A0A096MR74_PAPAN Loading...

Translation machinery-associated protein 16

Involved in the biogenesis of the 60S ribosomal subunit in the nucleus.

AlphaFold DB (A0A2K5KNW1), UniProt , Accession A0A096MR74, Species PAPAN (Papio anubis, Olive baboon), Gene TMA16, Length 203 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	51	Low	56	Low	234 Å²	234	140.3 Å²	140.3	100%	1.153	84%	0.844	S	S	*	*				0	127.9	0	-64.7	170	76.5	0	0	109.1
2	P	61.6	Low	56.2	Low	135 Å²	135	144.3 Å²	144.3	88%	0.877	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-73.5	133.7	175.3	28.8	-28.9	0	0	0	110.1
3	K	57.6	Low	56.6	Low	208 Å²	208	147.1 Å²	147.1	90%	0.904	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-68.1	134.1	179.8	-91.3	174.1	173.8	168.6	0	110.8
4	A	64.1	Low	57.3	Low	88 Å²	88	151.4 Å²	151.4	73%	0.727	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-59.1	139.9	175.2	0	0	0	0	0	111.7	K6	A4-K6 PolarHBondContact O-N 3.28Å
5	P	58.4	Low	58.5	Low	127 Å²	127	151.8 Å²	151.8	83%	0.825	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-67.3	122.6	177.5	26.3	-31.5	0	0	0	110	G7	P5-G7 PolarHBondContact O-N 3.28Å
6	K	55.6	Low	59.8	Low	208 Å²	208	151.6 Å²	151.6	90%	0.904	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-57.2	132.2	176.8	-75.8	-176.4	175.2	-177.5	0	110.3	A4	A4-K6 PolarHBondContact O-N 3.28Å
7	G	53.2	Low	61.3	Low	73 Å²	73	146.2 Å²	146.2	75%	0.753	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-50.9	139.3	-174.3	0	0	0	0	0	114	P5 S9	P5-G7 PolarHBondContact O-N 3.28Å; G7-S9 PolarHBondContact O-N 3.06Å
8	K	56.7	Low	63	Low	204 Å²	204	144.8 Å²	144.8	89%	0.887	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-63.1	117.6	171.9	-68.9	175.9	179.5	175.1	0	108.1	A10	K8-A10 PolarHBondContact O-N 3.06Å
9	S	52.5	Low	64.4	Low	79 Å²	79	141.9 Å²	141.9	55%	0.552	78%	0.778	S	S	*	*			trans	-63	96.2	172.6	55.9	0	0	0	0	109.6	G7 G11	G7-S9 PolarHBondContact O-N 3.06Å; S9-G11 PolarHBondContact O-N 3.11Å; S9-G11 VanDerWaalsContact O-N 3.09Å
10	A	53.1	Low	65.8	Low	113 Å²	113	145.4 Å²	145.4	93%	0.934	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	18.5	-175	0	0	0	0	0	114.6	K8	K8-A10 PolarHBondContact O-N 3.06Å
11	G	52	Low	67.1	Low	74 Å²	74	140.7 Å²	140.7	76%	0.763	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.8	15.1	-173.5	0	0	0	0	0	115.8	S9	S9-G11 PolarHBondContact O-N 3.11Å; S9-G11 VanDerWaalsContact O-N 3.09Å
12	R	58.2	Low	69.1	Low	189 Å²	189	140.1 Å²	140.1	71%	0.713	74%	0.743	S	S	*	*	S	Bend	trans	-91.9	120.5	170.9	-73.4	-179.6	177.3	176.7	-1.7	108.7	K14	R12-K14 PolarHBondContact O-N 3Å
13	E	61.3	Low	70.5	Confident	180 Å²	180	139 Å²	139	84%	0.841	73%	0.725	S	S	*	*			trans	-42	133	167.9	-67.4	-179.8	171.7	0	0	109.3	K15	E13-K15 VanDerWaalsContact C-N 3.3Å; E13-K15 PolarHBondContact O-N 3.29Å
14	K	67.5	Low	72.1	Confident	207 Å²	207	129.9 Å²	129.9	90%	0.9	69%	0.688	S	S	*	*			trans	-62.4	96.5	-177.7	-69.9	179.1	-176.3	173.1	0	107.7	R12 V16	R12-K14 PolarHBondContact O-N 3Å; K14-V16 PolarHBondContact O-N 3.11Å
15	K	75	Confident	73.5	Confident	158 Å²	158	127.6 Å²	127.6	69%	0.687	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-47.4	133.3	176.6	-62.5	-172.4	176.9	-166.3	0	109.4	E13 I17	E13-K15 VanDerWaalsContact C-N 3.3Å; E13-K15 PolarHBondContact O-N 3.29Å; K15-I17 VanDerWaalsContact O-CG1 3.27Å; K15-I17 WeakPolarHBondContact O-CG1 3.4Å; K15-I17 PolarHBondContact O-N 3.03Å; K15-I17 VanDerWaalsContact O-N 3.09Å
16	V	79.8	Confident	75.3	Confident	149 Å²	149	127.1 Å²	127.1	90%	0.903	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-52.4	117.4	174.2	-178.6	0	0	0	0	108.2	K14	K14-V16 PolarHBondContact O-N 3.11Å
17	I	85.4	Confident	77.1	Confident	59 Å²	59	121.3 Å²	121.3	30%	0.303	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-92.9	123.4	-176.5	-53.6	174.3	0	0	0	107	K15 K23 A24 I27	K15-I17 VanDerWaalsContact O-CG1 3.27Å; K15-I17 WeakPolarHBondContact O-CG1 3.4Å; K15-I17 PolarHBondContact O-N 3.03Å; K15-I17 VanDerWaalsContact O-N 3.09Å; I17-K23 HydrophobicContact CD1-CD 3.71Å; I17-K23 HydrophobicContact CD1-CG 3.98Å; I17-K23 HydrophobicContact CG1-CD 4.21Å; I17-K23 HydrophobicContact CG2-CB 4.07Å; I17-K23 HydrophobicContact CG2-CG 4.5Å; I17-A24 HydrophobicContact CG2-CB 3.86Å; I17-I27 HydrophobicContact CD1-CD1 3.44Å; I17-I27 VanDerWaalsContact CD1-CD1 3.44Å
18	H	90.8	Very high	79	Confident	121 Å²	121	122 Å²	122	56%	0.56	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-61.8	137	173.6	-165.8	-90.4	0	0	0	110.6	Y20 S21 A24	H18-Y20 VanDerWaalsContact C-N 3.27Å; H18-Y20 AromaticContact CE1-CD2 3.67Å; H18-Y20 PolarHBondContact ND1-N 2.8Å; H18-Y20 PolarHBondContact O-N 3.28Å; H18-S21 WeakPolarHBondContact O-CB 3.48Å; H18-S21 PolarHBondContact O-N 2.95Å; H18-A24 WeakPolarHBondContact O-CB 3.36Å
19	P	89.6	Confident	80.8	Confident	91 Å²	91	121.4 Å²	121.4	59%	0.591	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-35.1	-174.2	19.5	-33.3	0	0	0	114	S21 A24	P19-S21 VanDerWaalsContact C-N 3.32Å; P19-S21 PolarHBondContact O-N 3.27Å; P19-A24 VanDerWaalsContact O-CB 3.24Å; P19-A24 WeakPolarHBondContact O-CB 3.33Å
20	Y	92.1	Very high	82.9	Confident	211 Å²	211	123.4 Å²	123.4	83%	0.827	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	10.2	177.7	-53.5	-59.7	0	0	0	114.4	H18	H18-Y20 VanDerWaalsContact C-N 3.27Å; H18-Y20 AromaticContact CE1-CD2 3.67Å; H18-Y20 PolarHBondContact ND1-N 2.8Å; H18-Y20 PolarHBondContact O-N 3.28Å
21	S	93.9	Very high	84.9	Confident	46 Å²	46	120.4 Å²	120.4	32%	0.322	59%	0.592	S	S	.	*	S	Bend	trans	-71.4	148.9	177	179.8	0	0	0	0	111.8	H18 P19 K23 A24 A25	H18-S21 WeakPolarHBondContact O-CB 3.48Å; H18-S21 PolarHBondContact O-N 2.95Å; P19-S21 VanDerWaalsContact C-N 3.32Å; P19-S21 PolarHBondContact O-N 3.27Å; S21-K23 PolarHBondContact O-N 3.04Å; S21-K23 VanDerWaalsContact O-N 3.14Å; S21-K23 PolarHBondContact OG-N 3.07Å; S21-A24 WeakPolarHBondContact O-CB 3.25Å; S21-A24 PolarHBondContact O-N 2.64Å; S21-A25 PolarHBondContact O-N 3.49Å
22	R	92.8	Very high	87.1	Confident	222 Å²	222	121.4 Å²	121.4	84%	0.838	58%	0.576	S	S	*	*	H	α-helix	trans	-52	-35.8	168.9	-68	-176	178.4	-178	-0.2	112.3	A25 Q26	R22-A25 PolarHBondContact O-N 3.37Å; R22-Q26 WeakPolarHBondContact O-CG 3.38Å; R22-Q26 PolarHBondContact O-N 3.48Å
23	K	91.5	Very high	89	Confident	113 Å²	113	120.1 Å²	120.1	49%	0.491	58%	0.576	S	S	.	*	H	α-helix	trans	-69.3	-38.6	178.4	-167.6	178.8	178.1	-175.8	0	111.9	I17 S21 Q26 I27	I17-K23 HydrophobicContact CD1-CD 3.71Å; I17-K23 HydrophobicContact CD1-CG 3.98Å; I17-K23 HydrophobicContact CG1-CD 4.21Å; I17-K23 HydrophobicContact CG2-CB 4.07Å; I17-K23 HydrophobicContact CG2-CG 4.5Å; S21-K23 PolarHBondContact O-N 3.04Å; S21-K23 VanDerWaalsContact O-N 3.14Å; S21-K23 PolarHBondContact OG-N 3.07Å; K23-Q26 PolarHBondContact O-N 3.22Å; K23-I27 HydrophobicContact CG-CD1 4.42Å; K23-I27 VanDerWaalsContact O-CG1 3.31Å; K23-I27 WeakPolarHBondContact O-CG1 3.13Å; K23-I27 PolarHBondContact O-N 2.94Å; K23-I27 VanDerWaalsContact O-N 3.09Å
24	A	91.5	Very high	90.7	Very high	15 Å²	15	117.6 Å²	117.6	12%	0.124	56%	0.564	C	S	.	*	H	α-helix	trans	-64.4	-44.6	173.2	0	0	0	0	0	110.9	I17 H18 P19 S21 Q26 I27 T28	I17-A24 HydrophobicContact CG2-CB 3.86Å; H18-A24 WeakPolarHBondContact O-CB 3.36Å; P19-A24 VanDerWaalsContact O-CB 3.24Å; P19-A24 WeakPolarHBondContact O-CB 3.33Å; S21-A24 WeakPolarHBondContact O-CB 3.25Å; S21-A24 PolarHBondContact O-N 2.64Å; A24-Q26 VanDerWaalsContact C-N 3.28Å; A24-Q26 PolarHBondContact O-N 2.64Å; A24-I27 PolarHBondContact O-N 2.88Å; A24-I27 VanDerWaalsContact O-N 3.16Å; A24-T28 WeakPolarHBondContact O-CG2 3.5Å; A24-T28 PolarHBondContact O-N 3.45Å; A24-T28 PolarHBondContact O-OG1 2.73Å
25	A	93.3	Very high	92.1	Very high	41 Å²	41	112.1 Å²	112.1	34%	0.339	54%	0.542	S	S	.	.	H	α-helix	trans	-61.4	-32.3	175.9	0	0	0	0	0	113.6	S21 R22 T28 R29	S21-A25 PolarHBondContact O-N 3.49Å; R22-A25 PolarHBondContact O-N 3.37Å; A25-T28 WeakPolarHBondContact CA-OG1 3.43Å; A25-T28 PolarHBondContact O-OG1 3.19Å; A25-R29 WeakPolarHBondContact O-CB 3.38Å; A25-R29 WeakPolarHBondContact O-CD 3.49Å; A25-R29 WeakPolarHBondContact O-CG 3.36Å; A25-R29 PolarHBondContact O-N 3.43Å
26	Q	94.6	Very high	93.1	Very high	117 Å²	117	110.1 Å²	110.1	55%	0.547	53%	0.533	S	S	.	.	H	α-helix	trans	-69.6	-45.2	173.1	-75.9	174	-5.9	0	0	111.7	R22 K23 A24 T28 R29 E30	R22-Q26 WeakPolarHBondContact O-CG 3.38Å; R22-Q26 PolarHBondContact O-N 3.48Å; K23-Q26 PolarHBondContact O-N 3.22Å; A24-Q26 VanDerWaalsContact C-N 3.28Å; A24-Q26 PolarHBondContact O-N 2.64Å; Q26-T28 VanDerWaalsContact C-N 3.35Å; Q26-T28 PolarHBondContact O-N 3.31Å; Q26-R29 PolarHBondContact O-N 3.3Å; Q26-E30 WeakPolarHBondContact O-CG 3.37Å; Q26-E30 PolarHBondContact O-N 2.69Å
27	I	93.5	Very high	94	Very high	85 Å²	85	109 Å²	109	44%	0.436	52%	0.516	S	S	.	.	H	α-helix	trans	-60.4	-44.4	177.9	-67.7	164.7	0	0	0	110.8	I17 K23 A24 R29 E30 A31	I17-I27 HydrophobicContact CD1-CD1 3.44Å; I17-I27 VanDerWaalsContact CD1-CD1 3.44Å; K23-I27 HydrophobicContact CG-CD1 4.42Å; K23-I27 VanDerWaalsContact O-CG1 3.31Å; K23-I27 WeakPolarHBondContact O-CG1 3.13Å; K23-I27 PolarHBondContact O-N 2.94Å; K23-I27 VanDerWaalsContact O-N 3.09Å; A24-I27 PolarHBondContact O-N 2.88Å; A24-I27 VanDerWaalsContact O-N 3.16Å; I27-R29 PolarHBondContact O-N 3.23Å; I27-E30 PolarHBondContact O-N 3.48Å; I27-A31 WeakPolarHBondContact O-CB 3.5Å; I27-A31 PolarHBondContact O-N 3.09Å
28	T	93.9	Very high	94.5	Very high	89 Å²	89	110.1 Å²	110.1	55%	0.546	52%	0.52	S	S	.	.	H	α-helix	trans	-64.9	-39.5	178.7	55.9	0	0	0	0	112.1	A24 A25 Q26 A31 H32	A24-T28 WeakPolarHBondContact O-CG2 3.5Å; A24-T28 PolarHBondContact O-N 3.45Å; A24-T28 PolarHBondContact O-OG1 2.73Å; A25-T28 WeakPolarHBondContact CA-OG1 3.43Å; A25-T28 PolarHBondContact O-OG1 3.19Å; Q26-T28 VanDerWaalsContact C-N 3.35Å; Q26-T28 PolarHBondContact O-N 3.31Å; T28-A31 PolarHBondContact O-N 2.76Å; T28-H32 WeakPolarHBondContact O-CB 3.48Å; T28-H32 PolarHBondContact O-N 3.37Å
29	R	95.6	Very high	94.8	Very high	191 Å²	191	109.4 Å²	109.4	72%	0.721	52%	0.515	S	S	*	.	H	α-helix	trans	-62.4	-44.1	174	-75.1	172.5	-174.2	-171.4	1.9	112.2	A25 Q26 I27 K33	A25-R29 WeakPolarHBondContact O-CB 3.38Å; A25-R29 WeakPolarHBondContact O-CD 3.49Å; A25-R29 WeakPolarHBondContact O-CG 3.36Å; A25-R29 PolarHBondContact O-N 3.43Å; Q26-R29 PolarHBondContact O-N 3.3Å; I27-R29 PolarHBondContact O-N 3.23Å; R29-K33 WeakPolarHBondContact O-CB 3.43Å; R29-K33 PolarHBondContact O-N 2.75Å
30	E	95.9	Very high	95.1	Very high	120 Å²	120	109.8 Å²	109.8	56%	0.561	51%	0.512	S	S	*	.	H	α-helix	trans	-64.6	-44.4	177	-74.1	178.7	-176.8	0	0	111.6	Q26 I27 H32 K33 Q34	Q26-E30 WeakPolarHBondContact O-CG 3.37Å; Q26-E30 PolarHBondContact O-N 2.69Å; I27-E30 PolarHBondContact O-N 3.48Å; E30-H32 PolarHBondContact O-N 2.95Å; E30-K33 WeakPolarHBondContact O-CB 3.25Å; E30-K33 PolarHBondContact O-N 2.78Å; E30-Q34 WeakPolarHBondContact O-CG 3.48Å; E30-Q34 PolarHBondContact O-N 2.96Å
31	A	95.8	Very high	95.3	Very high	50 Å²	50	104.3 Å²	104.3	41%	0.413	49%	0.492	S	S	.	.	H	α-helix	trans	-59.1	-47.6	176.2	0	0	0	0	0	111.5	I27 T28 K33 Q34 E35	I27-A31 WeakPolarHBondContact O-CB 3.5Å; I27-A31 PolarHBondContact O-N 3.09Å; T28-A31 PolarHBondContact O-N 2.76Å; A31-K33 VanDerWaalsContact C-N 3.32Å; A31-K33 PolarHBondContact O-N 3.25Å; A31-Q34 WeakPolarHBondContact O-CB 3.39Å; A31-Q34 PolarHBondContact O-N 2.94Å; A31-Q34 VanDerWaalsContact O-N 3.15Å; A31-E35 WeakPolarHBondContact O-CB 3.34Å; A31-E35 PolarHBondContact O-N 3.11Å
32	H	97.4	Very high	95.4	Very high	95 Å²	95	106.6 Å²	106.6	44%	0.44	50%	0.501	S	S	.	.	H	α-helix	trans	-64.7	-35.4	177.8	-177	-117.3	0	0	0	112.7	T28 E30 K36	T28-H32 WeakPolarHBondContact O-CB 3.48Å; T28-H32 PolarHBondContact O-N 3.37Å; E30-H32 PolarHBondContact O-N 2.95Å; H32-K36 WeakPolarHBondContact CE1-CE 3.47Å; H32-K36 PolarHBondContact CE1-NZ 3.41Å; H32-K36 VanDerWaalsContact CE1-NZ 3.27Å; H32-K36 WeakPolarHBondContact NE2-CE 3.4Å; H32-K36 WeakPolarHBondContact O-CB 3.36Å; H32-K36 WeakPolarHBondContact O-CG 3.43Å; H32-K36 PolarHBondContact O-N 3.01Å
33	K	97.4	Very high	95.6	Very high	163 Å²	163	101.7 Å²	101.7	71%	0.709	49%	0.487	S	S	*	.	H	α-helix	trans	-64.4	-42.5	172.6	-177.1	-179.6	178.6	-179.8	0	111.4	R29 E30 A31 K37	R29-K33 WeakPolarHBondContact O-CB 3.43Å; R29-K33 PolarHBondContact O-N 2.75Å; E30-K33 WeakPolarHBondContact O-CB 3.25Å; E30-K33 PolarHBondContact O-N 2.78Å; A31-K33 VanDerWaalsContact C-N 3.32Å; A31-K33 PolarHBondContact O-N 3.25Å; K33-K37 WeakPolarHBondContact O-CB 3.47Å; K33-K37 PolarHBondContact O-N 3.28Å; K33-K37 VanDerWaalsContact O-N 3.08Å
34	Q	96.7	Very high	95.7	Very high	127 Å²	127	103.2 Å²	103.2	59%	0.593	49%	0.494	S	S	*	.	H	α-helix	trans	-65	-45.9	175.9	-72	179.3	1.6	0	0	111.2	E30 A31 K36 K37 E38	E30-Q34 WeakPolarHBondContact O-CG 3.48Å; E30-Q34 PolarHBondContact O-N 2.96Å; A31-Q34 WeakPolarHBondContact O-CB 3.39Å; A31-Q34 PolarHBondContact O-N 2.94Å; A31-Q34 VanDerWaalsContact O-N 3.15Å; Q34-K36 VanDerWaalsContact C-N 3.35Å; Q34-K36 PolarHBondContact O-N 3.46Å; Q34-K37 WeakPolarHBondContact O-CA 3.48Å; Q34-K37 WeakPolarHBondContact O-CB 3.45Å; Q34-K37 PolarHBondContact O-N 3.46Å; Q34-E38 WeakPolarHBondContact O-CG 3.47Å; Q34-E38 PolarHBondContact O-N 3.4Å
