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	178.1	179.5	0	0	0	0	0	113.6	I126	I126-G214 WeakPolarHBondContact CG1-O 3.16Å; I126-G214 PolarHBondContact N-O 3.01Å; I126-G214 PolarHBondContact O-N 3.08Å
215	Y	74.7	Confident	70	Confident	17 Å²	17	22 Å²	22	7%	0.067	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	123.7	-176.6	-179.4	-103.4	0	0	0	111.3	V120 R124 L217 P225 C252	V120-Y215 HydrophobicContact CG1-CE2 3.99Å; R124-Y215 HydrophobicContact CB-CD2 3.82Å; R124-Y215 HydrophobicContact CB-CE2 3.41Å; R124-Y215 VanDerWaalsContact CB-CE2 3.41Å; R124-Y215 VanDerWaalsContact CD-OH 3.26Å; R124-Y215 WeakPolarHBondContact CD-OH 3.5Å; R124-Y215 HydrophobicContact CG-CE2 4.18Å; R124-Y215 PolarHBondContact NH1-OH 3.37Å; Y215-L217 HydrophobicContact CD1-CD2 3.97Å; Y215-L217 HydrophobicContact CE1-CD2 3.7Å; Y215-P225 HydrophobicContact CD1-CG 3.92Å; Y215-P225 HydrophobicContact CE1-CG 3.66Å; Y215-C252 HydrophobicContact CD1-CB 4.24Å; Y215-C252 PolarHBondContact N-O 3.27Å; Y215-C252 PolarHBondContact O-N 3.35Å
216	R	77.2	Confident	71	Confident	41 Å²	41	24.1 Å²	24.1	16%	0.155	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	122.7	178	-176.9	176.2	-177.7	164	2.4	110.1	R124 I126 E239 Y249	R124-R216 PolarHBondContact O-N 3.04Å; I126-R216 HydrophobicContact CG2-CB 3.79Å; R216-E239 IonicContact NH1-OE1 3.25Å; R216-E239 PolarHBondContact NH1-OE1 2.02Å; R216-Y249 PolarHBondContact NH2-OH 3.37Å; R216-Y249 VanDerWaalsContact NH2-OH 3.07Å
217	L	76	Confident	71.9	Confident	5 Å²	5	25.2 Å²	25.2	3%	0.026	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-70.4	139.4	173	-63.5	-172.7	0	0	0	110.9	Y215 V221 R250 C252 F283	Y215-L217 HydrophobicContact CD1-CD2 3.97Å; Y215-L217 HydrophobicContact CE1-CD2 3.7Å; L217-V221 HydrophobicContact CD1-CG1 4.33Å; L217-V221 WeakPolarHBondContact CD1-O 3.5Å; L217-V221 HydrophobicContact CD2-CG1 4.15Å; L217-R250 HydrophobicContact CB-CB 3.87Å; L217-R250 HydrophobicContact CD1-CB 4.18Å; L217-R250 HydrophobicContact CG-CB 4.24Å; L217-R250 PolarHBondContact N-O 3.36Å; L217-C252 VanDerWaalsContact CD2-SG 3.58Å; L217-F283 HydrophobicContact CD1-CD2 3.68Å; L217-F283 HydrophobicContact CD1-CE2 3.48Å; L217-F283 VanDerWaalsContact CD1-CE2 3.48Å; L217-F283 HydrophobicContact CG-CE2 4.3Å
218	P	69.9	Low	73	Confident	35 Å²	35	25.4 Å²	25.4	23%	0.227	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-74.8	171.1	173.7	31.7	-35.3	0	0	0	112.3	V221 R250	P218-V221 HydrophobicContact CG-CB 4.05Å; P218-V221 HydrophobicContact CG-CG2 3.78Å; P218-V221 PolarHBondContact O-N 2.98Å; P218-R250 PolarHBondContact O-NH2 3.36Å; P218-R250 VanDerWaalsContact O-NH2 3.08Å
219	P	67.6	Low	74.3	Confident	20 Å²	20	23.1 Å²	23.1	13%	0.13	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	142.5	172.2	-29.4	38.1	0	0	0	112.9	V221 W247 E293 L297	P219-V221 PolarHBondContact O-N 3.32Å; P219-V221 VanDerWaalsContact O-N 3.16Å; P219-W247 HydrophobicContact CB-CE3 4.38Å; P219-W247 HydrophobicContact CB-CH2 4.42Å; P219-W247 HydrophobicContact CB-CZ3 4.18Å; P219-W247 HydrophobicContact CG-CD2 3.93Å; P219-W247 HydrophobicContact CG-CE3 3.67Å; P219-W247 HydrophobicContact CG-CH2 3.1Å; P219-W247 HydrophobicContact CG-CZ2 3.39Å; P219-W247 HydrophobicContact CG-CZ3 3.23Å; P219-E293 WeakPolarHBondContact CA-OE2 3.16Å; P219-E293 HydrophobicContact CB-CB 4.39Å; P219-L297 HydrophobicContact CB-CD2 4.06Å; P219-L297 HydrophobicContact CG-CD2 4.13Å
220	G	69.8	Low	75.5	Confident	18 Å²	18	23.3 Å²	23.3	19%	0.186	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	-7.7	179.8	0	0	0	0	0	115.4	F222 E293	G220-F222 WeakPolarHBondContact O-CD2 3.38Å; G220-F222 WeakPolarHBondContact O-CE2 3.49Å; G220-E293 PolarHBondContact N-OE2 2.91Å
221	V	77.4	Confident	76.7	Confident	60 Å²	60	23.4 Å²	23.4	36%	0.364	15%	0.153	S	C	.	.			trans	-105.8	125.5	178.7	-177.6	0	0	0	0	110.7	L217 P218 P219 R250	L217-V221 HydrophobicContact CD1-CG1 4.33Å; L217-V221 WeakPolarHBondContact CD1-O 3.5Å; L217-V221 HydrophobicContact CD2-CG1 4.15Å; P218-V221 HydrophobicContact CG-CB 4.05Å; P218-V221 HydrophobicContact CG-CG2 3.78Å; P218-V221 PolarHBondContact O-N 2.98Å; P219-V221 PolarHBondContact O-N 3.32Å; P219-V221 VanDerWaalsContact O-N 3.16Å; V221-R250 PolarHBondContact O-NE 3.49Å; V221-R250 PolarHBondContact O-NH2 3.27Å
222	F	84.4	Confident	77.7	Confident	13 Å²	13	27.3 Å²	27.3	6%	0.057	17%	0.174	C	C	.	.			trans	-129	11.8	-172	-60.7	-90.6	0	0	0	113.6	G220 R250 S282 F283 Y285 I290	G220-F222 WeakPolarHBondContact O-CD2 3.38Å; G220-F222 WeakPolarHBondContact O-CE2 3.49Å; F222-R250 VanDerWaalsContact CE1-CZ 3.43Å; F222-R250 VanDerWaalsContact CE1-NH1 3.34Å; F222-S282 CarbonylContact O-C 3.58Å; F222-S282 WeakPolarHBondContact O-CA 3.41Å; F222-S282 WeakPolarHBondContact O-CB 3.43Å; F222-F283 HydrophobicContact CB-CB 4.28Å; F222-F283 HydrophobicContact CD1-CB 4.16Å; F222-F283 PolarHBondContact O-N 3.22Å; F222-Y285 HydrophobicContact CB-CD1 3.54Å; F222-Y285 HydrophobicContact CB-CE1 4.13Å; F222-Y285 HydrophobicContact CB-CG 4.25Å; F222-Y285 HydrophobicContact CD1-CD1 4.29Å; F222-Y285 HydrophobicContact CD1-CG 4.23Å; F222-Y285 HydrophobicContact CD2-CD1 4.09Å; F222-Y285 HydrophobicContact CD2-CG 4.04Å; F222-Y285 AromaticContact CG-CD1 3.71Å; F222-Y285 HydrophobicContact CG-CD1 3.71Å; F222-Y285 AromaticContact CG-CG 3.9Å; F222-Y285 HydrophobicContact CG-CG 3.9Å; F222-I290 HydrophobicContact CE2-CD1 4.24Å; F222-I290 HydrophobicContact CE2-CG1 3.71Å; F222-I290 HydrophobicContact CZ-CG1 4.16Å
223	T	85.1	Confident	78.1	Confident	80 Å²	80	30.2 Å²	30.2	49%	0.491	19%	0.192	S	C	.	.	B	Isolated β-bridge	trans	-124.1	135.7	176.6	-48.1	0	0	0	0	108.7	I281	T223-I281 WeakPolarHBondContact CG2-O 3.44Å
224	C	84	Confident	78.2	Confident	10 Å²	10	30.5 Å²	30.5	7%	0.068	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-74	153.1	175.5	-70.6	0	0	0	0	111.9	F228 C252 I281	C224-F228 HydrophobicContact CB-CB 4.01Å; C224-C252 WeakPolarHBondContact CA-SG 3.32Å; C224-C252 HydrophobicContact CB-CB 3.76Å; C224-C252 WeakPolarHBondContact CB-SG 3.22Å; C224-C252 WeakPolarHBondContact SG-CB 3.26Å; C224-C252 CovalentContact SG-SG 2.04Å; C224-C252 PolarHBondContact SG-SG 2.95Å; C224-I281 PolarHBondContact N-O 2.04Å
225	P	77.8	Confident	77.5	Confident	50 Å²	50	36.3 Å²	36.3	33%	0.325	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-59.5	153.7	169.7	-21.2	33.4	0	0	0	111.8	Y215 G227 F228	Y215-P225 HydrophobicContact CD1-CG 3.92Å; Y215-P225 HydrophobicContact CE1-CG 3.66Å; P225-G227 PolarHBondContact O-N 2.89Å; P225-F228 HydrophobicContact CB-CD2 4.18Å; P225-F228 WeakPolarHBondContact O-CB 3.45Å; P225-F228 PolarHBondContact O-N 2.85Å
226	S	76.4	Confident	76.6	Confident	70 Å²	70	43.9 Å²	43.9	49%	0.49	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	129.8	176.8	-26	0	0	0	0	110.6	E455	S226-E455 WeakPolarHBondContact CB-OE1 3.25Å; S226-E455 PolarHBondContact OG-OE1 3.48Å
227	G	73.1	Confident	75.4	Confident	45 Å²	45	43 Å²	43	46%	0.464	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	0.9	-174.7	0	0	0	0	0	115.5	P225 I255	P225-G227 PolarHBondContact O-N 2.89Å; G227-I255 WeakPolarHBondContact O-CB 3.01Å; G227-I255 WeakPolarHBondContact O-CG2 2.91Å; G227-I255 PolarHBondContact O-N 3.03Å
228	F	82.3	Confident	74.2	Confident	9 Å²	9	47.6 Å²	47.6	4%	0.039	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	152.3	175.3	-67.9	-105.5	0	0	0	111.8	P116 W121 C224 P225 C252 L253 P254	P116-F228 HydrophobicContact CB-CE2 4.13Å; P116-F228 HydrophobicContact CB-CZ 4.44Å; P116-F228 HydrophobicContact CG-CE2 4.18Å; P116-F228 HydrophobicContact CG-CZ 4.07Å; W121-F228 AromaticContact CH2-CE1 3.93Å; W121-F228 HydrophobicContact CH2-CE1 3.93Å; W121-F228 AromaticContact CH2-CZ 3.98Å; W121-F228 HydrophobicContact CH2-CZ 3.98Å; W121-F228 HydrophobicContact CZ2-CE1 4.02Å; W121-F228 AromaticContact CZ2-CZ 3.62Å; W121-F228 HydrophobicContact CZ2-CZ 3.62Å; C224-F228 HydrophobicContact CB-CB 4.01Å; P225-F228 HydrophobicContact CB-CD2 4.18Å; P225-F228 WeakPolarHBondContact O-CB 3.45Å; P225-F228 PolarHBondContact O-N 2.85Å; F228-C252 HydrophobicContact CB-CB 3.97Å; F228-C252 HydrophobicContact CD1-CB 4.25Å; F228-C252 HydrophobicContact CG-CB 4.43Å; F228-L253 CarbonylContact C-O 3.42Å; F228-L253 WeakPolarHBondContact CA-O 3.17Å; F228-L253 WeakPolarHBondContact CB-O 3.45Å; F228-L253 WeakPolarHBondContact CD1-O 3.38Å; F228-P254 HydrophobicContact CD1-CG 4.33Å; F228-P254 HydrophobicContact CE1-CB 4.37Å; F228-P254 HydrophobicContact CE1-CG 3.76Å; F228-P254 HydrophobicContact CZ-CG 4.33Å
229	F	87.9	Confident	73.1	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	157.1	170.1	77.7	-87.8	0	0	0	110.7	C252 L253 P254 L257 W258 D271 P279 P280	F229-C252 CarbonylContact O-C 3.38Å; F229-C252 WeakPolarHBondContact O-CA 3.47Å; F229-L253 HydrophobicContact CD1-CB 4.15Å; F229-L253 WeakPolarHBondContact CD1-O 3.49Å; F229-L253 HydrophobicContact CE1-CB 3.55Å; F229-L253 HydrophobicContact CE2-CB 4.42Å; F229-L253 HydrophobicContact CZ-CB 3.71Å; F229-L253 HydrophobicContact CZ-CD1 4.13Å; F229-L253 HydrophobicContact CZ-CG 4.42Å; F229-L253 PolarHBondContact N-O 3.06Å; F229-L253 PolarHBondContact O-N 3Å; F229-P254 WeakPolarHBondContact CD1-O 3.26Å; F229-P254 VanDerWaalsContact CE1-O 3.3Å; F229-P254 WeakPolarHBondContact CE1-O 3.38Å; F229-L257 HydrophobicContact CE1-CB 4.29Å; F229-W258 HydrophobicContact CD1-CB 4.17Å; F229-W258 HydrophobicContact CD1-CE3 4.48Å; F229-W258 AromaticContact CD2-CE3 3.48Å; F229-W258 HydrophobicContact CD2-CE3 3.48Å; F229-W258 VanDerWaalsContact CD2-CE3 3.48Å; F229-W258 AromaticContact CD2-CZ3 3.89Å; F229-W258 HydrophobicContact CD2-CZ3 3.89Å; F229-W258 HydrophobicContact CE1-CB 4.06Å; F229-W258 AromaticContact CE2-CE3 3.57Å; F229-W258 HydrophobicContact CE2-CE3 3.57Å; F229-W258 HydrophobicContact CE2-CZ3 4.03Å; F229-W258 AromaticContact CG-CE3 3.97Å; F229-W258 HydrophobicContact CG-CE3 3.97Å; F229-W258 HydrophobicContact CZ-CB 4.48Å; F229-W258 HydrophobicContact CZ-CE3 4.1Å; F229-D271 HydrophobicContact CE2-CB 3.75Å; F229-D271 HydrophobicContact CZ-CB 3.59Å; F229-P279 HydrophobicContact CB-CB 3.63Å; F229-P279 HydrophobicContact CG-CB 4.36Å; F229-P280 CarbonylContact C-O 3.51Å; F229-P280 VanDerWaalsContact CA-O 3.25Å; F229-P280 WeakPolarHBondContact CA-O 3.45Å; F229-P280 WeakPolarHBondContact CB-O 3.4Å
230	A	89.2	Confident	71.8	Confident	3 Å²	3	53.1 Å²	53.1	3%	0.025	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	127.3	178.1	0	0	0	0	0	111.1	I251 P280 F283	A230-I251 WeakPolarHBondContact CA-O 3.44Å; A230-P280 PolarHBondContact N-O 3.41Å; A230-P280 WeakPolarHBondContact O-CG 3.29Å; A230-F283 HydrophobicContact CB-CD1 4.36Å; A230-F283 HydrophobicContact CB-CD2 4.09Å; A230-F283 HydrophobicContact CB-CE1 3.94Å; A230-F283 HydrophobicContact CB-CE2 3.56Å; A230-F283 HydrophobicContact CB-CG 4.46Å; A230-F283 HydrophobicContact CB-CZ 3.48Å; A230-F283 VanDerWaalsContact CB-CZ 3.48Å
231	C	88.1	Confident	70.4	Confident	4 Å²	4	59.9 Å²	59.9	3%	0.027	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-67.3	168.2	160.3	-63.3	0	0	0	0	110.7	I251 C265 S270 F283	C231-I251 HydrophobicContact CB-CB 4.36Å; C231-I251 PolarHBondContact N-O 2.97Å; C231-C265 WeakPolarHBondContact CA-SG 3.09Å; C231-C265 HydrophobicContact CB-CB 3.76Å; C231-C265 WeakPolarHBondContact CB-SG 3.43Å; C231-C265 VanDerWaalsContact SG-CA 3.52Å; C231-C265 WeakPolarHBondContact SG-CB 3.03Å; C231-C265 CovalentContact SG-SG 2.04Å; C231-C265 PolarHBondContact SG-SG 3.47Å; C231-S270 WeakPolarHBondContact CA-OG 3.23Å; C231-F283 WeakPolarHBondContact O-CE1 3.41Å
232	D	84.6	Confident	68.5	Low	84 Å²	84	65 Å²	65	45%	0.449	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-61.3	146.9	167.2	-88.6	-30.1	0	0	0	112.2	S268 S270	D232-S268 PolarHBondContact OD2-OG 2.92Å; D232-S270 PolarHBondContact N-OG 3Å
233	T	75.5	Confident	66.5	Low	64 Å²	64	66.1 Å²	66.1	39%	0.393	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-70.3	145.5	173.7	52.4	0	0	0	0	111.7	R250 F283	T233-R250 HydrophobicContact CG2-CG 4.28Å; T233-F283 HydrophobicContact CG2-CB 4.48Å; T233-F283 HydrophobicContact CG2-CD1 3.45Å; T233-F283 VanDerWaalsContact CG2-CD1 3.45Å; T233-F283 HydrophobicContact CG2-CE1 4.08Å; T233-F283 HydrophobicContact CG2-CG 4.36Å
234	F	69.7	Low	64.4	Low	12 Å²	12	66 Å²	66	5%	0.053	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-142.4	147.2	168.8	53.4	-90.1	0	0	0	112.6	M182 I237 P248 Y249 I251 P266 I267	M182-F234 HydrophobicContact CE-CZ 4.22Å; F234-I237 HydrophobicContact CD2-CB 4.37Å; F234-I237 HydrophobicContact CD2-CD1 4.2Å; F234-I237 HydrophobicContact CD2-CG1 3.85Å; F234-I237 HydrophobicContact CE1-CD1 4.16Å; F234-I237 HydrophobicContact CE2-CB 3.78Å; F234-I237 HydrophobicContact CE2-CD1 3.29Å; F234-I237 HydrophobicContact CE2-CG1 3.33Å; F234-I237 HydrophobicContact CZ-CD1 3.27Å; F234-I237 HydrophobicContact CZ-CG1 3.88Å; F234-P248 WeakPolarHBondContact O-CA 3.24Å; F234-Y249 HydrophobicContact CD2-CD2 4.19Å; F234-Y249 HydrophobicContact CD2-CG 4.11Å; F234-Y249 HydrophobicContact CE2-CD1 4.02Å; F234-Y249 AromaticContact CE2-CD2 3.86Å; F234-Y249 HydrophobicContact CE2-CD2 3.86Å; F234-Y249 AromaticContact CE2-CG 3.41Å; F234-Y249 HydrophobicContact CE2-CG 3.41Å; F234-Y249 VanDerWaalsContact CE2-CG 3.41Å; F234-Y249 HydrophobicContact CZ-CD1 4.3Å; F234-Y249 AromaticContact CZ-CG 3.88Å; F234-Y249 HydrophobicContact CZ-CG 3.88Å; F234-Y249 PolarHBondContact O-N 3.17Å; F234-I251 HydrophobicContact CE1-CD1 3.89Å; F234-I251 HydrophobicContact CZ-CD1 3.63Å; F234-P266 HydrophobicContact CE1-CG 3.87Å; F234-P266 HydrophobicContact CZ-CG 4.04Å; F234-I267 HydrophobicContact CB-CB 4.47Å; F234-I267 HydrophobicContact CB-CD1 3.68Å; F234-I267 HydrophobicContact CB-CG1 4.42Å; F234-I267 HydrophobicContact CD1-CB 4.11Å; F234-I267 HydrophobicContact CD1-CD1 4.32Å; F234-I267 HydrophobicContact CD1-CG1 4.26Å; F234-I267 HydrophobicContact CD2-CD1 4.14Å; F234-I267 HydrophobicContact CG-CB 4.42Å; F234-I267 HydrophobicContact CG-CD1 3.78Å; F234-I267 HydrophobicContact CG-CG1 4.22Å
