A0A3Q0KLQ6_SCHMA Loading...

Putative ubiquitin-protein ligase BRE1 AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KLQ6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 532 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	48.2	Very low	62.1	Low	221 Å²	221	152.5 Å²	152.5	100%	1.089	71%	0.705	S	S	*	*				0	-37.3	0	-100.2	174.6	-179.6	0	0	115.3	I3 K4	M1-I3 PolarHBondContact O-N 3.39Å; M1-K4 PolarHBondContact O-N 3.15Å
2	K	59	Low	63.5	Low	184 Å²	184	153.3 Å²	153.3	80%	0.8	70%	0.699	S	S	*	*	H	α-helix	trans	-68.6	-28.9	178.5	-72.4	-178.1	179.1	177.9	0	116	K4 T5	K2-K4 PolarHBondContact O-N 3.39Å; K2-K4 VanDerWaalsContact O-N 3.11Å; K2-T5 PolarHBondContact O-N 3.34Å
3	I	55.5	Low	64.7	Low	157 Å²	157	155.4 Å²	155.4	81%	0.805	70%	0.698	S	S	*	*	H	α-helix	trans	-54.9	-21.2	172.3	-75.9	166.7	0	0	0	113.5	M1	M1-I3 PolarHBondContact O-N 3.39Å
4	K	56.2	Low	65.5	Low	147 Å²	147	148.4 Å²	148.4	64%	0.639	68%	0.677	S	S	*	*	H	α-helix	trans	-83.4	-42	171.7	-76.7	-176.6	173.8	-177.1	0	111.6	M1 K2 V6 R7 Y8	M1-K4 PolarHBondContact O-N 3.15Å; K2-K4 PolarHBondContact O-N 3.39Å; K2-K4 VanDerWaalsContact O-N 3.11Å; K4-V6 PolarHBondContact O-N 2.94Å; K4-R7 PolarHBondContact O-N 3.45Å; K4-Y8 HydrophobicContact CB-CD2 4.17Å; K4-Y8 HydrophobicContact CB-CE2 4.21Å; K4-Y8 WeakPolarHBondContact O-CD2 3.41Å; K4-Y8 PolarHBondContact O-N 3.14Å
5	T	58.7	Low	66.6	Low	92 Å²	92	146.7 Å²	146.7	56%	0.564	67%	0.668	S	S	*	*	H	α-helix	trans	-60	-42.3	-171.5	-43.8	0	0	0	0	114.4	K2 R9	K2-T5 PolarHBondContact O-N 3.34Å; T5-R9 PolarHBondContact O-N 2.92Å
6	V	61.8	Low	67.5	Low	100 Å²	100	141.9 Å²	141.9	61%	0.606	65%	0.649	S	S	*	*	H	α-helix	trans	-71.2	-41.3	-179.9	177.9	0	0	0	0	111.8	K4 Y8 R9 I10	K4-V6 PolarHBondContact O-N 2.94Å; V6-Y8 PolarHBondContact O-N 3.36Å; V6-R9 PolarHBondContact O-N 3.42Å; V6-R9 VanDerWaalsContact O-N 3.15Å; V6-I10 HydrophobicContact CG1-CD1 4.25Å; V6-I10 PolarHBondContact O-N 2.93Å; V6-I10 VanDerWaalsContact O-N 3.12Å
7	R	61.5	Low	68.1	Low	187 Å²	187	138.8 Å²	138.8	71%	0.706	64%	0.637	S	S	*	*	H	α-helix	trans	-64.5	-40.1	177.3	-146.1	178.6	-163.8	171.8	3.9	111.5	K4 R9 I10 I11	K4-R7 PolarHBondContact O-N 3.45Å; R7-R9 VanDerWaalsContact C-N 3.31Å; R7-R9 PolarHBondContact O-N 3.02Å; R7-I10 PolarHBondContact O-N 3.11Å; R7-I11 HydrophobicContact CG-CD1 4.25Å; R7-I11 VanDerWaalsContact O-CG1 3.31Å; R7-I11 WeakPolarHBondContact O-CG1 3.41Å; R7-I11 PolarHBondContact O-N 3.01Å; R7-I11 VanDerWaalsContact O-N 3.09Å