35	E	97	Very high	95.8	Very high	92 Å²	92	104.6 Å²	104.6	43%	0.43	51%	0.505	S	S	.	.	H	α-helix	trans	-57.4	-46.7	177.7	-170.6	-169.6	167.7	0	0	111.6	A31 K37 E38 K39	A31-E35 WeakPolarHBondContact O-CB 3.34Å; A31-E35 PolarHBondContact O-N 3.11Å; E35-K37 VanDerWaalsContact C-N 3.32Å; E35-K37 PolarHBondContact O-N 2.79Å; E35-E38 PolarHBondContact O-N 2.86Å; E35-K39 HydrophobicContact CG-CD 4.41Å; E35-K39 WeakPolarHBondContact O-CB 3.47Å; E35-K39 WeakPolarHBondContact O-CG 3.23Å; E35-K39 PolarHBondContact O-N 2.88Å; E35-K39 WeakPolarHBondContact OE1-CE 3.4Å; E35-K39 IonicContact OE1-NZ 3.42Å; E35-K39 PolarHBondContact OE1-NZ 3.26Å
36	K	97.3	Very high	95.9	Very high	116 Å²	116	108.2 Å²	108.2	50%	0.504	52%	0.518	S	S	.	.	H	α-helix	trans	-59.7	-41.8	174.2	-76.9	179.9	169.2	-178.5	0	112.4	H32 Q34 K39 L40	H32-K36 WeakPolarHBondContact CE1-CE 3.47Å; H32-K36 PolarHBondContact CE1-NZ 3.41Å; H32-K36 VanDerWaalsContact CE1-NZ 3.27Å; H32-K36 WeakPolarHBondContact NE2-CE 3.4Å; H32-K36 WeakPolarHBondContact O-CB 3.36Å; H32-K36 WeakPolarHBondContact O-CG 3.43Å; H32-K36 PolarHBondContact O-N 3.01Å; Q34-K36 VanDerWaalsContact C-N 3.35Å; Q34-K36 PolarHBondContact O-N 3.46Å; K36-K39 PolarHBondContact O-N 2.88Å; K36-L40 WeakPolarHBondContact O-CG 3.29Å; K36-L40 PolarHBondContact O-N 3.42Å; K36-L40 VanDerWaalsContact O-N 3.07Å
37	K	97.3	Very high	95.8	Very high	125 Å²	125	111.6 Å²	111.6	54%	0.543	53%	0.526	S	S	.	.	H	α-helix	trans	-64.2	-44.5	178.3	-175.1	-178.4	179.9	-177.7	0	111.4	K33 Q34 E35 L40 K41	K33-K37 WeakPolarHBondContact O-CB 3.47Å; K33-K37 PolarHBondContact O-N 3.28Å; K33-K37 VanDerWaalsContact O-N 3.08Å; Q34-K37 WeakPolarHBondContact O-CA 3.48Å; Q34-K37 WeakPolarHBondContact O-CB 3.45Å; Q34-K37 PolarHBondContact O-N 3.46Å; E35-K37 VanDerWaalsContact C-N 3.32Å; E35-K37 PolarHBondContact O-N 2.79Å; K37-L40 PolarHBondContact O-N 3.16Å; K37-K41 WeakPolarHBondContact O-CG 3.3Å; K37-K41 PolarHBondContact O-N 3.07Å; K37-K41 VanDerWaalsContact O-N 3.11Å
38	E	97	Very high	95.8	Very high	82 Å²	82	111.3 Å²	111.3	38%	0.383	53%	0.525	S	S	.	.	H	α-helix	trans	-67.4	-39.6	177.5	-64.3	-48.3	125.8	0	0	111.6	Q34 E35 L40 K41 N42	Q34-E38 WeakPolarHBondContact O-CG 3.47Å; Q34-E38 PolarHBondContact O-N 3.4Å; E35-E38 PolarHBondContact O-N 2.86Å; E38-L40 PolarHBondContact O-N 3.33Å; E38-K41 WeakPolarHBondContact O-CB 3.24Å; E38-K41 PolarHBondContact O-N 3.34Å; E38-K41 VanDerWaalsContact O-N 3.16Å; E38-K41 IonicContact OE1-NZ 2.79Å; E38-K41 PolarHBondContact OE1-NZ 3.12Å; E38-K41 WeakPolarHBondContact OE2-CD 3.43Å; E38-K41 IonicContact OE2-NZ 2.76Å; E38-K41 PolarHBondContact OE2-NZ 3.04Å; E38-N42 WeakPolarHBondContact O-CB 3.47Å; E38-N42 PolarHBondContact O-N 2.97Å; E38-N42 PolarHBondContact O-ND2 2.97Å; E38-N42 PolarHBondContact O-OD1 3.13Å
39	K	96.6	Very high	95.7	Very high	106 Å²	106	110.3 Å²	110.3	46%	0.461	52%	0.517	S	S	.	.	H	α-helix	trans	-55.9	-49.2	172.7	-76.4	176.9	-177.8	172.8	0	112.1	E35 K36 K41 N42 E43	E35-K39 HydrophobicContact CG-CD 4.41Å; E35-K39 WeakPolarHBondContact O-CB 3.47Å; E35-K39 WeakPolarHBondContact O-CG 3.23Å; E35-K39 PolarHBondContact O-N 2.88Å; E35-K39 WeakPolarHBondContact OE1-CE 3.4Å; E35-K39 IonicContact OE1-NZ 3.42Å; E35-K39 PolarHBondContact OE1-NZ 3.26Å; K36-K39 PolarHBondContact O-N 2.88Å; K39-K41 VanDerWaalsContact C-N 3.3Å; K39-K41 PolarHBondContact O-N 3.32Å; K39-N42 PolarHBondContact O-N 3.14Å; K39-N42 VanDerWaalsContact O-N 3.16Å; K39-E43 WeakPolarHBondContact O-CG 3.45Å; K39-E43 PolarHBondContact O-N 2.97Å
40	L	96.6	Very high	95.6	Very high	99 Å²	99	106.9 Å²	106.9	52%	0.518	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-34.6	177.9	-70.6	172.2	0	0	0	113.1	K36 K37 E38 K44	K36-L40 WeakPolarHBondContact O-CG 3.29Å; K36-L40 PolarHBondContact O-N 3.42Å; K36-L40 VanDerWaalsContact O-N 3.07Å; K37-L40 PolarHBondContact O-N 3.16Å; E38-L40 PolarHBondContact O-N 3.33Å; L40-K44 VanDerWaalsContact O-CG 3.3Å; L40-K44 WeakPolarHBondContact O-CG 3.33Å; L40-K44 PolarHBondContact O-N 3.2Å
41	K	96.6	Very high	95.4	Very high	97 Å²	97	104.4 Å²	104.4	42%	0.422	50%	0.502	S	S	.	.	H	α-helix	trans	-67	-44.9	173.8	-73	170.4	174.7	179.1	0	111	K37 E38 K39 K44 A45	K37-K41 WeakPolarHBondContact O-CG 3.3Å; K37-K41 PolarHBondContact O-N 3.07Å; K37-K41 VanDerWaalsContact O-N 3.11Å; E38-K41 WeakPolarHBondContact O-CB 3.24Å; E38-K41 PolarHBondContact O-N 3.34Å; E38-K41 VanDerWaalsContact O-N 3.16Å; E38-K41 IonicContact OE1-NZ 2.79Å; E38-K41 PolarHBondContact OE1-NZ 3.12Å; E38-K41 WeakPolarHBondContact OE2-CD 3.43Å; E38-K41 IonicContact OE2-NZ 2.76Å; E38-K41 PolarHBondContact OE2-NZ 3.04Å; K39-K41 VanDerWaalsContact C-N 3.3Å; K39-K41 PolarHBondContact O-N 3.32Å; K41-K44 PolarHBondContact O-N 2.84Å; K41-A45 WeakPolarHBondContact O-CB 3.33Å; K41-A45 PolarHBondContact O-N 2.88Å
42	N	95.8	Very high	95.3	Very high	93 Å²	93	102.3 Å²	102.3	50%	0.497	49%	0.485	S	S	.	.	H	α-helix	trans	-63.4	-44.2	179.8	-67	-13	0	0	0	110.9	E38 K39 K44 A45 L46	E38-N42 WeakPolarHBondContact O-CB 3.47Å; E38-N42 PolarHBondContact O-N 2.97Å; E38-N42 PolarHBondContact O-ND2 2.97Å; E38-N42 PolarHBondContact O-OD1 3.13Å; K39-N42 PolarHBondContact O-N 3.14Å; K39-N42 VanDerWaalsContact O-N 3.16Å; N42-K44 VanDerWaalsContact C-N 3.35Å; N42-K44 PolarHBondContact O-N 3.3Å; N42-A45 PolarHBondContact O-N 3.48Å; N42-L46 WeakPolarHBondContact O-CB 3.4Å; N42-L46 VanDerWaalsContact O-CG 3.23Å; N42-L46 WeakPolarHBondContact O-CG 3.46Å; N42-L46 PolarHBondContact O-N 3.36Å
43	E	96.1	Very high	95.1	Very high	119 Å²	119	104.1 Å²	104.1	56%	0.556	49%	0.493	S	S	*	.	H	α-helix	trans	-59.4	-43.6	175.5	-73.7	173.3	-171.9	0	0	112.3	K39 L46 R47	K39-E43 WeakPolarHBondContact O-CG 3.45Å; K39-E43 PolarHBondContact O-N 2.97Å; E43-L46 PolarHBondContact O-N 3.21Å; E43-R47 PolarHBondContact O-N 2.96Å
44	K	94.3	Very high	94.8	Very high	146 Å²	146	98.3 Å²	98.3	64%	0.635	47%	0.468	S	S	*	.	H	α-helix	trans	-64.4	-43.5	175.6	-73.4	177.4	-178.1	-173.8	0	111.9	L40 K41 N42 R47 L48	L40-K44 VanDerWaalsContact O-CG 3.3Å; L40-K44 WeakPolarHBondContact O-CG 3.33Å; L40-K44 PolarHBondContact O-N 3.2Å; K41-K44 PolarHBondContact O-N 2.84Å; N42-K44 VanDerWaalsContact C-N 3.35Å; N42-K44 PolarHBondContact O-N 3.3Å; K44-R47 PolarHBondContact O-N 2.87Å; K44-L48 WeakPolarHBondContact O-CG 3.35Å; K44-L48 PolarHBondContact O-N 3.13Å
45	A	93.9	Very high	94.7	Very high	43 Å²	43	92.3 Å²	92.3	36%	0.355	44%	0.44	S	S	.	.	H	α-helix	trans	-62.4	-45	177.3	0	0	0	0	0	111.2	K41 N42 R47 L48 N49	K41-A45 WeakPolarHBondContact O-CB 3.33Å; K41-A45 PolarHBondContact O-N 2.88Å; N42-A45 PolarHBondContact O-N 3.48Å; A45-R47 VanDerWaalsContact C-N 3.34Å; A45-R47 PolarHBondContact O-N 3.33Å; A45-L48 PolarHBondContact O-N 3.09Å; A45-N49 WeakPolarHBondContact O-CB 3.1Å; A45-N49 PolarHBondContact O-N 3.36Å; A45-N49 PolarHBondContact O-ND2 3.4Å; A45-N49 PolarHBondContact O-OD1 3.24Å
46	L	94.4	Very high	94.5	Very high	117 Å²	117	90.7 Å²	90.7	61%	0.613	43%	0.433	S	S	*	.	H	α-helix	trans	-59.6	-43	175.8	-72.2	171.2	0	0	0	111.9	N42 E43 N49 L50	N42-L46 WeakPolarHBondContact O-CB 3.4Å; N42-L46 VanDerWaalsContact O-CG 3.23Å; N42-L46 WeakPolarHBondContact O-CG 3.46Å; N42-L46 PolarHBondContact O-N 3.36Å; E43-L46 PolarHBondContact O-N 3.21Å; L46-N49 PolarHBondContact O-N 3.07Å; L46-L50 WeakPolarHBondContact O-CB 3.32Å; L46-L50 PolarHBondContact O-N 2.94Å
47	R	92.8	Very high	94.4	Very high	188 Å²	188	87.2 Å²	87.2	71%	0.709	42%	0.416	S	S	*	.	H	α-helix	trans	-62.7	-42.9	176.4	-173.4	177.7	-176.3	169.2	1.7	112.1	E43 K44 A45 I51	E43-R47 PolarHBondContact O-N 2.96Å; K44-R47 PolarHBondContact O-N 2.87Å; A45-R47 VanDerWaalsContact C-N 3.34Å; A45-R47 PolarHBondContact O-N 3.33Å; R47-I51 WeakPolarHBondContact O-CG1 3.49Å; R47-I51 PolarHBondContact O-N 2.88Å
48	L	92.9	Very high	94.2	Very high	79 Å²	79	81.3 Å²	81.3	41%	0.414	39%	0.391	S	S	.	.	H	α-helix	trans	-67.3	-41.5	177.4	-71.2	172.7	0	0	0	111.6	K44 A45 L50 I51 G52 L153	K44-L48 WeakPolarHBondContact O-CG 3.35Å; K44-L48 PolarHBondContact O-N 3.13Å; A45-L48 PolarHBondContact O-N 3.09Å; L48-L50 VanDerWaalsContact C-N 3.35Å; L48-L50 PolarHBondContact O-N 3.39Å; L48-I51 PolarHBondContact O-N 3.37Å; L48-G52 PolarHBondContact O-N 3Å; L48-L153 HydrophobicContact CD2-CD1 4.18Å
49	N	92.8	Very high	94	Very high	69 Å²	69	78.9 Å²	78.9	37%	0.369	38%	0.379	S	S	.	.	H	α-helix	trans	-59.7	-45.3	175.8	-71.7	-13.2	0	0	0	111.1	A45 L46 I51 G52 E53 L150	A45-N49 WeakPolarHBondContact O-CB 3.1Å; A45-N49 PolarHBondContact O-N 3.36Å; A45-N49 PolarHBondContact O-ND2 3.4Å; A45-N49 PolarHBondContact O-OD1 3.24Å; L46-N49 PolarHBondContact O-N 3.07Å; N49-I51 VanDerWaalsContact C-N 3.29Å; N49-I51 PolarHBondContact O-N 2.76Å; N49-G52 CarbonylContact O-C 3.57Å; N49-G52 WeakPolarHBondContact O-CA 3.19Å; N49-G52 PolarHBondContact O-N 3.26Å; N49-E53 WeakPolarHBondContact O-CG 3.48Å; N49-E53 PolarHBondContact O-N 2.85Å; N49-L150 WeakPolarHBondContact OD1-CD1 3.45Å
50	L	92.5	Very high	93.8	Very high	118 Å²	118	78.8 Å²	78.8	62%	0.618	38%	0.384	S	S	*	.	H	α-helix	trans	-60.6	-39	178.7	-174.5	65.6	0	0	0	112.3	L46 L48 K54	L46-L50 WeakPolarHBondContact O-CB 3.32Å; L46-L50 PolarHBondContact O-N 2.94Å; L48-L50 VanDerWaalsContact C-N 3.35Å; L48-L50 PolarHBondContact O-N 3.39Å; L50-K54 WeakPolarHBondContact O-CB 3.46Å; L50-K54 PolarHBondContact O-N 3.37Å; L50-K54 VanDerWaalsContact O-N 3.12Å
51	I	92.4	Very high	93.6	Very high	69 Å²	69	78.2 Å²	78.2	35%	0.354	38%	0.379	S	S	.	.	H	α-helix	trans	-67.1	-43.6	174.3	-65.2	167.7	0	0	0	110.2	R47 L48 N49 K54 L55 L153	R47-I51 WeakPolarHBondContact O-CG1 3.49Å; R47-I51 PolarHBondContact O-N 2.88Å; L48-I51 PolarHBondContact O-N 3.37Å; N49-I51 VanDerWaalsContact C-N 3.29Å; N49-I51 PolarHBondContact O-N 2.76Å; I51-K54 WeakPolarHBondContact O-CB 3.46Å; I51-K54 PolarHBondContact O-N 3.16Å; I51-L55 HydrophobicContact CG2-CD1 3.97Å; I51-L55 HydrophobicContact CG2-CG 4.42Å; I51-L55 VanDerWaalsContact O-CG 3.29Å; I51-L55 WeakPolarHBondContact O-CG 3.17Å; I51-L55 PolarHBondContact O-N 2.96Å; I51-L153 HydrophobicContact CG2-CD1 4.37Å; I51-L153 HydrophobicContact CG2-CD2 4.44Å
52	G	93	Very high	93.3	Very high	6 Å²	6	74.4 Å²	74.4	6%	0.062	36%	0.363	C	S	.	.	H	α-helix	trans	-58.8	-47.7	176.9	0	0	0	0	0	112.8	L48 N49 K54 L55 Q56	L48-G52 PolarHBondContact O-N 3Å; N49-G52 CarbonylContact O-C 3.57Å; N49-G52 WeakPolarHBondContact O-CA 3.19Å; N49-G52 PolarHBondContact O-N 3.26Å; G52-K54 VanDerWaalsContact C-N 3.34Å; G52-K54 PolarHBondContact O-N 2.96Å; G52-L55 PolarHBondContact O-N 3.37Å; G52-Q56 WeakPolarHBondContact O-CB 3.45Å; G52-Q56 PolarHBondContact O-N 2.95Å
53	E	92.9	Very high	92.9	Very high	132 Å²	132	73 Å²	73	62%	0.617	36%	0.355	S	S	*	.	H	α-helix	trans	-61	-41.6	176.6	-73.6	177.7	-176	0	0	112.1	N49 L55 Q56 W57	N49-E53 WeakPolarHBondContact O-CG 3.48Å; N49-E53 PolarHBondContact O-N 2.85Å; E53-L55 PolarHBondContact O-N 3.49Å; E53-Q56 WeakPolarHBondContact O-CB 3.33Å; E53-Q56 PolarHBondContact O-N 3.23Å; E53-W57 PolarHBondContact O-N 3.18Å
54	K	92.9	Very high	92.3	Very high	42 Å²	42	72.3 Å²	72.3	18%	0.183	36%	0.361	C	S	.	.	H	α-helix	trans	-59.6	-48.1	174.4	176.7	174.1	175.5	-177.8	0	110.9	L50 I51 G52 W57 F58 Y81 E130	L50-K54 WeakPolarHBondContact O-CB 3.46Å; L50-K54 PolarHBondContact O-N 3.37Å; L50-K54 VanDerWaalsContact O-N 3.12Å; I51-K54 WeakPolarHBondContact O-CB 3.46Å; I51-K54 PolarHBondContact O-N 3.16Å; G52-K54 VanDerWaalsContact C-N 3.34Å; G52-K54 PolarHBondContact O-N 2.96Å; K54-W57 WeakPolarHBondContact O-CB 3.38Å; K54-W57 PolarHBondContact O-N 3.2Å; K54-F58 HydrophobicContact CG-CD2 4.19Å; K54-F58 HydrophobicContact CG-CE2 3.91Å; K54-F58 WeakPolarHBondContact O-CD2 3.39Å; K54-F58 PolarHBondContact O-N 2.86Å; K54-Y81 HydrophobicContact CG-CE2 4.14Å; K54-E130 WeakPolarHBondContact CE-O 3.42Å; K54-E130 PolarHBondContact NZ-O 3.06Å
55	L	93.1	Very high	91.7	Very high	1 Å²	1	73.6 Å²	73.6	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-65.9	-40.9	179.6	-69.3	174.5	0	0	0	112.4	I51 G52 E53 W57 F58 Q59 P132 F143 W146 L153 I156 M158	I51-L55 HydrophobicContact CG2-CD1 3.97Å; I51-L55 HydrophobicContact CG2-CG 4.42Å; I51-L55 VanDerWaalsContact O-CG 3.29Å; I51-L55 WeakPolarHBondContact O-CG 3.17Å; I51-L55 PolarHBondContact O-N 2.96Å; G52-L55 PolarHBondContact O-N 3.37Å; E53-L55 PolarHBondContact O-N 3.49Å; L55-W57 VanDerWaalsContact C-N 3.26Å; L55-W57 PolarHBondContact O-N 3.2Å; L55-F58 PolarHBondContact O-N 2.85Å; L55-Q59 PolarHBondContact O-N 2.88Å; L55-P132 HydrophobicContact CD2-CB 3.97Å; L55-P132 VanDerWaalsContact CD2-CD 3.48Å; L55-P132 HydrophobicContact CD2-CG 3.52Å; L55-F143 HydrophobicContact CB-CE2 4.08Å; L55-F143 HydrophobicContact CB-CZ 4.36Å; L55-F143 HydrophobicContact CD2-CE2 3.89Å; L55-F143 HydrophobicContact CD2-CZ 4.29Å; L55-F143 HydrophobicContact CG-CE2 4.46Å; L55-F143 WeakPolarHBondContact O-CZ 3.32Å; L55-W146 HydrophobicContact CB-CE3 4.45Å; L55-W146 HydrophobicContact CB-CH2 3.86Å; L55-W146 HydrophobicContact CB-CZ3 3.54Å; L55-W146 HydrophobicContact CD1-CH2 4.31Å; L55-W146 HydrophobicContact CD1-CZ3 4.49Å; L55-L153 HydrophobicContact CD1-CD2 3.24Å; L55-I156 HydrophobicContact CD1-CD1 4.25Å; L55-M158 HydrophobicContact CD2-CE 3.95Å; L55-M158 HydrophobicContact CD2-SD 3.91Å