235	D	57.3	Low	62.7	Low	122 Å²	122	66.6 Å²	66.6	65%	0.652	35%	0.352	S	S	*	.	S	Bend	trans	-84.2	-18.2	-178.2	-59.1	-35.4	0	0	0	112.9
236	K	54.4	Low	61.7	Low	176 Å²	176	72.1 Å²	72.1	77%	0.765	37%	0.374	S	S	*	.			trans	-147.5	127.6	-179.8	-63.1	-171.9	-179	-175.5	0	112.6
237	I	54	Low	61.2	Low	23 Å²	23	69.7 Å²	69.7	12%	0.118	35%	0.354	C	S	.	.			trans	-112.2	162.2	147.6	-93.4	175.4	0	0	0	107.3	M182 F234 E239 P266 I267	M182-I237 HydrophobicContact CB-CG2 3.99Å; M182-I237 HydrophobicContact CE-CD1 3.48Å; M182-I237 VanDerWaalsContact CE-CD1 3.48Å; M182-I237 HydrophobicContact SD-CD1 4.32Å; F234-I237 HydrophobicContact CD2-CB 4.37Å; F234-I237 HydrophobicContact CD2-CD1 4.2Å; F234-I237 HydrophobicContact CD2-CG1 3.85Å; F234-I237 HydrophobicContact CE1-CD1 4.16Å; F234-I237 HydrophobicContact CE2-CB 3.78Å; F234-I237 HydrophobicContact CE2-CD1 3.29Å; F234-I237 HydrophobicContact CE2-CG1 3.33Å; F234-I237 HydrophobicContact CZ-CD1 3.27Å; F234-I237 HydrophobicContact CZ-CG1 3.88Å; I237-E239 PolarHBondContact O-N 2.81Å; I237-P266 HydrophobicContact CD1-CB 3.69Å; I237-P266 HydrophobicContact CD1-CG 3.78Å; I237-I267 HydrophobicContact CG1-CD1 4.43Å
238	N	49.4	Very low	61	Low	101 Å²	101	68.9 Å²	68.9	54%	0.54	34%	0.34	S	S	.	.			trans	-71.9	58.8	171.9	-66.5	-27.3	0	0	0	111.8	Y179 R240	Y179-N238 PolarHBondContact OH-ND2 3.33Å; N238-R240 PolarHBondContact O-N 3.04Å; N238-R240 VanDerWaalsContact O-N 3.14Å
239	E	46.5	Very low	60.6	Low	37 Å²	37	69.1 Å²	69.1	17%	0.173	34%	0.341	C	S	.	.			trans	-62.9	112.9	165.3	-81.7	-164.7	163.4	0	0	108.1	P184 R216 I237 R241 Y249	P184-E239 WeakPolarHBondContact CG-OE1 3.49Å; R216-E239 IonicContact NH1-OE1 3.25Å; R216-E239 PolarHBondContact NH1-OE1 2.02Å; I237-E239 PolarHBondContact O-N 2.81Å; E239-R241 PolarHBondContact O-N 3.36Å; E239-R241 VanDerWaalsContact O-N 3.12Å; E239-Y249 HydrophobicContact CG-CE1 4.39Å; E239-Y249 VanDerWaalsContact OE1-CE1 3.28Å; E239-Y249 WeakPolarHBondContact OE1-CE1 3.3Å; E239-Y249 PolarHBondContact OE1-OH 3.07Å; E239-Y249 PolarHBondContact OE2-OH 3.5Å
240	R	40.8	Very low	60.3	Low	134 Å²	134	69.3 Å²	69.3	51%	0.506	34%	0.342	S	S	.	.	S	Bend	trans	-67.8	-6.5	-179.2	-81	-165.2	-179.3	-164.1	-7.4	114.5	L164 E166 N238	L164-R240 HydrophobicContact CD2-CB 3.68Å; L164-R240 VanDerWaalsContact O-CD 3.23Å; L164-R240 WeakPolarHBondContact O-CD 3.06Å; L164-R240 PolarHBondContact O-NE 2.94Å; E166-R240 PolarHBondContact O-NH2 3.21Å; N238-R240 PolarHBondContact O-N 3.04Å; N238-R240 VanDerWaalsContact O-N 3.14Å
241	R	41.2	Very low	60	Low	161 Å²	161	69.2 Å²	69.2	61%	0.608	34%	0.341	S	S	*	.	S	Bend	trans	-102.8	130.8	166.9	-56.9	-174.9	-169.8	-162.6	4.3	107.1	T162 E239 S243	T162-R241 PolarHBondContact OG1-NH2 3.29Å; E239-R241 PolarHBondContact O-N 3.36Å; E239-R241 VanDerWaalsContact O-N 3.12Å; R241-S243 VanDerWaalsContact C-N 3.31Å; R241-S243 PolarHBondContact O-N 3.27Å
242	N	37.5	Very low	59.8	Low	167 Å²	167	69 Å²	69	89%	0.893	34%	0.34	S	S	*	.			trans	-62.7	94.9	167.6	-80.9	-27.4	0	0	0	108.7	P244	N242-P244 WeakPolarHBondContact O-CD 3.2Å
243	S	42.7	Very low	59.6	Low	37 Å²	37	65 Å²	65	26%	0.259	32%	0.318	S	S	.	.			trans	-55.9	122.7	164.7	172.9	0	0	0	0	107.8	R241 L245	R241-S243 VanDerWaalsContact C-N 3.31Å; R241-S243 PolarHBondContact O-N 3.27Å; S243-L245 PolarHBondContact O-N 2.82Å; S243-L245 WeakPolarHBondContact OG-CB 3.01Å; S243-L245 PolarHBondContact OG-N 3.01Å; S243-L245 VanDerWaalsContact OG-N 3.12Å; S243-L245 PolarHBondContact OG-O 3.16Å
244	P	39.3	Very low	59.6	Low	77 Å²	77	62.1 Å²	62.1	50%	0.5	30%	0.3	S	S	.	.	S	Bend	trans	-67.5	-2.8	172.3	27.3	-31.3	0	0	0	112.1	N242 V300	N242-P244 WeakPolarHBondContact O-CD 3.2Å; P244-V300 HydrophobicContact CB-CG2 4.18Å; P244-V300 HydrophobicContact CG-CG1 4.29Å
245	L	49.2	Very low	60	Low	23 Å²	23	65.6 Å²	65.6	12%	0.12	32%	0.318	C	S	.	.			trans	-116.3	96.8	-170.6	-61.3	161.5	0	0	0	108.5	S243 W247 V300	S243-L245 PolarHBondContact O-N 2.82Å; S243-L245 WeakPolarHBondContact OG-CB 3.01Å; S243-L245 PolarHBondContact OG-N 3.01Å; S243-L245 VanDerWaalsContact OG-N 3.12Å; S243-L245 PolarHBondContact OG-O 3.16Å; L245-W247 HydrophobicContact CB-CD2 4.12Å; L245-W247 HydrophobicContact CB-CE3 3.98Å; L245-W247 HydrophobicContact CB-CH2 3.88Å; L245-W247 HydrophobicContact CB-CZ2 4.02Å; L245-W247 HydrophobicContact CB-CZ3 3.89Å; L245-W247 HydrophobicContact CD1-CH2 3.46Å; L245-W247 VanDerWaalsContact CD1-CH2 3.46Å; L245-W247 HydrophobicContact CD1-CZ2 3.94Å; L245-W247 HydrophobicContact CD1-CZ3 4.05Å; L245-W247 HydrophobicContact CD2-CE3 4.12Å; L245-W247 HydrophobicContact CD2-CH2 3.83Å; L245-W247 HydrophobicContact CD2-CZ3 3.47Å; L245-W247 VanDerWaalsContact CD2-CZ3 3.47Å; L245-W247 HydrophobicContact CG-CH2 3.88Å; L245-W247 HydrophobicContact CG-CZ2 4.42Å; L245-W247 HydrophobicContact CG-CZ3 3.97Å; L245-W247 PolarHBondContact O-N 2.83Å; L245-V300 HydrophobicContact CD1-CG1 4.43Å; L245-V300 HydrophobicContact CD2-CB 3.7Å; L245-V300 HydrophobicContact CD2-CG1 3.97Å; L245-V300 HydrophobicContact CD2-CG2 3.52Å; L245-V300 HydrophobicContact CG-CG1 4.32Å; L245-V300 HydrophobicContact CG-CG2 4.29Å
246	Q	57.1	Low	60.7	Low	166 Å²	166	62.5 Å²	62.5	78%	0.776	30%	0.297	S	S	*	.			trans	-86.3	32.4	-176.6	-55.7	178.6	-10.4	0	0	113.1	M296	Q246-M296 HydrophobicContact CB-CE 3.87Å
247	W	65.3	Low	61.7	Low	19 Å²	19	54.1 Å²	54.1	7%	0.072	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-81.2	151.3	176	58.4	61.1	0	0	0	111.2	P219 L245 E293 L297	P219-W247 HydrophobicContact CB-CE3 4.38Å; P219-W247 HydrophobicContact CB-CH2 4.42Å; P219-W247 HydrophobicContact CB-CZ3 4.18Å; P219-W247 HydrophobicContact CG-CD2 3.93Å; P219-W247 HydrophobicContact CG-CE3 3.67Å; P219-W247 HydrophobicContact CG-CH2 3.1Å; P219-W247 HydrophobicContact CG-CZ2 3.39Å; P219-W247 HydrophobicContact CG-CZ3 3.23Å; L245-W247 HydrophobicContact CB-CD2 4.12Å; L245-W247 HydrophobicContact CB-CE3 3.98Å; L245-W247 HydrophobicContact CB-CH2 3.88Å; L245-W247 HydrophobicContact CB-CZ2 4.02Å; L245-W247 HydrophobicContact CB-CZ3 3.89Å; L245-W247 HydrophobicContact CD1-CH2 3.46Å; L245-W247 VanDerWaalsContact CD1-CH2 3.46Å; L245-W247 HydrophobicContact CD1-CZ2 3.94Å; L245-W247 HydrophobicContact CD1-CZ3 4.05Å; L245-W247 HydrophobicContact CD2-CE3 4.12Å; L245-W247 HydrophobicContact CD2-CH2 3.83Å; L245-W247 HydrophobicContact CD2-CZ3 3.47Å; L245-W247 VanDerWaalsContact CD2-CZ3 3.47Å; L245-W247 HydrophobicContact CG-CH2 3.88Å; L245-W247 HydrophobicContact CG-CZ2 4.42Å; L245-W247 HydrophobicContact CG-CZ3 3.97Å; L245-W247 PolarHBondContact O-N 2.83Å; W247-E293 HydrophobicContact CB-CG 4Å; W247-L297 HydrophobicContact CH2-CD1 4.04Å; W247-L297 HydrophobicContact CZ3-CB 4.07Å; W247-L297 HydrophobicContact CZ3-CD1 4.09Å
248	P	69.9	Low	63.1	Low	27 Å²	27	54.7 Å²	54.7	18%	0.175	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-59.5	141.6	178.7	-22.9	33.5	0	0	0	111.9	F234 R250	F234-P248 WeakPolarHBondContact O-CA 3.24Å; P248-R250 PolarHBondContact O-N 2.61Å
249	Y	74.1	Confident	64.8	Low	14 Å²	14	51.4 Å²	51.4	6%	0.055	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-75	129.9	178	-73.5	-109.4	0	0	0	109	M182 R216 F234 E239	M182-Y249 HydrophobicContact SD-CD1 4.07Å; M182-Y249 HydrophobicContact SD-CE1 4.42Å; R216-Y249 PolarHBondContact NH2-OH 3.37Å; R216-Y249 VanDerWaalsContact NH2-OH 3.07Å; F234-Y249 HydrophobicContact CD2-CD2 4.19Å; F234-Y249 HydrophobicContact CD2-CG 4.11Å; F234-Y249 HydrophobicContact CE2-CD1 4.02Å; F234-Y249 AromaticContact CE2-CD2 3.86Å; F234-Y249 HydrophobicContact CE2-CD2 3.86Å; F234-Y249 AromaticContact CE2-CG 3.41Å; F234-Y249 HydrophobicContact CE2-CG 3.41Å; F234-Y249 VanDerWaalsContact CE2-CG 3.41Å; F234-Y249 HydrophobicContact CZ-CD1 4.3Å; F234-Y249 AromaticContact CZ-CG 3.88Å; F234-Y249 HydrophobicContact CZ-CG 3.88Å; F234-Y249 PolarHBondContact O-N 3.17Å; E239-Y249 HydrophobicContact CG-CE1 4.39Å; E239-Y249 VanDerWaalsContact OE1-CE1 3.28Å; E239-Y249 WeakPolarHBondContact OE1-CE1 3.3Å; E239-Y249 PolarHBondContact OE1-OH 3.07Å; E239-Y249 PolarHBondContact OE2-OH 3.5Å
250	R	81.6	Confident	66.2	Low	5 Å²	5	51.5 Å²	51.5	2%	0.019	25%	0.248	C	C	.	.			trans	-122.9	110.3	177.7	-72.3	-170.3	-64.8	-86.4	10.4	108.2	L217 P218 V221 F222 T233 P248 F283 E293	L217-R250 HydrophobicContact CB-CB 3.87Å; L217-R250 HydrophobicContact CD1-CB 4.18Å; L217-R250 HydrophobicContact CG-CB 4.24Å; L217-R250 PolarHBondContact N-O 3.36Å; P218-R250 PolarHBondContact O-NH2 3.36Å; P218-R250 VanDerWaalsContact O-NH2 3.08Å; V221-R250 PolarHBondContact O-NE 3.49Å; V221-R250 PolarHBondContact O-NH2 3.27Å; F222-R250 VanDerWaalsContact CE1-CZ 3.43Å; F222-R250 VanDerWaalsContact CE1-NH1 3.34Å; T233-R250 HydrophobicContact CG2-CG 4.28Å; P248-R250 PolarHBondContact O-N 2.61Å; R250-F283 HydrophobicContact CB-CD1 4.27Å; R250-F283 HydrophobicContact CB-CD2 4.05Å; R250-F283 HydrophobicContact CB-CE1 3.91Å; R250-F283 HydrophobicContact CB-CE2 3.75Å; R250-F283 HydrophobicContact CB-CG 4.31Å; R250-F283 HydrophobicContact CB-CZ 3.67Å; R250-F283 HydrophobicContact CG-CB 4.48Å; R250-F283 HydrophobicContact CG-CD1 3.79Å; R250-F283 HydrophobicContact CG-CD2 4.02Å; R250-F283 HydrophobicContact CG-CE1 3.89Å; R250-F283 HydrophobicContact CG-CE2 4.19Å; R250-F283 HydrophobicContact CG-CG 3.82Å; R250-F283 HydrophobicContact CG-CZ 4.12Å; R250-E293 IonicContact CZ-OE1 2.64Å; R250-E293 IonicContact CZ-OE2 3.54Å; R250-E293 IonicContact NH1-OE1 2.76Å; R250-E293 PolarHBondContact NH1-OE1 2.86Å; R250-E293 IonicContact NH1-OE2 3Å; R250-E293 IonicContact NH2-OE1 3.59Å; R250-E293 PolarHBondContact NH2-OE1 2.96Å; R250-E293 IonicContact NH2-OE2 3.64Å; R250-E293 PolarHBondContact NH2-OE2 2.91Å
251	I	82.7	Confident	67.9	Low	1 Å²	1	52 Å²	52	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.7	-169.7	-67.7	178.5	0	0	0	109.9	I126 I128 M182 A230 C231 F234 L253 P266 F283	I126-I251 HydrophobicContact CD1-CB 4.31Å; I126-I251 HydrophobicContact CD1-CD1 3.54Å; I126-I251 HydrophobicContact CD1-CG1 3.61Å; I126-I251 HydrophobicContact CD1-CG2 3.87Å; I128-I251 HydrophobicContact CD1-CD1 4.44Å; I128-I251 HydrophobicContact CD1-CG2 4.15Å; M182-I251 HydrophobicContact CE-CD1 3.19Å; M182-I251 HydrophobicContact SD-CD1 3.81Å; A230-I251 WeakPolarHBondContact CA-O 3.44Å; C231-I251 HydrophobicContact CB-CB 4.36Å; C231-I251 PolarHBondContact N-O 2.97Å; F234-I251 HydrophobicContact CE1-CD1 3.89Å; F234-I251 HydrophobicContact CZ-CD1 3.63Å; I251-L253 HydrophobicContact CG2-CD2 3.97Å; I251-L253 HydrophobicContact CG2-CG 4.12Å; I251-P266 HydrophobicContact CD1-CG 3.91Å; I251-F283 VanDerWaalsContact N-CZ 3.3Å; I251-F283 WeakPolarHBondContact O-CZ 3.29Å
252	C	83.4	Confident	69.4	Low	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	121.7	174.8	-61.2	0	0	0	0	109.3	Y215 L217 C224 F228 F229	Y215-C252 HydrophobicContact CD1-CB 4.24Å; Y215-C252 PolarHBondContact N-O 3.27Å; Y215-C252 PolarHBondContact O-N 3.35Å; L217-C252 VanDerWaalsContact CD2-SG 3.58Å; C224-C252 WeakPolarHBondContact CA-SG 3.32Å; C224-C252 HydrophobicContact CB-CB 3.76Å; C224-C252 WeakPolarHBondContact CB-SG 3.22Å; C224-C252 WeakPolarHBondContact SG-CB 3.26Å; C224-C252 CovalentContact SG-SG 2.04Å; C224-C252 PolarHBondContact SG-SG 2.95Å; F228-C252 HydrophobicContact CB-CB 3.97Å; F228-C252 HydrophobicContact CD1-CB 4.25Å; F228-C252 HydrophobicContact CG-CB 4.43Å; F229-C252 CarbonylContact O-C 3.38Å; F229-C252 WeakPolarHBondContact O-CA 3.47Å
253	L	80.6	Confident	71.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	152.5	174.2	-65	-171.9	0	0	0	110.5	I128 T212 F228 F229 I251 N264	I128-L253 HydrophobicContact CD1-CD2 4.1Å; T212-L253 HydrophobicContact CG2-CD1 4.38Å; T212-L253 HydrophobicContact CG2-CD2 3.96Å; F228-L253 CarbonylContact C-O 3.42Å; F228-L253 WeakPolarHBondContact CA-O 3.17Å; F228-L253 WeakPolarHBondContact CB-O 3.45Å; F228-L253 WeakPolarHBondContact CD1-O 3.38Å; F229-L253 HydrophobicContact CD1-CB 4.15Å; F229-L253 WeakPolarHBondContact CD1-O 3.49Å; F229-L253 HydrophobicContact CE1-CB 3.55Å; F229-L253 HydrophobicContact CE2-CB 4.42Å; F229-L253 HydrophobicContact CZ-CB 3.71Å; F229-L253 HydrophobicContact CZ-CD1 4.13Å; F229-L253 HydrophobicContact CZ-CG 4.42Å; F229-L253 PolarHBondContact N-O 3.06Å; F229-L253 PolarHBondContact O-N 3Å; I251-L253 HydrophobicContact CG2-CD2 3.97Å; I251-L253 HydrophobicContact CG2-CG 4.12Å; L253-N264 HydrophobicContact CD1-CB 3.67Å
254	P	75.8	Confident	72.9	Confident	2 Å²	2	38 Å²	38	1%	0.013	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	139.7	177.5	-22.8	32.4	0	0	0	111.8	S58 F228 F229 R256 L257	S58-P254 WeakPolarHBondContact O-CG 3.42Å; F228-P254 HydrophobicContact CD1-CG 4.33Å; F228-P254 HydrophobicContact CE1-CB 4.37Å; F228-P254 HydrophobicContact CE1-CG 3.76Å; F228-P254 HydrophobicContact CZ-CG 4.33Å; F229-P254 WeakPolarHBondContact CD1-O 3.26Å; F229-P254 VanDerWaalsContact CE1-O 3.3Å; F229-P254 WeakPolarHBondContact CE1-O 3.38Å; P254-R256 PolarHBondContact O-N 3.29Å; P254-L257 HydrophobicContact CG-CD1 4.44Å; P254-L257 PolarHBondContact O-N 3.1Å
255	I	77.6	Confident	75	Confident	85 Å²	85	34.4 Å²	34.4	44%	0.436	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-1.7	-177.8	-157.5	166.2	0	0	0	115.5	G227 P279	G227-I255 WeakPolarHBondContact O-CB 3.01Å; G227-I255 WeakPolarHBondContact O-CG2 2.91Å; G227-I255 PolarHBondContact O-N 3.03Å; I255-P279 HydrophobicContact CD1-CG 4.2Å; I255-P279 HydrophobicContact CG1-CB 4.43Å; I255-P279 HydrophobicContact CG1-CG 3.96Å