8	Y	68.3	Low	69	Low	167 Å²	167	136.7 Å²	136.7	66%	0.655	63%	0.628	S	S	*	*	H	α-helix	trans	-58.2	-42.3	171.5	-92.1	-76.4	0	0	0	111.8	K4 V6 Y12	K4-Y8 HydrophobicContact CB-CD2 4.17Å; K4-Y8 HydrophobicContact CB-CE2 4.21Å; K4-Y8 WeakPolarHBondContact O-CD2 3.41Å; K4-Y8 PolarHBondContact O-N 3.14Å; V6-Y8 PolarHBondContact O-N 3.36Å; Y8-Y12 WeakPolarHBondContact O-CB 3.2Å; Y8-Y12 PolarHBondContact O-N 2.63Å
9	R	69	Low	69.6	Low	202 Å²	202	133 Å²	133	76%	0.762	61%	0.613	S	S	*	*	H	α-helix	trans	-69.5	-38.2	-177.6	-157.6	161.8	176.2	138.5	-5.6	113.2	T5 V6 R7 W13	T5-R9 PolarHBondContact O-N 2.92Å; V6-R9 PolarHBondContact O-N 3.42Å; V6-R9 VanDerWaalsContact O-N 3.15Å; R7-R9 VanDerWaalsContact C-N 3.31Å; R7-R9 PolarHBondContact O-N 3.02Å; R9-W13 WeakPolarHBondContact O-CB 3.49Å; R9-W13 PolarHBondContact O-N 3.39Å
10	I	69.4	Low	70.4	Confident	115 Å²	115	132.8 Å²	132.8	59%	0.59	61%	0.61	S	S	*	*	H	α-helix	trans	-68.6	-46.5	175.8	-67.1	169.7	0	0	0	111.2	V6 R7 Y12 W13 S14	V6-I10 HydrophobicContact CG1-CD1 4.25Å; V6-I10 PolarHBondContact O-N 2.93Å; V6-I10 VanDerWaalsContact O-N 3.12Å; R7-I10 PolarHBondContact O-N 3.11Å; I10-Y12 VanDerWaalsContact C-N 3.32Å; I10-Y12 PolarHBondContact O-N 3.02Å; I10-W13 PolarHBondContact O-N 3.23Å; I10-S14 WeakPolarHBondContact O-CB 3.35Å; I10-S14 PolarHBondContact O-N 2.91Å
11	I	75.6	Confident	70.8	Confident	105 Å²	105	132.3 Å²	132.3	54%	0.538	61%	0.609	S	S	.	*	H	α-helix	trans	-64	-40.7	177.6	-65.3	166.6	0	0	0	110.2	R7 W13 S14 F15	R7-I11 HydrophobicContact CG-CD1 4.25Å; R7-I11 VanDerWaalsContact O-CG1 3.31Å; R7-I11 WeakPolarHBondContact O-CG1 3.41Å; R7-I11 PolarHBondContact O-N 3.01Å; R7-I11 VanDerWaalsContact O-N 3.09Å; I11-W13 PolarHBondContact O-N 3.32Å; I11-S14 PolarHBondContact O-N 3.23Å; I11-F15 VanDerWaalsContact O-CB 3.25Å; I11-F15 WeakPolarHBondContact O-CB 3.48Å; I11-F15 PolarHBondContact O-N 3.41Å
12	Y	78.6	Confident	72.5	Confident	162 Å²	162	127 Å²	127	64%	0.635	58%	0.584	S	S	*	*	H	α-helix	trans	-63.6	-38.3	175.9	-171.3	-99.7	0	0	0	112.6	Y8 I10 N16	Y8-Y12 WeakPolarHBondContact O-CB 3.2Å; Y8-Y12 PolarHBondContact O-N 2.63Å; I10-Y12 VanDerWaalsContact C-N 3.32Å; I10-Y12 PolarHBondContact O-N 3.02Å; Y12-N16 WeakPolarHBondContact CD1-ND2 3.35Å; Y12-N16 WeakPolarHBondContact CE1-ND2 3.46Å; Y12-N16 VanDerWaalsContact CZ-ND2 3.28Å; Y12-N16 WeakPolarHBondContact O-CB 3.42Å; Y12-N16 PolarHBondContact O-N 3.05Å; Y12-N16 PolarHBondContact O-ND2 3.48Å