56	Q	93.2	Very high	91.2	Very high	58 Å²	58	75.4 Å²	75.4	27%	0.271	37%	0.369	S	S	.	.	H	α-helix	trans	-53.9	-45.9	173.3	172.2	80.1	67.7	0	0	111.3	G52 E53 F58 Q59 N60 F148	G52-Q56 WeakPolarHBondContact O-CB 3.45Å; G52-Q56 PolarHBondContact O-N 2.95Å; E53-Q56 WeakPolarHBondContact O-CB 3.33Å; E53-Q56 PolarHBondContact O-N 3.23Å; Q56-F58 VanDerWaalsContact C-N 3.32Å; Q56-F58 PolarHBondContact O-N 3.02Å; Q56-Q59 PolarHBondContact O-N 3.2Å; Q56-N60 PolarHBondContact NE2-ND2 3.25Å; Q56-N60 VanDerWaalsContact NE2-ND2 3.2Å; Q56-N60 PolarHBondContact NE2-OD1 2.75Å; Q56-N60 VanDerWaalsContact O-CG 3.28Å; Q56-N60 PolarHBondContact O-N 3.04Å; Q56-F148 HydrophobicContact CB-CD1 4.3Å; Q56-F148 HydrophobicContact CB-CE1 4.11Å; Q56-F148 VanDerWaalsContact CD-CD1 3.47Å; Q56-F148 VanDerWaalsContact CD-CZ 3.45Å; Q56-F148 HydrophobicContact CG-CD1 4.5Å; Q56-F148 HydrophobicContact CG-CE1 4.12Å
57	W	95.1	Very high	90.5	Very high	42 Å²	42	75.3 Å²	75.3	16%	0.159	37%	0.369	C	S	.	.	H	α-helix	trans	-58.4	-47.4	177	-172.2	98.5	0	0	0	110.5	E53 K54 L55 Q59 N60 H61 L77 R80 Y81 R84	E53-W57 PolarHBondContact O-N 3.18Å; K54-W57 WeakPolarHBondContact O-CB 3.38Å; K54-W57 PolarHBondContact O-N 3.2Å; L55-W57 VanDerWaalsContact C-N 3.26Å; L55-W57 PolarHBondContact O-N 3.2Å; W57-Q59 PolarHBondContact O-N 3.31Å; W57-N60 PolarHBondContact O-N 3.35Å; W57-H61 AromaticContact CD1-CE1 3.67Å; W57-H61 AromaticContact CD2-CE1 3.8Å; W57-H61 AromaticContact CD2-ND1 3.51Å; W57-H61 AromaticContact CE2-CE1 3.33Å; W57-H61 AromaticContact CE2-CG 3.95Å; W57-H61 AromaticContact CE2-ND1 3.45Å; W57-H61 AromaticContact CE2-NE2 3.75Å; W57-H61 HydrophobicContact CE3-CB 4.4Å; W57-H61 AromaticContact CE3-ND1 3.92Å; W57-H61 AromaticContact CG-ND1 3.91Å; W57-H61 HydrophobicContact CH2-CB 4.12Å; W57-H61 AromaticContact CH2-CG 3.85Å; W57-H61 AromaticContact CZ2-CD2 3.75Å; W57-H61 AromaticContact CZ2-CE1 3.76Å; W57-H61 AromaticContact CZ2-CG 3.81Å; W57-H61 AromaticContact CZ2-ND1 3.81Å; W57-H61 AromaticContact CZ2-NE2 3.71Å; W57-H61 HydrophobicContact CZ3-CB 4.04Å; W57-H61 AromaticContact NE1-CE1 3.25Å; W57-H61 PolarHBondContact NE1-CE1 2.8Å; W57-H61 VanDerWaalsContact NE1-CE1 3.25Å; W57-H61 AromaticContact NE1-ND1 3.78Å; W57-H61 AromaticContact NE1-NE2 3.8Å; W57-H61 PolarHBondContact O-N 3.48Å; W57-H61 PolarHBondContact O-ND1 2.81Å; W57-L77 HydrophobicContact CZ3-CD1 4.24Å; W57-L77 HydrophobicContact CZ3-CG 4.5Å; W57-R80 VanDerWaalsContact CH2-C 3.5Å; W57-R80 HydrophobicContact CH2-CB 3.8Å; W57-R80 HydrophobicContact CZ2-CB 4.4Å; W57-Y81 HydrophobicContact CB-CD2 4.43Å; W57-Y81 HydrophobicContact CB-CE2 4.44Å; W57-Y81 AromaticContact CD2-CD2 3.59Å; W57-Y81 HydrophobicContact CD2-CD2 3.59Å; W57-Y81 HydrophobicContact CD2-CE2 4.4Å; W57-Y81 AromaticContact CE3-CD2 3.46Å; W57-Y81 HydrophobicContact CE3-CD2 3.46Å; W57-Y81 VanDerWaalsContact CE3-CD2 3.46Å; W57-Y81 HydrophobicContact CE3-CE2 4.49Å; W57-Y81 HydrophobicContact CE3-CG 4.12Å; W57-Y81 HydrophobicContact CG-CD2 4.01Å; W57-Y81 HydrophobicContact CG-CE2 4.37Å; W57-Y81 VanDerWaalsContact CZ3-CB 3.45Å; W57-Y81 HydrophobicContact CZ3-CD2 4.02Å; W57-Y81 HydrophobicContact CZ3-CG 4.22Å; W57-R84 HydrophobicContact CZ2-CB 4.47Å
58	F	93.9	Very high	90.1	Very high	2 Å²	2	74.8 Å²	74.8	1%	0.009	37%	0.367	C	S	.	.	H	α-helix	trans	-60.6	-47	177.8	-78.2	-73.5	0	0	0	111.7	K54 L55 Q56 N60 H61 L62 L77 Y81 I131 P132 F143	K54-F58 HydrophobicContact CG-CD2 4.19Å; K54-F58 HydrophobicContact CG-CE2 3.91Å; K54-F58 WeakPolarHBondContact O-CD2 3.39Å; K54-F58 PolarHBondContact O-N 2.86Å; L55-F58 PolarHBondContact O-N 2.85Å; Q56-F58 VanDerWaalsContact C-N 3.32Å; Q56-F58 PolarHBondContact O-N 3.02Å; F58-N60 VanDerWaalsContact C-N 3.33Å; F58-N60 PolarHBondContact O-N 3.44Å; F58-H61 CarbonylContact O-C 3.47Å; F58-H61 PolarHBondContact O-N 3.26Å; F58-H61 VanDerWaalsContact O-N 3.13Å; F58-L62 WeakPolarHBondContact O-CG 3.38Å; F58-L62 PolarHBondContact O-N 3.2Å; F58-L62 VanDerWaalsContact O-N 3.09Å; F58-L77 HydrophobicContact CD1-CD2 3.8Å; F58-L77 HydrophobicContact CD1-CG 3.94Å; F58-L77 HydrophobicContact CE1-CD2 4.33Å; F58-L77 HydrophobicContact CE1-CG 4.11Å; F58-Y81 HydrophobicContact CE1-CG 4.47Å; F58-Y81 HydrophobicContact CE2-CD1 4.5Å; F58-Y81 AromaticContact CE2-CD2 3.99Å; F58-Y81 HydrophobicContact CE2-CD2 3.99Å; F58-Y81 HydrophobicContact CE2-CE2 4.24Å; F58-Y81 HydrophobicContact CE2-CG 4.12Å; F58-Y81 HydrophobicContact CZ-CD1 4.15Å; F58-Y81 HydrophobicContact CZ-CD2 4.04Å; F58-Y81 AromaticContact CZ-CG 3.74Å; F58-Y81 HydrophobicContact CZ-CG 3.74Å; F58-I131 HydrophobicContact CE1-CG2 4.07Å; F58-I131 HydrophobicContact CE2-CG2 3.94Å; F58-I131 HydrophobicContact CZ-CB 4.34Å; F58-I131 HydrophobicContact CZ-CG2 3.52Å; F58-P132 HydrophobicContact CB-CG 4.28Å; F58-F143 HydrophobicContact CB-CE1 4.22Å; F58-F143 HydrophobicContact CB-CZ 4.08Å
59	Q	92	Very high	89.9	Confident	30 Å²	30	72 Å²	72	14%	0.14	35%	0.352	C	S	.	.	H	α-helix	trans	-58.9	-42.6	-179.8	-170	175.5	1.1	0	0	112.4	L55 Q56 W57 H61 L62 F143 R144 W146 F148	L55-Q59 PolarHBondContact O-N 2.88Å; Q56-Q59 PolarHBondContact O-N 3.2Å; W57-Q59 PolarHBondContact O-N 3.31Å; Q59-H61 VanDerWaalsContact C-N 3.27Å; Q59-H61 PolarHBondContact O-N 2.88Å; Q59-L62 PolarHBondContact O-N 3.45Å; Q59-F143 HydrophobicContact CB-CE1 3.98Å; Q59-F143 HydrophobicContact CB-CZ 3.95Å; Q59-F143 PolarHBondContact NE2-O 3.43Å; Q59-R144 PolarHBondContact NE2-O 2.91Å; Q59-W146 PolarHBondContact NE2-O 2.95Å; Q59-W146 VanDerWaalsContact OE1-CE3 3.23Å; Q59-F148 HydrophobicContact CG-CZ 4.49Å
60	N	92.9	Very high	89.8	Confident	105 Å²	105	72 Å²	72	56%	0.561	36%	0.357	S	S	*	.	H	α-helix	trans	-67.8	-26.1	179.1	-69	-5.5	0	0	0	113.3	Q56 W57 F58	Q56-N60 PolarHBondContact NE2-ND2 3.25Å; Q56-N60 VanDerWaalsContact NE2-ND2 3.2Å; Q56-N60 PolarHBondContact NE2-OD1 2.75Å; Q56-N60 VanDerWaalsContact O-CG 3.28Å; Q56-N60 PolarHBondContact O-N 3.04Å; W57-N60 PolarHBondContact O-N 3.35Å; F58-N60 VanDerWaalsContact C-N 3.33Å; F58-N60 PolarHBondContact O-N 3.44Å
61	H	91.2	Very high	89.7	Confident	87 Å²	87	70.7 Å²	70.7	40%	0.403	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	6.1	-179.1	-64.8	79.4	0	0	0	112.8	W57 F58 Q59 L77	W57-H61 AromaticContact CD1-CE1 3.67Å; W57-H61 AromaticContact CD2-CE1 3.8Å; W57-H61 AromaticContact CD2-ND1 3.51Å; W57-H61 AromaticContact CE2-CE1 3.33Å; W57-H61 AromaticContact CE2-CG 3.95Å; W57-H61 AromaticContact CE2-ND1 3.45Å; W57-H61 AromaticContact CE2-NE2 3.75Å; W57-H61 HydrophobicContact CE3-CB 4.4Å; W57-H61 AromaticContact CE3-ND1 3.92Å; W57-H61 AromaticContact CG-ND1 3.91Å; W57-H61 HydrophobicContact CH2-CB 4.12Å; W57-H61 AromaticContact CH2-CG 3.85Å; W57-H61 AromaticContact CZ2-CD2 3.75Å; W57-H61 AromaticContact CZ2-CE1 3.76Å; W57-H61 AromaticContact CZ2-CG 3.81Å; W57-H61 AromaticContact CZ2-ND1 3.81Å; W57-H61 AromaticContact CZ2-NE2 3.71Å; W57-H61 HydrophobicContact CZ3-CB 4.04Å; W57-H61 AromaticContact NE1-CE1 3.25Å; W57-H61 PolarHBondContact NE1-CE1 2.8Å; W57-H61 VanDerWaalsContact NE1-CE1 3.25Å; W57-H61 AromaticContact NE1-ND1 3.78Å; W57-H61 AromaticContact NE1-NE2 3.8Å; W57-H61 PolarHBondContact O-N 3.48Å; W57-H61 PolarHBondContact O-ND1 2.81Å; F58-H61 CarbonylContact O-C 3.47Å; F58-H61 PolarHBondContact O-N 3.26Å; F58-H61 VanDerWaalsContact O-N 3.13Å; Q59-H61 VanDerWaalsContact C-N 3.27Å; Q59-H61 PolarHBondContact O-N 2.88Å; H61-L77 HydrophobicContact CB-CD1 3.96Å
62	L	90.5	Very high	89.6	Confident	16 Å²	16	73.2 Å²	73.2	8%	0.084	36%	0.355	C	S	.	.	S	Bend	trans	-77	142.2	169.3	-74.1	174.9	0	0	0	110.5	F58 Q59 P64 Y69 L77 I134 L140 F143	F58-L62 WeakPolarHBondContact O-CG 3.38Å; F58-L62 PolarHBondContact O-N 3.2Å; F58-L62 VanDerWaalsContact O-N 3.09Å; Q59-L62 PolarHBondContact O-N 3.45Å; L62-P64 WeakPolarHBondContact O-CD 3.39Å; L62-Y69 HydrophobicContact CD2-CD2 4.43Å; L62-Y69 HydrophobicContact CD2-CE1 4.14Å; L62-Y69 HydrophobicContact CD2-CE2 3.63Å; L62-Y69 VanDerWaalsContact CD2-CZ 3.46Å; L62-Y69 WeakPolarHBondContact CD2-OH 3.48Å; L62-L77 HydrophobicContact CD2-CD2 3.81Å; L62-I134 HydrophobicContact CD1-CG2 4.43Å; L62-I134 HydrophobicContact CD2-CG2 4.07Å; L62-L140 HydrophobicContact CD1-CD1 3.83Å; L62-L140 HydrophobicContact CD2-CD1 4.35Å; L62-F143 HydrophobicContact CD1-CD1 3.5Å; L62-F143 VanDerWaalsContact CD1-CD1 3.5Å; L62-F143 HydrophobicContact CD1-CE1 3.52Å
63	D	87.9	Confident	89.5	Confident	65 Å²	65	74.8 Å²	74.8	35%	0.348	36%	0.362	S	S	.	.			trans	-76.6	123	174.1	-178.6	-16.3	0	0	0	108	Q65 K66 Y69 R144	D63-Q65 PolarHBondContact O-N 3.43Å; D63-Q65 PolarHBondContact OD1-N 3.5Å; D63-K66 HydrophobicContact CB-CB 4.29Å; D63-K66 HydrophobicContact CB-CD 4.3Å; D63-K66 HydrophobicContact CB-CG 4.27Å; D63-Y69 WeakPolarHBondContact CB-OH 3.42Å; D63-Y69 PolarHBondContact N-OH 3.07Å; D63-R144 PolarHBondContact O-NH2 3.28Å
64	P	83	Confident	89.4	Confident	104 Å²	104	68.5 Å²	68.5	68%	0.675	33%	0.332	S	S	*	.	S	Bend	trans	-61	-28.2	-179.8	-23.4	33.8	0	0	0	113.9	L62 R144	L62-P64 WeakPolarHBondContact O-CD 3.39Å; P64-R144 VanDerWaalsContact O-CZ 3.3Å; P64-R144 PolarHBondContact O-NH1 2.97Å; P64-R144 PolarHBondContact O-NH2 3.32Å
65	Q	81.5	Confident	89.4	Confident	172 Å²	172	66.6 Å²	66.6	80%	0.804	32%	0.324	S	S	*	.	S	Bend	trans	-90.3	-20.4	-171.7	-63.4	-158.7	-13.8	0	0	113.9	D63 N67	D63-Q65 PolarHBondContact O-N 3.43Å; D63-Q65 PolarHBondContact OD1-N 3.5Å; Q65-N67 PolarHBondContact O-N 3.25Å
66	K	83.6	Confident	89.3	Confident	81 Å²	81	70.4 Å²	70.4	35%	0.352	34%	0.342	S	S	.	.			trans	-77.2	122.1	-177.8	-82	-173.9	173.8	-174.2	0	112.5	D63 Y69 D73 R144	D63-K66 HydrophobicContact CB-CB 4.29Å; D63-K66 HydrophobicContact CB-CD 4.3Å; D63-K66 HydrophobicContact CB-CG 4.27Å; K66-Y69 HydrophobicContact CB-CE2 4.23Å; K66-Y69 HydrophobicContact CD-CE1 4.33Å; K66-D73 IonicContact NZ-OD2 3.86Å; K66-D73 PolarHBondContact NZ-OD2 3.02Å; K66-R144 PolarHBondContact O-NH2 3.14Å
67	N	79.7	Confident	89.3	Confident	115 Å²	115	68 Å²	68	62%	0.615	33%	0.331	S	S	*	.	S	Bend	trans	-85.6	-17.1	178.8	-70.2	-33	0	0	0	114.3	Q65 A137 L140	Q65-N67 PolarHBondContact O-N 3.25Å; N67-A137 WeakPolarHBondContact O-CB 3.5Å; N67-L140 WeakPolarHBondContact O-CD2 3.27Å
68	R	84.2	Confident	89.2	Confident	178 Å²	178	66 Å²	66	67%	0.672	32%	0.323	S	S	*	.			trans	-149.4	145	178.1	-68.9	-171.6	-177.2	-154.1	0.5	110.2	A137	R68-A137 HydrophobicContact CG-CB 3.92Å
69	Y	90	Very high	89.2	Confident	21 Å²	21	70.5 Å²	70.5	8%	0.082	34%	0.344	C	S	.	.			trans	-101.2	140.7	171.4	-75.7	-101	0	0	0	110.5	L62 D63 K66 D73 I134 L135 L140	L62-Y69 HydrophobicContact CD2-CD2 4.43Å; L62-Y69 HydrophobicContact CD2-CE1 4.14Å; L62-Y69 HydrophobicContact CD2-CE2 3.63Å; L62-Y69 VanDerWaalsContact CD2-CZ 3.46Å; L62-Y69 WeakPolarHBondContact CD2-OH 3.48Å; D63-Y69 WeakPolarHBondContact CB-OH 3.42Å; D63-Y69 PolarHBondContact N-OH 3.07Å; K66-Y69 HydrophobicContact CB-CE2 4.23Å; K66-Y69 HydrophobicContact CD-CE1 4.33Å; Y69-D73 HydrophobicContact CD1-CB 3.74Å; Y69-I134 WeakPolarHBondContact CB-O 3.21Å; Y69-I134 HydrophobicContact CD1-CD1 4.14Å; Y69-I134 HydrophobicContact CD2-CB 4.03Å; Y69-I134 HydrophobicContact CG-CB 4.22Å; Y69-I134 HydrophobicContact CG-CD1 3.99Å; Y69-I134 HydrophobicContact CG-CG1 4.25Å; Y69-I134 PolarHBondContact N-O 3.12Å; Y69-L135 WeakPolarHBondContact O-CD2 3.4Å; Y69-L140 HydrophobicContact CD2-CD1 4.24Å; Y69-L140 HydrophobicContact CD2-CD2 4.02Å; Y69-L140 HydrophobicContact CE2-CD1 4.1Å; Y69-L140 HydrophobicContact CE2-CD2 4.04Å
70	S	90.6	Very high	89.3	Confident	69 Å²	69	76.7 Å²	76.7	48%	0.483	37%	0.366	S	S	.	.			trans	-76.8	160.8	163.5	-176.2	0	0	0	0	109.8	K72 D73 A74	S70-K72 PolarHBondContact O-N 3.47Å; S70-D73 PolarHBondContact O-N 3.05Å; S70-A74 PolarHBondContact O-N 3.28Å
71	K	89.6	Confident	89.4	Confident	89 Å²	89	72.2 Å²	72.2	39%	0.387	34%	0.342	S	S	.	.	H	α-helix	trans	-56.3	-39.7	171.4	-70.7	-172.4	169.2	-158	0	111.9	A74 C75 L135 D165	K71-A74 WeakPolarHBondContact O-CB 3.39Å; K71-A74 PolarHBondContact O-N 2.68Å; K71-C75 PolarHBondContact O-N 3.05Å; K71-C75 PolarHBondContact O-SG 3.01Å; K71-C75 VanDerWaalsContact O-SG 3.34Å; K71-L135 HydrophobicContact CG-CD1 4.18Å; K71-L135 HydrophobicContact CG-CD2 4.36Å; K71-D165 HydrophobicContact CD-CB 4.32Å; K71-D165 IonicContact NZ-OD1 3.48Å; K71-D165 PolarHBondContact NZ-OD1 3.36Å
72	K	90.5	Very high	89.5	Confident	123 Å²	123	68.2 Å²	68.2	54%	0.535	32%	0.323	S	S	.	.	H	α-helix	trans	-61.8	-46.1	177	-171.8	179.1	179.6	-177.5	0	111.5	S70 A74 C75 Q76	S70-K72 PolarHBondContact O-N 3.47Å; K72-A74 VanDerWaalsContact C-N 3.29Å; K72-A74 PolarHBondContact O-N 3.41Å; K72-C75 PolarHBondContact O-N 3.36Å; K72-Q76 WeakPolarHBondContact O-CG 3.33Å; K72-Q76 PolarHBondContact O-N 3.16Å