256	R	71.7	Confident	76	Confident	57 Å²	57	33.5 Å²	33.5	22%	0.215	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-8.7	178.3	-41.9	-174.3	-147.1	171.7	17	113.7	H59 Y109 L112 P254 W258	H59-R256 PolarHBondContact CD2-NH2 3.16Å; H59-R256 VanDerWaalsContact CD2-NH2 3.27Å; H59-R256 PolarHBondContact NE2-NH2 3.44Å; Y109-R256 HydrophobicContact CD1-CB 3.91Å; Y109-R256 VanDerWaalsContact CD1-CD 3.49Å; Y109-R256 HydrophobicContact CD1-CG 4.37Å; Y109-R256 HydrophobicContact CE1-CB 3.58Å; Y109-R256 HydrophobicContact CE1-CG 4.47Å; Y109-R256 PolarHBondContact O-NH1 3.37Å; Y109-R256 PolarHBondContact O-NH2 3.48Å; Y109-R256 PolarHBondContact OH-O 2.96Å; L112-R256 VanDerWaalsContact CD1-NH1 3.34Å; P254-R256 PolarHBondContact O-N 3.29Å; R256-W258 VanDerWaalsContact C-N 3.33Å
257	L	76.6	Confident	76.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	-98.6	17.7	169.5	-51.2	-175.5	0	0	0	111.2	S61 Y109 T212 F229 P254 D260 N264	S61-L257 WeakPolarHBondContact OG-CD1 3.43Å; Y109-L257 HydrophobicContact CE2-CD2 3.94Å; T212-L257 HydrophobicContact CG2-CD1 3.47Å; T212-L257 VanDerWaalsContact CG2-CD1 3.47Å; F229-L257 HydrophobicContact CE1-CB 4.29Å; P254-L257 HydrophobicContact CG-CD1 4.44Å; P254-L257 PolarHBondContact O-N 3.1Å; L257-D260 WeakPolarHBondContact CD2-OD2 3.4Å; L257-N264 HydrophobicContact CB-CB 4.37Å; L257-N264 HydrophobicContact CD1-CB 4.38Å
258	W	82	Confident	76.6	Confident	36 Å²	36	31.1 Å²	31.1	14%	0.136	17%	0.166	C	C	.	.	S	Bend	trans	-94.5	115.9	171.8	177.4	-91.7	0	0	0	107.9	F229 R256 D260 S270 D271 Q273 P279 P280	F229-W258 HydrophobicContact CD1-CB 4.17Å; F229-W258 HydrophobicContact CD1-CE3 4.48Å; F229-W258 AromaticContact CD2-CE3 3.48Å; F229-W258 HydrophobicContact CD2-CE3 3.48Å; F229-W258 VanDerWaalsContact CD2-CE3 3.48Å; F229-W258 AromaticContact CD2-CZ3 3.89Å; F229-W258 HydrophobicContact CD2-CZ3 3.89Å; F229-W258 HydrophobicContact CE1-CB 4.06Å; F229-W258 AromaticContact CE2-CE3 3.57Å; F229-W258 HydrophobicContact CE2-CE3 3.57Å; F229-W258 HydrophobicContact CE2-CZ3 4.03Å; F229-W258 AromaticContact CG-CE3 3.97Å; F229-W258 HydrophobicContact CG-CE3 3.97Å; F229-W258 HydrophobicContact CZ-CB 4.48Å; F229-W258 HydrophobicContact CZ-CE3 4.1Å; R256-W258 VanDerWaalsContact C-N 3.33Å; W258-D260 PolarHBondContact O-N 2.7Å; W258-S270 WeakPolarHBondContact CH2-O 3.43Å; W258-S270 VanDerWaalsContact CZ3-O 3.24Å; W258-S270 WeakPolarHBondContact CZ3-O 3.18Å; W258-D271 HydrophobicContact CE3-CB 4.47Å; W258-Q273 WeakPolarHBondContact CH2-O 3.48Å; W258-Q273 WeakPolarHBondContact CZ2-O 3.17Å; W258-P279 HydrophobicContact CB-CG 4.27Å; W258-P279 HydrophobicContact CD2-CB 3.8Å; W258-P279 HydrophobicContact CD2-CG 3.86Å; W258-P279 HydrophobicContact CE3-CB 4.06Å; W258-P279 HydrophobicContact CG-CB 4.06Å; W258-P279 HydrophobicContact CG-CG 3.66Å; W258-P280 HydrophobicContact CH2-CG 4.38Å; W258-P280 VanDerWaalsContact CZ3-CD 3.49Å; W258-P280 HydrophobicContact CZ3-CG 4.18Å
259	C	84.9	Confident	76.9	Confident	32 Å²	32	30.2 Å²	30.2	22%	0.216	16%	0.162	C	C	.	.	S	Bend	trans	55.9	45.1	-178.1	-57.6	0	0	0	0	113.7	N261 D271 E272 C275	C259-N261 VanDerWaalsContact C-N 3.28Å; C259-D271 PolarHBondContact N-O 2.79Å; C259-D271 PolarHBondContact SG-O 2.98Å; C259-E272 VanDerWaalsContact C-OE1 3.31Å; C259-E272 WeakPolarHBondContact CA-OE1 3.43Å; C259-C275 HydrophobicContact CB-CB 3.72Å; C259-C275 WeakPolarHBondContact CB-SG 3.26Å; C259-C275 WeakPolarHBondContact SG-CA 3.45Å; C259-C275 WeakPolarHBondContact SG-CB 3Å; C259-C275 CovalentContact SG-SG 2.02Å; C259-C275 PolarHBondContact SG-SG 3.31Å
260	D	77.2	Confident	77.4	Confident	38 Å²	38	30 Å²	30	20%	0.203	16%	0.162	C	C	.	.	S	Bend	trans	-85.7	-1.1	171.5	68.3	-3.8	0	0	0	112.6	L257 W258 V262 N264 E272	L257-D260 WeakPolarHBondContact CD2-OD2 3.4Å; W258-D260 PolarHBondContact O-N 2.7Å; D260-V262 WeakPolarHBondContact OD1-CA 3.39Å; D260-V262 WeakPolarHBondContact OD1-CB 3.49Å; D260-V262 WeakPolarHBondContact OD1-CG2 3.27Å; D260-V262 PolarHBondContact OD1-N 3.11Å; D260-N264 PolarHBondContact OD1-ND2 3.15Å; D260-N264 PolarHBondContact OD2-ND2 3.24Å; D260-E272 PolarHBondContact N-OE1 3.22Å
261	N	76.5	Confident	77.5	Confident	144 Å²	144	29.8 Å²	29.8	77%	0.77	16%	0.161	S	C	*	.	S	Bend	trans	75.9	25	-173.1	-47.2	-105	0	0	0	113.2	C259 E272	C259-N261 VanDerWaalsContact C-N 3.28Å; N261-E272 VanDerWaalsContact CA-CD 3.48Å; N261-E272 VanDerWaalsContact CA-OE1 3.31Å; N261-E272 WeakPolarHBondContact CA-OE1 3.13Å; N261-E272 WeakPolarHBondContact CA-OE2 3.31Å; N261-E272 PolarHBondContact N-OE1 2.66Å; N261-E272 PolarHBondContact N-OE2 3.11Å
262	V	72.3	Confident	77.7	Confident	17 Å²	17	32 Å²	32	10%	0.103	17%	0.172	C	C	.	.	S	Bend	trans	-128.9	139.2	-179.1	-168.8	0	0	0	0	109.2	I63 I210 D260 N264 E272	I63-V262 HydrophobicContact CD1-CG2 4Å; I210-V262 HydrophobicContact CB-CG1 4.28Å; I210-V262 HydrophobicContact CD1-CG1 3.47Å; I210-V262 VanDerWaalsContact CD1-CG1 3.47Å; I210-V262 HydrophobicContact CG1-CG1 3.57Å; I210-V262 HydrophobicContact CG2-CG1 3.89Å; D260-V262 WeakPolarHBondContact OD1-CA 3.39Å; D260-V262 WeakPolarHBondContact OD1-CB 3.49Å; D260-V262 WeakPolarHBondContact OD1-CG2 3.27Å; D260-V262 PolarHBondContact OD1-N 3.11Å; V262-N264 PolarHBondContact O-N 2.86Å; V262-N264 VanDerWaalsContact O-N 3.11Å; V262-N264 PolarHBondContact O-ND2 2.94Å; V262-E272 PolarHBondContact N-OE1 2.93Å; V262-E272 WeakPolarHBondContact O-CG 3.38Å
263	L	76.9	Confident	77.7	Confident	55 Å²	55	36 Å²	36	29%	0.288	19%	0.19	S	C	.	.			trans	-86.4	84.2	176.8	-49.3	170.3	0	0	0	108.8	P178 F180 E272	P178-L263 HydrophobicContact CB-CD1 4.45Å; P178-L263 HydrophobicContact CG-CD1 3.89Å; F180-L263 VanDerWaalsContact CE1-O 3.29Å; F180-L263 WeakPolarHBondContact CE1-O 3.34Å; F180-L263 HydrophobicContact CZ-CB 4.13Å; F180-L263 WeakPolarHBondContact CZ-O 3.2Å; L263-E272 HydrophobicContact CD2-CB 4.03Å; L263-E272 HydrophobicContact CD2-CG 3.83Å
264	N	76.2	Confident	78	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	22%	0.216	C	C	.	.			trans	-82.6	-33.7	177.1	-51.8	-89.2	0	0	0	111.3	S61 T212 L253 L257 D260 V262 D271	S61-N264 PolarHBondContact OG-OD1 3.45Å; T212-N264 HydrophobicContact CG2-CB 4.21Å; T212-N264 PolarHBondContact OG1-OD1 3.28Å; L253-N264 HydrophobicContact CD1-CB 3.67Å; L257-N264 HydrophobicContact CB-CB 4.37Å; L257-N264 HydrophobicContact CD1-CB 4.38Å; D260-N264 PolarHBondContact OD1-ND2 3.15Å; D260-N264 PolarHBondContact OD2-ND2 3.24Å; V262-N264 PolarHBondContact O-N 2.86Å; V262-N264 VanDerWaalsContact O-N 3.11Å; V262-N264 PolarHBondContact O-ND2 2.94Å; N264-D271 VanDerWaalsContact CA-OD2 3.23Å; N264-D271 WeakPolarHBondContact CA-OD2 3.28Å; N264-D271 WeakPolarHBondContact CB-OD2 3.5Å; N264-D271 PolarHBondContact N-OD2 2.93Å; N264-D271 PolarHBondContact ND2-OD2 3.07Å
265	C	82.7	Confident	78.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	-75.3	126.1	176.3	-77.8	0	0	0	0	111.8	C231 I267 S270 D271	C231-C265 WeakPolarHBondContact CA-SG 3.09Å; C231-C265 HydrophobicContact CB-CB 3.76Å; C231-C265 WeakPolarHBondContact CB-SG 3.43Å; C231-C265 VanDerWaalsContact SG-CA 3.52Å; C231-C265 WeakPolarHBondContact SG-CB 3.03Å; C231-C265 CovalentContact SG-SG 2.04Å; C231-C265 PolarHBondContact SG-SG 3.47Å; C265-I267 VanDerWaalsContact C-N 3.26Å; C265-I267 PolarHBondContact O-N 3.23Å; C265-I267 VanDerWaalsContact O-N 3.1Å; C265-S270 WeakPolarHBondContact CB-OG 3.45Å; C265-S270 PolarHBondContact SG-OG 3.25Å; C265-S270 VanDerWaalsContact SG-OG 3.37Å; C265-D271 HydrophobicContact CB-CB 4.21Å; C265-D271 WeakPolarHBondContact CB-OD1 3.3Å; C265-D271 PolarHBondContact N-OD1 3.46Å; C265-D271 PolarHBondContact N-OD2 3.4Å
266	P	71	Confident	78.6	Confident	4 Å²	4	45.1 Å²	45.1	3%	0.026	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-0.6	-160.9	32.8	-38.5	0	0	0	115.6	I128 F180 M182 F234 I237 I251	I128-P266 HydrophobicContact CD1-CG 4.22Å; I128-P266 HydrophobicContact CG2-CB 4.1Å; F180-P266 HydrophobicContact CB-CB 3.8Å; F180-P266 VanDerWaalsContact CD1-CA 3.48Å; F180-P266 HydrophobicContact CD1-CB 3.68Å; F180-P266 HydrophobicContact CD2-CB 4.41Å; F180-P266 WeakPolarHBondContact CD2-O 3.38Å; F180-P266 HydrophobicContact CE1-CB 4.32Å; F180-P266 HydrophobicContact CG-CB 3.72Å; F180-P266 WeakPolarHBondContact CG-O 3.45Å; M182-P266 HydrophobicContact CE-CB 4.23Å; M182-P266 HydrophobicContact CE-CG 3.71Å; F234-P266 HydrophobicContact CE1-CG 3.87Å; F234-P266 HydrophobicContact CZ-CG 4.04Å; I237-P266 HydrophobicContact CD1-CB 3.69Å; I237-P266 HydrophobicContact CD1-CG 3.78Å; I251-P266 HydrophobicContact CD1-CG 3.91Å
267	I	68.5	Low	79.1	Confident	69 Å²	69	48.8 Å²	48.8	35%	0.354	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.7	143	168.6	-73.3	-162.8	0	0	0	108.7	F234 I237 C265 G269	F234-I267 HydrophobicContact CB-CB 4.47Å; F234-I267 HydrophobicContact CB-CD1 3.68Å; F234-I267 HydrophobicContact CB-CG1 4.42Å; F234-I267 HydrophobicContact CD1-CB 4.11Å; F234-I267 HydrophobicContact CD1-CD1 4.32Å; F234-I267 HydrophobicContact CD1-CG1 4.26Å; F234-I267 HydrophobicContact CD2-CD1 4.14Å; F234-I267 HydrophobicContact CG-CB 4.42Å; F234-I267 HydrophobicContact CG-CD1 3.78Å; F234-I267 HydrophobicContact CG-CG1 4.22Å; I237-I267 HydrophobicContact CG1-CD1 4.43Å; C265-I267 VanDerWaalsContact C-N 3.26Å; C265-I267 PolarHBondContact O-N 3.23Å; C265-I267 VanDerWaalsContact O-N 3.1Å; I267-G269 PolarHBondContact O-N 2.76Å
268	S	66.6	Low	79.6	Confident	67 Å²	67	54.7 Å²	54.7	47%	0.469	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	-14.3	179.5	80.7	0	0	0	0	118.1	D232 S270 Q273	D232-S268 PolarHBondContact OD2-OG 2.92Å; S268-S270 VanDerWaalsContact C-N 3.33Å; S268-S270 PolarHBondContact OG-N 2.99Å; S268-Q273 PolarHBondContact O-NE2 3.19Å
269	G	75.5	Confident	79.8	Confident	8 Å²	8	54.4 Å²	54.4	8%	0.082	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	40.4	-170.1	0	0	0	0	0	111.9	I267 D271 E272 Q273	I267-G269 PolarHBondContact O-N 2.76Å; G269-D271 VanDerWaalsContact CA-OD1 3.29Å; G269-D271 WeakPolarHBondContact CA-OD1 3.35Å; G269-D271 PolarHBondContact O-N 2.96Å; G269-D271 VanDerWaalsContact O-N 3.08Å; G269-E272 PolarHBondContact O-N 3.39Å; G269-Q273 PolarHBondContact O-N 2.99Å
270	S	84.4	Confident	80	Confident	9 Å²	9	55.6 Å²	55.6	6%	0.063	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.1	-175.1	54.3	0	0	0	0	114	C231 D232 W258 C265 S268	C231-S270 WeakPolarHBondContact CA-OG 3.23Å; D232-S270 PolarHBondContact N-OG 3Å; W258-S270 WeakPolarHBondContact CH2-O 3.43Å; W258-S270 VanDerWaalsContact CZ3-O 3.24Å; W258-S270 WeakPolarHBondContact CZ3-O 3.18Å; C265-S270 WeakPolarHBondContact CB-OG 3.45Å; C265-S270 PolarHBondContact SG-OG 3.25Å; C265-S270 VanDerWaalsContact SG-OG 3.37Å; S268-S270 VanDerWaalsContact C-N 3.33Å; S268-S270 PolarHBondContact OG-N 2.99Å
271	D	83.7	Confident	80.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-25.1	173.8	51	-25.9	0	0	0	114.9	F229 W258 C259 N264 C265 G269	F229-D271 HydrophobicContact CE2-CB 3.75Å; F229-D271 HydrophobicContact CZ-CB 3.59Å; W258-D271 HydrophobicContact CE3-CB 4.47Å; C259-D271 PolarHBondContact N-O 2.79Å; C259-D271 PolarHBondContact SG-O 2.98Å; N264-D271 VanDerWaalsContact CA-OD2 3.23Å; N264-D271 WeakPolarHBondContact CA-OD2 3.28Å; N264-D271 WeakPolarHBondContact CB-OD2 3.5Å; N264-D271 PolarHBondContact N-OD2 2.93Å; N264-D271 PolarHBondContact ND2-OD2 3.07Å; C265-D271 HydrophobicContact CB-CB 4.21Å; C265-D271 WeakPolarHBondContact CB-OD1 3.3Å; C265-D271 PolarHBondContact N-OD1 3.46Å; C265-D271 PolarHBondContact N-OD2 3.4Å; G269-D271 VanDerWaalsContact CA-OD1 3.29Å; G269-D271 WeakPolarHBondContact CA-OD1 3.35Å; G269-D271 PolarHBondContact O-N 2.96Å; G269-D271 VanDerWaalsContact O-N 3.08Å
272	E	86.9	Confident	81.1	Confident	49 Å²	49	54.7 Å²	54.7	23%	0.229	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	0.5	173.8	-69.2	-60.4	138	0	0	112.3	C259 D260 N261 V262 L263 G269	C259-E272 VanDerWaalsContact C-OE1 3.31Å; C259-E272 WeakPolarHBondContact CA-OE1 3.43Å; D260-E272 PolarHBondContact N-OE1 3.22Å; N261-E272 VanDerWaalsContact CA-CD 3.48Å; N261-E272 VanDerWaalsContact CA-OE1 3.31Å; N261-E272 WeakPolarHBondContact CA-OE1 3.13Å; N261-E272 WeakPolarHBondContact CA-OE2 3.31Å; N261-E272 PolarHBondContact N-OE1 2.66Å; N261-E272 PolarHBondContact N-OE2 3.11Å; V262-E272 PolarHBondContact N-OE1 2.93Å; V262-E272 WeakPolarHBondContact O-CG 3.38Å; L263-E272 HydrophobicContact CD2-CB 4.03Å; L263-E272 HydrophobicContact CD2-CG 3.83Å; G269-E272 PolarHBondContact O-N 3.39Å
273	Q	85	Confident	81.7	Confident	82 Å²	82	54.2 Å²	54.2	38%	0.383	31%	0.313	S	S	.	.	S	Bend	trans	-90.7	141.1	174.5	-70.4	-176.5	51.3	0	0	111.3	W258 S268 G269 C275	W258-Q273 WeakPolarHBondContact CH2-O 3.48Å; W258-Q273 WeakPolarHBondContact CZ2-O 3.17Å; S268-Q273 PolarHBondContact O-NE2 3.19Å; G269-Q273 PolarHBondContact O-N 2.99Å; Q273-C275 VanDerWaalsContact C-N 3.34Å; Q273-C275 PolarHBondContact O-N 3.47Å
274	N	85	Confident	81.9	Confident	103 Å²	103	56.8 Å²	56.8	55%	0.551	33%	0.333	S	S	*	.			trans	58.2	37.1	170.8	-59.7	-59.8	0	0	0	115	S276 F277	N274-S276 PolarHBondContact O-N 2.8Å; N274-F277 HydrophobicContact CB-CD2 3.81Å; N274-F277 HydrophobicContact CB-CE2 4.43Å; N274-F277 WeakPolarHBondContact O-CB 3.32Å; N274-F277 PolarHBondContact O-N 3.26Å
275	C	85.7	Confident	82	Confident	66 Å²	66	63.3 Å²	63.3	45%	0.446	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-12.1	178.9	-60.2	0	0	0	0	117.2	C259 Q273 F277	C259-C275 HydrophobicContact CB-CB 3.72Å; C259-C275 WeakPolarHBondContact CB-SG 3.26Å; C259-C275 WeakPolarHBondContact SG-CA 3.45Å; C259-C275 WeakPolarHBondContact SG-CB 3Å; C259-C275 CovalentContact SG-SG 2.02Å; C259-C275 PolarHBondContact SG-SG 3.31Å; Q273-C275 VanDerWaalsContact C-N 3.34Å; Q273-C275 PolarHBondContact O-N 3.47Å; C275-F277 VanDerWaalsContact C-N 3.33Å
276	S	82	Confident	81.6	Confident	110 Å²	110	66.8 Å²	66.8	77%	0.769	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-5.8	172	51.4	0	0	0	0	114.3	N274	N274-S276 PolarHBondContact O-N 2.8Å