13	W	78.9	Confident	73.9	Confident	181 Å²	181	124.7 Å²	124.7	69%	0.686	57%	0.574	S	S	*	*	H	α-helix	trans	-69.1	-46.4	175.7	-159.3	80	0	0	0	111.5	R9 I10 I11 F15 N16 M17	R9-W13 WeakPolarHBondContact O-CB 3.49Å; R9-W13 PolarHBondContact O-N 3.39Å; I10-W13 PolarHBondContact O-N 3.23Å; I11-W13 PolarHBondContact O-N 3.32Å; W13-F15 PolarHBondContact O-N 3.35Å; W13-N16 PolarHBondContact O-N 3.11Å; W13-M17 HydrophobicContact CH2-CE 4.41Å; W13-M17 HydrophobicContact CH2-SD 4.42Å; W13-M17 WeakPolarHBondContact O-CB 2.97Å; W13-M17 PolarHBondContact O-N 3.2Å
14	S	75.9	Confident	75.3	Confident	57 Å²	57	121.7 Å²	121.7	40%	0.399	56%	0.56	S	S	.	*	H	α-helix	trans	-56.6	-46.6	173.5	172.5	0	0	0	0	112.4	I10 I11 M17 Q18	I10-S14 WeakPolarHBondContact O-CB 3.35Å; I10-S14 PolarHBondContact O-N 2.91Å; I11-S14 PolarHBondContact O-N 3.23Å; S14-M17 WeakPolarHBondContact O-CB 3.49Å; S14-M17 PolarHBondContact O-N 3.33Å; S14-Q18 WeakPolarHBondContact O-CG 3.33Å; S14-Q18 PolarHBondContact O-N 3.42Å
15	F	82.1	Confident	76.7	Confident	124 Å²	124	121.3 Å²	121.3	54%	0.544	56%	0.558	S	S	.	*	H	α-helix	trans	-69.9	-40.8	-178.2	-163.6	-100.8	0	0	0	111.2	I11 W13 M17 Q18 L19	I11-F15 VanDerWaalsContact O-CB 3.25Å; I11-F15 WeakPolarHBondContact O-CB 3.48Å; I11-F15 PolarHBondContact O-N 3.41Å; W13-F15 PolarHBondContact O-N 3.35Å; F15-M17 VanDerWaalsContact C-N 3.31Å; F15-M17 PolarHBondContact O-N 3.15Å; F15-Q18 PolarHBondContact O-N 2.88Å; F15-L19 HydrophobicContact CD1-CD1 3.76Å; F15-L19 HydrophobicContact CE1-CD1 3.49Å; F15-L19 VanDerWaalsContact CE1-CD1 3.49Å; F15-L19 HydrophobicContact CZ-CD1 4.44Å; F15-L19 WeakPolarHBondContact O-CB 3.5Å; F15-L19 PolarHBondContact O-N 3.01Å
16	N	81.6	Confident	78.1	Confident	69 Å²	69	122.6 Å²	122.6	37%	0.369	56%	0.56	S	S	.	*	H	α-helix	trans	-63.3	-35.6	172.4	-85.4	-60.7	0	0	0	112.7	Y12 W13 L19 K20	Y12-N16 WeakPolarHBondContact CD1-ND2 3.35Å; Y12-N16 WeakPolarHBondContact CE1-ND2 3.46Å; Y12-N16 VanDerWaalsContact CZ-ND2 3.28Å; Y12-N16 WeakPolarHBondContact O-CB 3.42Å; Y12-N16 PolarHBondContact O-N 3.05Å; Y12-N16 PolarHBondContact O-ND2 3.48Å; W13-N16 PolarHBondContact O-N 3.11Å; N16-L19 PolarHBondContact O-N 2.89Å; N16-K20 VanDerWaalsContact O-CB 3.26Å; N16-K20 WeakPolarHBondContact O-CB 3.16Å; N16-K20 PolarHBondContact O-N 3.25Å
17	M	78.3	Confident	79.5	Confident	90 Å²	90	123.9 Å²	123.9	44%	0.443	56%	0.56	S	S	.	*	H	α-helix	trans	-63.7	-45.6	174.9	-154.9	74.6	164.1	0	0	110.7	W13 S14 F15 K20 E21	W13-M17 HydrophobicContact CH2-CE 4.41Å; W13-M17 HydrophobicContact CH2-SD 4.42Å; W13-M17 WeakPolarHBondContact O-CB 2.97Å; W13-M17 PolarHBondContact O-N 3.2Å; S14-M17 WeakPolarHBondContact O-CB 3.49Å; S14-M17 PolarHBondContact O-N 3.33Å; F15-M17 VanDerWaalsContact C-N 3.31Å; F15-M17 PolarHBondContact O-N 3.15Å; M17-K20 PolarHBondContact O-N 3.27Å; M17-E21 WeakPolarHBondContact O-CG 3.39Å; M17-E21 PolarHBondContact O-N 2.79Å