73	D	90.4	Very high	89.7	Confident	39 Å²	39	70.7 Å²	70.7	21%	0.209	34%	0.337	C	S	.	.	H	α-helix	trans	-63.3	-37.6	177.5	-65.2	18.5	0	0	0	111.2	K66 Y69 S70 Q76 L77	K66-D73 IonicContact NZ-OD2 3.86Å; K66-D73 PolarHBondContact NZ-OD2 3.02Å; Y69-D73 HydrophobicContact CD1-CB 3.74Å; S70-D73 PolarHBondContact O-N 3.05Å; D73-Q76 PolarHBondContact O-N 3.29Å; D73-L77 WeakPolarHBondContact O-CB 3.47Å; D73-L77 PolarHBondContact O-N 2.93Å
74	A	91.4	Very high	90	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-64.4	-43.6	175.5	0	0	0	0	0	112	S70 K71 K72 L77 I78 I134 L135 I161	S70-A74 PolarHBondContact O-N 3.28Å; K71-A74 WeakPolarHBondContact O-CB 3.39Å; K71-A74 PolarHBondContact O-N 2.68Å; K72-A74 VanDerWaalsContact C-N 3.29Å; K72-A74 PolarHBondContact O-N 3.41Å; A74-L77 PolarHBondContact O-N 3.41Å; A74-I78 VanDerWaalsContact O-CG1 3.3Å; A74-I78 WeakPolarHBondContact O-CG1 3.46Å; A74-I78 PolarHBondContact O-N 3.42Å; A74-I134 HydrophobicContact CB-CD1 3.75Å; A74-I134 HydrophobicContact CB-CG1 4.22Å; A74-L135 HydrophobicContact CB-CD2 4.4Å; A74-I161 HydrophobicContact CB-CD1 3.65Å
75	C	92.3	Very high	90.5	Very high	2 Å²	2	67.6 Å²	67.6	1%	0.014	31%	0.307	C	S	.	.	H	α-helix	trans	-60.6	-43.5	173.4	-69.5	0	0	0	0	112.1	K71 K72 L77 I78 E79 Y124 A166	K71-C75 PolarHBondContact O-N 3.05Å; K71-C75 PolarHBondContact O-SG 3.01Å; K71-C75 VanDerWaalsContact O-SG 3.34Å; K72-C75 PolarHBondContact O-N 3.36Å; C75-L77 VanDerWaalsContact C-N 3.3Å; C75-L77 PolarHBondContact O-N 3.39Å; C75-I78 WeakPolarHBondContact O-CB 3.36Å; C75-I78 PolarHBondContact O-N 2.86Å; C75-I78 VanDerWaalsContact O-N 3.16Å; C75-E79 WeakPolarHBondContact O-CG 3.2Å; C75-E79 PolarHBondContact O-N 2.8Å; C75-Y124 WeakPolarHBondContact CB-OH 3.44Å; C75-Y124 PolarHBondContact SG-OH 3.09Å; C75-A166 HydrophobicContact CB-CB 3.83Å
76	Q	92.6	Very high	91.1	Very high	80 Å²	80	62.6 Å²	62.6	37%	0.374	29%	0.292	S	S	.	.	H	α-helix	trans	-61.6	-38.8	175.1	-71.7	176.8	-1.5	0	0	112.2	K72 D73 I78 E79 R80	K72-Q76 WeakPolarHBondContact O-CG 3.33Å; K72-Q76 PolarHBondContact O-N 3.16Å; D73-Q76 PolarHBondContact O-N 3.29Å; Q76-I78 VanDerWaalsContact C-N 3.34Å; Q76-E79 PolarHBondContact O-N 3.46Å; Q76-R80 WeakPolarHBondContact O-CG 3.3Å; Q76-R80 PolarHBondContact O-N 2.82Å
77	L	93.2	Very high	91.6	Very high	8 Å²	8	62.7 Å²	62.7	4%	0.042	30%	0.302	C	S	.	.	H	α-helix	trans	-65.8	-38.5	175.7	-170.6	63.8	0	0	0	111.5	W57 F58 H61 L62 D73 A74 C75 R80 Y81 I134	W57-L77 HydrophobicContact CZ3-CD1 4.24Å; W57-L77 HydrophobicContact CZ3-CG 4.5Å; F58-L77 HydrophobicContact CD1-CD2 3.8Å; F58-L77 HydrophobicContact CD1-CG 3.94Å; F58-L77 HydrophobicContact CE1-CD2 4.33Å; F58-L77 HydrophobicContact CE1-CG 4.11Å; H61-L77 HydrophobicContact CB-CD1 3.96Å; L62-L77 HydrophobicContact CD2-CD2 3.81Å; D73-L77 WeakPolarHBondContact O-CB 3.47Å; D73-L77 PolarHBondContact O-N 2.93Å; A74-L77 PolarHBondContact O-N 3.41Å; C75-L77 VanDerWaalsContact C-N 3.3Å; C75-L77 PolarHBondContact O-N 3.39Å; L77-R80 PolarHBondContact O-N 3.39Å; L77-Y81 PolarHBondContact O-N 2.96Å; L77-I134 HydrophobicContact CD2-CD1 3.89Å
78	I	93.3	Very high	92.2	Very high	0 Å²	0	60 Å²	60	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65	-42.4	173.8	-65.7	164.1	0	0	0	111.1	A74 C75 Q76 R80 Y81 L82 Y124 L129 I131 I161	A74-I78 VanDerWaalsContact O-CG1 3.3Å; A74-I78 WeakPolarHBondContact O-CG1 3.46Å; A74-I78 PolarHBondContact O-N 3.42Å; C75-I78 WeakPolarHBondContact O-CB 3.36Å; C75-I78 PolarHBondContact O-N 2.86Å; C75-I78 VanDerWaalsContact O-N 3.16Å; Q76-I78 VanDerWaalsContact C-N 3.34Å; I78-R80 VanDerWaalsContact C-N 3.3Å; I78-R80 PolarHBondContact O-N 3.42Å; I78-Y81 WeakPolarHBondContact O-CA 3.49Å; I78-Y81 WeakPolarHBondContact O-CB 3.34Å; I78-Y81 PolarHBondContact O-N 3.33Å; I78-L82 HydrophobicContact CG2-CD1 4.06Å; I78-L82 HydrophobicContact CG2-CG 4.25Å; I78-L82 WeakPolarHBondContact O-CG 3.38Å; I78-L82 PolarHBondContact O-N 2.69Å; I78-Y124 HydrophobicContact CB-CE2 4.13Å; I78-Y124 HydrophobicContact CD1-CD2 4.23Å; I78-Y124 HydrophobicContact CD1-CE2 3.71Å; I78-Y124 HydrophobicContact CG2-CD1 4.48Å; I78-Y124 HydrophobicContact CG2-CD2 3.62Å; I78-Y124 HydrophobicContact CG2-CE1 4.47Å; I78-Y124 HydrophobicContact CG2-CE2 3.63Å; I78-Y124 HydrophobicContact CG2-CG 4.06Å; I78-L129 HydrophobicContact CG2-CD2 3.74Å; I78-I131 HydrophobicContact CD1-CD1 4.07Å; I78-I131 HydrophobicContact CD1-CG2 4.28Å; I78-I131 HydrophobicContact CG1-CD1 4.21Å; I78-I131 HydrophobicContact CG1-CG2 4.03Å; I78-I161 HydrophobicContact CD1-CB 3.76Å; I78-I161 HydrophobicContact CD1-CG2 3.8Å
79	E	93	Very high	92.7	Very high	96 Å²	96	53 Å²	53	45%	0.449	26%	0.262	S	S	.	.	H	α-helix	trans	-61.1	-40.9	176.9	-74.7	171.5	-171.7	0	0	111.8	C75 Q76 Y81 L82 N83	C75-E79 WeakPolarHBondContact O-CG 3.2Å; C75-E79 PolarHBondContact O-N 2.8Å; Q76-E79 PolarHBondContact O-N 3.46Å; E79-Y81 VanDerWaalsContact C-N 3.32Å; E79-Y81 PolarHBondContact O-N 3.24Å; E79-L82 PolarHBondContact O-N 3.47Å; E79-N83 WeakPolarHBondContact O-CB 3.39Å; E79-N83 PolarHBondContact O-N 3.11Å; E79-N83 PolarHBondContact O-ND2 3.45Å
80	R	94.4	Very high	92.8	Very high	161 Å²	161	57.7 Å²	57.7	61%	0.608	29%	0.285	S	S	*	.	H	α-helix	trans	-61.2	-40.8	171.7	-69.3	176.3	-175.5	-167.2	0.2	111.7	W57 Q76 L77 I78 N83 R84	W57-R80 VanDerWaalsContact CH2-C 3.5Å; W57-R80 HydrophobicContact CH2-CB 3.8Å; W57-R80 HydrophobicContact CZ2-CB 4.4Å; Q76-R80 WeakPolarHBondContact O-CG 3.3Å; Q76-R80 PolarHBondContact O-N 2.82Å; L77-R80 PolarHBondContact O-N 3.39Å; I78-R80 VanDerWaalsContact C-N 3.3Å; I78-R80 PolarHBondContact O-N 3.42Å; R80-N83 CarbonylContact O-C 3.59Å; R80-N83 PolarHBondContact O-N 3.22Å; R80-R84 PolarHBondContact O-N 3.35Å
81	Y	94.6	Very high	92.9	Very high	11 Å²	11	61 Å²	61	4%	0.043	29%	0.292	C	S	.	.	H	α-helix	trans	-63.1	-44	176.5	174.8	-100.4	0	0	0	112.1	K54 W57 F58 L77 I78 E79 N83 R84 E120 L129	K54-Y81 HydrophobicContact CG-CE2 4.14Å; W57-Y81 HydrophobicContact CB-CD2 4.43Å; W57-Y81 HydrophobicContact CB-CE2 4.44Å; W57-Y81 AromaticContact CD2-CD2 3.59Å; W57-Y81 HydrophobicContact CD2-CD2 3.59Å; W57-Y81 HydrophobicContact CD2-CE2 4.4Å; W57-Y81 AromaticContact CE3-CD2 3.46Å; W57-Y81 HydrophobicContact CE3-CD2 3.46Å; W57-Y81 VanDerWaalsContact CE3-CD2 3.46Å; W57-Y81 HydrophobicContact CE3-CE2 4.49Å; W57-Y81 HydrophobicContact CE3-CG 4.12Å; W57-Y81 HydrophobicContact CG-CD2 4.01Å; W57-Y81 HydrophobicContact CG-CE2 4.37Å; W57-Y81 VanDerWaalsContact CZ3-CB 3.45Å; W57-Y81 HydrophobicContact CZ3-CD2 4.02Å; W57-Y81 HydrophobicContact CZ3-CG 4.22Å; F58-Y81 HydrophobicContact CE1-CG 4.47Å; F58-Y81 HydrophobicContact CE2-CD1 4.5Å; F58-Y81 AromaticContact CE2-CD2 3.99Å; F58-Y81 HydrophobicContact CE2-CD2 3.99Å; F58-Y81 HydrophobicContact CE2-CE2 4.24Å; F58-Y81 HydrophobicContact CE2-CG 4.12Å; F58-Y81 HydrophobicContact CZ-CD1 4.15Å; F58-Y81 HydrophobicContact CZ-CD2 4.04Å; F58-Y81 AromaticContact CZ-CG 3.74Å; F58-Y81 HydrophobicContact CZ-CG 3.74Å; L77-Y81 PolarHBondContact O-N 2.96Å; I78-Y81 WeakPolarHBondContact O-CA 3.49Å; I78-Y81 WeakPolarHBondContact O-CB 3.34Å; I78-Y81 PolarHBondContact O-N 3.33Å; E79-Y81 VanDerWaalsContact C-N 3.32Å; E79-Y81 PolarHBondContact O-N 3.24Å; Y81-N83 PolarHBondContact O-N 3.24Å; Y81-R84 VanDerWaalsContact CE1-NH1 3.28Å; Y81-R84 VanDerWaalsContact CZ-CZ 3.46Å; Y81-R84 VanDerWaalsContact CZ-NH1 3.28Å; Y81-R84 WeakPolarHBondContact O-CB 3.37Å; Y81-R84 WeakPolarHBondContact O-CD 3.39Å; Y81-R84 WeakPolarHBondContact O-CG 3.28Å; Y81-R84 PolarHBondContact O-N 3.16Å; Y81-R84 PolarHBondContact O-NH1 3.2Å; Y81-R84 PolarHBondContact OH-NH2 3.31Å; Y81-E120 WeakPolarHBondContact CE1-OE1 3.4Å; Y81-E120 PolarHBondContact OH-OE1 2.95Å; Y81-L129 HydrophobicContact CD1-CD2 3.93Å; Y81-L129 HydrophobicContact CE1-CD2 4.12Å
82	L	93.1	Very high	93	Very high	3 Å²	3	57.4 Å²	57.4	2%	0.016	28%	0.277	C	S	.	.	H	α-helix	trans	-64.4	-32	178.1	-69.6	173.1	0	0	0	111.9	I78 E79 E120 R121 Y124	I78-L82 HydrophobicContact CG2-CD1 4.06Å; I78-L82 HydrophobicContact CG2-CG 4.25Å; I78-L82 WeakPolarHBondContact O-CG 3.38Å; I78-L82 PolarHBondContact O-N 2.69Å; E79-L82 PolarHBondContact O-N 3.47Å; L82-E120 HydrophobicContact CD2-CB 3.47Å; L82-E120 VanDerWaalsContact CD2-CB 3.47Å; L82-R121 HydrophobicContact CD1-CG 4.29Å; L82-R121 HydrophobicContact CD2-CG 4.32Å; L82-Y124 HydrophobicContact CD1-CD1 3.88Å; L82-Y124 HydrophobicContact CD1-CE1 4.49Å; L82-Y124 HydrophobicContact CD1-CG 4.2Å
83	N	93.9	Very high	93	Very high	68 Å²	68	58.1 Å²	58.1	36%	0.364	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	7.8	179.2	-65.5	-25.6	0	0	0	113.8	E79 R80 Y81 F85 S86 R121	E79-N83 WeakPolarHBondContact O-CB 3.39Å; E79-N83 PolarHBondContact O-N 3.11Å; E79-N83 PolarHBondContact O-ND2 3.45Å; R80-N83 CarbonylContact O-C 3.59Å; R80-N83 PolarHBondContact O-N 3.22Å; Y81-N83 PolarHBondContact O-N 3.24Å; N83-F85 PolarHBondContact O-N 3.46Å; N83-S86 WeakPolarHBondContact O-CB 3.34Å; N83-S86 PolarHBondContact O-N 3.23Å; N83-S86 PolarHBondContact O-OG 2.88Å; N83-R121 PolarHBondContact OD1-NH2 3.3Å
84	R	94.4	Very high	93	Very high	67 Å²	67	60.9 Å²	60.9	25%	0.253	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.1	-176.5	73	-172	177.1	-80.8	7	114.9	W57 R80 Y81 E120	W57-R84 HydrophobicContact CZ2-CB 4.47Å; R80-R84 PolarHBondContact O-N 3.35Å; Y81-R84 VanDerWaalsContact CE1-NH1 3.28Å; Y81-R84 VanDerWaalsContact CZ-CZ 3.46Å; Y81-R84 VanDerWaalsContact CZ-NH1 3.28Å; Y81-R84 WeakPolarHBondContact O-CB 3.37Å; Y81-R84 WeakPolarHBondContact O-CD 3.39Å; Y81-R84 WeakPolarHBondContact O-CG 3.28Å; Y81-R84 PolarHBondContact O-N 3.16Å; Y81-R84 PolarHBondContact O-NH1 3.2Å; Y81-R84 PolarHBondContact OH-NH2 3.31Å; R84-E120 IonicContact CZ-OE1 2.93Å; R84-E120 IonicContact CZ-OE2 2.85Å; R84-E120 IonicContact NH1-OE1 3.98Å; R84-E120 IonicContact NH1-OE2 2.66Å; R84-E120 PolarHBondContact NH1-OE2 3.45Å; R84-E120 IonicContact NH2-OE1 3.22Å; R84-E120 PolarHBondContact NH2-OE1 3.48Å; R84-E120 IonicContact NH2-OE2 2.67Å; R84-E120 PolarHBondContact NH2-OE2 3.27Å
85	F	94.3	Very high	92.8	Very high	36 Å²	36	63.6 Å²	63.6	16%	0.158	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	2.8	-179.6	-60.5	-64.5	0	0	0	113.9	N83 S87 E88 L89 I113 M117	N83-F85 PolarHBondContact O-N 3.46Å; F85-S87 VanDerWaalsContact C-N 3.32Å; F85-S87 PolarHBondContact O-N 3.35Å; F85-E88 WeakPolarHBondContact CD1-OE2 3.23Å; F85-E88 PolarHBondContact O-N 3.42Å; F85-L89 WeakPolarHBondContact O-CG 3.49Å; F85-L89 PolarHBondContact O-N 2.82Å; F85-I113 HydrophobicContact CB-CG2 3.53Å; F85-I113 HydrophobicContact CD1-CD1 4.44Å; F85-I113 HydrophobicContact CD1-CG1 4.49Å; F85-I113 HydrophobicContact CD1-CG2 4.47Å; F85-I113 HydrophobicContact CD2-CG2 3.91Å; F85-I113 HydrophobicContact CG-CG2 3.75Å; F85-M117 HydrophobicContact CB-SD 4.14Å; F85-M117 HydrophobicContact CD2-CG 4.15Å
86	S	93.3	Very high	92.6	Very high	68 Å²	68	64.3 Å²	64.3	48%	0.476	31%	0.313	S	S	.	.	H	α-helix	trans	-58.3	-44.7	-176	59.1	0	0	0	0	112.1	N83 L89 E90	N83-S86 WeakPolarHBondContact O-CB 3.34Å; N83-S86 PolarHBondContact O-N 3.23Å; N83-S86 PolarHBondContact O-OG 2.88Å; S86-L89 PolarHBondContact O-N 2.8Å; S86-E90 WeakPolarHBondContact O-CB 3.41Å; S86-E90 PolarHBondContact O-N 2.86Å
87	S	94.1	Very high	92.3	Very high	82 Å²	82	63.7 Å²	63.7	57%	0.573	32%	0.318	S	S	*	.	H	α-helix	trans	-65.4	-38.5	178.2	177.8	0	0	0	0	112.9	F85 Q91	F85-S87 VanDerWaalsContact C-N 3.32Å; F85-S87 PolarHBondContact O-N 3.35Å; S87-Q91 WeakPolarHBondContact O-CB 3.45Å; S87-Q91 PolarHBondContact O-N 3.17Å
88	E	93.2	Very high	91.9	Very high	60 Å²	60	69.8 Å²	69.8	28%	0.28	35%	0.349	S	S	.	.	H	α-helix	trans	-65.7	-42.9	176.2	-174.6	-178.7	173.8	0	0	110.8	F85 Q91 I92 R109 I113	F85-E88 WeakPolarHBondContact CD1-OE2 3.23Å; F85-E88 PolarHBondContact O-N 3.42Å; E88-Q91 PolarHBondContact O-N 2.73Å; E88-I92 HydrophobicContact CG-CD1 4.24Å; E88-I92 WeakPolarHBondContact O-CG1 3.48Å; E88-I92 PolarHBondContact O-N 3.01Å; E88-R109 IonicContact OE1-CZ 3.39Å; E88-R109 IonicContact OE1-NE 3.57Å; E88-R109 PolarHBondContact OE1-NE 2.85Å; E88-R109 IonicContact OE1-NH2 3.65Å; E88-R109 PolarHBondContact OE1-NH2 3.41Å; E88-R109 IonicContact OE2-CZ 2.84Å; E88-R109 IonicContact OE2-NE 2.86Å; E88-R109 IonicContact OE2-NH2 2.69Å; E88-R109 PolarHBondContact OE2-NH2 3.05Å; E88-I113 HydrophobicContact CG-CD1 4.08Å; E88-I113 WeakPolarHBondContact OE1-CD1 3.36Å; E88-I113 WeakPolarHBondContact OE2-CD1 3.5Å
89	L	93.7	Very high	91	Very high	29 Å²	29	75.2 Å²	75.2	15%	0.152	37%	0.369	C	S	.	.	H	α-helix	trans	-65.2	-43.7	177.6	-72.7	178	0	0	0	112.2	F85 S86 Q91 I92 E93 E110 I113 K114 M117	F85-L89 WeakPolarHBondContact O-CG 3.49Å; F85-L89 PolarHBondContact O-N 2.82Å; S86-L89 PolarHBondContact O-N 2.8Å; L89-Q91 VanDerWaalsContact C-N 3.31Å; L89-Q91 PolarHBondContact O-N 2.87Å; L89-I92 PolarHBondContact O-N 3.05Å; L89-E93 WeakPolarHBondContact O-CB 3.48Å; L89-E93 PolarHBondContact O-N 3.27Å; L89-E110 HydrophobicContact CD2-CG 3.74Å; L89-I113 HydrophobicContact CD1-CG2 3.96Å; L89-I113 HydrophobicContact CD2-CB 4.22Å; L89-I113 HydrophobicContact CD2-CD1 4.38Å; L89-I113 HydrophobicContact CD2-CG2 3.86Å; L89-I113 HydrophobicContact CG-CG2 3.93Å; L89-K114 HydrophobicContact CD2-CG 4.41Å; L89-M117 HydrophobicContact CD1-SD 3.74Å