277	F	82.4	Confident	81.7	Confident	134 Å²	134	73.6 Å²	73.6	59%	0.588	41%	0.409	S	S	*	.	S	Bend	trans	-105.5	162.7	-179.1	-68.6	-99.4	0	0	0	111.9	N274 C275	N274-F277 HydrophobicContact CB-CD2 3.81Å; N274-F277 HydrophobicContact CB-CE2 4.43Å; N274-F277 WeakPolarHBondContact O-CB 3.32Å; N274-F277 PolarHBondContact O-N 3.26Å; C275-F277 VanDerWaalsContact C-N 3.33Å
278	T	85.1	Confident	82	Confident	125 Å²	125	77 Å²	77	77%	0.767	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-63.9	134.6	168.4	49.1	0	0	0	0	110.1
279	P	87.1	Confident	82.2	Confident	30 Å²	30	77.4 Å²	77.4	20%	0.195	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-54.4	136.5	176.7	-23.3	31.4	0	0	0	111.3	F229 I255 W258 I281	F229-P279 HydrophobicContact CB-CB 3.63Å; F229-P279 HydrophobicContact CG-CB 4.36Å; I255-P279 HydrophobicContact CD1-CG 4.2Å; I255-P279 HydrophobicContact CG1-CB 4.43Å; I255-P279 HydrophobicContact CG1-CG 3.96Å; W258-P279 HydrophobicContact CB-CG 4.27Å; W258-P279 HydrophobicContact CD2-CB 3.8Å; W258-P279 HydrophobicContact CD2-CG 3.86Å; W258-P279 HydrophobicContact CE3-CB 4.06Å; W258-P279 HydrophobicContact CG-CB 4.06Å; W258-P279 HydrophobicContact CG-CG 3.66Å; P279-I281 PolarHBondContact O-N 2.86Å
280	P	89	Confident	82.1	Confident	56 Å²	56	78.9 Å²	78.9	36%	0.364	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-64.8	130.9	175.4	28.1	-34.2	0	0	0	109.6	F229 A230 W258	F229-P280 CarbonylContact C-O 3.51Å; F229-P280 VanDerWaalsContact CA-O 3.25Å; F229-P280 WeakPolarHBondContact CA-O 3.45Å; F229-P280 WeakPolarHBondContact CB-O 3.4Å; A230-P280 PolarHBondContact N-O 3.41Å; A230-P280 WeakPolarHBondContact O-CG 3.29Å; W258-P280 HydrophobicContact CH2-CG 4.38Å; W258-P280 VanDerWaalsContact CZ3-CD 3.49Å; W258-P280 HydrophobicContact CZ3-CG 4.18Å
281	I	88.8	Confident	81.6	Confident	97 Å²	97	83 Å²	83	50%	0.497	44%	0.44	S	S	.	.			trans	-107.2	-0.8	178.1	61	169	0	0	0	113	T223 C224 P279	T223-I281 WeakPolarHBondContact CG2-O 3.44Å; C224-I281 PolarHBondContact N-O 2.04Å; P279-I281 PolarHBondContact O-N 2.86Å
282	S	88.7	Confident	81.1	Confident	67 Å²	67	85.7 Å²	85.7	47%	0.469	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-149.4	150.2	-176.2	56.5	0	0	0	0	112.7	F222	F222-S282 CarbonylContact O-C 3.58Å; F222-S282 WeakPolarHBondContact O-CA 3.41Å; F222-S282 WeakPolarHBondContact O-CB 3.43Å
283	F	85.6	Confident	80.4	Confident	7 Å²	7	83.7 Å²	83.7	3%	0.031	45%	0.445	C	S	.	.			trans	-91.4	141.4	178.8	-63.1	-90.1	0	0	0	110.1	L217 F222 A230 C231 T233 R250 I251 Y285	L217-F283 HydrophobicContact CD1-CD2 3.68Å; L217-F283 HydrophobicContact CD1-CE2 3.48Å; L217-F283 VanDerWaalsContact CD1-CE2 3.48Å; L217-F283 HydrophobicContact CG-CE2 4.3Å; F222-F283 HydrophobicContact CB-CB 4.28Å; F222-F283 HydrophobicContact CD1-CB 4.16Å; F222-F283 PolarHBondContact O-N 3.22Å; A230-F283 HydrophobicContact CB-CD1 4.36Å; A230-F283 HydrophobicContact CB-CD2 4.09Å; A230-F283 HydrophobicContact CB-CE1 3.94Å; A230-F283 HydrophobicContact CB-CE2 3.56Å; A230-F283 HydrophobicContact CB-CG 4.46Å; A230-F283 HydrophobicContact CB-CZ 3.48Å; A230-F283 VanDerWaalsContact CB-CZ 3.48Å; C231-F283 WeakPolarHBondContact O-CE1 3.41Å; T233-F283 HydrophobicContact CG2-CB 4.48Å; T233-F283 HydrophobicContact CG2-CD1 3.45Å; T233-F283 VanDerWaalsContact CG2-CD1 3.45Å; T233-F283 HydrophobicContact CG2-CE1 4.08Å; T233-F283 HydrophobicContact CG2-CG 4.36Å; R250-F283 HydrophobicContact CB-CD1 4.27Å; R250-F283 HydrophobicContact CB-CD2 4.05Å; R250-F283 HydrophobicContact CB-CE1 3.91Å; R250-F283 HydrophobicContact CB-CE2 3.75Å; R250-F283 HydrophobicContact CB-CG 4.31Å; R250-F283 HydrophobicContact CB-CZ 3.67Å; R250-F283 HydrophobicContact CG-CB 4.48Å; R250-F283 HydrophobicContact CG-CD1 3.79Å; R250-F283 HydrophobicContact CG-CD2 4.02Å; R250-F283 HydrophobicContact CG-CE1 3.89Å; R250-F283 HydrophobicContact CG-CE2 4.19Å; R250-F283 HydrophobicContact CG-CG 3.82Å; R250-F283 HydrophobicContact CG-CZ 4.12Å; I251-F283 VanDerWaalsContact N-CZ 3.3Å; I251-F283 WeakPolarHBondContact O-CZ 3.29Å; F283-Y285 PolarHBondContact O-N 3.24Å
284	P	80	Confident	79.6	Confident	109 Å²	109	84.6 Å²	84.6	71%	0.708	45%	0.445	S	S	*	.			trans	-66	131.6	172.4	28.4	-33.6	0	0	0	110.1
285	Y	77.4	Confident	78.9	Confident	137 Å²	137	85.6 Å²	85.6	54%	0.537	44%	0.442	S	S	.	.			trans	-138.3	148.9	-179.6	68.5	-96.6	0	0	0	112.8	F222 F283 I290	F222-Y285 HydrophobicContact CB-CD1 3.54Å; F222-Y285 HydrophobicContact CB-CE1 4.13Å; F222-Y285 HydrophobicContact CB-CG 4.25Å; F222-Y285 HydrophobicContact CD1-CD1 4.29Å; F222-Y285 HydrophobicContact CD1-CG 4.23Å; F222-Y285 HydrophobicContact CD2-CD1 4.09Å; F222-Y285 HydrophobicContact CD2-CG 4.04Å; F222-Y285 AromaticContact CG-CD1 3.71Å; F222-Y285 HydrophobicContact CG-CD1 3.71Å; F222-Y285 AromaticContact CG-CG 3.9Å; F222-Y285 HydrophobicContact CG-CG 3.9Å; F283-Y285 PolarHBondContact O-N 3.24Å; Y285-I290 HydrophobicContact CD2-CD1 3.6Å; Y285-I290 HydrophobicContact CD2-CG1 4.24Å; Y285-I290 HydrophobicContact CE2-CD1 3.78Å
286	T	74.7	Confident	78	Confident	73 Å²	73	84.6 Å²	84.6	45%	0.448	43%	0.431	S	S	.	.			trans	-109.7	151.3	168.5	65	0	0	0	0	110	F288 Q289 I290	T286-F288 PolarHBondContact O-N 3.35Å; T286-F288 VanDerWaalsContact O-N 3.16Å; T286-Q289 PolarHBondContact O-N 2.68Å; T286-Q289 VanDerWaalsContact O-N 3.09Å; T286-Q289 WeakPolarHBondContact OG1-CG 3.46Å; T286-Q289 PolarHBondContact OG1-N 3.36Å; T286-Q289 PolarHBondContact OG1-OE1 3.31Å; T286-I290 PolarHBondContact O-N 3.41Å
287	K	74.6	Confident	77.2	Confident	147 Å²	147	79.7 Å²	79.7	64%	0.639	40%	0.396	S	S	*	.	H	α-helix	trans	-54.8	-33.4	173	178.2	175	166.9	178.8	0	112.4	I290 E291	K287-I290 PolarHBondContact O-N 2.85Å; K287-E291 WeakPolarHBondContact CE-OE1 3.45Å; K287-E291 IonicContact NZ-OE1 2.7Å; K287-E291 PolarHBondContact NZ-OE1 3.48Å; K287-E291 WeakPolarHBondContact O-CG 3.42Å; K287-E291 PolarHBondContact O-N 3.12Å
288	F	73.6	Confident	76.3	Confident	142 Å²	142	76.7 Å²	76.7	62%	0.623	39%	0.386	S	S	*	.	H	α-helix	trans	-65.7	-41.4	177	-179.2	-98.4	0	0	0	112.8	T286 I290 E291 N292	T286-F288 PolarHBondContact O-N 3.35Å; T286-F288 VanDerWaalsContact O-N 3.16Å; F288-I290 VanDerWaalsContact C-N 3.35Å; F288-E291 PolarHBondContact O-N 2.96Å; F288-N292 WeakPolarHBondContact O-CB 3.49Å; F288-N292 PolarHBondContact O-N 2.81Å
289	Q	71	Confident	75.4	Confident	74 Å²	74	74.6 Å²	74.6	35%	0.346	37%	0.37	S	S	.	.	H	α-helix	trans	-61.7	-42.8	173.8	-75.6	157.8	-58.5	0	0	111.3	T286 N292 E293	T286-Q289 PolarHBondContact O-N 2.68Å; T286-Q289 VanDerWaalsContact O-N 3.09Å; T286-Q289 WeakPolarHBondContact OG1-CG 3.46Å; T286-Q289 PolarHBondContact OG1-N 3.36Å; T286-Q289 PolarHBondContact OG1-OE1 3.31Å; Q289-N292 PolarHBondContact O-N 2.89Å; Q289-E293 WeakPolarHBondContact O-CB 3.45Å; Q289-E293 WeakPolarHBondContact O-CG 3.5Å; Q289-E293 PolarHBondContact O-N 2.99Å
290	I	72.7	Confident	74	Confident	40 Å²	40	73.9 Å²	73.9	21%	0.205	37%	0.365	C	S	.	.	H	α-helix	trans	-58	-51.7	175.4	-59.6	-177.7	0	0	0	111.1	F222 Y285 T286 K287 F288 N292 E293 Y294	F222-I290 HydrophobicContact CE2-CD1 4.24Å; F222-I290 HydrophobicContact CE2-CG1 3.71Å; F222-I290 HydrophobicContact CZ-CG1 4.16Å; Y285-I290 HydrophobicContact CD2-CD1 3.6Å; Y285-I290 HydrophobicContact CD2-CG1 4.24Å; Y285-I290 HydrophobicContact CE2-CD1 3.78Å; T286-I290 PolarHBondContact O-N 3.41Å; K287-I290 PolarHBondContact O-N 2.85Å; F288-I290 VanDerWaalsContact C-N 3.35Å; I290-N292 VanDerWaalsContact C-N 3.26Å; I290-N292 PolarHBondContact O-N 3.18Å; I290-E293 PolarHBondContact O-N 3.02Å; I290-Y294 HydrophobicContact CG2-CD2 3.72Å; I290-Y294 HydrophobicContact CG2-CE2 3.63Å; I290-Y294 VanDerWaalsContact O-CD2 3.28Å; I290-Y294 WeakPolarHBondContact O-CD2 3.47Å; I290-Y294 PolarHBondContact O-N 2.76Å
291	E	74.8	Confident	72.4	Confident	96 Å²	96	71.5 Å²	71.5	45%	0.449	35%	0.349	S	S	.	.	H	α-helix	trans	-64.3	-30.7	-179.8	-72	177.4	169.4	0	0	112.6	K287 F288 R295	K287-E291 WeakPolarHBondContact CE-OE1 3.45Å; K287-E291 IonicContact NZ-OE1 2.7Å; K287-E291 PolarHBondContact NZ-OE1 3.48Å; K287-E291 WeakPolarHBondContact O-CG 3.42Å; K287-E291 PolarHBondContact O-N 3.12Å; F288-E291 PolarHBondContact O-N 2.96Å; E291-R295 PolarHBondContact O-N 3.14Å
292	N	73.8	Confident	71.1	Confident	55 Å²	55	70.7 Å²	70.7	29%	0.294	35%	0.346	S	S	.	.	H	α-helix	trans	-77.3	-41.7	176.7	-163.4	67.8	0	0	0	112.7	F288 Q289 I290 R295 M296	F288-N292 WeakPolarHBondContact O-CB 3.49Å; F288-N292 PolarHBondContact O-N 2.81Å; Q289-N292 PolarHBondContact O-N 2.89Å; I290-N292 VanDerWaalsContact C-N 3.26Å; I290-N292 PolarHBondContact O-N 3.18Å; N292-R295 WeakPolarHBondContact O-CB 3.42Å; N292-R295 PolarHBondContact O-N 3.15Å; N292-R295 PolarHBondContact OD1-NH1 2.89Å; N292-M296 PolarHBondContact ND2-SD 3.01Å; N292-M296 WeakPolarHBondContact O-CG 3.41Å; N292-M296 PolarHBondContact O-N 3.41Å
293	E	71.3	Confident	69.5	Low	7 Å²	7	74 Å²	74	3%	0.033	35%	0.354	C	S	.	.	H	α-helix	trans	-60.6	-44.7	174.3	-79.4	-178.6	-159.6	0	0	111.8	P219 G220 W247 R250 Q289 I290 R295 M296 L297	P219-E293 WeakPolarHBondContact CA-OE2 3.16Å; P219-E293 HydrophobicContact CB-CB 4.39Å; G220-E293 PolarHBondContact N-OE2 2.91Å; W247-E293 HydrophobicContact CB-CG 4Å; R250-E293 IonicContact CZ-OE1 2.64Å; R250-E293 IonicContact CZ-OE2 3.54Å; R250-E293 IonicContact NH1-OE1 2.76Å; R250-E293 PolarHBondContact NH1-OE1 2.86Å; R250-E293 IonicContact NH1-OE2 3Å; R250-E293 IonicContact NH2-OE1 3.59Å; R250-E293 PolarHBondContact NH2-OE1 2.96Å; R250-E293 IonicContact NH2-OE2 3.64Å; R250-E293 PolarHBondContact NH2-OE2 2.91Å; Q289-E293 WeakPolarHBondContact O-CB 3.45Å; Q289-E293 WeakPolarHBondContact O-CG 3.5Å; Q289-E293 PolarHBondContact O-N 2.99Å; I290-E293 PolarHBondContact O-N 3.02Å; E293-R295 VanDerWaalsContact C-N 3.29Å; E293-R295 PolarHBondContact O-N 3.1Å; E293-M296 PolarHBondContact O-N 2.64Å; E293-L297 VanDerWaalsContact O-CB 3.22Å; E293-L297 WeakPolarHBondContact O-CB 3.13Å; E293-L297 PolarHBondContact O-N 3.37Å
294	Y	67.7	Low	67.9	Low	101 Å²	101	76.3 Å²	76.3	40%	0.396	36%	0.364	S	S	.	.	H	α-helix	trans	-65.7	-30.5	175	-79.5	-59.8	0	0	0	113.1	I290 L297 N298	I290-Y294 HydrophobicContact CG2-CD2 3.72Å; I290-Y294 HydrophobicContact CG2-CE2 3.63Å; I290-Y294 VanDerWaalsContact O-CD2 3.28Å; I290-Y294 WeakPolarHBondContact O-CD2 3.47Å; I290-Y294 PolarHBondContact O-N 2.76Å; Y294-L297 HydrophobicContact CD1-CD2 4.38Å; Y294-N298 WeakPolarHBondContact O-CB 3.23Å; Y294-N298 VanDerWaalsContact O-CG 3.22Å; Y294-N298 PolarHBondContact O-N 3.4Å; Y294-N298 PolarHBondContact O-ND2 3.23Å
295	R	70.4	Confident	66.4	Low	125 Å²	125	76.5 Å²	76.5	47%	0.472	36%	0.356	S	S	.	.	H	α-helix	trans	-66.3	-55.1	172.5	-171.6	-175	-60.5	115.8	5.4	110.8	E291 N292 E293 L297 N298 D299	E291-R295 PolarHBondContact O-N 3.14Å; N292-R295 WeakPolarHBondContact O-CB 3.42Å; N292-R295 PolarHBondContact O-N 3.15Å; N292-R295 PolarHBondContact OD1-NH1 2.89Å; E293-R295 VanDerWaalsContact C-N 3.29Å; E293-R295 PolarHBondContact O-N 3.1Å; R295-L297 VanDerWaalsContact C-N 3.29Å; R295-L297 PolarHBondContact O-N 3.26Å; R295-N298 PolarHBondContact O-N 2.86Å; R295-D299 VanDerWaalsContact O-CG 3.22Å; R295-D299 PolarHBondContact O-N 2.9Å
296	M	67.1	Low	64.9	Low	44 Å²	44	76.2 Å²	76.2	22%	0.217	36%	0.357	C	S	.	.	H	α-helix	trans	-59.7	-38.8	179.9	-66.9	170.8	68.2	0	0	112.4	Q246 N292 E293 D299 V300	Q246-M296 HydrophobicContact CB-CE 3.87Å; N292-M296 PolarHBondContact ND2-SD 3.01Å; N292-M296 WeakPolarHBondContact O-CG 3.41Å; N292-M296 PolarHBondContact O-N 3.41Å; E293-M296 PolarHBondContact O-N 2.64Å; M296-D299 PolarHBondContact O-N 3.36Å; M296-V300 PolarHBondContact O-N 3.19Å; M296-V300 VanDerWaalsContact O-N 3.14Å
297	L	64.9	Low	63.4	Low	8 Å²	8	76.7 Å²	76.7	4%	0.042	36%	0.357	C	S	.	.	H	α-helix	trans	-61.5	-49.5	172.8	178.9	60.8	0	0	0	111.1	P219 W247 E293 Y294 R295 D299 V300 L301 Y316	P219-L297 HydrophobicContact CB-CD2 4.06Å; P219-L297 HydrophobicContact CG-CD2 4.13Å; W247-L297 HydrophobicContact CH2-CD1 4.04Å; W247-L297 HydrophobicContact CZ3-CB 4.07Å; W247-L297 HydrophobicContact CZ3-CD1 4.09Å; E293-L297 VanDerWaalsContact O-CB 3.22Å; E293-L297 WeakPolarHBondContact O-CB 3.13Å; E293-L297 PolarHBondContact O-N 3.37Å; Y294-L297 HydrophobicContact CD1-CD2 4.38Å; R295-L297 VanDerWaalsContact C-N 3.29Å; R295-L297 PolarHBondContact O-N 3.26Å; L297-D299 VanDerWaalsContact C-N 3.34Å; L297-D299 PolarHBondContact O-N 3.27Å; L297-V300 PolarHBondContact O-N 3.16Å; L297-L301 HydrophobicContact CD1-CD1 3.9Å; L297-L301 HydrophobicContact CD1-CG 4.04Å; L297-L301 HydrophobicContact CD2-CD1 4.45Å; L297-L301 HydrophobicContact CG-CD1 3.72Å; L297-L301 HydrophobicContact CG-CG 4.3Å; L297-L301 WeakPolarHBondContact O-CB 3.3Å; L297-L301 WeakPolarHBondContact O-CG 3.2Å; L297-L301 PolarHBondContact O-N 3.35Å; L297-Y316 HydrophobicContact CD2-CD2 3.99Å; L297-Y316 HydrophobicContact CD2-CE2 3.62Å; L297-Y316 HydrophobicContact CG-CE2 4.49Å
298	N	64.5	Low	61.9	Low	71 Å²	71	75.3 Å²	75.3	38%	0.38	36%	0.361	S	S	.	.	H	α-helix	trans	-61.5	-40.8	176.8	-77.2	-17.6	0	0	0	112.2	Y294 R295 V300 L301 N302	Y294-N298 WeakPolarHBondContact O-CB 3.23Å; Y294-N298 VanDerWaalsContact O-CG 3.22Å; Y294-N298 PolarHBondContact O-N 3.4Å; Y294-N298 PolarHBondContact O-ND2 3.23Å; R295-N298 PolarHBondContact O-N 2.86Å; N298-V300 VanDerWaalsContact C-N 3.34Å; N298-V300 PolarHBondContact O-N 3.02Å; N298-L301 PolarHBondContact O-N 3.39Å; N298-N302 VanDerWaalsContact O-CB 3.28Å; N298-N302 WeakPolarHBondContact O-CB 3.41Å; N298-N302 PolarHBondContact O-N 2.94Å; N298-N302 PolarHBondContact O-ND2 3.33Å; N298-N302 VanDerWaalsContact O-ND2 3.16Å; N298-N302 PolarHBondContact O-OD1 2.78Å
299	D	65.3	Low	60.2	Low	81 Å²	81	72.7 Å²	72.7	43%	0.433	36%	0.36	S	S	.	.	H	α-helix	trans	-60.4	-43	179.3	-65.3	-32	0	0	0	111.4	R295 M296 L297 N302 Q303	R295-D299 VanDerWaalsContact O-CG 3.22Å; R295-D299 PolarHBondContact O-N 2.9Å; M296-D299 PolarHBondContact O-N 3.36Å; L297-D299 VanDerWaalsContact C-N 3.34Å; L297-D299 PolarHBondContact O-N 3.27Å; D299-N302 PolarHBondContact O-N 2.7Å; D299-Q303 WeakPolarHBondContact O-CG 3.42Å; D299-Q303 PolarHBondContact O-N 2.84Å; D299-Q303 VanDerWaalsContact O-N 3.11Å