18	Q	82.6	Confident	80.8	Confident	100 Å²	100	118.2 Å²	118.2	47%	0.467	55%	0.548	S	S	.	.	H	α-helix	trans	-66.1	-38.5	175.2	-72.1	176.9	-17.6	0	0	112.7	S14 F15 K20 E21 L22	S14-Q18 WeakPolarHBondContact O-CG 3.33Å; S14-Q18 PolarHBondContact O-N 3.42Å; F15-Q18 PolarHBondContact O-N 2.88Å; Q18-K20 VanDerWaalsContact C-N 3.3Å; Q18-K20 PolarHBondContact O-N 2.91Å; Q18-E21 PolarHBondContact O-N 3.23Å; Q18-L22 WeakPolarHBondContact O-CB 3.49Å; Q18-L22 VanDerWaalsContact O-CG 3.27Å; Q18-L22 WeakPolarHBondContact O-CG 3.26Å; Q18-L22 PolarHBondContact O-N 3.04Å
19	L	82.1	Confident	81.8	Confident	67 Å²	67	114.7 Å²	114.7	35%	0.351	54%	0.539	S	S	.	.	H	α-helix	trans	-64.8	-37.4	175.1	-125.1	148.3	0	0	0	111.3	F15 N16 K23	F15-L19 HydrophobicContact CD1-CD1 3.76Å; F15-L19 HydrophobicContact CE1-CD1 3.49Å; F15-L19 VanDerWaalsContact CE1-CD1 3.49Å; F15-L19 HydrophobicContact CZ-CD1 4.44Å; F15-L19 WeakPolarHBondContact O-CB 3.5Å; F15-L19 PolarHBondContact O-N 3.01Å; N16-L19 PolarHBondContact O-N 2.89Å; L19-K23 HydrophobicContact CD2-CD 4.44Å; L19-K23 WeakPolarHBondContact O-CB 3.46Å; L19-K23 VanDerWaalsContact O-CG 3.32Å; L19-K23 WeakPolarHBondContact O-CG 3.35Å; L19-K23 PolarHBondContact O-N 3.09Å
20	K	84.5	Confident	83	Confident	129 Å²	129	108.6 Å²	108.6	56%	0.561	53%	0.527	S	S	*	.	H	α-helix	trans	-68.2	-47.7	174.2	-171.3	174.9	179.8	-176.9	0	111	N16 M17 Q18 L22 K23 D24	N16-K20 VanDerWaalsContact O-CB 3.26Å; N16-K20 WeakPolarHBondContact O-CB 3.16Å; N16-K20 PolarHBondContact O-N 3.25Å; M17-K20 PolarHBondContact O-N 3.27Å; Q18-K20 VanDerWaalsContact C-N 3.3Å; Q18-K20 PolarHBondContact O-N 2.91Å; K20-L22 VanDerWaalsContact C-N 3.32Å; K20-L22 PolarHBondContact O-N 3.03Å; K20-K23 PolarHBondContact O-N 3.29Å; K20-D24 WeakPolarHBondContact O-CB 3.17Å; K20-D24 PolarHBondContact O-N 2.96Å
21	E	79.9	Confident	84.1	Confident	123 Å²	123	107 Å²	107	58%	0.575	52%	0.519	S	S	*	.	H	α-helix	trans	-57.9	-42.7	174.7	-79.3	177.3	173.1	0	0	112.2	M17 Q18 K25	M17-E21 WeakPolarHBondContact O-CG 3.39Å; M17-E21 PolarHBondContact O-N 2.79Å; Q18-E21 PolarHBondContact O-N 3.23Å; E21-K25 WeakPolarHBondContact O-CB 3.29Å; E21-K25 PolarHBondContact O-N 3.48Å
22	L	84	Confident	84.9	Confident	109 Å²	109	104.4 Å²	104.4	57%	0.571	51%	0.511	S	S	*	.	H	α-helix	trans	-69.3	-39.6	177.8	-73.5	170.6	0	0	0	112.2	Q18 K20 K25 I26	Q18-L22 WeakPolarHBondContact O-CB 3.49Å; Q18-L22 VanDerWaalsContact O-CG 3.27Å; Q18-L22 WeakPolarHBondContact O-CG 3.26Å; Q18-L22 PolarHBondContact O-N 3.04Å; K20-L22 VanDerWaalsContact C-N 3.32Å; K20-L22 PolarHBondContact O-N 3.03Å; L22-K25 PolarHBondContact O-N 3.2Å; L22-I26 VanDerWaalsContact O-CG1 3.28Å; L22-I26 WeakPolarHBondContact O-CG1 3.25Å; L22-I26 PolarHBondContact O-N 3.08Å