90	E	93.4	Very high	89.7	Confident	121 Å²	121	76.6 Å²	76.6	57%	0.565	38%	0.38	S	S	*	.	H	α-helix	trans	-60.6	-42	176.3	-175.3	177.1	-171.9	0	0	111.2	S86 I92 E93 L94	S86-E90 WeakPolarHBondContact O-CB 3.41Å; S86-E90 PolarHBondContact O-N 2.86Å; E90-I92 PolarHBondContact O-N 3.34Å; E90-E93 PolarHBondContact O-N 3.19Å; E90-L94 HydrophobicContact CG-CD1 4.21Å; E90-L94 WeakPolarHBondContact O-CB 3.47Å; E90-L94 VanDerWaalsContact O-CG 3.32Å; E90-L94 WeakPolarHBondContact O-CG 3.4Å; E90-L94 PolarHBondContact O-N 3.01Å
91	Q	92.5	Very high	88.7	Confident	137 Å²	137	81 Å²	81	64%	0.64	40%	0.396	S	S	*	.	H	α-helix	trans	-63.5	-41.4	176.1	-172	177.7	11.4	0	0	112.6	S87 E88 L89 H95	S87-Q91 WeakPolarHBondContact O-CB 3.45Å; S87-Q91 PolarHBondContact O-N 3.17Å; E88-Q91 PolarHBondContact O-N 2.73Å; L89-Q91 VanDerWaalsContact C-N 3.31Å; L89-Q91 PolarHBondContact O-N 2.87Å; Q91-H95 WeakPolarHBondContact O-CB 3.4Å; Q91-H95 PolarHBondContact O-N 3.38Å
92	I	90.8	Very high	87.7	Confident	14 Å²	14	86.9 Å²	86.9	7%	0.072	42%	0.424	C	S	.	.	H	α-helix	trans	-64	-43.2	176	-69.8	167.6	0	0	0	110.5	E88 L89 E90 H95 N96 H106 E110	E88-I92 HydrophobicContact CG-CD1 4.24Å; E88-I92 WeakPolarHBondContact O-CG1 3.48Å; E88-I92 PolarHBondContact O-N 3.01Å; L89-I92 PolarHBondContact O-N 3.05Å; E90-I92 PolarHBondContact O-N 3.34Å; I92-H95 PolarHBondContact O-N 3.33Å; I92-N96 WeakPolarHBondContact CG2-ND2 3.49Å; I92-N96 WeakPolarHBondContact O-CB 3.49Å; I92-N96 VanDerWaalsContact O-CG 3.3Å; I92-N96 PolarHBondContact O-N 2.97Å; I92-N96 PolarHBondContact O-ND2 3.45Å; I92-N96 VanDerWaalsContact O-ND2 3.14Å; I92-H106 HydrophobicContact CD1-CB 4.23Å; I92-H106 HydrophobicContact CG1-CB 4.2Å; I92-H106 HydrophobicContact CG2-CB 4.2Å; I92-E110 HydrophobicContact CD1-CB 4.43Å; I92-E110 HydrophobicContact CG2-CB 4.36Å; I92-E110 HydrophobicContact CG2-CG 4.25Å
93	E	90.4	Very high	86.9	Confident	139 Å²	139	88.9 Å²	88.9	65%	0.65	45%	0.446	S	S	*	.	H	α-helix	trans	-62.5	-48.6	178.5	-176.1	169.1	-170	0	0	111.5	L89 E90 H95 N96 S97	L89-E93 WeakPolarHBondContact O-CB 3.48Å; L89-E93 PolarHBondContact O-N 3.27Å; E90-E93 PolarHBondContact O-N 3.19Å; E93-H95 PolarHBondContact O-N 3.39Å; E93-N96 PolarHBondContact O-N 3.38Å; E93-S97 PolarHBondContact O-N 3.05Å; E93-S97 PolarHBondContact O-OG 3.31Å
94	L	90.8	Very high	86.4	Confident	97 Å²	97	92.9 Å²	92.9	51%	0.508	46%	0.456	S	S	.	.	H	α-helix	trans	-60.4	-43.8	176.1	-73.7	172	0	0	0	112.5	E90 N96 S97 I98	E90-L94 HydrophobicContact CG-CD1 4.21Å; E90-L94 WeakPolarHBondContact O-CB 3.47Å; E90-L94 VanDerWaalsContact O-CG 3.32Å; E90-L94 WeakPolarHBondContact O-CG 3.4Å; E90-L94 PolarHBondContact O-N 3.01Å; L94-N96 VanDerWaalsContact C-N 3.29Å; L94-N96 PolarHBondContact O-N 2.98Å; L94-S97 PolarHBondContact O-OG 3Å; L94-I98 WeakPolarHBondContact O-CD1 3.47Å; L94-I98 VanDerWaalsContact O-CG1 3.29Å; L94-I98 WeakPolarHBondContact O-CG1 3.33Å; L94-I98 PolarHBondContact O-N 2.88Å
95	H	87.9	Confident	85.9	Confident	57 Å²	57	94.6 Å²	94.6	26%	0.264	46%	0.462	S	S	.	.	H	α-helix	trans	-63.8	-38.7	178.6	177.9	-76.3	0	0	0	111.5	Q91 I92 E93	Q91-H95 WeakPolarHBondContact O-CB 3.4Å; Q91-H95 PolarHBondContact O-N 3.38Å; I92-H95 PolarHBondContact O-N 3.33Å; E93-H95 PolarHBondContact O-N 3.39Å
96	N	87.8	Confident	85.6	Confident	16 Å²	16	98.1 Å²	98.1	9%	0.086	48%	0.479	C	S	.	.	H	α-helix	trans	-71.6	-44.6	-179.9	-74.6	-32.5	0	0	0	111.5	I92 E93 L94 I98 R99 D100 R105	I92-N96 WeakPolarHBondContact CG2-ND2 3.49Å; I92-N96 WeakPolarHBondContact O-CB 3.49Å; I92-N96 VanDerWaalsContact O-CG 3.3Å; I92-N96 PolarHBondContact O-N 2.97Å; I92-N96 PolarHBondContact O-ND2 3.45Å; I92-N96 VanDerWaalsContact O-ND2 3.14Å; E93-N96 PolarHBondContact O-N 3.38Å; L94-N96 VanDerWaalsContact C-N 3.29Å; L94-N96 PolarHBondContact O-N 2.98Å; N96-I98 PolarHBondContact O-N 2.91Å; N96-R99 CarbonylContact O-C 3.47Å; N96-R99 PolarHBondContact O-N 3.09Å; N96-D100 PolarHBondContact O-N 3.43Å; N96-R105 PolarHBondContact ND2-O 2.97Å; N96-R105 PolarHBondContact OD1-N 3.36Å; N96-R105 PolarHBondContact OD1-O 3.05Å
97	S	85.7	Confident	85.4	Confident	68 Å²	68	97.8 Å²	97.8	48%	0.476	48%	0.476	S	S	.	.	H	α-helix	trans	-61.7	-28	-179.6	65.3	0	0	0	0	114	E93 L94	E93-S97 PolarHBondContact O-N 3.05Å; E93-S97 PolarHBondContact O-OG 3.31Å; L94-S97 PolarHBondContact O-OG 3Å
98	I	84.4	Confident	85.3	Confident	135 Å²	135	98.1 Å²	98.1	69%	0.692	48%	0.478	S	S	*	.	H	α-helix	trans	-77	-27.7	176.2	-63.9	166.1	0	0	0	111.9	L94 N96	L94-I98 WeakPolarHBondContact O-CD1 3.47Å; L94-I98 VanDerWaalsContact O-CG1 3.29Å; L94-I98 WeakPolarHBondContact O-CG1 3.33Å; L94-I98 PolarHBondContact O-N 2.88Å; N96-I98 PolarHBondContact O-N 2.91Å
99	R	74.6	Confident	85.4	Confident	114 Å²	114	100 Å²	100	43%	0.43	48%	0.483	S	S	.	.			trans	-122.1	29.9	-169.7	-62.3	-169	-176.3	-152.9	4.3	113.7	N96 R101 Q102	N96-R99 CarbonylContact O-C 3.47Å; N96-R99 PolarHBondContact O-N 3.09Å; R99-R101 PolarHBondContact O-N 2.91Å; R99-Q102 PolarHBondContact O-N 3.23Å
100	D	67.2	Low	85.4	Confident	126 Å²	126	99.2 Å²	99.2	67%	0.674	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-51.5	-28.6	-174.2	-81.2	-25	0	0	0	114.6	N96 Q102	N96-D100 PolarHBondContact O-N 3.43Å; D100-Q102 VanDerWaalsContact C-N 3.33Å; D100-Q102 PolarHBondContact O-N 3.44Å
101	R	72.8	Confident	85.4	Confident	253 Å²	253	96.7 Å²	96.7	96%	0.955	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-75.3	-14.2	178.5	-60.6	-174.2	-177.2	-168.3	0.7	114.7	R99	R99-R101 PolarHBondContact O-N 2.91Å
102	Q	72.4	Confident	85.6	Confident	134 Å²	134	93.6 Å²	93.6	63%	0.626	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-106.3	16.3	-175	-69	-169.2	-17.2	0	0	114.4	R99 D100	R99-Q102 PolarHBondContact O-N 3.23Å; D100-Q102 VanDerWaalsContact C-N 3.33Å; D100-Q102 PolarHBondContact O-N 3.44Å
103	G	77.3	Confident	85.8	Confident	46 Å²	46	93 Å²	93	47%	0.474	46%	0.459	S	S	.	.			trans	78.5	147	179.4	0	0	0	0	0	113.2	R105	G103-R105 PolarHBondContact O-N 3.02Å
104	R	84.3	Confident	86	Confident	151 Å²	151	91.3 Å²	91.3	57%	0.57	45%	0.449	S	S	*	.			trans	-69.9	122.1	-174	-171.4	178.6	177.5	178.8	7.4	111.3	C107 E110	R104-C107 HydrophobicContact CG-CB 4.44Å; R104-E110 IonicContact CZ-OE1 3.92Å; R104-E110 IonicContact CZ-OE2 3.32Å; R104-E110 IonicContact NE-OE2 3.22Å; R104-E110 PolarHBondContact NE-OE2 2.87Å; R104-E110 IonicContact NH2-OE1 2.71Å; R104-E110 PolarHBondContact NH2-OE1 3.16Å; R104-E110 IonicContact NH2-OE2 2.7Å; R104-E110 PolarHBondContact NH2-OE2 3.42Å
105	R	83.8	Confident	86.2	Confident	104 Å²	104	91.5 Å²	91.5	39%	0.392	45%	0.448	S	S	.	.	S	Bend	trans	-90.9	157.2	174.9	-57	-164	-172.8	176.7	-9.3	110.2	N96 G103 C107	N96-R105 PolarHBondContact ND2-O 2.97Å; N96-R105 PolarHBondContact OD1-N 3.36Å; N96-R105 PolarHBondContact OD1-O 3.05Å; G103-R105 PolarHBondContact O-N 3.02Å; R105-C107 PolarHBondContact O-N 3.15Å; R105-C107 VanDerWaalsContact O-N 3.12Å
106	H	87.2	Confident	86.6	Confident	109 Å²	109	90.2 Å²	90.2	51%	0.505	44%	0.444	S	S	.	.	S	Bend	trans	59.8	19.1	176.4	-55	-76.9	0	0	0	116.2	I92 S108 R109 E110	I92-H106 HydrophobicContact CD1-CB 4.23Å; I92-H106 HydrophobicContact CG1-CB 4.2Å; I92-H106 HydrophobicContact CG2-CB 4.2Å; H106-S108 VanDerWaalsContact C-N 3.32Å; H106-S108 PolarHBondContact O-N 2.98Å; H106-R109 PolarHBondContact O-N 2.9Å; H106-E110 WeakPolarHBondContact O-CB 3.46Å; H106-E110 PolarHBondContact O-N 2.87Å
107	C	89.2	Confident	86.8	Confident	62 Å²	62	90.7 Å²	90.7	42%	0.419	45%	0.446	S	S	.	.	H	α-helix	trans	-56.5	-42.2	-178.3	60.7	0	0	0	0	113.1	R104 R105 E110 T111	R104-C107 HydrophobicContact CG-CB 4.44Å; R105-C107 PolarHBondContact O-N 3.15Å; R105-C107 VanDerWaalsContact O-N 3.12Å; C107-E110 PolarHBondContact O-N 3.39Å; C107-T111 WeakPolarHBondContact O-CB 3.42Å; C107-T111 PolarHBondContact O-N 3.07Å; C107-T111 PolarHBondContact O-OG1 2.88Å
108	S	92.6	Very high	87.3	Confident	88 Å²	88	93.9 Å²	93.9	62%	0.615	45%	0.453	S	S	*	.	H	α-helix	trans	-62.7	-45.3	179.3	56.6	0	0	0	0	112.4	H106 V112	H106-S108 VanDerWaalsContact C-N 3.32Å; H106-S108 PolarHBondContact O-N 2.98Å; S108-V112 VanDerWaalsContact O-CG2 3.3Å; S108-V112 WeakPolarHBondContact O-CG2 3.33Å; S108-V112 PolarHBondContact O-N 3.46Å; S108-V112 VanDerWaalsContact O-N 3.09Å
109	R	93.8	Very high	87.8	Confident	99 Å²	99	94.1 Å²	94.1	37%	0.374	45%	0.445	S	S	.	.	H	α-helix	trans	-65.1	-45.8	177.9	178	60.6	179.7	149.6	9.7	111	E88 H106 T111 V112 I113	E88-R109 IonicContact OE1-CZ 3.39Å; E88-R109 IonicContact OE1-NE 3.57Å; E88-R109 PolarHBondContact OE1-NE 2.85Å; E88-R109 IonicContact OE1-NH2 3.65Å; E88-R109 PolarHBondContact OE1-NH2 3.41Å; E88-R109 IonicContact OE2-CZ 2.84Å; E88-R109 IonicContact OE2-NE 2.86Å; E88-R109 IonicContact OE2-NH2 2.69Å; E88-R109 PolarHBondContact OE2-NH2 3.05Å; H106-R109 PolarHBondContact O-N 2.9Å; R109-T111 PolarHBondContact O-N 3.08Å; R109-V112 PolarHBondContact O-N 3.33Å; R109-I113 HydrophobicContact CG-CD1 4.03Å; R109-I113 WeakPolarHBondContact O-CG1 3.44Å; R109-I113 PolarHBondContact O-N 3.18Å
110	E	93.7	Very high	88.7	Confident	14 Å²	14	89.8 Å²	89.8	7%	0.065	43%	0.43	C	S	.	.	H	α-helix	trans	-59.2	-45.8	178.4	-163.9	-164.9	143.5	0	0	111.6	L89 I92 R104 H106 C107 V112 I113 K114	L89-E110 HydrophobicContact CD2-CG 3.74Å; I92-E110 HydrophobicContact CD1-CB 4.43Å; I92-E110 HydrophobicContact CG2-CB 4.36Å; I92-E110 HydrophobicContact CG2-CG 4.25Å; R104-E110 IonicContact CZ-OE1 3.92Å; R104-E110 IonicContact CZ-OE2 3.32Å; R104-E110 IonicContact NE-OE2 3.22Å; R104-E110 PolarHBondContact NE-OE2 2.87Å; R104-E110 IonicContact NH2-OE1 2.71Å; R104-E110 PolarHBondContact NH2-OE1 3.16Å; R104-E110 IonicContact NH2-OE2 2.7Å; R104-E110 PolarHBondContact NH2-OE2 3.42Å; H106-E110 WeakPolarHBondContact O-CB 3.46Å; H106-E110 PolarHBondContact O-N 2.87Å; C107-E110 PolarHBondContact O-N 3.39Å; E110-V112 PolarHBondContact O-N 2.72Å; E110-I113 PolarHBondContact O-N 3.37Å; E110-K114 HydrophobicContact CG-CD 4.33Å; E110-K114 WeakPolarHBondContact O-CB 3.41Å; E110-K114 WeakPolarHBondContact O-CG 3.47Å; E110-K114 PolarHBondContact O-N 3.34Å; E110-K114 VanDerWaalsContact OE1-CE 3.31Å; E110-K114 WeakPolarHBondContact OE1-CE 3.35Å; E110-K114 IonicContact OE1-NZ 3.17Å; E110-K114 PolarHBondContact OE1-NZ 3.4Å
111	T	94.7	Very high	89.9	Confident	67 Å²	67	88.3 Å²	88.3	41%	0.411	42%	0.415	S	S	.	.	H	α-helix	trans	-61.3	-44.7	176.6	-59.9	0	0	0	0	111.7	C107 R109 I113 K114 Q115	C107-T111 WeakPolarHBondContact O-CB 3.42Å; C107-T111 PolarHBondContact O-N 3.07Å; C107-T111 PolarHBondContact O-OG1 2.88Å; R109-T111 PolarHBondContact O-N 3.08Å; T111-I113 VanDerWaalsContact C-N 3.35Å; T111-I113 PolarHBondContact O-N 3.17Å; T111-K114 PolarHBondContact O-N 3.34Å; T111-Q115 HydrophobicContact CG2-CG 4.36Å; T111-Q115 WeakPolarHBondContact O-CB 3.26Å; T111-Q115 VanDerWaalsContact O-CG 3.27Å; T111-Q115 WeakPolarHBondContact O-CG 3.32Å; T111-Q115 PolarHBondContact O-N 3.02Å
112	V	95.7	Very high	90.9	Very high	73 Å²	73	83 Å²	83	44%	0.442	40%	0.401	S	S	.	.	H	α-helix	trans	-63.2	-40.8	178.6	169.9	0	0	0	0	111.7	S108 R109 E110 T116	S108-V112 VanDerWaalsContact O-CG2 3.3Å; S108-V112 WeakPolarHBondContact O-CG2 3.33Å; S108-V112 PolarHBondContact O-N 3.46Å; S108-V112 VanDerWaalsContact O-N 3.09Å; R109-V112 PolarHBondContact O-N 3.33Å; E110-V112 PolarHBondContact O-N 2.72Å; V112-T116 WeakPolarHBondContact O-CB 3.44Å; V112-T116 PolarHBondContact O-N 3.17Å; V112-T116 PolarHBondContact O-OG1 3.05Å
113	I	95	Very high	91.9	Very high	2 Å²	2	81.5 Å²	81.5	1%	0.01	39%	0.394	C	S	.	.	H	α-helix	trans	-63.3	-51.3	176.1	-69.4	170.4	0	0	0	110.1	F85 E88 L89 R109 E110 T111 Q115 T116 M117	F85-I113 HydrophobicContact CB-CG2 3.53Å; F85-I113 HydrophobicContact CD1-CD1 4.44Å; F85-I113 HydrophobicContact CD1-CG1 4.49Å; F85-I113 HydrophobicContact CD1-CG2 4.47Å; F85-I113 HydrophobicContact CD2-CG2 3.91Å; F85-I113 HydrophobicContact CG-CG2 3.75Å; E88-I113 HydrophobicContact CG-CD1 4.08Å; E88-I113 WeakPolarHBondContact OE1-CD1 3.36Å; E88-I113 WeakPolarHBondContact OE2-CD1 3.5Å; L89-I113 HydrophobicContact CD1-CG2 3.96Å; L89-I113 HydrophobicContact CD2-CB 4.22Å; L89-I113 HydrophobicContact CD2-CD1 4.38Å; L89-I113 HydrophobicContact CD2-CG2 3.86Å; L89-I113 HydrophobicContact CG-CG2 3.93Å; R109-I113 HydrophobicContact CG-CD1 4.03Å; R109-I113 WeakPolarHBondContact O-CG1 3.44Å; R109-I113 PolarHBondContact O-N 3.18Å; E110-I113 PolarHBondContact O-N 3.37Å; T111-I113 VanDerWaalsContact C-N 3.35Å; T111-I113 PolarHBondContact O-N 3.17Å; I113-Q115 PolarHBondContact O-N 3.48Å; I113-T116 WeakPolarHBondContact O-CA 3.48Å; I113-T116 PolarHBondContact O-N 2.91Å; I113-M117 HydrophobicContact CG2-CG 4.28Å; I113-M117 HydrophobicContact CG2-SD 3.91Å; I113-M117 WeakPolarHBondContact O-CG 3.39Å; I113-M117 PolarHBondContact O-N 3.33Å