300	V	58.3	Low	58.6	Low	14 Å²	14	72.4 Å²	72.4	9%	0.085	36%	0.361	C	S	.	.	H	α-helix	trans	-74.3	-37.5	176	169.8	0	0	0	0	112.6	P244 L245 M296 L297 N298 N302 Q303 F304	P244-V300 HydrophobicContact CB-CG2 4.18Å; P244-V300 HydrophobicContact CG-CG1 4.29Å; L245-V300 HydrophobicContact CD1-CG1 4.43Å; L245-V300 HydrophobicContact CD2-CB 3.7Å; L245-V300 HydrophobicContact CD2-CG1 3.97Å; L245-V300 HydrophobicContact CD2-CG2 3.52Å; L245-V300 HydrophobicContact CG-CG1 4.32Å; L245-V300 HydrophobicContact CG-CG2 4.29Å; M296-V300 PolarHBondContact O-N 3.19Å; M296-V300 VanDerWaalsContact O-N 3.14Å; L297-V300 PolarHBondContact O-N 3.16Å; N298-V300 VanDerWaalsContact C-N 3.34Å; N298-V300 PolarHBondContact O-N 3.02Å; V300-N302 VanDerWaalsContact C-N 3.25Å; V300-N302 PolarHBondContact O-N 3.46Å; V300-Q303 WeakPolarHBondContact O-CB 3.29Å; V300-Q303 PolarHBondContact O-N 3.32Å; V300-F304 HydrophobicContact CG1-CD2 3.71Å; V300-F304 HydrophobicContact CG1-CE2 3.57Å; V300-F304 VanDerWaalsContact O-CD2 3.26Å; V300-F304 WeakPolarHBondContact O-CD2 3.35Å; V300-F304 PolarHBondContact O-N 3.36Å
301	L	56.2	Low	56.8	Low	7 Å²	7	71.7 Å²	71.7	4%	0.037	36%	0.357	C	S	.	.	H	α-helix	trans	-64.2	-32.1	173.2	-70	170.1	0	0	0	112.1	L297 N298 F304 E305 L311 Y316	L297-L301 HydrophobicContact CD1-CD1 3.9Å; L297-L301 HydrophobicContact CD1-CG 4.04Å; L297-L301 HydrophobicContact CD2-CD1 4.45Å; L297-L301 HydrophobicContact CG-CD1 3.72Å; L297-L301 HydrophobicContact CG-CG 4.3Å; L297-L301 WeakPolarHBondContact O-CB 3.3Å; L297-L301 WeakPolarHBondContact O-CG 3.2Å; L297-L301 PolarHBondContact O-N 3.35Å; N298-L301 PolarHBondContact O-N 3.39Å; L301-F304 CarbonylContact O-C 3.59Å; L301-F304 PolarHBondContact O-N 3.28Å; L301-E305 PolarHBondContact O-N 3.19Å; L301-L311 HydrophobicContact CD2-CD2 3.89Å; L301-L311 HydrophobicContact CD2-CG 3.86Å; L301-Y316 HydrophobicContact CD1-CD1 3.33Å; L301-Y316 HydrophobicContact CD1-CD2 4.26Å; L301-Y316 HydrophobicContact CD1-CE1 3.34Å; L301-Y316 HydrophobicContact CD1-CE2 4.26Å; L301-Y316 HydrophobicContact CD1-CG 3.81Å; L301-Y316 HydrophobicContact CD2-CD1 4.13Å; L301-Y316 HydrophobicContact CD2-CG 4.33Å; L301-Y316 HydrophobicContact CG-CD1 4.39Å
302	N	61.3	Low	55.2	Low	79 Å²	79	73.5 Å²	73.5	42%	0.422	37%	0.366	S	S	.	.	H	α-helix	trans	-72.3	-36.2	174.2	-67.8	-19.7	0	0	0	111.4	N298 D299 V300 F304 E305	N298-N302 VanDerWaalsContact O-CB 3.28Å; N298-N302 WeakPolarHBondContact O-CB 3.41Å; N298-N302 PolarHBondContact O-N 2.94Å; N298-N302 PolarHBondContact O-ND2 3.33Å; N298-N302 VanDerWaalsContact O-ND2 3.16Å; N298-N302 PolarHBondContact O-OD1 2.78Å; D299-N302 PolarHBondContact O-N 2.7Å; V300-N302 VanDerWaalsContact C-N 3.25Å; V300-N302 PolarHBondContact O-N 3.46Å; N302-F304 VanDerWaalsContact C-N 3.29Å; N302-F304 PolarHBondContact O-N 3.01Å; N302-E305 WeakPolarHBondContact O-CB 3.29Å; N302-E305 PolarHBondContact O-N 3.47Å
303	Q	55.2	Low	53.4	Low	138 Å²	138	78.1 Å²	78.1	65%	0.645	38%	0.383	S	S	*	.	H	α-helix	trans	-60.9	-39.4	169.5	-70.3	171.1	10.8	0	0	111.6	D299 V300 E305	D299-Q303 WeakPolarHBondContact O-CG 3.42Å; D299-Q303 PolarHBondContact O-N 2.84Å; D299-Q303 VanDerWaalsContact O-N 3.11Å; V300-Q303 WeakPolarHBondContact O-CB 3.29Å; V300-Q303 PolarHBondContact O-N 3.32Å; Q303-E305 VanDerWaalsContact C-N 3.34Å
304	F	51.7	Low	51.8	Low	55 Å²	55	81.5 Å²	81.5	24%	0.241	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-86	8.4	176.3	-65.7	-56.5	0	0	0	114.8	V300 L301 N302 K306 N307 L310 L311	V300-F304 HydrophobicContact CG1-CD2 3.71Å; V300-F304 HydrophobicContact CG1-CE2 3.57Å; V300-F304 VanDerWaalsContact O-CD2 3.26Å; V300-F304 WeakPolarHBondContact O-CD2 3.35Å; V300-F304 PolarHBondContact O-N 3.36Å; L301-F304 CarbonylContact O-C 3.59Å; L301-F304 PolarHBondContact O-N 3.28Å; N302-F304 VanDerWaalsContact C-N 3.29Å; N302-F304 PolarHBondContact O-N 3.01Å; F304-K306 PolarHBondContact O-N 3.14Å; F304-K306 VanDerWaalsContact O-N 3.15Å; F304-N307 CarbonylContact O-C 3.46Å; F304-N307 WeakPolarHBondContact O-CA 3.42Å; F304-N307 PolarHBondContact O-N 3.46Å; F304-L310 HydrophobicContact CB-CB 4.49Å; F304-L310 HydrophobicContact CD1-CB 4.33Å; F304-L310 HydrophobicContact CD1-CD1 3.82Å; F304-L310 HydrophobicContact CD1-CD2 4.33Å; F304-L310 HydrophobicContact CD1-CG 4.38Å; F304-L310 HydrophobicContact CD2-CD2 4.21Å; F304-L310 HydrophobicContact CE1-CD1 3.69Å; F304-L310 HydrophobicContact CE1-CD2 4.22Å; F304-L310 HydrophobicContact CE1-CG 4.48Å; F304-L310 HydrophobicContact CE2-CD2 4.08Å; F304-L310 HydrophobicContact CG-CB 4.35Å; F304-L310 HydrophobicContact CG-CD2 4.33Å; F304-L310 HydrophobicContact CZ-CD1 4.3Å; F304-L310 HydrophobicContact CZ-CD2 4.09Å; F304-L311 HydrophobicContact CB-CD1 4.1Å; F304-L311 VanDerWaalsContact O-CD1 3.25Å; F304-L311 WeakPolarHBondContact O-CD1 3.38Å
305	E	47.8	Very low	50.1	Low	112 Å²	112	78.7 Å²	78.7	52%	0.523	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-66.4	-18.9	-177.9	-171.5	156.3	-119.2	0	0	113.4	L301 N302 Q303 K318	L301-E305 PolarHBondContact O-N 3.19Å; N302-E305 WeakPolarHBondContact O-CB 3.29Å; N302-E305 PolarHBondContact O-N 3.47Å; Q303-E305 VanDerWaalsContact C-N 3.34Å; E305-K318 IonicContact OE1-NZ 3.57Å; E305-K318 PolarHBondContact OE1-NZ 2.8Å
306	K	46.1	Very low	48.3	Very low	131 Å²	131	76.3 Å²	76.3	57%	0.57	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-79	-18.4	167.4	-71.2	-171.3	175.4	-174.1	0	113.7	T18 D19 F304	T18-K306 PolarHBondContact O-NZ 3.27Å; T18-K306 PolarHBondContact OG1-NZ 2.9Å; D19-K306 IonicContact OD1-NZ 2.65Å; F304-K306 PolarHBondContact O-N 3.14Å; F304-K306 VanDerWaalsContact O-N 3.15Å
307	N	44.3	Very low	47	Very low	84 Å²	84	84.6 Å²	84.6	45%	0.449	43%	0.427	S	S	.	.			trans	-118.5	77.7	-172.5	-72.7	-5.5	0	0	0	112.1	F304 S309 L310	F304-N307 CarbonylContact O-C 3.46Å; F304-N307 WeakPolarHBondContact O-CA 3.42Å; F304-N307 PolarHBondContact O-N 3.46Å; N307-S309 VanDerWaalsContact C-N 3.26Å; N307-S309 PolarHBondContact O-N 3.49Å; N307-S309 VanDerWaalsContact O-N 3.16Å; N307-L310 HydrophobicContact CB-CB 4.41Å; N307-L310 WeakPolarHBondContact O-CB 3.34Å; N307-L310 PolarHBondContact O-N 2.87Å
308	T	41.6	Very low	45.6	Very low	117 Å²	117	87.4 Å²	87.4	72%	0.718	44%	0.439	S	S	*	.	H	α-helix	trans	-56	-32.4	-176.8	43.8	0	0	0	0	115.1	L310 L311 E312	T308-L310 PolarHBondContact O-N 3.46Å; T308-L311 PolarHBondContact O-N 2.94Å; T308-E312 PolarHBondContact O-N 3.28Å
309	S	38.4	Very low	44.4	Very low	87 Å²	87	91.5 Å²	91.5	61%	0.608	45%	0.453	S	S	*	.	H	α-helix	trans	-60.5	-28.4	176.3	50.3	0	0	0	0	113.5	N307 F313	N307-S309 VanDerWaalsContact C-N 3.26Å; N307-S309 PolarHBondContact O-N 3.49Å; N307-S309 VanDerWaalsContact O-N 3.16Å; S309-F313 PolarHBondContact O-N 2.81Å
310	L	37.3	Very low	43	Very low	68 Å²	68	92.9 Å²	92.9	36%	0.356	47%	0.465	S	S	.	.	H	α-helix	trans	-81.7	-31.4	-177.4	-125.8	147.6	0	0	0	112.1	F304 N307 T308 F313 V314	F304-L310 HydrophobicContact CB-CB 4.49Å; F304-L310 HydrophobicContact CD1-CB 4.33Å; F304-L310 HydrophobicContact CD1-CD1 3.82Å; F304-L310 HydrophobicContact CD1-CD2 4.33Å; F304-L310 HydrophobicContact CD1-CG 4.38Å; F304-L310 HydrophobicContact CD2-CD2 4.21Å; F304-L310 HydrophobicContact CE1-CD1 3.69Å; F304-L310 HydrophobicContact CE1-CD2 4.22Å; F304-L310 HydrophobicContact CE1-CG 4.48Å; F304-L310 HydrophobicContact CE2-CD2 4.08Å; F304-L310 HydrophobicContact CG-CB 4.35Å; F304-L310 HydrophobicContact CG-CD2 4.33Å; F304-L310 HydrophobicContact CZ-CD1 4.3Å; F304-L310 HydrophobicContact CZ-CD2 4.09Å; N307-L310 HydrophobicContact CB-CB 4.41Å; N307-L310 WeakPolarHBondContact O-CB 3.34Å; N307-L310 PolarHBondContact O-N 2.87Å; T308-L310 PolarHBondContact O-N 3.46Å; L310-F313 PolarHBondContact O-N 3.26Å; L310-V314 VanDerWaalsContact O-CG2 3.27Å; L310-V314 WeakPolarHBondContact O-CG2 3.42Å; L310-V314 PolarHBondContact O-N 3.36Å
311	L	35.9	Very low	42	Very low	26 Å²	26	97.7 Å²	97.7	14%	0.136	50%	0.499	C	S	.	.	H	α-helix	trans	-66.9	-36.4	173.6	-79.8	94	0	0	0	112.5	L301 F304 T308 F313 V314 Y316 K318	L301-L311 HydrophobicContact CD2-CD2 3.89Å; L301-L311 HydrophobicContact CD2-CG 3.86Å; F304-L311 HydrophobicContact CB-CD1 4.1Å; F304-L311 VanDerWaalsContact O-CD1 3.25Å; F304-L311 WeakPolarHBondContact O-CD1 3.38Å; T308-L311 PolarHBondContact O-N 2.94Å; L311-F313 VanDerWaalsContact C-N 3.29Å; L311-V314 PolarHBondContact O-N 2.98Å; L311-Y316 PolarHBondContact O-N 2.86Å; L311-K318 HydrophobicContact CD2-CB 4.41Å
312	E	40.9	Very low	41.3	Very low	134 Å²	134	104 Å²	104	63%	0.626	53%	0.528	S	S	*	.	H	α-helix	trans	-67.1	-35.3	177.4	-154.6	151.3	-136.2	0	0	110.6	T308 V314 G315	T308-E312 PolarHBondContact O-N 3.28Å; E312-V314 VanDerWaalsContact C-N 3.29Å; E312-V314 PolarHBondContact O-N 2.95Å; E312-G315 PolarHBondContact O-N 3.37Å
313	F	35.6	Very low	40.2	Very low	151 Å²	151	105.6 Å²	105.6	66%	0.662	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-16.3	176.7	-146.5	-90.2	0	0	0	115.1	L185 S309 L310 L311	L185-F313 HydrophobicContact CD1-CD1 4.35Å; L185-F313 HydrophobicContact CD1-CE1 3.57Å; L185-F313 HydrophobicContact CD1-CZ 4.25Å; S309-F313 PolarHBondContact O-N 2.81Å; L310-F313 PolarHBondContact O-N 3.26Å; L311-F313 VanDerWaalsContact C-N 3.29Å
314	V	37	Very low	39.7	Very low	78 Å²	78	102.1 Å²	102.1	47%	0.473	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	7.1	172.5	-146.1	0	0	0	0	112.2	L310 L311 E312 Y316	L310-V314 VanDerWaalsContact O-CG2 3.27Å; L310-V314 WeakPolarHBondContact O-CG2 3.42Å; L310-V314 PolarHBondContact O-N 3.36Å; L311-V314 PolarHBondContact O-N 2.98Å; E312-V314 VanDerWaalsContact C-N 3.29Å; E312-V314 PolarHBondContact O-N 2.95Å; V314-Y316 PolarHBondContact O-N 3.39Å; V314-Y316 VanDerWaalsContact O-N 3.11Å
315	G	33.4	Very low	39.6	Very low	43 Å²	43	106 Å²	106	44%	0.443	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	63	11.6	-172.8	0	0	0	0	0	114.2	E312 R317	E312-G315 PolarHBondContact O-N 3.37Å; G315-R317 PolarHBondContact O-N 2.98Å
316	Y	32.6	Very low	39.6	Very low	75 Å²	75	105.2 Å²	105.2	29%	0.294	55%	0.547	S	S	.	.			trans	-95.2	83	-170.8	-161.5	-87.3	0	0	0	111.6	L297 L301 L311 V314 K318	L297-Y316 HydrophobicContact CD2-CD2 3.99Å; L297-Y316 HydrophobicContact CD2-CE2 3.62Å; L297-Y316 HydrophobicContact CG-CE2 4.49Å; L301-Y316 HydrophobicContact CD1-CD1 3.33Å; L301-Y316 HydrophobicContact CD1-CD2 4.26Å; L301-Y316 HydrophobicContact CD1-CE1 3.34Å; L301-Y316 HydrophobicContact CD1-CE2 4.26Å; L301-Y316 HydrophobicContact CD1-CG 3.81Å; L301-Y316 HydrophobicContact CD2-CD1 4.13Å; L301-Y316 HydrophobicContact CD2-CG 4.33Å; L301-Y316 HydrophobicContact CG-CD1 4.39Å; L311-Y316 PolarHBondContact O-N 2.86Å; V314-Y316 PolarHBondContact O-N 3.39Å; V314-Y316 VanDerWaalsContact O-N 3.11Å; Y316-K318 VanDerWaalsContact C-N 3.29Å; Y316-K318 HydrophobicContact CD1-CB 4.2Å; Y316-K318 HydrophobicContact CE1-CB 4.11Å; Y316-K318 PolarHBondContact O-N 2.88Å
317	R	38.6	Very low	39.6	Very low	217 Å²	217	104.1 Å²	104.1	82%	0.819	55%	0.545	S	S	*	.			trans	-68.1	88.8	164.5	-74.6	-172.6	171.5	177.1	-0.3	109.9	G315 K319	G315-R317 PolarHBondContact O-N 2.98Å; R317-K319 PolarHBondContact O-N 3.42Å
318	K	36.3	Very low	40	Very low	67 Å²	67	104.3 Å²	104.3	29%	0.291	55%	0.546	S	S	.	.			trans	-48.7	109.9	169.9	-178.7	171.5	179.7	172.6	0	108.1	E305 L311 Y316 T320	E305-K318 IonicContact OE1-NZ 3.57Å; E305-K318 PolarHBondContact OE1-NZ 2.8Å; L311-K318 HydrophobicContact CD2-CB 4.41Å; Y316-K318 VanDerWaalsContact C-N 3.29Å; Y316-K318 HydrophobicContact CD1-CB 4.2Å; Y316-K318 HydrophobicContact CE1-CB 4.11Å; Y316-K318 PolarHBondContact O-N 2.88Å; K318-T320 PolarHBondContact O-N 2.92Å
319	K	37.7	Very low	40.8	Very low	158 Å²	158	103.5 Å²	103.5	69%	0.687	54%	0.537	S	S	*	.			trans	-61	110	169.4	-92.6	-175.1	175.1	177.2	0	107	R317 S321	R317-K319 PolarHBondContact O-N 3.42Å; K319-S321 PolarHBondContact O-N 3.11Å
320	T	37.5	Very low	41.7	Very low	110 Å²	110	106 Å²	106	68%	0.675	54%	0.537	S	S	*	.			trans	-73.9	61.3	173.2	39.9	0	0	0	0	110.5	K318 E322	K318-T320 PolarHBondContact O-N 2.92Å; T320-E322 CarbonylContact C-O 3.59Å
321	S	36.9	Very low	42.8	Very low	114 Å²	114	105 Å²	105	80%	0.797	54%	0.539	S	S	*	.			trans	-68.1	-24.3	166.2	49.5	0	0	0	0	111.5	K319 Q323	K319-S321 PolarHBondContact O-N 3.11Å; S321-Q323 PolarHBondContact O-N 3.24Å
322	E	40.3	Very low	44.3	Very low	141 Å²	141	111.7 Å²	111.7	66%	0.659	56%	0.563	S	S	*	*	S	Bend	trans	-73.5	102	155.1	-66.5	179.6	155.6	0	0	107.8	T320	T320-E322 CarbonylContact C-O 3.59Å
323	Q	39.3	Very low	45.6	Very low	111 Å²	111	108.6 Å²	108.6	52%	0.519	55%	0.553	S	S	.	*			trans	-54.2	123	159.2	-70.6	-179.6	-22.1	0	0	106.7	S321 I325 M327	S321-Q323 PolarHBondContact O-N 3.24Å; Q323-I325 PolarHBondContact O-N 3.23Å; Q323-M327 HydrophobicContact CG-SD 4.33Å
324	P	43.5	Very low	47.2	Very low	65 Å²	65	105.5 Å²	105.5	42%	0.422	54%	0.544	S	S	.	.			trans	-59.7	145.9	179.8	25.8	-33.6	0	0	0	108.2	T326 M327 L328	P324-T326 CarbonylContact O-C 3.51Å; P324-T326 PolarHBondContact O-N 2.89Å; P324-M327 HydrophobicContact CG-CB 3.8Å; P324-M327 WeakPolarHBondContact O-CA 3.28Å; P324-M327 WeakPolarHBondContact O-CB 3.45Å; P324-M327 PolarHBondContact O-N 3.37Å; P324-L328 PolarHBondContact O-N 3.03Å; P324-L328 VanDerWaalsContact O-N 3.11Å
325	I	51.1	Low	48.9	Very low	137 Å²	137	105.8 Å²	105.8	70%	0.703	55%	0.546	S	S	*	.	H	α-helix	trans	-56.5	-27.4	-174.8	-62.3	173.3	0	0	0	110.6	Q323 L328 L329	Q323-I325 PolarHBondContact O-N 3.23Å; I325-L328 PolarHBondContact O-N 3.49Å; I325-L329 HydrophobicContact CG2-CD1 4Å; I325-L329 HydrophobicContact CG2-CG 4.3Å; I325-L329 WeakPolarHBondContact O-CB 3.37Å; I325-L329 WeakPolarHBondContact O-CD1 3.12Å; I325-L329 WeakPolarHBondContact O-CG 3.23Å; I325-L329 PolarHBondContact O-N 2.62Å