23	K	87.5	Confident	85.5	Confident	135 Å²	135	101.5 Å²	101.5	59%	0.587	50%	0.503	S	S	*	.	H	α-helix	trans	-64.3	-49.7	173.5	-81	-176	178.5	-172	0	111.6	L19 K20 K25 I26 E27	L19-K23 HydrophobicContact CD2-CD 4.44Å; L19-K23 WeakPolarHBondContact O-CB 3.46Å; L19-K23 VanDerWaalsContact O-CG 3.32Å; L19-K23 WeakPolarHBondContact O-CG 3.35Å; L19-K23 PolarHBondContact O-N 3.09Å; K20-K23 PolarHBondContact O-N 3.29Å; K23-K25 PolarHBondContact O-N 2.94Å; K23-I26 PolarHBondContact O-N 3.44Å; K23-I26 VanDerWaalsContact O-N 3.15Å; K23-E27 WeakPolarHBondContact O-CB 3.4Å; K23-E27 PolarHBondContact O-N 3.18Å
24	D	85.1	Confident	86.2	Confident	95 Å²	95	97.6 Å²	97.6	51%	0.508	49%	0.492	S	S	.	.	H	α-helix	trans	-59	-36.5	176.3	-68	-14.4	0	0	0	110.4	K20 S28	K20-D24 WeakPolarHBondContact O-CB 3.17Å; K20-D24 PolarHBondContact O-N 2.96Å; D24-S28 VanDerWaalsContact O-CB 3.25Å; D24-S28 WeakPolarHBondContact O-CB 3.31Å; D24-S28 PolarHBondContact O-N 3Å; D24-S28 PolarHBondContact O-OG 2.78Å
25	K	85.7	Confident	87	Confident	138 Å²	138	101.2 Å²	101.2	60%	0.6	50%	0.5	S	S	*	.	H	α-helix	trans	-69.6	-44.1	175.2	-159.8	168.8	-170.2	176.8	0	112.2	E21 L22 K23 S28 M29	E21-K25 WeakPolarHBondContact O-CB 3.29Å; E21-K25 PolarHBondContact O-N 3.48Å; L22-K25 PolarHBondContact O-N 3.2Å; K23-K25 PolarHBondContact O-N 2.94Å; K25-S28 WeakPolarHBondContact CA-OG 3.47Å; K25-S28 PolarHBondContact O-N 3.24Å; K25-S28 PolarHBondContact O-OG 2.99Å; K25-M29 WeakPolarHBondContact O-CB 3.27Å; K25-M29 WeakPolarHBondContact O-CG 3.4Å; K25-M29 PolarHBondContact O-N 3.45Å
26	I	88.7	Confident	87.5	Confident	120 Å²	120	99 Å²	99	62%	0.615	49%	0.494	S	S	*	.	H	α-helix	trans	-62.7	-43.7	174.8	-70.4	165.3	0	0	0	110.8	L22 K23 M29 S30	L22-I26 VanDerWaalsContact O-CG1 3.28Å; L22-I26 WeakPolarHBondContact O-CG1 3.25Å; L22-I26 PolarHBondContact O-N 3.08Å; K23-I26 PolarHBondContact O-N 3.44Å; K23-I26 VanDerWaalsContact O-N 3.15Å; I26-M29 PolarHBondContact O-N 3.32Å; I26-S30 WeakPolarHBondContact O-CB 3.28Å; I26-S30 PolarHBondContact O-N 3.31Å
27	E	90.9	Very high	88	Confident	127 Å²	127	101.3 Å²	101.3	59%	0.593	50%	0.501	S	S	*	.	H	α-helix	trans	-60.3	-48.2	176.2	-163.6	85.4	-146.8	0	0	110.1	K23 M29 S30 I31	K23-E27 WeakPolarHBondContact O-CB 3.4Å; K23-E27 PolarHBondContact O-N 3.18Å; E27-M29 VanDerWaalsContact C-N 3.33Å; E27-M29 PolarHBondContact O-N 2.96Å; E27-S30 PolarHBondContact O-N 2.62Å; E27-I31 HydrophobicContact CG-CD1 4.14Å; E27-I31 WeakPolarHBondContact O-CB 3.13Å; E27-I31 VanDerWaalsContact O-CG1 3.26Å; E27-I31 WeakPolarHBondContact O-CG1 3.5Å; E27-I31 PolarHBondContact O-N 3.34Å