114	K	95.1	Very high	92.6	Very high	103 Å²	103	79.9 Å²	79.9	45%	0.448	37%	0.374	S	S	.	.	H	α-helix	trans	-57.7	-47.2	-179.2	-75.7	178.7	171.3	178	0	111.7	L89 E110 T111 T116 M117 E118	L89-K114 HydrophobicContact CD2-CG 4.41Å; E110-K114 HydrophobicContact CG-CD 4.33Å; E110-K114 WeakPolarHBondContact O-CB 3.41Å; E110-K114 WeakPolarHBondContact O-CG 3.47Å; E110-K114 PolarHBondContact O-N 3.34Å; E110-K114 VanDerWaalsContact OE1-CE 3.31Å; E110-K114 WeakPolarHBondContact OE1-CE 3.35Å; E110-K114 IonicContact OE1-NZ 3.17Å; E110-K114 PolarHBondContact OE1-NZ 3.4Å; T111-K114 PolarHBondContact O-N 3.34Å; K114-T116 VanDerWaalsContact C-N 3.27Å; K114-T116 PolarHBondContact O-N 3.45Å; K114-M117 PolarHBondContact O-N 2.93Å; K114-E118 WeakPolarHBondContact O-CB 3.35Å; K114-E118 PolarHBondContact O-N 3.22Å
115	Q	96.1	Very high	92.9	Very high	101 Å²	101	78.4 Å²	78.4	47%	0.472	37%	0.373	S	S	.	.	H	α-helix	trans	-61.8	-33.9	175	-72.8	176.1	-5.5	0	0	113	T111 I113 R119	T111-Q115 HydrophobicContact CG2-CG 4.36Å; T111-Q115 WeakPolarHBondContact O-CB 3.26Å; T111-Q115 VanDerWaalsContact O-CG 3.27Å; T111-Q115 WeakPolarHBondContact O-CG 3.32Å; T111-Q115 PolarHBondContact O-N 3.02Å; I113-Q115 PolarHBondContact O-N 3.48Å; Q115-R119 WeakPolarHBondContact O-CB 3.41Å; Q115-R119 VanDerWaalsContact O-CG 3.26Å; Q115-R119 WeakPolarHBondContact O-CG 3.43Å; Q115-R119 PolarHBondContact O-N 2.94Å; Q115-R119 VanDerWaalsContact O-N 3.17Å; Q115-R119 PolarHBondContact O-NE 3.16Å
116	T	94.7	Very high	93.3	Very high	30 Å²	30	76.7 Å²	76.7	18%	0.184	39%	0.387	C	S	.	.	H	α-helix	trans	-73.2	-44.4	178.1	-58.8	0	0	0	0	111.1	V112 I113 K114 E118 R119 E120	V112-T116 WeakPolarHBondContact O-CB 3.44Å; V112-T116 PolarHBondContact O-N 3.17Å; V112-T116 PolarHBondContact O-OG1 3.05Å; I113-T116 WeakPolarHBondContact O-CA 3.48Å; I113-T116 PolarHBondContact O-N 2.91Å; K114-T116 VanDerWaalsContact C-N 3.27Å; K114-T116 PolarHBondContact O-N 3.45Å; T116-E118 VanDerWaalsContact C-N 3.35Å; T116-E118 PolarHBondContact O-N 2.85Å; T116-R119 PolarHBondContact O-N 3.35Å; T116-R119 PolarHBondContact OG1-NH2 3.2Å; T116-E120 WeakPolarHBondContact O-CG 3.31Å; T116-E120 PolarHBondContact O-N 3.09Å
117	M	93.9	Very high	93.3	Very high	26 Å²	26	79.8 Å²	79.8	13%	0.128	40%	0.396	C	S	.	.	H	α-helix	trans	-61.2	-43.1	175.2	-72.1	-179.5	63.8	0	0	112	F85 L89 I113 K114 E120 R121	F85-M117 HydrophobicContact CB-SD 4.14Å; F85-M117 HydrophobicContact CD2-CG 4.15Å; L89-M117 HydrophobicContact CD1-SD 3.74Å; I113-M117 HydrophobicContact CG2-CG 4.28Å; I113-M117 HydrophobicContact CG2-SD 3.91Å; I113-M117 WeakPolarHBondContact O-CG 3.39Å; I113-M117 PolarHBondContact O-N 3.33Å; K114-M117 PolarHBondContact O-N 2.93Å; M117-E120 PolarHBondContact O-N 3.44Å; M117-R121 WeakPolarHBondContact O-CB 3.35Å; M117-R121 WeakPolarHBondContact O-CG 3.45Å; M117-R121 PolarHBondContact O-N 3.49Å
118	E	94.9	Very high	93.3	Very high	135 Å²	135	77.1 Å²	77.1	63%	0.631	38%	0.379	S	S	*	.	H	α-helix	trans	-60.3	-48.3	177.1	-176.3	177	-166.5	0	0	111.4	K114 T116 E120 R121 Q122	K114-E118 WeakPolarHBondContact O-CB 3.35Å; K114-E118 PolarHBondContact O-N 3.22Å; T116-E118 VanDerWaalsContact C-N 3.35Å; T116-E118 PolarHBondContact O-N 2.85Å; E118-E120 PolarHBondContact O-N 2.87Å; E118-R121 PolarHBondContact O-N 3.39Å; E118-Q122 WeakPolarHBondContact O-CB 3.49Å; E118-Q122 PolarHBondContact O-N 2.82Å
119	R	94.5	Very high	93.3	Very high	140 Å²	140	73 Å²	73	53%	0.528	35%	0.35	S	S	.	.	H	α-helix	trans	-60.5	-44.2	176.3	-74.7	-178.3	-63.6	165.8	2.2	112.5	Q115 T116 Q123	Q115-R119 WeakPolarHBondContact O-CB 3.41Å; Q115-R119 VanDerWaalsContact O-CG 3.26Å; Q115-R119 WeakPolarHBondContact O-CG 3.43Å; Q115-R119 PolarHBondContact O-N 2.94Å; Q115-R119 VanDerWaalsContact O-N 3.17Å; Q115-R119 PolarHBondContact O-NE 3.16Å; T116-R119 PolarHBondContact O-N 3.35Å; T116-R119 PolarHBondContact OG1-NH2 3.2Å; R119-Q123 VanDerWaalsContact O-CG 3.28Å; R119-Q123 WeakPolarHBondContact O-CG 3.16Å; R119-Q123 PolarHBondContact O-N 3.01Å
120	E	93.4	Very high	93.3	Very high	22 Å²	22	72.7 Å²	72.7	10%	0.103	35%	0.353	C	S	.	.	H	α-helix	trans	-67.7	-38.4	179.3	-70.3	-179.1	156	0	0	112	Y81 L82 R84 T116 M117 E118 Q123 Y124	Y81-E120 WeakPolarHBondContact CE1-OE1 3.4Å; Y81-E120 PolarHBondContact OH-OE1 2.95Å; L82-E120 HydrophobicContact CD2-CB 3.47Å; L82-E120 VanDerWaalsContact CD2-CB 3.47Å; R84-E120 IonicContact CZ-OE1 2.93Å; R84-E120 IonicContact CZ-OE2 2.85Å; R84-E120 IonicContact NH1-OE1 3.98Å; R84-E120 IonicContact NH1-OE2 2.66Å; R84-E120 PolarHBondContact NH1-OE2 3.45Å; R84-E120 IonicContact NH2-OE1 3.22Å; R84-E120 PolarHBondContact NH2-OE1 3.48Å; R84-E120 IonicContact NH2-OE2 2.67Å; R84-E120 PolarHBondContact NH2-OE2 3.27Å; T116-E120 WeakPolarHBondContact O-CG 3.31Å; T116-E120 PolarHBondContact O-N 3.09Å; M117-E120 PolarHBondContact O-N 3.44Å; E118-E120 PolarHBondContact O-N 2.87Å; E120-Q123 PolarHBondContact O-N 3.31Å; E120-Y124 WeakPolarHBondContact O-CB 3.5Å; E120-Y124 PolarHBondContact O-N 2.95Å
121	R	93.6	Very high	93.2	Very high	95 Å²	95	72 Å²	72	36%	0.358	35%	0.35	S	S	.	.	H	α-helix	trans	-63.9	-47.3	174.3	-78.9	-177.9	177	-83.1	-3.7	111.8	L82 N83 M117 E118 Q123 Y124 E125	L82-R121 HydrophobicContact CD1-CG 4.29Å; L82-R121 HydrophobicContact CD2-CG 4.32Å; N83-R121 PolarHBondContact OD1-NH2 3.3Å; M117-R121 WeakPolarHBondContact O-CB 3.35Å; M117-R121 WeakPolarHBondContact O-CG 3.45Å; M117-R121 PolarHBondContact O-N 3.49Å; E118-R121 PolarHBondContact O-N 3.39Å; R121-Q123 VanDerWaalsContact C-N 3.25Å; R121-Q123 PolarHBondContact O-N 2.67Å; R121-Y124 PolarHBondContact O-N 2.95Å; R121-Y124 VanDerWaalsContact O-N 3.09Å; R121-E125 PolarHBondContact O-N 3.36Å
122	Q	93.8	Very high	93.1	Very high	142 Å²	142	68.9 Å²	68.9	66%	0.664	33%	0.331	S	S	*	.	H	α-helix	trans	-58.7	-39.6	176.8	-169.5	179.7	27.5	0	0	111.6	E118 G126	E118-Q122 WeakPolarHBondContact O-CB 3.49Å; E118-Q122 PolarHBondContact O-N 2.82Å; Q122-G126 PolarHBondContact O-N 3.23Å
123	Q	92.4	Very high	93	Very high	103 Å²	103	66.1 Å²	66.1	48%	0.481	31%	0.313	S	S	.	.	H	α-helix	trans	-64.5	-44.7	174.3	-74.8	175.6	5.2	0	0	112.2	R119 E120 R121 Y127 G128 L129	R119-Q123 VanDerWaalsContact O-CG 3.28Å; R119-Q123 WeakPolarHBondContact O-CG 3.16Å; R119-Q123 PolarHBondContact O-N 3.01Å; E120-Q123 PolarHBondContact O-N 3.31Å; R121-Q123 VanDerWaalsContact C-N 3.25Å; R121-Q123 PolarHBondContact O-N 2.67Å; Q123-Y127 PolarHBondContact O-N 3Å; Q123-Y127 VanDerWaalsContact O-N 3.16Å; Q123-G128 CarbonylContact O-C 3.47Å; Q123-G128 WeakPolarHBondContact O-CA 3.39Å; Q123-G128 PolarHBondContact O-N 3.41Å; Q123-L129 HydrophobicContact CB-CD1 4.41Å
124	Y	93.1	Very high	92.8	Very high	12 Å²	12	66.1 Å²	66.1	5%	0.047	31%	0.313	C	S	.	.	H	α-helix	trans	-65.1	-40.2	-178.8	179.6	-121.7	0	0	0	113.1	C75 I78 L82 E120 R121 L129 I161 G162 A163	C75-Y124 WeakPolarHBondContact CB-OH 3.44Å; C75-Y124 PolarHBondContact SG-OH 3.09Å; I78-Y124 HydrophobicContact CB-CE2 4.13Å; I78-Y124 HydrophobicContact CD1-CD2 4.23Å; I78-Y124 HydrophobicContact CD1-CE2 3.71Å; I78-Y124 HydrophobicContact CG2-CD1 4.48Å; I78-Y124 HydrophobicContact CG2-CD2 3.62Å; I78-Y124 HydrophobicContact CG2-CE1 4.47Å; I78-Y124 HydrophobicContact CG2-CE2 3.63Å; I78-Y124 HydrophobicContact CG2-CG 4.06Å; L82-Y124 HydrophobicContact CD1-CD1 3.88Å; L82-Y124 HydrophobicContact CD1-CE1 4.49Å; L82-Y124 HydrophobicContact CD1-CG 4.2Å; E120-Y124 WeakPolarHBondContact O-CB 3.5Å; E120-Y124 PolarHBondContact O-N 2.95Å; R121-Y124 PolarHBondContact O-N 2.95Å; R121-Y124 VanDerWaalsContact O-N 3.09Å; Y124-L129 HydrophobicContact CD2-CB 4.16Å; Y124-I161 WeakPolarHBondContact CD2-O 3.4Å; Y124-G162 VanDerWaalsContact CE2-C 3.5Å; Y124-G162 VanDerWaalsContact O-CA 3.32Å; Y124-G162 WeakPolarHBondContact O-CA 3.24Å; Y124-A163 HydrophobicContact CD1-CB 4.19Å; Y124-A163 HydrophobicContact CE1-CB 3.75Å; Y124-A163 PolarHBondContact O-N 3.37Å
125	E	91	Very high	92.5	Very high	120 Å²	120	62.4 Å²	62.4	56%	0.561	30%	0.298	S	S	*	.	H	α-helix	trans	-76.3	-39.4	179.5	-70.4	171	-166.1	0	0	112.2	R121	R121-E125 PolarHBondContact O-N 3.36Å
126	G	90.2	Very high	92.3	Very high	67 Å²	67	61.2 Å²	61.2	69%	0.691	30%	0.295	S	S	*	.	H	α-helix	trans	-79	-72.3	-176.5	0	0	0	0	0	114.1	Q122	Q122-G126 PolarHBondContact O-N 3.23Å
127	Y	87.1	Confident	92.1	Very high	174 Å²	174	60.9 Å²	60.9	68%	0.682	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-16.1	-168.8	-179.3	-120.1	0	0	0	113.8	Q123 K160	Q123-Y127 PolarHBondContact O-N 3Å; Q123-Y127 VanDerWaalsContact O-N 3.16Å; Y127-K160 HydrophobicContact CD1-CD 4Å; Y127-K160 HydrophobicContact CE1-CD 3.33Å; Y127-K160 PolarHBondContact OH-NZ 3.35Å
128	G	90.7	Very high	91.9	Very high	7 Å²	7	63.2 Å²	63.2	7%	0.072	32%	0.315	C	S	.	.			trans	100.7	138.6	-175.8	0	0	0	0	0	112.3	Q123 I161	Q123-G128 CarbonylContact O-C 3.47Å; Q123-G128 WeakPolarHBondContact O-CA 3.39Å; Q123-G128 PolarHBondContact O-N 3.41Å; G128-I161 CarbonylContact C-O 3.57Å; G128-I161 VanDerWaalsContact CA-O 3.24Å; G128-I161 WeakPolarHBondContact CA-O 3.11Å
129	L	92.6	Very high	91.8	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	131.3	177.8	-168.3	69.1	0	0	0	109.2	I78 Y81 Q123 Y124 I131 K160 I161	I78-L129 HydrophobicContact CG2-CD2 3.74Å; Y81-L129 HydrophobicContact CD1-CD2 3.93Å; Y81-L129 HydrophobicContact CE1-CD2 4.12Å; Q123-L129 HydrophobicContact CB-CD1 4.41Å; Y124-L129 HydrophobicContact CD2-CB 4.16Å; L129-I131 HydrophobicContact CD2-CG2 4.29Å; L129-I131 HydrophobicContact CG-CG2 4.33Å; L129-I131 PolarHBondContact O-N 2.85Å; L129-K160 WeakPolarHBondContact O-CA 3.39Å; L129-I161 PolarHBondContact N-O 3.46Å; L129-I161 PolarHBondContact O-N 3.47Å
130	E	92.8	Very high	91.6	Very high	94 Å²	94	51.2 Å²	51.2	44%	0.439	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	116.7	177.1	-171.5	173.4	-163	0	0	110.2	K54 M158 K160	K54-E130 WeakPolarHBondContact CE-O 3.42Å; K54-E130 PolarHBondContact NZ-O 3.06Å; E130-M158 HydrophobicContact CG-CB 3.8Å; E130-M158 HydrophobicContact CG-CE 3.81Å; E130-M158 HydrophobicContact CG-CG 4.48Å; E130-M158 WeakPolarHBondContact OE1-CB 3.29Å; E130-K160 HydrophobicContact CB-CG 4.31Å
131	I	92.8	Very high	91.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	159.9	-179.8	67.1	156.3	0	0	0	110.2	F58 I78 L129 I134 M158 R159 I161	F58-I131 HydrophobicContact CE1-CG2 4.07Å; F58-I131 HydrophobicContact CE2-CG2 3.94Å; F58-I131 HydrophobicContact CZ-CB 4.34Å; F58-I131 HydrophobicContact CZ-CG2 3.52Å; I78-I131 HydrophobicContact CD1-CD1 4.07Å; I78-I131 HydrophobicContact CD1-CG2 4.28Å; I78-I131 HydrophobicContact CG1-CD1 4.21Å; I78-I131 HydrophobicContact CG1-CG2 4.03Å; L129-I131 HydrophobicContact CD2-CG2 4.29Å; L129-I131 HydrophobicContact CG-CG2 4.33Å; L129-I131 PolarHBondContact O-N 2.85Å; I131-I134 HydrophobicContact CD1-CD1 4.17Å; I131-I134 HydrophobicContact CD1-CG1 4.37Å; I131-M158 CarbonylContact O-C 3.56Å; I131-M158 WeakPolarHBondContact O-CA 3.48Å; I131-R159 PolarHBondContact N-O 3.03Å; I131-R159 PolarHBondContact O-N 3.02Å; I131-I161 HydrophobicContact CD1-CD1 3.57Å; I131-I161 HydrophobicContact CD1-CG1 4.19Å; I131-I161 HydrophobicContact CG1-CD1 4.01Å; I131-I161 HydrophobicContact CG1-CG1 4.14Å
132	P	92.9	Very high	91.3	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	144.1	173.4	19.8	-26.8	0	0	0	110.4	L55 F58 I134 F143 I156 M158	L55-P132 HydrophobicContact CD2-CB 3.97Å; L55-P132 VanDerWaalsContact CD2-CD 3.48Å; L55-P132 HydrophobicContact CD2-CG 3.52Å; F58-P132 HydrophobicContact CB-CG 4.28Å; P132-I134 PolarHBondContact O-N 3.35Å; P132-F143 HydrophobicContact CB-CD1 4.27Å; P132-F143 HydrophobicContact CB-CD2 3.79Å; P132-F143 HydrophobicContact CB-CE1 4.23Å; P132-F143 HydrophobicContact CB-CE2 3.78Å; P132-F143 HydrophobicContact CB-CG 4.06Å; P132-F143 HydrophobicContact CB-CZ 4Å; P132-F143 HydrophobicContact CG-CD1 4.23Å; P132-F143 HydrophobicContact CG-CD2 4.15Å; P132-F143 HydrophobicContact CG-CE1 3.72Å; P132-F143 HydrophobicContact CG-CE2 3.66Å; P132-F143 HydrophobicContact CG-CG 4.43Å; P132-F143 HydrophobicContact CG-CZ 3.41Å; P132-F143 VanDerWaalsContact CG-CZ 3.41Å; P132-I156 HydrophobicContact CB-CG2 3.93Å; P132-M158 HydrophobicContact CB-SD 4.32Å
133	D	92.3	Very high	91.2	Very high	14 Å²	14	48.7 Å²	48.7	8%	0.075	26%	0.261	C	S	.	.			trans	-74	87.7	-175.1	-178.6	27.5	0	0	0	111.7	L135 N136 N139 K157 R159	D133-L135 VanDerWaalsContact C-N 3.34Å; D133-L135 PolarHBondContact OD1-N 3.46Å; D133-N136 PolarHBondContact OD2-ND2 2.97Å; D133-N139 HydrophobicContact CB-CB 4.37Å; D133-N139 WeakPolarHBondContact O-CB 3.15Å; D133-N139 PolarHBondContact OD2-ND2 3.27Å; D133-K157 HydrophobicContact CB-CB 4.33Å; D133-K157 WeakPolarHBondContact CB-O 3.38Å; D133-K157 PolarHBondContact N-O 3.42Å; D133-R159 HydrophobicContact CB-CB 4.19Å
134	I	91.1	Very high	91.1	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	25%	0.251	C	S	.	.			trans	-84.1	-6.8	179.5	58.4	176.1	0	0	0	113.7	L62 Y69 A74 L77 I131 P132 L140	L62-I134 HydrophobicContact CD1-CG2 4.43Å; L62-I134 HydrophobicContact CD2-CG2 4.07Å; Y69-I134 WeakPolarHBondContact CB-O 3.21Å; Y69-I134 HydrophobicContact CD1-CD1 4.14Å; Y69-I134 HydrophobicContact CD2-CB 4.03Å; Y69-I134 HydrophobicContact CG-CB 4.22Å; Y69-I134 HydrophobicContact CG-CD1 3.99Å; Y69-I134 HydrophobicContact CG-CG1 4.25Å; Y69-I134 PolarHBondContact N-O 3.12Å; A74-I134 HydrophobicContact CB-CD1 3.75Å; A74-I134 HydrophobicContact CB-CG1 4.22Å; L77-I134 HydrophobicContact CD2-CD1 3.89Å; I131-I134 HydrophobicContact CD1-CD1 4.17Å; I131-I134 HydrophobicContact CD1-CG1 4.37Å; P132-I134 PolarHBondContact O-N 3.35Å; I134-L140 HydrophobicContact CB-CD1 4.09Å; I134-L140 HydrophobicContact CG2-CD1 3.89Å