326	T	47.6	Very low	50.7	Low	95 Å²	95	109.8 Å²	109.8	58%	0.583	55%	0.551	S	S	*	*	H	α-helix	trans	-62.2	-40.4	169.5	53.5	0	0	0	0	114.4	P324 F330	P324-T326 CarbonylContact O-C 3.51Å; P324-T326 PolarHBondContact O-N 2.89Å; T326-F330 WeakPolarHBondContact O-CB 3.11Å; T326-F330 WeakPolarHBondContact O-CD2 3.33Å; T326-F330 PolarHBondContact O-N 3.42Å
327	M	46.7	Very low	52.6	Low	108 Å²	108	113 Å²	113	53%	0.532	56%	0.563	S	S	.	*	H	α-helix	trans	-72.2	-38.7	175.4	-173.3	-179.7	-165.9	0	0	111.5	Q323 P324 F330 A331	Q323-M327 HydrophobicContact CG-SD 4.33Å; P324-M327 HydrophobicContact CG-CB 3.8Å; P324-M327 WeakPolarHBondContact O-CA 3.28Å; P324-M327 WeakPolarHBondContact O-CB 3.45Å; P324-M327 PolarHBondContact O-N 3.37Å; M327-F330 PolarHBondContact O-N 2.61Å; M327-A331 WeakPolarHBondContact O-CB 3.49Å; M327-A331 PolarHBondContact O-N 3.33Å
328	L	52.1	Low	54.1	Low	88 Å²	88	108.3 Å²	108.3	46%	0.461	55%	0.553	S	S	.	*	H	α-helix	trans	-68.6	-37.8	175.6	-159.7	150.3	0	0	0	110.8	P324 I325 A331 Y332	P324-L328 PolarHBondContact O-N 3.03Å; P324-L328 VanDerWaalsContact O-N 3.11Å; I325-L328 PolarHBondContact O-N 3.49Å; L328-A331 PolarHBondContact O-N 3.34Å; L328-Y332 HydrophobicContact CD2-CD2 4.37Å; L328-Y332 WeakPolarHBondContact O-CB 3.43Å; L328-Y332 PolarHBondContact O-N 2.95Å
329	L	57.1	Low	55.9	Low	101 Å²	101	108.7 Å²	108.7	53%	0.529	56%	0.564	S	S	.	*	H	α-helix	trans	-63.5	-43.7	168	-78.2	167.6	0	0	0	112.2	I325 A331 Y332 V333	I325-L329 HydrophobicContact CG2-CD1 4Å; I325-L329 HydrophobicContact CG2-CG 4.3Å; I325-L329 WeakPolarHBondContact O-CB 3.37Å; I325-L329 WeakPolarHBondContact O-CD1 3.12Å; I325-L329 WeakPolarHBondContact O-CG 3.23Å; I325-L329 PolarHBondContact O-N 2.62Å; L329-A331 VanDerWaalsContact C-N 3.31Å; L329-A331 PolarHBondContact O-N 3.01Å; L329-Y332 PolarHBondContact O-N 2.92Å; L329-V333 WeakPolarHBondContact O-CB 3.36Å; L329-V333 VanDerWaalsContact O-CG2 3.28Å; L329-V333 WeakPolarHBondContact O-CG2 3.41Å; L329-V333 PolarHBondContact O-N 2.88Å
330	F	59.1	Low	57.7	Low	138 Å²	138	104.6 Å²	104.6	61%	0.605	55%	0.55	S	S	*	.	H	α-helix	trans	-62	-39.2	174.9	-107.9	-80.9	0	0	0	111.6	T326 M327 N334	T326-F330 WeakPolarHBondContact O-CB 3.11Å; T326-F330 WeakPolarHBondContact O-CD2 3.33Å; T326-F330 PolarHBondContact O-N 3.42Å; M327-F330 PolarHBondContact O-N 2.61Å; F330-N334 WeakPolarHBondContact O-CB 3.08Å; F330-N334 VanDerWaalsContact O-CG 3.24Å; F330-N334 PolarHBondContact O-N 3.33Å; F330-N334 PolarHBondContact O-ND2 2.58Å
331	A	59.5	Low	59.6	Low	48 Å²	48	103 Å²	103	40%	0.397	54%	0.536	S	S	.	.	H	α-helix	trans	-64.7	-41.9	173	0	0	0	0	0	111.5	M327 L328 L329 T335	M327-A331 WeakPolarHBondContact O-CB 3.49Å; M327-A331 PolarHBondContact O-N 3.33Å; L328-A331 PolarHBondContact O-N 3.34Å; L329-A331 VanDerWaalsContact C-N 3.31Å; L329-A331 PolarHBondContact O-N 3.01Å; A331-T335 WeakPolarHBondContact O-CB 3.43Å; A331-T335 WeakPolarHBondContact O-CG2 3.47Å; A331-T335 PolarHBondContact O-N 2.87Å; A331-T335 PolarHBondContact O-OG1 3.25Å
332	Y	66.9	Low	61.5	Low	167 Å²	167	102.8 Å²	102.8	66%	0.655	53%	0.525	S	S	*	.	H	α-helix	trans	-66.5	-40.9	176.6	-126.8	-82.6	0	0	0	112.5	L328 L329 T335 F336	L328-Y332 HydrophobicContact CD2-CD2 4.37Å; L328-Y332 WeakPolarHBondContact O-CB 3.43Å; L328-Y332 PolarHBondContact O-N 2.95Å; L329-Y332 PolarHBondContact O-N 2.92Å; Y332-T335 WeakPolarHBondContact CA-OG1 2.95Å; Y332-T335 PolarHBondContact O-OG1 2.85Å; Y332-F336 WeakPolarHBondContact O-CB 3.42Å; Y332-F336 PolarHBondContact O-N 3.26Å
333	V	69.6	Low	63.2	Low	68 Å²	68	99.3 Å²	99.3	41%	0.412	52%	0.515	S	S	.	.	H	α-helix	trans	-68.4	-45.4	177.3	167.8	0	0	0	0	110.4	L329 F336 W337	L329-V333 WeakPolarHBondContact O-CB 3.36Å; L329-V333 VanDerWaalsContact O-CG2 3.28Å; L329-V333 WeakPolarHBondContact O-CG2 3.41Å; L329-V333 PolarHBondContact O-N 2.88Å; V333-F336 PolarHBondContact O-N 2.91Å; V333-W337 WeakPolarHBondContact O-CB 2.92Å; V333-W337 PolarHBondContact O-N 3.17Å
334	N	69.1	Low	65.1	Low	86 Å²	86	98.2 Å²	98.2	46%	0.46	51%	0.512	S	S	.	.	H	α-helix	trans	-67	-40.2	177	-74.5	-18.6	0	0	0	112.4	F330 W337 L338	F330-N334 WeakPolarHBondContact O-CB 3.08Å; F330-N334 VanDerWaalsContact O-CG 3.24Å; F330-N334 PolarHBondContact O-N 3.33Å; F330-N334 PolarHBondContact O-ND2 2.58Å; N334-W337 PolarHBondContact O-N 3.09Å; N334-L338 WeakPolarHBondContact O-CB 2.94Å; N334-L338 WeakPolarHBondContact O-CD1 3.45Å; N334-L338 VanDerWaalsContact O-CG 3.27Å; N334-L338 WeakPolarHBondContact O-CG 3.42Å; N334-L338 PolarHBondContact O-N 2.97Å
335	T	72.1	Confident	66.8	Low	84 Å²	84	99.9 Å²	99.9	52%	0.515	52%	0.517	S	S	.	.	H	α-helix	trans	-69.2	-35.9	175	49.9	0	0	0	0	112	A331 Y332 L338 S339	A331-T335 WeakPolarHBondContact O-CB 3.43Å; A331-T335 WeakPolarHBondContact O-CG2 3.47Å; A331-T335 PolarHBondContact O-N 2.87Å; A331-T335 PolarHBondContact O-OG1 3.25Å; Y332-T335 WeakPolarHBondContact CA-OG1 2.95Å; Y332-T335 PolarHBondContact O-OG1 2.85Å; T335-L338 PolarHBondContact O-N 3.47Å; T335-S339 WeakPolarHBondContact O-CB 3.44Å; T335-S339 PolarHBondContact O-N 3.21Å
336	F	71.9	Confident	68.3	Low	127 Å²	127	97.4 Å²	97.4	56%	0.557	50%	0.504	S	S	*	.	H	α-helix	trans	-62.7	-50	171.2	-174.2	-97.7	0	0	0	111.7	Y332 V333 L338 S339 L340	Y332-F336 WeakPolarHBondContact O-CB 3.42Å; Y332-F336 PolarHBondContact O-N 3.26Å; V333-F336 PolarHBondContact O-N 2.91Å; F336-L338 PolarHBondContact O-N 2.01Å; F336-S339 PolarHBondContact O-N 2.86Å; F336-S339 VanDerWaalsContact O-N 3.16Å; F336-S339 PolarHBondContact O-OG 2.97Å; F336-L340 HydrophobicContact CE1-CD1 4.17Å; F336-L340 HydrophobicContact CZ-CD1 4.36Å; F336-L340 WeakPolarHBondContact O-CB 3.5Å; F336-L340 PolarHBondContact O-N 2.65Å; F336-L340 VanDerWaalsContact O-N 3.08Å
337	W	71.3	Confident	69.9	Low	143 Å²	143	97.9 Å²	97.9	54%	0.542	50%	0.503	S	S	.	.	H	α-helix	trans	-59.2	-43.8	175.1	-82.5	115.3	0	0	0	112.4	V333 N334 S339 L340 I341	V333-W337 WeakPolarHBondContact O-CB 2.92Å; V333-W337 PolarHBondContact O-N 3.17Å; N334-W337 PolarHBondContact O-N 3.09Å; W337-S339 PolarHBondContact O-N 2.84Å; W337-L340 PolarHBondContact O-N 3.03Å; W337-I341 HydrophobicContact CB-CD1 4.3Å; W337-I341 HydrophobicContact CE3-CD1 4.09Å; W337-I341 HydrophobicContact CE3-CG1 4.38Å; W337-I341 VanDerWaalsContact O-CB 3.31Å; W337-I341 WeakPolarHBondContact O-CB 3.39Å; W337-I341 VanDerWaalsContact O-CG1 3.25Å; W337-I341 WeakPolarHBondContact O-CG1 3.43Å; W337-I341 PolarHBondContact O-N 3.27Å
338	L	70.7	Confident	71.6	Confident	118 Å²	118	97 Å²	97	62%	0.618	50%	0.499	S	S	*	.	H	α-helix	trans	-60.6	-43.3	174.2	-77.2	165	0	0	0	111.7	N334 T335 F336 L340 L342	N334-L338 WeakPolarHBondContact O-CB 2.94Å; N334-L338 WeakPolarHBondContact O-CD1 3.45Å; N334-L338 VanDerWaalsContact O-CG 3.27Å; N334-L338 WeakPolarHBondContact O-CG 3.42Å; N334-L338 PolarHBondContact O-N 2.97Å; T335-L338 PolarHBondContact O-N 3.47Å; F336-L338 PolarHBondContact O-N 2.01Å; L338-L340 PolarHBondContact O-N 2.91Å; L338-L342 WeakPolarHBondContact O-CB 3.35Å; L338-L342 PolarHBondContact O-N 3.25Å
339	S	73.8	Confident	73	Confident	75 Å²	75	99.2 Å²	99.2	52%	0.524	51%	0.505	S	S	.	.	H	α-helix	trans	-64.1	-22.8	177.8	79.2	0	0	0	0	113.8	T335 F336 W337 P343	T335-S339 WeakPolarHBondContact O-CB 3.44Å; T335-S339 PolarHBondContact O-N 3.21Å; F336-S339 PolarHBondContact O-N 2.86Å; F336-S339 VanDerWaalsContact O-N 3.16Å; F336-S339 PolarHBondContact O-OG 2.97Å; W337-S339 PolarHBondContact O-N 2.84Å; S339-P343 WeakPolarHBondContact O-CD 3.44Å; S339-P343 VanDerWaalsContact O-CG 3.25Å; S339-P343 WeakPolarHBondContact O-CG 3.27Å
340	L	75.4	Confident	74.3	Confident	73 Å²	73	98.5 Å²	98.5	38%	0.382	50%	0.501	S	S	.	.	H	α-helix	trans	-97.9	-36	-178.6	-166.2	147.6	0	0	0	112.2	F336 W337 L338 P343 I344	F336-L340 HydrophobicContact CE1-CD1 4.17Å; F336-L340 HydrophobicContact CZ-CD1 4.36Å; F336-L340 WeakPolarHBondContact O-CB 3.5Å; F336-L340 PolarHBondContact O-N 2.65Å; F336-L340 VanDerWaalsContact O-N 3.08Å; W337-L340 PolarHBondContact O-N 3.03Å; L338-L340 PolarHBondContact O-N 2.91Å; L340-P343 WeakPolarHBondContact O-CD 3.16Å; L340-P343 WeakPolarHBondContact O-CG 3.44Å; L340-I344 HydrophobicContact CD2-CD1 3.84Å; L340-I344 VanDerWaalsContact O-CD1 3.31Å; L340-I344 WeakPolarHBondContact O-CD1 3.4Å; L340-I344 VanDerWaalsContact O-CG1 3.31Å; L340-I344 WeakPolarHBondContact O-CG1 3.31Å
341	I	77.7	Confident	75.4	Confident	77 Å²	77	95.8 Å²	95.8	40%	0.395	49%	0.492	S	S	.	.	H	α-helix	trans	-74.7	-40.7	177.3	-68.7	167.1	0	0	0	111.4	W337 I344 L345	W337-I341 HydrophobicContact CB-CD1 4.3Å; W337-I341 HydrophobicContact CE3-CD1 4.09Å; W337-I341 HydrophobicContact CE3-CG1 4.38Å; W337-I341 VanDerWaalsContact O-CB 3.31Å; W337-I341 WeakPolarHBondContact O-CB 3.39Å; W337-I341 VanDerWaalsContact O-CG1 3.25Å; W337-I341 WeakPolarHBondContact O-CG1 3.43Å; W337-I341 PolarHBondContact O-N 3.27Å; I341-I344 PolarHBondContact O-N 3.19Å; I341-L345 HydrophobicContact CG2-CD1 3.76Å; I341-L345 HydrophobicContact CG2-CG 4.09Å; I341-L345 WeakPolarHBondContact O-CG 3.43Å; I341-L345 PolarHBondContact O-N 2.84Å
342	L	76	Confident	76.4	Confident	108 Å²	108	96.7 Å²	96.7	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-57.6	-49.2	-178.5	-170.3	70.3	0	0	0	113.7	L338 I344 L345 I346	L338-L342 WeakPolarHBondContact O-CB 3.35Å; L338-L342 PolarHBondContact O-N 3.25Å; L342-I344 VanDerWaalsContact C-N 3.31Å; L342-I344 PolarHBondContact O-N 2.92Å; L342-L345 PolarHBondContact O-N 2.87Å; L342-I346 HydrophobicContact CG-CD1 4.05Å; L342-I346 VanDerWaalsContact O-CG1 3.31Å; L342-I346 WeakPolarHBondContact O-CG1 3.43Å; L342-I346 PolarHBondContact O-N 2.83Å
343	P	76.9	Confident	77.1	Confident	69 Å²	69	92.6 Å²	92.6	45%	0.448	48%	0.481	S	S	.	.	H	α-helix	trans	-67.2	-29.8	176.4	26.6	-35.1	0	0	0	113	S339 L340 I346 L347	S339-P343 WeakPolarHBondContact O-CD 3.44Å; S339-P343 VanDerWaalsContact O-CG 3.25Å; S339-P343 WeakPolarHBondContact O-CG 3.27Å; L340-P343 WeakPolarHBondContact O-CD 3.16Å; L340-P343 WeakPolarHBondContact O-CG 3.44Å; P343-I346 PolarHBondContact O-N 2.78Å; P343-L347 WeakPolarHBondContact O-CB 3.37Å; P343-L347 PolarHBondContact O-N 3.12Å
344	I	79.7	Confident	77.7	Confident	87 Å²	87	94.5 Å²	94.5	45%	0.446	49%	0.489	S	S	.	.	H	α-helix	trans	-66.4	-44.9	174	-67.1	171.5	0	0	0	110.3	L340 I341 L342 L347 I348	L340-I344 HydrophobicContact CD2-CD1 3.84Å; L340-I344 VanDerWaalsContact O-CD1 3.31Å; L340-I344 WeakPolarHBondContact O-CD1 3.4Å; L340-I344 VanDerWaalsContact O-CG1 3.31Å; L340-I344 WeakPolarHBondContact O-CG1 3.31Å; I341-I344 PolarHBondContact O-N 3.19Å; L342-I344 VanDerWaalsContact C-N 3.31Å; L342-I344 PolarHBondContact O-N 2.92Å; I344-L347 PolarHBondContact O-N 2.74Å; I344-I348 HydrophobicContact CG2-CD1 3.85Å; I344-I348 VanDerWaalsContact O-CG1 3.29Å; I344-I348 WeakPolarHBondContact O-CG1 3.05Å; I344-I348 PolarHBondContact O-N 2.86Å
345	L	79.8	Confident	78.3	Confident	100 Å²	100	94.9 Å²	94.9	52%	0.524	49%	0.49	S	S	.	.	H	α-helix	trans	-62.2	-42.6	174.7	-71.9	173.7	0	0	0	111.9	I341 L342 I348 F349	I341-L345 HydrophobicContact CG2-CD1 3.76Å; I341-L345 HydrophobicContact CG2-CG 4.09Å; I341-L345 WeakPolarHBondContact O-CG 3.43Å; I341-L345 PolarHBondContact O-N 2.84Å; L342-L345 PolarHBondContact O-N 2.87Å; L345-I348 PolarHBondContact O-N 3.05Å; L345-F349 WeakPolarHBondContact O-CB 3.32Å; L345-F349 PolarHBondContact O-N 3.34Å
346	I	81.8	Confident	78.5	Confident	86 Å²	86	94.6 Å²	94.6	44%	0.441	49%	0.491	S	S	.	.	H	α-helix	trans	-62.3	-42.4	175.4	-69.2	165.5	0	0	0	110.9	L342 P343 F349 I350	L342-I346 HydrophobicContact CG-CD1 4.05Å; L342-I346 VanDerWaalsContact O-CG1 3.31Å; L342-I346 WeakPolarHBondContact O-CG1 3.43Å; L342-I346 PolarHBondContact O-N 2.83Å; P343-I346 PolarHBondContact O-N 2.78Å; I346-F349 PolarHBondContact O-N 3.27Å; I346-I350 HydrophobicContact CG2-CD1 3.8Å; I346-I350 HydrophobicContact CG2-CG1 4.47Å; I346-I350 VanDerWaalsContact O-CG1 3.31Å; I346-I350 WeakPolarHBondContact O-CG1 3.27Å; I346-I350 PolarHBondContact O-N 3.27Å
347	L	80.9	Confident	78.8	Confident	105 Å²	105	91.9 Å²	91.9	55%	0.55	48%	0.484	S	S	.	.	H	α-helix	trans	-62.1	-45.5	176.5	-170.1	75.7	0	0	0	111.5	P343 I344 F349 I350 I351	P343-L347 WeakPolarHBondContact O-CB 3.37Å; P343-L347 PolarHBondContact O-N 3.12Å; I344-L347 PolarHBondContact O-N 2.74Å; L347-F349 VanDerWaalsContact C-N 3.32Å; L347-F349 PolarHBondContact O-N 2.87Å; L347-I350 PolarHBondContact O-N 2.9Å; L347-I351 HydrophobicContact CD2-CD1 4.44Å; L347-I351 HydrophobicContact CG-CD1 3.98Å; L347-I351 WeakPolarHBondContact O-CB 3.42Å; L347-I351 VanDerWaalsContact O-CG1 3.26Å; L347-I351 WeakPolarHBondContact O-CG1 3.2Å; L347-I351 PolarHBondContact O-N 2.66Å
348	I	83.1	Confident	79.1	Confident	90 Å²	90	92.3 Å²	92.3	46%	0.462	49%	0.487	S	S	.	.	H	α-helix	trans	-63.1	-38.5	176.2	-68	165.6	0	0	0	111	I344 L345 I351 T352	I344-I348 HydrophobicContact CG2-CD1 3.85Å; I344-I348 VanDerWaalsContact O-CG1 3.29Å; I344-I348 WeakPolarHBondContact O-CG1 3.05Å; I344-I348 PolarHBondContact O-N 2.86Å; L345-I348 PolarHBondContact O-N 3.05Å; I348-I351 PolarHBondContact O-N 3.15Å; I348-T352 WeakPolarHBondContact O-CB 3.3Å; I348-T352 WeakPolarHBondContact O-CG2 3.39Å; I348-T352 PolarHBondContact O-N 2.67Å; I348-T352 PolarHBondContact O-OG1 2.86Å
349	F	79.9	Confident	79.2	Confident	134 Å²	134	93.8 Å²	93.8	59%	0.588	49%	0.488	S	S	*	.	H	α-helix	trans	-66.3	-42.7	176.3	-169.9	-112.1	0	0	0	112	L345 I346 L347 T352 I353	L345-F349 WeakPolarHBondContact O-CB 3.32Å; L345-F349 PolarHBondContact O-N 3.34Å; I346-F349 PolarHBondContact O-N 3.27Å; L347-F349 VanDerWaalsContact C-N 3.32Å; L347-F349 PolarHBondContact O-N 2.87Å; F349-T352 WeakPolarHBondContact CA-OG1 3.23Å; F349-T352 PolarHBondContact O-N 3.08Å; F349-T352 PolarHBondContact O-OG1 3.08Å; F349-T352 VanDerWaalsContact O-OG1 3.09Å; F349-I353 HydrophobicContact CD1-CD1 3.8Å; F349-I353 HydrophobicContact CE1-CD1 3.42Å; F349-I353 VanDerWaalsContact CE1-CD1 3.42Å; F349-I353 HydrophobicContact CE1-CG1 4.48Å; F349-I353 HydrophobicContact CE2-CD1 4.42Å; F349-I353 HydrophobicContact CG-CD1 4.45Å; F349-I353 HydrophobicContact CZ-CD1 3.78Å; F349-I353 WeakPolarHBondContact O-CB 3.22Å; F349-I353 WeakPolarHBondContact O-CG1 3.44Å; F349-I353 PolarHBondContact O-N 2.05Å