28	S	88.2	Confident	88.8	Confident	67 Å²	67	101.8 Å²	101.8	47%	0.469	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-38.5	177.1	74	0	0	0	0	112.8	D24 K25 S32	D24-S28 VanDerWaalsContact O-CB 3.25Å; D24-S28 WeakPolarHBondContact O-CB 3.31Å; D24-S28 PolarHBondContact O-N 3Å; D24-S28 PolarHBondContact O-OG 2.78Å; K25-S28 WeakPolarHBondContact CA-OG 3.47Å; K25-S28 PolarHBondContact O-N 3.24Å; K25-S28 PolarHBondContact O-OG 2.99Å; S28-S32 WeakPolarHBondContact O-CB 3.41Å; S28-S32 PolarHBondContact O-N 3.31Å
29	M	89	Confident	89.3	Confident	94 Å²	94	101.1 Å²	101.1	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-69.2	-40.5	175.9	-74.7	-67.4	-57.1	0	0	111.5	K25 I26 E27 S32 H33	K25-M29 WeakPolarHBondContact O-CB 3.27Å; K25-M29 WeakPolarHBondContact O-CG 3.4Å; K25-M29 PolarHBondContact O-N 3.45Å; I26-M29 PolarHBondContact O-N 3.32Å; E27-M29 VanDerWaalsContact C-N 3.33Å; E27-M29 PolarHBondContact O-N 2.96Å; M29-S32 WeakPolarHBondContact O-CB 3.47Å; M29-S32 PolarHBondContact O-N 2.91Å; M29-H33 WeakPolarHBondContact CE-NE2 3.27Å; M29-H33 WeakPolarHBondContact O-CB 3.34Å; M29-H33 PolarHBondContact O-CD2 3.45Å; M29-H33 VanDerWaalsContact O-CD2 3.32Å; M29-H33 PolarHBondContact O-N 3.39Å
30	S	93.3	Very high	89.9	Confident	73 Å²	73	103.4 Å²	103.4	51%	0.51	51%	0.513	S	S	.	.	H	α-helix	trans	-66.2	-42.2	177.1	-168.1	0	0	0	0	111.3	I26 E27 S32 H33 E34	I26-S30 WeakPolarHBondContact O-CB 3.28Å; I26-S30 PolarHBondContact O-N 3.31Å; E27-S30 PolarHBondContact O-N 2.62Å; S30-S32 VanDerWaalsContact C-N 3.33Å; S30-H33 PolarHBondContact O-N 3.47Å; S30-E34 WeakPolarHBondContact O-CB 3.27Å; S30-E34 PolarHBondContact O-N 2.85Å
31	I	93	Very high	90.4	Very high	82 Å²	82	101.6 Å²	101.6	42%	0.421	51%	0.508	S	S	.	.	H	α-helix	trans	-63.7	-40.4	173.6	-67.8	166.2	0	0	0	110.4	E27 K35	E27-I31 HydrophobicContact CG-CD1 4.14Å; E27-I31 WeakPolarHBondContact O-CB 3.13Å; E27-I31 VanDerWaalsContact O-CG1 3.26Å; E27-I31 WeakPolarHBondContact O-CG1 3.5Å; E27-I31 PolarHBondContact O-N 3.34Å; I31-K35 HydrophobicContact CG2-CD 4.2Å; I31-K35 WeakPolarHBondContact O-CB 3.45Å; I31-K35 VanDerWaalsContact O-CG 3.27Å; I31-K35 WeakPolarHBondContact O-CG 3.28Å; I31-K35 PolarHBondContact O-N 3.26Å