135	L	88.9	Confident	90.9	Very high	25 Å²	25	53.3 Å²	53.3	13%	0.131	28%	0.279	C	S	.	.	S	Bend	trans	-76.4	-32.4	179.4	-60.8	177.8	0	0	0	111.4	Y69 K71 A74 D133 I161	Y69-L135 WeakPolarHBondContact O-CD2 3.4Å; K71-L135 HydrophobicContact CG-CD1 4.18Å; K71-L135 HydrophobicContact CG-CD2 4.36Å; A74-L135 HydrophobicContact CB-CD2 4.4Å; D133-L135 VanDerWaalsContact C-N 3.34Å; D133-L135 PolarHBondContact OD1-N 3.46Å; L135-I161 HydrophobicContact CD1-CD1 4.44Å
136	N	91.6	Very high	90.9	Very high	76 Å²	76	48 Å²	48	41%	0.406	25%	0.254	S	S	.	.	S	Bend	trans	-91.2	123.4	177.7	-75.3	-38.8	0	0	0	111	D133 S138 N139 L140	D133-N136 PolarHBondContact OD2-ND2 2.97Å; N136-S138 VanDerWaalsContact C-N 3.3Å; N136-S138 PolarHBondContact O-N 3.26Å; N136-N139 HydrophobicContact CB-CB 4.17Å; N136-N139 PolarHBondContact O-N 3Å; N136-L140 WeakPolarHBondContact O-CB 3.46Å; N136-L140 PolarHBondContact O-N 2.94Å
137	A	90.1	Very high	90.8	Very high	24 Å²	24	50.1 Å²	50.1	20%	0.198	25%	0.25	C	C	.	.	H	α-helix	trans	-60.4	-36	-178.3	0	0	0	0	0	113.5	N67 R68 K141	N67-A137 WeakPolarHBondContact O-CB 3.5Å; R68-A137 HydrophobicContact CG-CB 3.92Å; A137-K141 WeakPolarHBondContact O-CG 3.41Å; A137-K141 PolarHBondContact O-N 3.46Å; A137-K141 VanDerWaalsContact O-N 3.11Å
138	S	91.3	Very high	90.7	Very high	75 Å²	75	45.8 Å²	45.8	52%	0.524	24%	0.235	S	C	.	.	H	α-helix	trans	-64.2	-46.4	177.6	57	0	0	0	0	111.6	N136 L140 K141 T142	N136-S138 VanDerWaalsContact C-N 3.3Å; N136-S138 PolarHBondContact O-N 3.26Å; S138-L140 VanDerWaalsContact C-N 3.33Å; S138-K141 PolarHBondContact O-N 3.34Å; S138-T142 PolarHBondContact O-N 3.3Å; S138-T142 PolarHBondContact O-OG1 3.21Å
139	N	91.2	Very high	90.6	Very high	19 Å²	19	48.4 Å²	48.4	10%	0.102	25%	0.247	C	C	.	.	H	α-helix	trans	-70	-35.9	-178.7	-60.4	-13.8	0	0	0	110.5	D133 N136 K141 T142 F143	D133-N139 HydrophobicContact CB-CB 4.37Å; D133-N139 WeakPolarHBondContact O-CB 3.15Å; D133-N139 PolarHBondContact OD2-ND2 3.27Å; N136-N139 HydrophobicContact CB-CB 4.17Å; N136-N139 PolarHBondContact O-N 3Å; N139-K141 PolarHBondContact O-N 3.24Å; N139-T142 WeakPolarHBondContact CA-OG1 3.39Å; N139-T142 PolarHBondContact O-N 3.09Å; N139-T142 PolarHBondContact O-OG1 2.96Å; N139-F143 VanDerWaalsContact O-CB 3.25Å; N139-F143 WeakPolarHBondContact O-CB 3.39Å; N139-F143 PolarHBondContact O-N 3.21Å
140	L	90.6	Very high	90.3	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-41.9	174	-175.1	67	0	0	0	112	L62 N67 Y69 I134 N136 S138 F143 R144	L62-L140 HydrophobicContact CD1-CD1 3.83Å; L62-L140 HydrophobicContact CD2-CD1 4.35Å; N67-L140 WeakPolarHBondContact O-CD2 3.27Å; Y69-L140 HydrophobicContact CD2-CD1 4.24Å; Y69-L140 HydrophobicContact CD2-CD2 4.02Å; Y69-L140 HydrophobicContact CE2-CD1 4.1Å; Y69-L140 HydrophobicContact CE2-CD2 4.04Å; I134-L140 HydrophobicContact CB-CD1 4.09Å; I134-L140 HydrophobicContact CG2-CD1 3.89Å; N136-L140 WeakPolarHBondContact O-CB 3.46Å; N136-L140 PolarHBondContact O-N 2.94Å; S138-L140 VanDerWaalsContact C-N 3.33Å; L140-F143 PolarHBondContact O-N 2.74Å; L140-R144 WeakPolarHBondContact O-CG 3.44Å; L140-R144 PolarHBondContact O-N 3.27Å
141	K	90.5	Very high	90.1	Very high	130 Å²	130	55 Å²	55	57%	0.565	28%	0.277	S	S	*	.	H	α-helix	trans	-61.2	-50.7	174.8	-72.2	178.4	-179.3	-170.2	0	111.5	A137 S138 N139 F143 R144 E145	A137-K141 WeakPolarHBondContact O-CG 3.41Å; A137-K141 PolarHBondContact O-N 3.46Å; A137-K141 VanDerWaalsContact O-N 3.11Å; S138-K141 PolarHBondContact O-N 3.34Å; N139-K141 PolarHBondContact O-N 3.24Å; K141-F143 PolarHBondContact O-N 3.48Å; K141-R144 PolarHBondContact O-N 2.99Å; K141-R144 VanDerWaalsContact O-N 3.07Å; K141-E145 PolarHBondContact O-N 2.89Å
142	T	90.7	Very high	89.8	Confident	74 Å²	74	58.8 Å²	58.8	45%	0.454	29%	0.293	S	S	.	.	H	α-helix	trans	-60.3	-32.5	177.5	53.8	0	0	0	0	112.7	S138 N139 W146	S138-T142 PolarHBondContact O-N 3.3Å; S138-T142 PolarHBondContact O-OG1 3.21Å; N139-T142 WeakPolarHBondContact CA-OG1 3.39Å; N139-T142 PolarHBondContact O-N 3.09Å; N139-T142 PolarHBondContact O-OG1 2.96Å; T142-W146 PolarHBondContact O-N 3.31Å
143	F	91.6	Very high	89.5	Confident	3 Å²	3	59.7 Å²	59.7	1%	0.013	30%	0.298	C	S	.	.	H	α-helix	trans	-75.7	-31.4	178	-176	-113.5	0	0	0	112.6	L55 F58 Q59 L62 P132 N139 L140 K141 W146 I156	L55-F143 HydrophobicContact CB-CE2 4.08Å; L55-F143 HydrophobicContact CB-CZ 4.36Å; L55-F143 HydrophobicContact CD2-CE2 3.89Å; L55-F143 HydrophobicContact CD2-CZ 4.29Å; L55-F143 HydrophobicContact CG-CE2 4.46Å; L55-F143 WeakPolarHBondContact O-CZ 3.32Å; F58-F143 HydrophobicContact CB-CE1 4.22Å; F58-F143 HydrophobicContact CB-CZ 4.08Å; Q59-F143 HydrophobicContact CB-CE1 3.98Å; Q59-F143 HydrophobicContact CB-CZ 3.95Å; Q59-F143 PolarHBondContact NE2-O 3.43Å; L62-F143 HydrophobicContact CD1-CD1 3.5Å; L62-F143 VanDerWaalsContact CD1-CD1 3.5Å; L62-F143 HydrophobicContact CD1-CE1 3.52Å; P132-F143 HydrophobicContact CB-CD1 4.27Å; P132-F143 HydrophobicContact CB-CD2 3.79Å; P132-F143 HydrophobicContact CB-CE1 4.23Å; P132-F143 HydrophobicContact CB-CE2 3.78Å; P132-F143 HydrophobicContact CB-CG 4.06Å; P132-F143 HydrophobicContact CB-CZ 4Å; P132-F143 HydrophobicContact CG-CD1 4.23Å; P132-F143 HydrophobicContact CG-CD2 4.15Å; P132-F143 HydrophobicContact CG-CE1 3.72Å; P132-F143 HydrophobicContact CG-CE2 3.66Å; P132-F143 HydrophobicContact CG-CG 4.43Å; P132-F143 HydrophobicContact CG-CZ 3.41Å; P132-F143 VanDerWaalsContact CG-CZ 3.41Å; N139-F143 VanDerWaalsContact O-CB 3.25Å; N139-F143 WeakPolarHBondContact O-CB 3.39Å; N139-F143 PolarHBondContact O-N 3.21Å; L140-F143 PolarHBondContact O-N 2.74Å; K141-F143 PolarHBondContact O-N 3.48Å; F143-W146 HydrophobicContact CE2-CE3 4.16Å; F143-W146 WeakPolarHBondContact O-CB 3.27Å; F143-I156 HydrophobicContact CD2-CD1 4.06Å; F143-I156 HydrophobicContact CD2-CG1 4.44Å; F143-I156 HydrophobicContact CD2-CG2 3.81Å; F143-I156 HydrophobicContact CE2-CD1 4.38Å; F143-I156 HydrophobicContact CE2-CG2 4.41Å
144	R	89.6	Confident	89.4	Confident	71 Å²	71	64.4 Å²	64.4	27%	0.268	33%	0.329	S	S	.	.	H	α-helix	trans	-71.5	-41.9	174.5	-77.5	178.2	175.5	-174.9	1.2	113	Q59 D63 P64 K66 L140 K141 W146	Q59-R144 PolarHBondContact NE2-O 2.91Å; D63-R144 PolarHBondContact O-NH2 3.28Å; P64-R144 VanDerWaalsContact O-CZ 3.3Å; P64-R144 PolarHBondContact O-NH1 2.97Å; P64-R144 PolarHBondContact O-NH2 3.32Å; K66-R144 PolarHBondContact O-NH2 3.14Å; L140-R144 WeakPolarHBondContact O-CG 3.44Å; L140-R144 PolarHBondContact O-N 3.27Å; K141-R144 PolarHBondContact O-N 2.99Å; K141-R144 VanDerWaalsContact O-N 3.07Å; R144-W146 PolarHBondContact O-N 3.32Å
145	E	90	Very high	89.3	Confident	140 Å²	140	70.5 Å²	70.5	65%	0.654	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	4.5	178.3	-66.8	167.8	-166.1	0	0	112.5	K141 D147	K141-E145 PolarHBondContact O-N 2.89Å; E145-D147 PolarHBondContact O-N 3.36Å
146	W	90.9	Very high	89.4	Confident	9 Å²	9	70 Å²	70	3%	0.034	36%	0.359	C	S	.	.			trans	-73.5	115.2	179.1	177.9	52	0	0	0	110.7	L55 Q59 T142 F143 R144 F148 D149 L153 I156	L55-W146 HydrophobicContact CB-CE3 4.45Å; L55-W146 HydrophobicContact CB-CH2 3.86Å; L55-W146 HydrophobicContact CB-CZ3 3.54Å; L55-W146 HydrophobicContact CD1-CH2 4.31Å; L55-W146 HydrophobicContact CD1-CZ3 4.49Å; Q59-W146 PolarHBondContact NE2-O 2.95Å; Q59-W146 VanDerWaalsContact OE1-CE3 3.23Å; T142-W146 PolarHBondContact O-N 3.31Å; F143-W146 HydrophobicContact CE2-CE3 4.16Å; F143-W146 WeakPolarHBondContact O-CB 3.27Å; R144-W146 PolarHBondContact O-N 3.32Å; W146-F148 HydrophobicContact CE3-CD1 4.01Å; W146-F148 HydrophobicContact CE3-CE1 4.2Å; W146-F148 HydrophobicContact CH2-CD1 4.01Å; W146-F148 AromaticContact CZ3-CD1 3.67Å; W146-F148 HydrophobicContact CZ3-CD1 3.67Å; W146-F148 HydrophobicContact CZ3-CE1 4.02Å; W146-F148 PolarHBondContact O-N 3.01Å; W146-F148 VanDerWaalsContact O-N 3.11Å; W146-D149 PolarHBondContact NE1-O 2.97Å; W146-L153 HydrophobicContact CH2-CD2 4.11Å; W146-L153 HydrophobicContact CZ2-CD2 3.63Å; W146-L153 HydrophobicContact CZ2-CG 4.41Å; W146-I156 HydrophobicContact CB-CD1 4.39Å; W146-I156 HydrophobicContact CD2-CD1 3.67Å; W146-I156 HydrophobicContact CE3-CD1 4.14Å; W146-I156 HydrophobicContact CG-CD1 3.76Å
147	D	87.3	Confident	89.5	Confident	111 Å²	111	72.6 Å²	72.6	59%	0.594	37%	0.367	S	S	*	.			trans	-79.6	25.1	-178	-45.2	-57.3	0	0	0	114.5	E145 D149 K152	E145-D147 PolarHBondContact O-N 3.36Å; D147-D149 PolarHBondContact O-N 3.09Å; D147-K152 IonicContact OD2-NZ 2.73Å; D147-K152 PolarHBondContact OD2-NZ 3.49Å
148	F	84.6	Confident	89.6	Confident	83 Å²	83	74.6 Å²	74.6	36%	0.364	37%	0.373	S	S	.	.	S	Bend	trans	62.9	8.9	-175.7	-51.2	-66.4	0	0	0	116.1	Q56 Q59 W146 L150	Q56-F148 HydrophobicContact CB-CD1 4.3Å; Q56-F148 HydrophobicContact CB-CE1 4.11Å; Q56-F148 VanDerWaalsContact CD-CD1 3.47Å; Q56-F148 VanDerWaalsContact CD-CZ 3.45Å; Q56-F148 HydrophobicContact CG-CD1 4.5Å; Q56-F148 HydrophobicContact CG-CE1 4.12Å; Q59-F148 HydrophobicContact CG-CZ 4.49Å; W146-F148 HydrophobicContact CE3-CD1 4.01Å; W146-F148 HydrophobicContact CE3-CE1 4.2Å; W146-F148 HydrophobicContact CH2-CD1 4.01Å; W146-F148 AromaticContact CZ3-CD1 3.67Å; W146-F148 HydrophobicContact CZ3-CD1 3.67Å; W146-F148 HydrophobicContact CZ3-CE1 4.02Å; W146-F148 PolarHBondContact O-N 3.01Å; W146-F148 VanDerWaalsContact O-N 3.11Å; F148-L150 PolarHBondContact O-N 3.22Å; F148-L150 VanDerWaalsContact O-N 3.14Å
149	D	89	Confident	89.7	Confident	62 Å²	62	75.7 Å²	75.7	33%	0.332	37%	0.365	S	S	.	.			trans	-69	113.6	173.8	-176	3.4	0	0	0	110.1	W146 D147 K151 K152	W146-D149 PolarHBondContact NE1-O 2.97Å; D147-D149 PolarHBondContact O-N 3.09Å; D149-K151 PolarHBondContact O-N 2.95Å; D149-K151 VanDerWaalsContact O-N 3.13Å; D149-K151 WeakPolarHBondContact OD1-CB 3.49Å; D149-K151 WeakPolarHBondContact OD1-CG 3.42Å; D149-K151 PolarHBondContact OD1-N 2.7Å; D149-K152 HydrophobicContact CB-CD 4.18Å; D149-K152 HydrophobicContact CB-CG 4.13Å; D149-K152 WeakPolarHBondContact O-CB 3.43Å; D149-K152 PolarHBondContact O-N 2.66Å
150	L	86.4	Confident	89.8	Confident	57 Å²	57	79.2 Å²	79.2	30%	0.298	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-61	-21.3	179.4	-61.4	173.6	0	0	0	112.6	N49 F148 K152 L153	N49-L150 WeakPolarHBondContact OD1-CD1 3.45Å; F148-L150 PolarHBondContact O-N 3.22Å; F148-L150 VanDerWaalsContact O-N 3.14Å; L150-K152 VanDerWaalsContact C-N 3.27Å; L150-K152 PolarHBondContact O-N 2.71Å; L150-L153 HydrophobicContact CB-CD1 4.2Å; L150-L153 HydrophobicContact CD2-CD1 3.84Å; L150-L153 HydrophobicContact CD2-CG 4.44Å; L150-L153 WeakPolarHBondContact O-CB 3.46Å; L150-L153 WeakPolarHBondContact O-CD1 3.31Å; L150-L153 VanDerWaalsContact O-CG 3.23Å; L150-L153 WeakPolarHBondContact O-CG 3.47Å; L150-L153 PolarHBondContact O-N 3.02Å
151	K	88.1	Confident	89.8	Confident	177 Å²	177	79.3 Å²	79.3	77%	0.77	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-69.9	-25.3	174.8	-63.5	176	-178	172.8	0	112.8	D149 L153 P154	D149-K151 PolarHBondContact O-N 2.95Å; D149-K151 VanDerWaalsContact O-N 3.13Å; D149-K151 WeakPolarHBondContact OD1-CB 3.49Å; D149-K151 WeakPolarHBondContact OD1-CG 3.42Å; D149-K151 PolarHBondContact OD1-N 2.7Å; K151-L153 VanDerWaalsContact C-N 3.31Å; K151-P154 VanDerWaalsContact O-CD 3.25Å; K151-P154 WeakPolarHBondContact O-CD 3.3Å
152	K	87.8	Confident	89.8	Confident	79 Å²	79	73.6 Å²	73.6	34%	0.343	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-84.8	-4.4	178.5	-60.4	-178.7	-175.5	179.1	0	112.5	D147 D149 L150 P154 N155	D147-K152 IonicContact OD2-NZ 2.73Å; D147-K152 PolarHBondContact OD2-NZ 3.49Å; D149-K152 HydrophobicContact CB-CD 4.18Å; D149-K152 HydrophobicContact CB-CG 4.13Å; D149-K152 WeakPolarHBondContact O-CB 3.43Å; D149-K152 PolarHBondContact O-N 2.66Å; L150-K152 VanDerWaalsContact C-N 3.27Å; L150-K152 PolarHBondContact O-N 2.71Å; K152-P154 VanDerWaalsContact C-CD 3.42Å; K152-N155 WeakPolarHBondContact O-CB 3.44Å; K152-N155 PolarHBondContact O-N 3.01Å
153	L	87.2	Confident	89.5	Confident	20 Å²	20	71.6 Å²	71.6	11%	0.105	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-52.1	-42.9	177.7	-71.8	177.1	0	0	0	114.3	L48 I51 L55 W146 L150 K151 N155 I156	L48-L153 HydrophobicContact CD2-CD1 4.18Å; I51-L153 HydrophobicContact CG2-CD1 4.37Å; I51-L153 HydrophobicContact CG2-CD2 4.44Å; L55-L153 HydrophobicContact CD1-CD2 3.24Å; W146-L153 HydrophobicContact CH2-CD2 4.11Å; W146-L153 HydrophobicContact CZ2-CD2 3.63Å; W146-L153 HydrophobicContact CZ2-CG 4.41Å; L150-L153 HydrophobicContact CB-CD1 4.2Å; L150-L153 HydrophobicContact CD2-CD1 3.84Å; L150-L153 HydrophobicContact CD2-CG 4.44Å; L150-L153 WeakPolarHBondContact O-CB 3.46Å; L150-L153 WeakPolarHBondContact O-CD1 3.31Å; L150-L153 VanDerWaalsContact O-CG 3.23Å; L150-L153 WeakPolarHBondContact O-CG 3.47Å; L150-L153 PolarHBondContact O-N 3.02Å; K151-L153 VanDerWaalsContact C-N 3.31Å; L153-N155 PolarHBondContact O-N 3Å; L153-N155 VanDerWaalsContact O-N 3.16Å; L153-I156 HydrophobicContact CD2-CD1 4.31Å; L153-I156 PolarHBondContact O-N 3.43Å