350	I	84.6	Confident	79	Confident	85 Å²	85	95.5 Å²	95.5	44%	0.436	49%	0.491	S	S	.	.	H	α-helix	trans	-63.7	-44.8	174.3	-69.2	166.2	0	0	0	110.7	I346 L347 T352 I353 L354	I346-I350 HydrophobicContact CG2-CD1 3.8Å; I346-I350 HydrophobicContact CG2-CG1 4.47Å; I346-I350 VanDerWaalsContact O-CG1 3.31Å; I346-I350 WeakPolarHBondContact O-CG1 3.27Å; I346-I350 PolarHBondContact O-N 3.27Å; L347-I350 PolarHBondContact O-N 2.9Å; I350-T352 PolarHBondContact O-N 3.12Å; I350-I353 PolarHBondContact O-N 2.93Å; I350-L354 HydrophobicContact CG2-CD1 3.88Å; I350-L354 HydrophobicContact CG2-CG 4.42Å; I350-L354 WeakPolarHBondContact O-CB 3.46Å; I350-L354 VanDerWaalsContact O-CG 3.28Å; I350-L354 WeakPolarHBondContact O-CG 3.28Å; I350-L354 PolarHBondContact O-N 3.04Å
351	I	83.5	Confident	78.6	Confident	81 Å²	81	97.1 Å²	97.1	42%	0.415	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-42.9	177.3	-70.6	166	0	0	0	111.2	L347 I348 L354 L355	L347-I351 HydrophobicContact CD2-CD1 4.44Å; L347-I351 HydrophobicContact CG-CD1 3.98Å; L347-I351 WeakPolarHBondContact O-CB 3.42Å; L347-I351 VanDerWaalsContact O-CG1 3.26Å; L347-I351 WeakPolarHBondContact O-CG1 3.2Å; L347-I351 PolarHBondContact O-N 2.66Å; I348-I351 PolarHBondContact O-N 3.15Å; I351-L354 PolarHBondContact O-N 2.85Å; I351-L355 HydrophobicContact CG2-CD1 3.92Å; I351-L355 HydrophobicContact CG2-CG 4.46Å; I351-L355 WeakPolarHBondContact O-CB 3.34Å; I351-L355 VanDerWaalsContact O-CG 3.27Å; I351-L355 WeakPolarHBondContact O-CG 3.42Å; I351-L355 PolarHBondContact O-N 2.88Å
352	T	79.4	Confident	77.9	Confident	68 Å²	68	98.2 Å²	98.2	42%	0.417	50%	0.501	S	S	.	.	H	α-helix	trans	-70.4	-36.1	178.4	47.4	0	0	0	0	112.5	I348 F349 I350 L355 C356	I348-T352 WeakPolarHBondContact O-CB 3.3Å; I348-T352 WeakPolarHBondContact O-CG2 3.39Å; I348-T352 PolarHBondContact O-N 2.67Å; I348-T352 PolarHBondContact O-OG1 2.86Å; F349-T352 WeakPolarHBondContact CA-OG1 3.23Å; F349-T352 PolarHBondContact O-N 3.08Å; F349-T352 PolarHBondContact O-OG1 3.08Å; F349-T352 VanDerWaalsContact O-OG1 3.09Å; I350-T352 PolarHBondContact O-N 3.12Å; T352-L355 PolarHBondContact O-N 3.17Å; T352-C356 WeakPolarHBondContact O-CB 3.32Å; T352-C356 PolarHBondContact O-N 2.9Å
353	I	82.2	Confident	76.9	Confident	80 Å²	80	101.8 Å²	101.8	41%	0.41	51%	0.507	S	S	.	.	H	α-helix	trans	-60.6	-48.9	168.4	-75.2	174.7	0	0	0	110.8	F349 I350 L355 C356 V357	F349-I353 HydrophobicContact CD1-CD1 3.8Å; F349-I353 HydrophobicContact CE1-CD1 3.42Å; F349-I353 VanDerWaalsContact CE1-CD1 3.42Å; F349-I353 HydrophobicContact CE1-CG1 4.48Å; F349-I353 HydrophobicContact CE2-CD1 4.42Å; F349-I353 HydrophobicContact CG-CD1 4.45Å; F349-I353 HydrophobicContact CZ-CD1 3.78Å; F349-I353 WeakPolarHBondContact O-CB 3.22Å; F349-I353 WeakPolarHBondContact O-CG1 3.44Å; F349-I353 PolarHBondContact O-N 2.05Å; I350-I353 PolarHBondContact O-N 2.93Å; I353-L355 VanDerWaalsContact C-N 3.31Å; I353-L355 PolarHBondContact O-N 2.68Å; I353-C356 PolarHBondContact O-N 3Å; I353-C356 VanDerWaalsContact O-N 3.15Å; I353-V357 HydrophobicContact CG2-CG2 4.27Å; I353-V357 WeakPolarHBondContact O-CB 3.25Å; I353-V357 WeakPolarHBondContact O-CG2 3.38Å; I353-V357 PolarHBondContact O-N 2.91Å
354	L	82.2	Confident	76	Confident	108 Å²	108	106.2 Å²	106.2	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-60.8	-39.3	178.5	-73.9	169.2	0	0	0	112	I350 I351 Y358	I350-L354 HydrophobicContact CG2-CD1 3.88Å; I350-L354 HydrophobicContact CG2-CG 4.42Å; I350-L354 WeakPolarHBondContact O-CB 3.46Å; I350-L354 VanDerWaalsContact O-CG 3.28Å; I350-L354 WeakPolarHBondContact O-CG 3.28Å; I350-L354 PolarHBondContact O-N 3.04Å; I351-L354 PolarHBondContact O-N 2.85Å; L354-Y358 WeakPolarHBondContact O-CB 3.29Å; L354-Y358 PolarHBondContact O-N 2.86Å
355	L	81.5	Confident	74.7	Confident	95 Å²	95	112.3 Å²	112.3	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-67.7	-37.3	174.4	-73.2	169.2	0	0	0	112.7	I351 T352 I353 K359	I351-L355 HydrophobicContact CG2-CD1 3.92Å; I351-L355 HydrophobicContact CG2-CG 4.46Å; I351-L355 WeakPolarHBondContact O-CB 3.34Å; I351-L355 VanDerWaalsContact O-CG 3.27Å; I351-L355 WeakPolarHBondContact O-CG 3.42Å; I351-L355 PolarHBondContact O-N 2.88Å; T352-L355 PolarHBondContact O-N 3.17Å; I353-L355 VanDerWaalsContact C-N 3.31Å; I353-L355 PolarHBondContact O-N 2.68Å; L355-K359 WeakPolarHBondContact O-CB 3.13Å; L355-K359 WeakPolarHBondContact O-CG 3.49Å; L355-K359 PolarHBondContact O-N 3.18Å
356	C	76.1	Confident	73.2	Confident	77 Å²	77	112.8 Å²	112.8	52%	0.52	54%	0.537	S	S	.	.	H	α-helix	trans	-66.7	-47	172.9	-89.6	0	0	0	0	111.8	T352 I353 Y358 K359 L360	T352-C356 WeakPolarHBondContact O-CB 3.32Å; T352-C356 PolarHBondContact O-N 2.9Å; I353-C356 PolarHBondContact O-N 3Å; I353-C356 VanDerWaalsContact O-N 3.15Å; C356-Y358 VanDerWaalsContact C-N 3.33Å; C356-Y358 PolarHBondContact O-N 2.91Å; C356-K359 PolarHBondContact O-N 2.84Å; C356-L360 WeakPolarHBondContact O-CB 3.28Å; C356-L360 VanDerWaalsContact O-CG 3.29Å; C356-L360 WeakPolarHBondContact O-CG 3.38Å; C356-L360 PolarHBondContact O-N 3.14Å
357	V	79.4	Confident	71.3	Confident	70 Å²	70	113 Å²	113	42%	0.424	55%	0.546	S	S	.	.	H	α-helix	trans	-60.7	-42.8	174.9	171.5	0	0	0	0	110.6	I353 L360 L361	I353-V357 HydrophobicContact CG2-CG2 4.27Å; I353-V357 WeakPolarHBondContact O-CB 3.25Å; I353-V357 WeakPolarHBondContact O-CG2 3.38Å; I353-V357 PolarHBondContact O-N 2.91Å; V357-L360 PolarHBondContact O-N 3Å; V357-L361 HydrophobicContact CG1-CD1 3.77Å; V357-L361 HydrophobicContact CG1-CG 4.24Å; V357-L361 WeakPolarHBondContact O-CB 3.48Å; V357-L361 VanDerWaalsContact O-CG 3.29Å; V357-L361 WeakPolarHBondContact O-CG 3.39Å; V357-L361 PolarHBondContact O-N 3.24Å
358	Y	76.2	Confident	69.3	Low	153 Å²	153	110.8 Å²	110.8	60%	0.6	55%	0.548	S	S	*	.	H	α-helix	trans	-62.8	-43.6	174.8	-178.4	-108.6	0	0	0	112.4	L354 C356 L360 L361 K362	L354-Y358 WeakPolarHBondContact O-CB 3.29Å; L354-Y358 PolarHBondContact O-N 2.86Å; C356-Y358 VanDerWaalsContact C-N 3.33Å; C356-Y358 PolarHBondContact O-N 2.91Å; Y358-L360 VanDerWaalsContact C-N 3.35Å; Y358-L360 PolarHBondContact O-N 2.92Å; Y358-L361 PolarHBondContact O-N 2.73Å; Y358-K362 WeakPolarHBondContact O-CB 3.49Å; Y358-K362 PolarHBondContact O-N 3.37Å
359	K	73.6	Confident	66.9	Low	148 Å²	148	112.4 Å²	112.4	64%	0.643	56%	0.556	S	S	*	*	H	α-helix	trans	-63.3	-37.5	173.7	-79.2	179.4	177.4	178.4	0	112.5	L355 C356 R363	L355-K359 WeakPolarHBondContact O-CB 3.13Å; L355-K359 WeakPolarHBondContact O-CG 3.49Å; L355-K359 PolarHBondContact O-N 3.18Å; C356-K359 PolarHBondContact O-N 2.84Å; K359-R363 WeakPolarHBondContact O-CB 3.18Å; K359-R363 WeakPolarHBondContact O-CG 3.11Å; K359-R363 PolarHBondContact O-N 3.36Å
360	L	68.7	Low	64.5	Low	112 Å²	112	112 Å²	112	59%	0.586	57%	0.565	S	S	*	*	H	α-helix	trans	-71.8	-41	177.2	-72.7	167.8	0	0	0	112.3	C356 V357 Y358 R363 K364	C356-L360 WeakPolarHBondContact O-CB 3.28Å; C356-L360 VanDerWaalsContact O-CG 3.29Å; C356-L360 WeakPolarHBondContact O-CG 3.38Å; C356-L360 PolarHBondContact O-N 3.14Å; V357-L360 PolarHBondContact O-N 3Å; Y358-L360 VanDerWaalsContact C-N 3.35Å; Y358-L360 PolarHBondContact O-N 2.92Å; L360-R363 PolarHBondContact O-N 3.37Å; L360-K364 PolarHBondContact O-N 3.04Å
361	L	67.9	Low	61.9	Low	106 Å²	106	118.1 Å²	118.1	56%	0.555	58%	0.582	S	S	*	*	H	α-helix	trans	-66.5	-40.5	173.6	-73	171.9	0	0	0	111.6	V357 Y358 K364 R365	V357-L361 HydrophobicContact CG1-CD1 3.77Å; V357-L361 HydrophobicContact CG1-CG 4.24Å; V357-L361 WeakPolarHBondContact O-CB 3.48Å; V357-L361 VanDerWaalsContact O-CG 3.29Å; V357-L361 WeakPolarHBondContact O-CG 3.39Å; V357-L361 PolarHBondContact O-N 3.24Å; Y358-L361 PolarHBondContact O-N 2.73Å; L361-K364 PolarHBondContact O-N 3.24Å; L361-R365 PolarHBondContact O-N 2.97Å
362	K	63.1	Low	59.3	Low	100 Å²	100	120.6 Å²	120.6	44%	0.435	60%	0.601	S	S	.	*	H	α-helix	trans	-62.3	-48.3	173.2	-177.9	170.8	173.3	176.1	0	110.8	Y358 K364 R365 E366	Y358-K362 WeakPolarHBondContact O-CB 3.49Å; Y358-K362 PolarHBondContact O-N 3.37Å; K362-K364 VanDerWaalsContact C-N 3.33Å; K362-K364 PolarHBondContact O-N 3.13Å; K362-R365 PolarHBondContact O-N 3.35Å; K362-R365 VanDerWaalsContact O-N 3.07Å; K362-E366 VanDerWaalsContact CE-CD 3.41Å; K362-E366 WeakPolarHBondContact CE-OE1 3.45Å; K362-E366 HydrophobicContact CG-CG 4.43Å; K362-E366 IonicContact NZ-OE1 3.49Å; K362-E366 WeakPolarHBondContact O-CG 3.3Å; K362-E366 PolarHBondContact O-N 3.34Å
363	R	55.4	Low	57	Low	183 Å²	183	122.8 Å²	122.8	69%	0.691	61%	0.614	S	S	*	*	H	α-helix	trans	-57.3	-40.5	172.5	-82.8	-176.9	170	-178.1	-3.4	112.8	K359 L360 E366 S367	K359-R363 WeakPolarHBondContact O-CB 3.18Å; K359-R363 WeakPolarHBondContact O-CG 3.11Å; K359-R363 PolarHBondContact O-N 3.36Å; L360-R363 PolarHBondContact O-N 3.37Å; R363-E366 PolarHBondContact O-N 3.15Å; R363-S367 VanDerWaalsContact O-CB 3.3Å; R363-S367 WeakPolarHBondContact O-CB 3.47Å; R363-S367 PolarHBondContact O-N 3Å; R363-S367 PolarHBondContact O-OG 2.9Å
364	K	56.6	Low	54.6	Low	162 Å²	162	126.9 Å²	126.9	70%	0.704	63%	0.632	S	S	*	*	H	α-helix	trans	-67.5	-30.2	174.5	-83	-168.8	172.3	-173.4	0	113.9	L360 L361 K362 S367	L360-K364 PolarHBondContact O-N 3.04Å; L361-K364 PolarHBondContact O-N 3.24Å; K362-K364 VanDerWaalsContact C-N 3.33Å; K362-K364 PolarHBondContact O-N 3.13Å; K364-S367 PolarHBondContact O-OG 3.21Å
365	R	52.2	Low	52.1	Low	216 Å²	216	127.9 Å²	127.9	82%	0.815	64%	0.642	S	S	*	*	H	α-helix	trans	-72.7	-39.9	171	-100.1	-178	169.1	171.1	-2.9	112	L361 K362 G368	L361-R365 PolarHBondContact O-N 2.97Å; K362-R365 PolarHBondContact O-N 3.35Å; K362-R365 VanDerWaalsContact O-N 3.07Å; R365-G368 PolarHBondContact O-N 2.68Å
366	E	48.6	Very low	49.9	Very low	110 Å²	110	131.1 Å²	131.1	51%	0.514	65%	0.652	S	S	.	*	H	α-helix	trans	-75.2	-34.8	-179.4	-69.9	171.3	155.3	0	0	111.9	K362 R363 G368 I369	K362-E366 VanDerWaalsContact CE-CD 3.41Å; K362-E366 WeakPolarHBondContact CE-OE1 3.45Å; K362-E366 HydrophobicContact CG-CG 4.43Å; K362-E366 IonicContact NZ-OE1 3.49Å; K362-E366 WeakPolarHBondContact O-CG 3.3Å; K362-E366 PolarHBondContact O-N 3.34Å; R363-E366 PolarHBondContact O-N 3.15Å; E366-G368 PolarHBondContact O-N 2.66Å; E366-I369 PolarHBondContact O-N 2.96Å
367	S	42.9	Very low	47.9	Very low	91 Å²	91	134.2 Å²	134.2	64%	0.636	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-1.4	171.3	74.9	0	0	0	0	114.1	R363 K364	R363-S367 VanDerWaalsContact O-CB 3.3Å; R363-S367 WeakPolarHBondContact O-CB 3.47Å; R363-S367 PolarHBondContact O-N 3Å; R363-S367 PolarHBondContact O-OG 2.9Å; K364-S367 PolarHBondContact O-OG 3.21Å
368	G	37.6	Very low	45.4	Very low	58 Å²	58	141.3 Å²	141.3	60%	0.598	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-7.8	174.1	0	0	0	0	0	113.9	R365 E366 V370	R365-G368 PolarHBondContact O-N 2.68Å; E366-G368 PolarHBondContact O-N 2.66Å; G368-V370 PolarHBondContact O-N 3.11Å
369	I	33.5	Very low	43.5	Very low	123 Å²	123	138.9 Å²	138.9	63%	0.631	69%	0.687	S	S	*	*			trans	-100.2	80.9	-176.1	-53.3	178.6	0	0	0	109.3	E366 R371	E366-I369 PolarHBondContact O-N 2.96Å; I369-R371 HydrophobicContact CG2-CG 4.31Å; I369-R371 PolarHBondContact O-N 3.29Å
370	V	30.1	Very low	41.5	Very low	126 Å²	126	137 Å²	137	76%	0.764	69%	0.689	S	S	*	*			trans	-69.1	95.6	170.8	-178.8	0	0	0	0	108.8	G368 V372	G368-V370 PolarHBondContact O-N 3.11Å; V370-V372 HydrophobicContact CG1-CG2 4.26Å; V370-V372 PolarHBondContact O-N 3.19Å
371	R	29.8	Very low	39.6	Very low	214 Å²	214	138.7 Å²	138.7	81%	0.808	70%	0.698	S	S	*	*			trans	-75.1	101.9	167.1	-75.5	-170.8	174.3	-174.4	-1.6	108.9	I369 T373	I369-R371 HydrophobicContact CG2-CG 4.31Å; I369-R371 PolarHBondContact O-N 3.29Å; R371-T373 PolarHBondContact O-N 2.95Å; R371-T373 VanDerWaalsContact O-N 3.11Å
372	V	29.5	Very low	38	Very low	132 Å²	132	139.2 Å²	139.2	80%	0.8	71%	0.71	S	S	*	*			trans	-70.7	99.9	166.3	-177.9	0	0	0	0	107.9	V370	V370-V372 HydrophobicContact CG1-CG2 4.26Å; V370-V372 PolarHBondContact O-N 3.19Å
373	T	31.1	Very low	36.5	Very low	115 Å²	115	143.2 Å²	143.2	71%	0.706	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-100.1	122.6	164.7	45.9	0	0	0	0	108.5	R371 V375	R371-T373 PolarHBondContact O-N 2.95Å; R371-T373 VanDerWaalsContact O-N 3.11Å; T373-V375 PolarHBondContact O-N 3.19Å
374	E	31.4	Very low	35.3	Very low	165 Å²	165	139.7 Å²	139.7	77%	0.771	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-58.1	133.4	178.9	-61.9	-174.8	140.8	0	0	111.3
375	V	28.6	Very low	34.1	Very low	130 Å²	130	136.9 Å²	136.9	79%	0.788	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-88.5	128.4	167.2	177.5	0	0	0	0	107.7	T373	T373-V375 PolarHBondContact O-N 3.19Å
376	K	35.7	Very low	33.2	Very low	163 Å²	163	133.6 Å²	133.6	71%	0.709	73%	0.733	S	S	*	*			trans	-119.2	111.4	166.2	-75	-173	176.7	177.9	0	110.2
377	D	33.6	Very low	32.6	Very low	142 Å²	142	136 Å²	136	76%	0.759	75%	0.749	S	S	*	*			trans	54.4	117.6	139.8	-48	-39.8	0	0	0	120.3
378	Y	27.9	Very low	32.3	Very low	218 Å²	218	134.7 Å²	134.7	86%	0.855	74%	0.744	S	S	*	*			trans	-60.6	177.1	156.7	-68.1	-86.5	0	0	0	111.3
379	P	36.9	Very low	32.3	Very low	103 Å²	103	138.1 Å²	138.1	67%	0.669	75%	0.753	S	S	*	*			cis	-153.2	174.2	24.5	41.9	-18.5	0	0	0	121
380	T	29.6	Very low	32.3	Very low	109 Å²	109	138.8 Å²	138.8	67%	0.669	76%	0.757	S	S	*	*			trans	63.5	130.8	140.8	47.7	0	0	0	0	125.2
381	N	29.5	Very low	32.6	Very low	146 Å²	146	141 Å²	141	78%	0.781	76%	0.757	S	S	*	*			trans	78.4	107.6	132.9	-59.7	0.5	0	0	0	123.4
382	S	34.6	Very low	32.9	Very low	117 Å²	117	137.5 Å²	137.5	82%	0.818	75%	0.754	S	S	*	*				160.5	132.1	129.7	40.3	0	0	0	0	107.9
383	E	31.8	Very low	33.4	Very low	184 Å²	184	135.4 Å²	135.4	86%	0.86	75%	0.745	S	S	*	*			cis	107.4	132	27.2	-172.5	169.4	-124.7	0	0	111.9
384	S	30.3	Very low	33.7	Very low	110 Å²	110	136.8 Å²	136.8	77%	0.769	75%	0.747	S	S	*	*			trans	67.4	154.8	-177.3	80.4	0	0	0	0	116.6
385	C	30.8	Very low	33.9	Very low	102 Å²	102	135.5 Å²	135.5	69%	0.689	75%	0.745	S	S	*	*			cis	-164.3	151.9	-23.6	-115	0	0	0	0	109.5
386	D	33.7	Very low	34.1	Very low	148 Å²	148	135.3 Å²	135.3	79%	0.791	74%	0.74	S	S	*	*			trans	46.9	146.2	151.4	-49.1	-47.8	0	0	0	120.3
387	D	35.1	Very low	34.1	Very low	159 Å²	159	133.9 Å²	133.9	85%	0.85	74%	0.74	S	S	*	*			cis	-164.7	174.2	48.9	-173.9	20.6	0	0	0	112.7
388	A	38.4	Very low	34.1	Very low	65 Å²	65	134.3 Å²	134.3	54%	0.537	74%	0.737	S	S	.	*			trans	67.9	95.6	152.9	0	0	0	0	0	121.5
389	T	36.7	Very low	34.2	Very low	130 Å²	130	133.5 Å²	133.5	80%	0.798	73%	0.734	S	S	*	*				40.7	148.4	121.2	59	0	0	0	0	122
390	L	33	Very low	34.1	Very low	136 Å²	136	133 Å²	133	71%	0.712	73%	0.732	S	S	*	*			cis	-160.4	149.5	20.1	-157.1	72.4	0	0	0	111.1
391	K	37.1	Very low	34.3	Very low	173 Å²	173	137 Å²	137	75%	0.752	74%	0.74	S	S	*	*			trans	27.3	141.9	149.5	-65.5	175.6	-178.2	178	0	120
392	N	36.8	Very low	34.2	Very low	140 Å²	140	137.1 Å²	137.1	75%	0.749	74%	0.741	S	S	*	*			cis	-178.4	-171	16.2	-114.5	32.6	0	0	0	107.1
393	S	39.7	Very low	34.2	Very low	88 Å²	88	138.6 Å²	138.6	62%	0.615	75%	0.745	S	S	*	*			cis	170.5	145.4	-32.5	67.5	0	0	0	0	107.7
394	I	36.5	Very low	33.9	Very low	145 Å²	145	140.1 Å²	140.1	74%	0.744	74%	0.744	S	S	*	*			cis	-163.4	153.2	-3.4	-140.9	173.4	0	0	0	109.8
395	N	36.2	Very low	34	Very low	138 Å²	138	139.6 Å²	139.6	74%	0.738	74%	0.741	S	S	*	*			trans	57.4	174.8	160.6	-65.5	2.7	0	0	0	121.6
396	N	31.8	Very low	34	Very low	125 Å²	125	142.9 Å²	142.9	67%	0.668	75%	0.746	S	S	*	*				-176.4	167.7	-60.6	-128.1	49.4	0	0	0	110.2
397	D	36.3	Very low	34	Very low	133 Å²	133	142.4 Å²	142.4	71%	0.711	74%	0.744	S	S	*	*			trans	67.5	167.9	156.2	-55	-27.6	0	0	0	120.7
398	H	33.1	Very low	33.8	Very low	151 Å²	151	141.9 Å²	141.9	70%	0.699	74%	0.736	S	S	*	*				-168.8	138.3	-65	-129	2.3	0	0	0	110.8
399	Y	31.4	Very low	33.3	Very low	202 Å²	202	145 Å²	145	79%	0.792	74%	0.743	S	S	*	*			trans	59.9	161.3	166.6	-75.7	-107.2	0	0	0	117.5
400	S	33.6	Very low	33	Very low	91 Å²	91	145 Å²	145	64%	0.636	74%	0.738	S	S	*	*			cis	-171.2	165.7	-32.4	60	0	0	0	0	112.6
401	K	33.3	Very low	33	Very low	193 Å²	193	148.1 Å²	148.1	84%	0.839	75%	0.746	S	S	*	*			trans	92.1	137.4	142.9	-151	173.9	-174.1	-179.5	0	119.2
402	N	28.7	Very low	32.6	Very low	149 Å²	149	150 Å²	150	80%	0.797	75%	0.748	S	S	*	*			trans	-76	163.2	-173.8	-26.4	-17.5	0	0	0	113.3
403	V	33.2	Very low	32.4	Very low	148 Å²	148	151 Å²	151	90%	0.897	75%	0.748	S	S	*	*				-169.9	169.1	121	140.1	0	0	0	0	111.7
404	Y	27.3	Very low	32.1	Very low	216 Å²	216	153.7 Å²	153.7	85%	0.847	76%	0.761	S	S	*	*			trans	-75.6	174.5	-162.7	-119	-110.2	0	0	0	118.6
405	S	32.3	Very low	31.6	Very low	99 Å²	99	152.2 Å²	152.2	69%	0.692	76%	0.763	S	S	*	*			trans	98.4	145.7	147.4	-75.8	0	0	0	0	121.1
406	E	29.7	Very low	31.6	Very low	172 Å²	172	153.6 Å²	153.6	80%	0.804	77%	0.77	S	S	*	*			trans	-68.5	150.8	177.9	-57.7	126.5	116.2	0	0	112.7
407	D	33.2	Very low	31.5	Very low	138 Å²	138	154.5 Å²	154.5	74%	0.738	78%	0.775	S	S	*	*				-166.1	139.3	115.1	-116.3	-11.2	0	0	0	114.5
408	Q	31.2	Very low	31.2	Very low	147 Å²	147	155.6 Å²	155.6	69%	0.687	78%	0.781	S	S	*	*			trans	48.4	118.9	145.1	-55.2	-167	35.9	0	0	125.4
409	L	28	Very low	30.9	Very low	131 Å²	131	157.6 Å²	157.6	69%	0.686	79%	0.788	S	S	*	*				58.8	136.2	123.7	-74.9	111.9	0	0	0	123.3
410	N	30.2	Very low	31.1	Very low	131 Å²	131	156.2 Å²	156.2	70%	0.701	79%	0.789	S	S	*	*			trans	69	106.3	143.6	-64.4	-21.9	0	0	0	120.7
411	K	32.9	Very low	30.8	Very low	200 Å²	200	158.3 Å²	158.3	87%	0.87	79%	0.793	S	S	*	*				-175.2	131.7	100.2	-100.7	160.9	-176.7	170.4	0	116.1
412	R	30.4	Very low	30.8	Very low	212 Å²	212	156.6 Å²	156.6	80%	0.8	79%	0.793	S	S	*	*			trans	42.8	113.8	140.4	-72.1	-169.8	164.3	170	-3	121.6
413	E	30.9	Very low	30.9	Very low	161 Å²	161	155.6 Å²	155.6	75%	0.752	79%	0.788	S	S	*	*				32.3	126.8	102.1	-55.8	167	129.4	0	0	119.5
414	T	34.7	Very low	30.6	Very low	145 Å²	145	155.8 Å²	155.8	89%	0.89	78%	0.784	S	S	*	*				-151.7	135.3	117.7	29.7	0	0	0	0	109.1
415	C	25.8	Very low	30.8	Very low	115 Å²	115	150.3 Å²	150.3	78%	0.777	78%	0.777	S	S	*	*			trans	-85.6	166.7	172.7	-55.9	0	0	0	0	111.1
416	N	35	Very low	30.5	Very low	166 Å²	166	153.7 Å²	153.7	89%	0.888	79%	0.787	S	S	*	*			trans	-153.2	134.1	148.7	-105.4	-6.7	0	0	0	108.2
417	D	29.7	Very low	30.4	Very low	145 Å²	145	149 Å²	149	78%	0.775	79%	0.785	S	S	*	*			trans	-80.2	154.9	177.6	-54.1	-81.9	0	0	0	111.8
418	D	31.5	Very low	30	Very low	156 Å²	156	148.4 Å²	148.4	83%	0.834	79%	0.791	S	S	*	*			trans	-146.8	98.5	157.2	-124.9	-32.1	0	0	0	109.6
419	F	26.9	Very low	29.7	Very low	193 Å²	193	144.6 Å²	144.6	85%	0.846	79%	0.792	S	S	*	*			trans	-102.9	114.6	-179.6	-130.7	-81	0	0	0	108.5
420	Q	33.8	Very low	29.7	Very low	172 Å²	172	145.7 Å²	145.7	80%	0.804	80%	0.799	S	S	*	*			trans	-124.8	111.8	170.6	-73.3	-159	-2.2	0	0	112.4
421	N	28	Very low	29.5	Very low	135 Å²	135	146.1 Å²	146.1	72%	0.722	80%	0.801	S	S	*	*			trans	-67.5	147.4	163.6	-88.2	-30.6	0	0	0	111
422	N	32.8	Very low	29.2	Very low	157 Å²	157	143.6 Å²	143.6	84%	0.84	80%	0.797	S	S	*	*			trans	-153.5	139.2	140.5	-109.3	-47.2	0	0	0	111.8
423	N	30.7	Very low	28.9	Very low	129 Å²	129	143.4 Å²	143.4	69%	0.69	80%	0.798	S	S	*	*			trans	-85.3	145.2	-176.8	-57.6	-47	0	0	0	111.2
424	N	27.9	Very low	28.6	Very low	152 Å²	152	143.5 Å²	143.5	81%	0.813	80%	0.798	S	S	*	*				168.6	165.4	109.5	-89.5	-42.6	0	0	0	115.2
425	S	30.4	Very low	28.1	Very low	100 Å²	100	145.9 Å²	145.9	70%	0.699	80%	0.796	S	S	*	*			trans	69.6	104	156.3	56	0	0	0	0	120.2
426	N	27.7	Very low	28	Very low	170 Å²	170	149.6 Å²	149.6	91%	0.909	80%	0.799	S	S	*	*				40.8	117.9	122	-54.8	-2.2	0	0	0	119.8
427	G	26	Very low	27.5	Very low	74 Å²	74	149.2 Å²	149.2	76%	0.763	80%	0.796	S	S	*	*			trans	164.8	118.9	146.2	0	0	0	0	0	116.6
428	S	26.6	Very low	27.4	Very low	125 Å²	125	148.3 Å²	148.3	87%	0.874	80%	0.798	S	S	*	*			trans	26.7	110	144.1	-170.2	0	0	0	0	118.2
429	G	24.4	Very low	27.2	Very low	68 Å²	68	145.7 Å²	145.7	70%	0.701	79%	0.792	S	S	*	*			trans	-63.7	172.5	-176	0	0	0	0	0	118
430	N	26.9	Very low	27.1	Very low	154 Å²	154	143.3 Å²	143.3	82%	0.824	79%	0.788	S	S	*	*			trans	-154.1	164.1	157.8	-96	-31.1	0	0	0	108.3	D432	N430-D432 PolarHBondContact O-N 3.33Å; N430-D432 VanDerWaalsContact O-N 3.15Å
431	D	27.1	Very low	26.9	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	79%	0.788	S	S	*	*			trans	-78.8	89.5	-173.1	-51.2	-84.2	0	0	0	113.7	Y433	D431-Y433 HydrophobicContact CB-CE2 4.47Å
432	D	26.2	Very low	26.7	Very low	146 Å²	146	141 Å²	141	78%	0.781	79%	0.786	S	S	*	*			trans	-92.2	99.8	173	-94.6	-42.6	0	0	0	112.4	N430 H434	N430-D432 PolarHBondContact O-N 3.33Å; N430-D432 VanDerWaalsContact O-N 3.15Å; D432-H434 PolarHBondContact O-N 2.9Å
433	Y	24.2	Very low	26.5	Very low	209 Å²	209	143.6 Å²	143.6	82%	0.82	79%	0.785	S	S	*	*			trans	-71.6	108.6	172.2	-78.3	-100.8	0	0	0	111	D431 K435	D431-Y433 HydrophobicContact CB-CE2 4.47Å; Y433-K435 PolarHBondContact O-N 2.73Å
434	H	25.1	Very low	26.2	Very low	163 Å²	163	145.2 Å²	145.2	76%	0.755	79%	0.793	S	S	*	*			trans	-65.8	94.6	173.5	-75.5	-56.9	0	0	0	112.2	D432 F436	D432-H434 PolarHBondContact O-N 2.9Å; H434-F436 HydrophobicContact CB-CE2 4.25Å; H434-F436 WeakPolarHBondContact O-CD2 3.46Å; H434-F436 PolarHBondContact O-N 3.24Å; H434-F436 VanDerWaalsContact O-N 3.14Å
435	K	24.3	Very low	26.1	Very low	195 Å²	195	146.6 Å²	146.6	85%	0.848	80%	0.801	S	S	*	*			trans	-79.7	89.7	179.7	-170.7	177.9	-174	175.2	0	111.3	Y433 L437	Y433-K435 PolarHBondContact O-N 2.73Å; K435-L437 PolarHBondContact O-N 3.17Å
436	F	24	Very low	25.9	Very low	192 Å²	192	144.4 Å²	144.4	84%	0.842	79%	0.793	S	S	*	*			trans	-61.4	133.9	173.2	-72.9	-85.9	0	0	0	111.7	H434	H434-F436 HydrophobicContact CB-CE2 4.25Å; H434-F436 WeakPolarHBondContact O-CD2 3.46Å; H434-F436 PolarHBondContact O-N 3.24Å; H434-F436 VanDerWaalsContact O-N 3.14Å
437	L	24.2	Very low	25.8	Very low	159 Å²	159	144.9 Å²	144.9	83%	0.832	79%	0.79	S	S	*	*			trans	-85.7	131.4	173.7	-78.2	154.4	0	0	0	109.2	K435 S439	K435-L437 PolarHBondContact O-N 3.17Å; L437-S439 PolarHBondContact O-N 3.32Å; L437-S439 VanDerWaalsContact O-N 3.1Å
438	P	27	Very low	25.7	Very low	126 Å²	126	148.4 Å²	148.4	82%	0.818	79%	0.79	S	S	*	*			trans	-73.5	102.7	175.8	29.2	-32.8	0	0	0	110.1	D440	P438-D440 PolarHBondContact O-N 3.01Å
439	S	27.8	Very low	25.7	Very low	101 Å²	101	149.2 Å²	149.2	71%	0.706	79%	0.785	S	S	*	*			trans	-75.4	113.9	176.6	52.6	0	0	0	0	112	L437 V441	L437-S439 PolarHBondContact O-N 3.32Å; L437-S439 VanDerWaalsContact O-N 3.1Å; S439-V441 PolarHBondContact O-N 3.07Å
440	D	25.2	Very low	25.8	Very low	142 Å²	142	151.5 Å²	151.5	76%	0.759	79%	0.79	S	S	*	*			trans	38.5	73.7	151.4	-64.2	-53.2	0	0	0	118.9	P438	P438-D440 PolarHBondContact O-N 3.01Å
441	V	28.4	Very low	25.7	Very low	133 Å²	133	152.6 Å²	152.6	81%	0.806	80%	0.795	S	S	*	*			trans	-122.1	80.7	151.8	-171	0	0	0	0	109.6	S439	S439-V441 PolarHBondContact O-N 3.07Å
442	N	24.9	Very low	25.5	Very low	125 Å²	125	148.8 Å²	148.8	67%	0.668	79%	0.789	S	S	*	*			trans	-79.7	154.9	163.1	-79.8	-71.2	0	0	0	109.9
443	Y	26.9	Very low	25.5	Very low	213 Å²	213	150 Å²	150	84%	0.835	80%	0.796	S	S	*	*			trans	66.3	124.3	-174.5	-49.9	-87.6	0	0	0	112.6
444	L	26	Very low	25.5	Very low	162 Å²	162	148.9 Å²	148.9	85%	0.848	80%	0.798	S	S	*	*			cis	-146.5	120.4	40.3	-153.4	75.7	0	0	0	111.4
445	N	25.1	Very low	25.5	Very low	182 Å²	182	148.2 Å²	148.2	97%	0.973	80%	0.795	S	S	*	*			trans	-106.3	84.8	175.4	-149.5	-3.7	0	0	0	108.7
446	G	26	Very low	25.5	Very low	53 Å²	53	146.9 Å²	146.9	55%	0.546	80%	0.795	S	S	.	*			trans	-160.4	139	-172.2	0	0	0	0	0	114.4
447	H	26	Very low	25.6	Very low	181 Å²	181	140.5 Å²	140.5	84%	0.838	78%	0.778	S	S	*	*			trans	50.6	67.8	168.6	-65	-58.7	0	0	0	118.8	N449	H447-N449 PolarHBondContact O-N 2.73Å
448	L	24.6	Very low	25.8	Very low	147 Å²	147	137.2 Å²	137.2	77%	0.77	77%	0.766	S	S	*	*			trans	-72.7	110.2	131.7	-90	165	0	0	0	108.4
449	N	26.1	Very low	25.6	Very low	142 Å²	142	139.3 Å²	139.3	76%	0.759	77%	0.77	S	S	*	*			trans	-162.2	111.9	160.4	-112.6	-12.6	0	0	0	112.4	H447 L451	H447-N449 PolarHBondContact O-N 2.73Å; N449-L451 PolarHBondContact O-N 2.99Å
450	S	25.4	Very low	25.6	Very low	116 Å²	116	141.3 Å²	141.3	81%	0.811	77%	0.771	S	S	*	*	S	Bend	trans	28.1	79.4	145.9	-179.5	0	0	0	0	118.3
451	L	25.2	Very low	25.5	Very low	177 Å²	177	140.6 Å²	140.6	93%	0.927	77%	0.767	S	S	*	*			trans	-163.9	158.5	143.8	-103.9	153.9	0	0	0	109.1	N449	N449-L451 PolarHBondContact O-N 2.99Å
452	G	23.7	Very low	25.5	Very low	61 Å²	61	140.5 Å²	140.5	63%	0.629	77%	0.767	S	S	*	*			trans	-91.3	169.3	-173.7	0	0	0	0	0	114.2
453	N	24.5	Very low	25.7	Very low	172 Å²	172	139.6 Å²	139.6	92%	0.92	77%	0.766	S	S	*	*			trans	49.6	73.6	163.5	-60.3	7.9	0	0	0	116.2
454	Q	25.5	Very low	25.7	Very low	185 Å²	185	138.1 Å²	138.1	86%	0.864	77%	0.766	S	S	*	*			trans	-140.2	123	157.4	-108.3	167.8	2.1	0	0	110.6
455	E	24.9	Very low	25.9	Very low	148 Å²	148	140.1 Å²	140.1	69%	0.692	77%	0.768	S	S	*	*			trans	-66.2	137.8	166.2	-68.5	168.4	104.6	0	0	109.2	S226	S226-E455 WeakPolarHBondContact CB-OE1 3.25Å; S226-E455 PolarHBondContact OG-OE1 3.48Å
456	I	25.1	Very low	26.2	Very low	167 Å²	167	144.1 Å²	144.1	86%	0.856	78%	0.781	S	S	*	*			trans	-114.9	80.8	166.3	-55.6	179.7	0	0	0	106.9
457	A	26.1	Very low	26.2	Very low	58 Å²	58	148.7 Å²	148.7	48%	0.479	79%	0.793	S	S	.	*			trans	-78.1	126.5	165.4	0	0	0	0	0	108.6	L459	A457-L459 PolarHBondContact O-N 2.94Å; A457-L459 VanDerWaalsContact O-N 3.1Å
458	P	26.6	Very low	26.2	Very low	90 Å²	90	147 Å²	147	58%	0.584	79%	0.79	S	S	*	*			trans	-72.3	103.5	174.8	28.7	-32.3	0	0	0	109.8	I460	P458-I460 PolarHBondContact O-N 3.14Å
459	L	23.1	Very low	26.3	Very low	170 Å²	170	147 Å²	147	89%	0.89	79%	0.791	S	S	*	*			trans	-69.5	111.5	167.2	-78.2	101.3	0	0	0	109.6	A457	A457-L459 PolarHBondContact O-N 2.94Å; A457-L459 VanDerWaalsContact O-N 3.1Å
460	I	27.4	Very low	26.3	Very low	143 Å²	143	147.3 Å²	147.3	73%	0.733	79%	0.793	S	S	*	*			trans	-93.8	106.5	160.5	-61	-179.2	0	0	0	107.3	P458 V462	P458-I460 PolarHBondContact O-N 3.14Å; I460-V462 PolarHBondContact O-N 3.35Å
461	D	23.8	Very low	26.4	Very low	128 Å²	128	149.3 Å²	149.3	68%	0.684	79%	0.792	S	S	*	*			trans	-75.4	104.9	176.5	-175.9	7.2	0	0	0	110.1	T463	D461-T463 PolarHBondContact O-N 3.21Å; D461-T463 WeakPolarHBondContact OD2-CG2 3.49Å
462	V	27.9	Very low	26.4	Very low	131 Å²	131	147.4 Å²	147.4	79%	0.794	78%	0.783	S	S	*	*			trans	-77.5	70.7	178.5	-171.6	0	0	0	0	109.5	I460 H464	I460-V462 PolarHBondContact O-N 3.35Å; V462-H464 PolarHBondContact O-N 3.14Å
463	T	30.7	Very low	26.6	Very low	106 Å²	106	153.6 Å²	153.6	65%	0.65	79%	0.794	S	S	*	*			trans	-63.6	127.9	178.7	44.8	0	0	0	0	111.9	D461	D461-T463 PolarHBondContact O-N 3.21Å; D461-T463 WeakPolarHBondContact OD2-CG2 3.49Å
464	H	26.1	Very low	26.8	Very low	182 Å²	182	152.2 Å²	152.2	84%	0.843	79%	0.785	S	S	*	*			trans	-46.4	138.6	-178.6	-81.6	-91.9	0	0	0	114.9	V462	V462-H464 PolarHBondContact O-N 3.14Å
465	K	30.2	Very low	26.9	Very low	204 Å²	204	149.4 Å²	149.4	89%	0.887	78%	0.778	S	S	*	*			trans	-128.6	104.5	145.1	-79.1	-175.6	178.8	170.4	0	110.5
466	Q	30.9	Very low	27.1	Very low	266 Å²	266	149.5 Å²	149.5	100%	1.243	79%	0.786	S	S	*	*			trans	27.6	0	161.7	-60.4	-171.8	-70.1	0	0	117.7

Retrieved 466 of 466 residues in 75.4 ms (Link to these results)

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