154	P	88.8	Confident	89.1	Confident	112 Å²	112	76.3 Å²	76.3	73%	0.727	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-63.5	-21.1	179.1	-22.7	35.7	0	0	0	114	K151 K152 I156	K151-P154 VanDerWaalsContact O-CD 3.25Å; K151-P154 WeakPolarHBondContact O-CD 3.3Å; K152-P154 VanDerWaalsContact C-CD 3.42Å; P154-I156 VanDerWaalsContact C-N 3.33Å
155	N	89	Confident	88.6	Confident	130 Å²	130	75.5 Å²	75.5	70%	0.695	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-78.8	-21	178	-64.1	-9.5	0	0	0	111.9	K152 L153 K157	K152-N155 WeakPolarHBondContact O-CB 3.44Å; K152-N155 PolarHBondContact O-N 3.01Å; L153-N155 PolarHBondContact O-N 3Å; L153-N155 VanDerWaalsContact O-N 3.16Å; N155-K157 PolarHBondContact O-N 3.04Å
156	I	91.8	Very high	87.7	Confident	14 Å²	14	70.3 Å²	70.3	7%	0.072	36%	0.357	C	S	.	.	S	Bend	trans	-80.1	117.7	179	-59.9	168.5	0	0	0	108.2	L55 P132 F143 W146 L153 P154 M158	L55-I156 HydrophobicContact CD1-CD1 4.25Å; P132-I156 HydrophobicContact CB-CG2 3.93Å; F143-I156 HydrophobicContact CD2-CD1 4.06Å; F143-I156 HydrophobicContact CD2-CG1 4.44Å; F143-I156 HydrophobicContact CD2-CG2 3.81Å; F143-I156 HydrophobicContact CE2-CD1 4.38Å; F143-I156 HydrophobicContact CE2-CG2 4.41Å; W146-I156 HydrophobicContact CB-CD1 4.39Å; W146-I156 HydrophobicContact CD2-CD1 3.67Å; W146-I156 HydrophobicContact CE3-CD1 4.14Å; W146-I156 HydrophobicContact CG-CD1 3.76Å; L153-I156 HydrophobicContact CD2-CD1 4.31Å; L153-I156 PolarHBondContact O-N 3.43Å; P154-I156 VanDerWaalsContact C-N 3.33Å; I156-M158 HydrophobicContact CG2-SD 4.22Å; I156-M158 PolarHBondContact O-N 3.23Å
157	K	92.5	Very high	86.8	Confident	132 Å²	132	75.3 Å²	75.3	57%	0.574	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-73.1	124.6	175.5	-70.1	-174.8	178.9	176.2	0	110.1	D133 N155	D133-K157 HydrophobicContact CB-CB 4.33Å; D133-K157 WeakPolarHBondContact CB-O 3.38Å; D133-K157 PolarHBondContact N-O 3.42Å; N155-K157 PolarHBondContact O-N 3.04Å
158	M	92.8	Very high	85.6	Confident	65 Å²	65	75.5 Å²	75.5	32%	0.32	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	146.1	176.6	-57.4	-63.9	-73.5	0	0	110.4	L55 E130 I131 P132 I156	L55-M158 HydrophobicContact CD2-CE 3.95Å; L55-M158 HydrophobicContact CD2-SD 3.91Å; E130-M158 HydrophobicContact CG-CB 3.8Å; E130-M158 HydrophobicContact CG-CE 3.81Å; E130-M158 HydrophobicContact CG-CG 4.48Å; E130-M158 WeakPolarHBondContact OE1-CB 3.29Å; I131-M158 CarbonylContact O-C 3.56Å; I131-M158 WeakPolarHBondContact O-CA 3.48Å; P132-M158 HydrophobicContact CB-SD 4.32Å; I156-M158 HydrophobicContact CG2-SD 4.22Å; I156-M158 PolarHBondContact O-N 3.23Å
159	R	92.8	Very high	84.6	Confident	99 Å²	99	79.3 Å²	79.3	37%	0.374	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	141.6	179.1	-173.3	173.3	-179.3	162.1	3.5	110.1	I131 D133	I131-R159 PolarHBondContact N-O 3.03Å; I131-R159 PolarHBondContact O-N 3.02Å; D133-R159 HydrophobicContact CB-CB 4.19Å
160	K	93.4	Very high	82.9	Confident	93 Å²	93	86.3 Å²	86.3	40%	0.404	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	128.2	174	-67.8	165	179.1	158.8	0	109.4	Y127 L129 E130	Y127-K160 HydrophobicContact CD1-CD 4Å; Y127-K160 HydrophobicContact CE1-CD 3.33Å; Y127-K160 PolarHBondContact OH-NZ 3.35Å; L129-K160 WeakPolarHBondContact O-CA 3.39Å; E130-K160 HydrophobicContact CB-CG 4.31Å
161	I	91.4	Very high	81.1	Confident	4 Å²	4	89 Å²	89	2%	0.021	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.1	176	-58.3	-170.1	0	0	0	107.8	A74 I78 Y124 G128 L129 I131 L135 D165	A74-I161 HydrophobicContact CB-CD1 3.65Å; I78-I161 HydrophobicContact CD1-CB 3.76Å; I78-I161 HydrophobicContact CD1-CG2 3.8Å; Y124-I161 WeakPolarHBondContact CD2-O 3.4Å; G128-I161 CarbonylContact C-O 3.57Å; G128-I161 VanDerWaalsContact CA-O 3.24Å; G128-I161 WeakPolarHBondContact CA-O 3.11Å; L129-I161 PolarHBondContact N-O 3.46Å; L129-I161 PolarHBondContact O-N 3.47Å; I131-I161 HydrophobicContact CD1-CD1 3.57Å; I131-I161 HydrophobicContact CD1-CG1 4.19Å; I131-I161 HydrophobicContact CG1-CD1 4.01Å; I131-I161 HydrophobicContact CG1-CG1 4.14Å; L135-I161 HydrophobicContact CD1-CD1 4.44Å; I161-D165 HydrophobicContact CG2-CB 4.05Å
162	G	89.4	Confident	79.1	Confident	11 Å²	11	90.1 Å²	90.1	11%	0.113	46%	0.462	C	S	.	.			trans	-109.7	169.8	178.6	0	0	0	0	0	112.9	Y124 N164 D165	Y124-G162 VanDerWaalsContact CE2-C 3.5Å; Y124-G162 VanDerWaalsContact O-CA 3.32Å; Y124-G162 WeakPolarHBondContact O-CA 3.24Å; G162-N164 PolarHBondContact O-N 3.34Å; G162-D165 PolarHBondContact N-OD2 2.99Å; G162-D165 WeakPolarHBondContact O-CB 3.46Å; G162-D165 PolarHBondContact O-N 3.12Å
163	A	85.5	Confident	76.9	Confident	32 Å²	32	97.7 Å²	97.7	26%	0.264	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-56.1	-33.9	176.6	0	0	0	0	0	112.7	Y124 D165 A166	Y124-A163 HydrophobicContact CD1-CB 4.19Å; Y124-A163 HydrophobicContact CE1-CB 3.75Å; Y124-A163 PolarHBondContact O-N 3.37Å; A163-D165 PolarHBondContact O-N 3.18Å; A163-A166 WeakPolarHBondContact O-CB 3.44Å; A163-A166 PolarHBondContact O-N 3.14Å
164	N	82	Confident	75	Confident	102 Å²	102	106 Å²	106	55%	0.545	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-66	-16.6	178.4	-67.1	-45.1	0	0	0	114.3	G162 A166	G162-N164 PolarHBondContact O-N 3.34Å; N164-A166 VanDerWaalsContact C-N 3.33Å
165	D	79.2	Confident	72.7	Confident	53 Å²	53	106.5 Å²	106.5	28%	0.283	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-78.3	-17.8	176.8	-80.9	-61.5	0	0	0	113	K71 I161 G162 A163 I167	K71-D165 HydrophobicContact CD-CB 4.32Å; K71-D165 IonicContact NZ-OD1 3.48Å; K71-D165 PolarHBondContact NZ-OD1 3.36Å; I161-D165 HydrophobicContact CG2-CB 4.05Å; G162-D165 PolarHBondContact N-OD2 2.99Å; G162-D165 WeakPolarHBondContact O-CB 3.46Å; G162-D165 PolarHBondContact O-N 3.12Å; A163-D165 PolarHBondContact O-N 3.18Å; D165-I167 VanDerWaalsContact C-N 3.28Å
166	A	71.6	Confident	70.4	Confident	32 Å²	32	107.3 Å²	107.3	26%	0.264	53%	0.527	S	S	.	.	S	Bend	trans	-69.8	-29.3	176.1	0	0	0	0	0	112	C75 A163 N164	C75-A166 HydrophobicContact CB-CB 3.83Å; A163-A166 WeakPolarHBondContact O-CB 3.44Å; A163-A166 PolarHBondContact O-N 3.14Å; N164-A166 VanDerWaalsContact C-N 3.33Å
167	I	71.8	Confident	68	Low	113 Å²	113	112.8 Å²	112.8	58%	0.579	56%	0.555	S	S	*	*	S	Bend	trans	-89	122.4	-179	-55.3	173.5	0	0	0	108.1	D165 K169	D165-I167 VanDerWaalsContact C-N 3.28Å; I167-K169 PolarHBondContact O-N 3.17Å
168	P	62.2	Low	65.6	Low	115 Å²	115	112.2 Å²	112.2	75%	0.747	56%	0.563	S	S	*	*			trans	-64.3	103.6	172.1	26.4	-31.6	0	0	0	108.4	K170	P168-K170 PolarHBondContact O-N 2.91Å; P168-K170 VanDerWaalsContact O-N 3.12Å
169	K	64.6	Low	63.2	Low	164 Å²	164	114.7 Å²	114.7	71%	0.713	58%	0.582	S	S	*	*			trans	-58.2	120.2	167.9	-66.4	-173.6	179.9	-177.1	0	106.8	I167 C171	I167-K169 PolarHBondContact O-N 3.17Å; K169-C171 VanDerWaalsContact C-N 3.29Å; K169-C171 PolarHBondContact O-N 3.48Å
170	K	52.2	Low	60.9	Low	209 Å²	209	117 Å²	117	91%	0.909	60%	0.601	S	S	*	*			trans	-57.4	97.2	168.8	-70.1	-170.5	179.1	-177.8	0	107.1	P168 K172	P168-K170 PolarHBondContact O-N 2.91Å; P168-K170 VanDerWaalsContact O-N 3.12Å; K170-K172 PolarHBondContact O-N 3.42Å; K170-K172 VanDerWaalsContact O-N 3.09Å
171	C	48.1	Very low	58.3	Low	114 Å²	114	121.4 Å²	121.4	77%	0.77	62%	0.623	S	S	*	*			trans	-66	112.6	171.2	-84.9	0	0	0	0	106.5	K169 R173	K169-C171 VanDerWaalsContact C-N 3.29Å; K169-C171 PolarHBondContact O-N 3.48Å; C171-R173 PolarHBondContact O-N 2.92Å
172	K	46.3	Very low	55.7	Low	200 Å²	200	127.9 Å²	127.9	87%	0.87	66%	0.658	S	S	*	*			trans	-55.4	113.7	156.3	-65.8	-172.6	179.2	-175.7	0	105.2	K170 K174	K170-K172 PolarHBondContact O-N 3.42Å; K170-K172 VanDerWaalsContact O-N 3.09Å; K172-K174 PolarHBondContact O-N 2.88Å
173	R	43.4	Very low	53.3	Low	237 Å²	237	135.4 Å²	135.4	89%	0.894	70%	0.695	S	S	*	*			trans	-54.1	114	173.3	-73.8	178.9	-178.3	163.3	-0.5	106	C171 T175	C171-R173 PolarHBondContact O-N 2.92Å; R173-T175 PolarHBondContact O-N 2.93Å; R173-T175 VanDerWaalsContact O-N 3.11Å
174	K	46.3	Very low	50.8	Low	196 Å²	196	137.7 Å²	137.7	85%	0.852	72%	0.721	S	S	*	*			trans	-71.8	102.9	163.7	-73.8	-175.5	177.8	-175.4	0	105.1	K172 I176	K172-K174 PolarHBondContact O-N 2.88Å; K174-I176 PolarHBondContact O-N 3.2Å
175	T	39.5	Very low	49	Very low	121 Å²	121	141.7 Å²	141.7	74%	0.742	74%	0.737	S	S	*	*			trans	-59	108.9	165.4	-45.4	0	0	0	0	106	R173 I177	R173-T175 PolarHBondContact O-N 2.93Å; R173-T175 VanDerWaalsContact O-N 3.11Å; T175-I177 VanDerWaalsContact C-N 3.3Å; T175-I177 HydrophobicContact CG2-CG1 4.22Å; T175-I177 PolarHBondContact O-N 3Å
176	I	42.5	Very low	47	Very low	147 Å²	147	147.2 Å²	147.2	75%	0.754	77%	0.765	S	S	*	*			trans	-72.1	97.4	167.7	-61.4	170.7	0	0	0	104	K174 T178	K174-I176 PolarHBondContact O-N 3.2Å; I176-T178 HydrophobicContact CG2-CG2 4.15Å; I176-T178 PolarHBondContact O-N 3.18Å
177	I	40.5	Very low	45.2	Very low	130 Å²	130	153.6 Å²	153.6	67%	0.667	79%	0.79	S	S	*	*			trans	-77.1	102.6	165.7	-56.7	175.9	0	0	0	104.8	T175 V179	T175-I177 VanDerWaalsContact C-N 3.3Å; T175-I177 HydrophobicContact CG2-CG1 4.22Å; T175-I177 PolarHBondContact O-N 3Å; I177-V179 HydrophobicContact CG2-CG2 3.61Å; I177-V179 PolarHBondContact O-N 3.43Å
178	T	41.5	Very low	43.5	Very low	119 Å²	119	156.1 Å²	156.1	73%	0.73	80%	0.803	S	S	*	*			trans	-72.9	101.3	161.3	46.4	0	0	0	0	106.6	I176	I176-T178 HydrophobicContact CG2-CG2 4.15Å; I176-T178 PolarHBondContact O-N 3.18Å
179	V	42.9	Very low	42.5	Very low	118 Å²	118	157.8 Å²	157.8	72%	0.715	81%	0.806	S	S	*	*			trans	-87.8	101	168.2	-175.9	0	0	0	0	106.5	I177	I177-V179 HydrophobicContact CG2-CG2 3.61Å; I177-V179 PolarHBondContact O-N 3.43Å
180	D	44	Very low	41.3	Very low	147 Å²	147	157.6 Å²	157.6	79%	0.786	81%	0.813	S	S	*	*			trans	-141.7	136.5	156.9	-80	-41.8	0	0	0	106.9
181	Q	39	Very low	40.8	Very low	185 Å²	185	156.7 Å²	156.7	86%	0.864	81%	0.812	S	S	*	*			trans	85.8	135	-174.6	-62.2	168.3	-3.1	0	0	115.3
182	D	37.1	Very low	40.5	Very low	141 Å²	141	156.9 Å²	156.9	75%	0.754	81%	0.814	S	S	*	*			cis	-168	155.8	-21.6	-141.8	-20.5	0	0	0	104.1
183	L	39.1	Very low	40.2	Very low	169 Å²	169	153 Å²	153	89%	0.885	81%	0.812	S	S	*	*			trans	-13	132.5	172.8	-66.3	156.4	0	0	0	120
184	G	32.8	Very low	40	Very low	79 Å²	79	148.3 Å²	148.3	81%	0.814	81%	0.805	S	S	*	*			trans	-171.8	86	166.2	0	0	0	0	0	113.7
185	E	44	Very low	39.9	Very low	187 Å²	187	144.3 Å²	144.3	87%	0.874	80%	0.802	S	S	*	*			trans	-43.5	129.9	167.8	-173.4	174.7	-131.2	0	0	113.9
186	L	36.9	Very low	40.1	Very low	169 Å²	169	145.7 Å²	145.7	89%	0.885	80%	0.804	S	S	*	*			trans	-153.6	137.9	155.1	-80	-172.9	0	0	0	111.6
187	E	35.3	Very low	40.7	Very low	166 Å²	166	148.3 Å²	148.3	78%	0.776	81%	0.814	S	S	*	*			trans	-71	145.7	-158.1	-63.3	158.4	152.5	0	0	115.3
188	L	36.3	Very low	40.8	Very low	165 Å²	165	150.1 Å²	150.1	86%	0.864	82%	0.819	S	S	*	*			trans	-88.5	104	167.4	-65.3	172.7	0	0	0	108.6
189	N	39.5	Very low	41.2	Very low	151 Å²	151	151.5 Å²	151.5	81%	0.807	82%	0.819	S	S	*	*			trans	-90.6	101.1	163.1	-84	-15.8	0	0	0	108.8
190	D	40.8	Very low	41.2	Very low	159 Å²	159	152 Å²	152	85%	0.85	82%	0.823	S	S	*	*			trans	-78.8	104.6	160.1	-82.5	-37.7	0	0	0	108.1
191	E	40.9	Very low	41.4	Very low	190 Å²	190	149.9 Å²	149.9	89%	0.888	83%	0.826	S	S	*	*			trans	-120	119.9	155.7	-78.3	-145.7	155.8	0	0	110.1
192	S	41.8	Very low	42.1	Very low	119 Å²	119	147.4 Å²	147.4	83%	0.832	82%	0.823	S	S	*	*			trans	-70.1	139.1	171.7	66.9	0	0	0	0	110.5
193	S	40	Very low	42.8	Very low	117 Å²	117	149 Å²	149	82%	0.818	86%	0.855	S	S	*	*			trans	-147.8	108.7	147.3	-164.9	0	0	0	0	110.1
194	D	40.3	Very low	43	Very low	140 Å²	140	148 Å²	148	75%	0.749	85%	0.854	S	S	*	*			trans	-63.5	137.2	163.7	-170.3	15	0	0	0	110.6
195	S	43.3	Very low	43.6	Very low	112 Å²	112	151.6 Å²	151.6	78%	0.783	86%	0.856	S	S	*	*			trans	-170.3	104.2	151.1	62.4	0	0	0	0	110.4
196	D	44.5	Very low	43.5	Very low	149 Å²	149	149.6 Å²	149.6	80%	0.797	86%	0.855	S	S	*	*			trans	-55.2	142	156.4	-77.2	-39.2	0	0	0	111.4
197	E	53.3	Low	43.9	Very low	203 Å²	203	148.5 Å²	148.5	95%	0.949	85%	0.853	S	S	*	*			trans	-165.1	149.8	136.9	-111.4	176.2	-162.3	0	0	113.3
198	E	44.3	Very low	44.5	Very low	167 Å²	167	147.4 Å²	147.4	78%	0.78	86%	0.858	S	S	*	*			trans	-72.3	156.5	-156.2	-94.7	-171	122.1	0	0	119.1
199	M	48.8	Very low	45	Very low	148 Å²	148	146.2 Å²	146.2	73%	0.729	86%	0.857	S	S	*	*			trans	51.3	125.1	132.4	-55	-72.3	-90.8	0	0	120.4
200	T	43.7	Very low	45.4	Very low	130 Å²	130	145.9 Å²	145.9	80%	0.798	86%	0.861	S	S	*	*				-177.5	136.4	101.5	28.4	0	0	0	0	111.7
201	A	48.3	Very low	45.7	Very low	102 Å²	102	144.8 Å²	144.8	84%	0.843	86%	0.862	S	S	*	*			trans	-87.1	140.6	162.1	0	0	0	0	0	109.1
202	V	53.5	Low	46.2	Very low	133 Å²	133	141.1 Å²	141.1	81%	0.806	86%	0.859	S	S	*	*			trans	-135	114.5	168.6	-177.7	0	0	0	0	110
203	A	52.1	Low	46.5	Very low	173 Å²	173	143.1 Å²	143.1	100%	1.43	86%	0.862	S	S	*	*			trans	51.9	0	151.2	0	0	0	0	0	120.1

Retrieved 203 of 203 residues in 526.6 ms (Link to these results)

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