32	S	92.2	Very high	91	Very high	51 Å²	51	101.7 Å²	101.7	36%	0.357	50%	0.503	S	S	.	.	H	α-helix	trans	-61.9	-49.2	175	-166.5	0	0	0	0	111.3	S28 M29 S30 E34 K35 D36	S28-S32 WeakPolarHBondContact O-CB 3.41Å; S28-S32 PolarHBondContact O-N 3.31Å; M29-S32 WeakPolarHBondContact O-CB 3.47Å; M29-S32 PolarHBondContact O-N 2.91Å; S30-S32 VanDerWaalsContact C-N 3.33Å; S32-E34 VanDerWaalsContact C-N 3.33Å; S32-E34 PolarHBondContact O-N 2.84Å; S32-K35 WeakPolarHBondContact O-CB 3.46Å; S32-K35 PolarHBondContact O-N 3.42Å; S32-D36 PolarHBondContact O-N 3.35Å
33	H	91.4	Very high	91.6	Very high	101 Å²	101	99.8 Å²	99.8	47%	0.468	49%	0.494	S	S	.	.	H	α-helix	trans	-64.3	-37	-179.7	-74	-167	0	0	0	112.5	M29 S30 D36 K37	M29-H33 WeakPolarHBondContact CE-NE2 3.27Å; M29-H33 WeakPolarHBondContact O-CB 3.34Å; M29-H33 PolarHBondContact O-CD2 3.45Å; M29-H33 VanDerWaalsContact O-CD2 3.32Å; M29-H33 PolarHBondContact O-N 3.39Å; S30-H33 PolarHBondContact O-N 3.47Å; H33-D36 PolarHBondContact O-N 3.37Å; H33-K37 WeakPolarHBondContact O-CB 3.43Å; H33-K37 WeakPolarHBondContact O-CG 3.48Å; H33-K37 PolarHBondContact O-N 3.49Å
34	E	93.8	Very high	91.8	Very high	98 Å²	98	95.3 Å²	95.3	46%	0.458	48%	0.482	S	S	.	.	H	α-helix	trans	-68.8	-39.4	176.5	-162.3	59.5	-155.7	0	0	111	S30 S32 D36 K37 E38	S30-E34 WeakPolarHBondContact O-CB 3.27Å; S30-E34 PolarHBondContact O-N 2.85Å; S32-E34 VanDerWaalsContact C-N 3.33Å; S32-E34 PolarHBondContact O-N 2.84Å; E34-D36 PolarHBondContact O-N 3.43Å; E34-K37 PolarHBondContact O-N 2.94Å; E34-K37 IonicContact OE2-NZ 2.75Å; E34-E38 WeakPolarHBondContact O-CB 3.44Å; E34-E38 WeakPolarHBondContact O-CG 3.38Å; E34-E38 PolarHBondContact O-N 2.9Å
35	K	93.4	Very high	92.4	Very high	133 Å²	133	97.7 Å²	97.7	58%	0.578	49%	0.488	S	S	*	.	H	α-helix	trans	-60.9	-43	170.8	-74.6	174.8	-179.7	179.6	0	112.1	I31 S32 E38 L39	I31-K35 HydrophobicContact CG2-CD 4.2Å; I31-K35 WeakPolarHBondContact O-CB 3.45Å; I31-K35 VanDerWaalsContact O-CG 3.27Å; I31-K35 WeakPolarHBondContact O-CG 3.28Å; I31-K35 PolarHBondContact O-N 3.26Å; S32-K35 WeakPolarHBondContact O-CB 3.46Å; S32-K35 PolarHBondContact O-N 3.42Å; K35-E38 PolarHBondContact O-N 3.14Å; K35-L39 WeakPolarHBondContact O-CB 3.44Å; K35-L39 PolarHBondContact O-N 2.95Å
36	D	92.5	Very high	92.8	Very high	78 Å²	78	96.8 Å²	96.8	42%	0.417	49%	0.486	S	S	.	.	H	α-helix	trans	-65.8	-42	178.6	-65.6	-24.9	0	0	0	111.1	S32 H33 E34 L39 I40	S32-D36 PolarHBondContact O-N 3.35Å; H33-D36 PolarHBondContact O-N 3.37Å; E34-D36 PolarHBondContact O-N 3.43Å; D36-L39 WeakPolarHBondContact O-CB 3.41Å; D36-L39 PolarHBondContact O-N 3.3Å; D36-I40 VanDerWaalsContact O-CG1 3.26Å; D36-I40 WeakPolarHBondContact O-CG1 3.47Å; D36-I40 PolarHBondContact O-N 2.85Å
37	K	92.8	Very high	93.1	Very high	117 Å²	117	97.4 Å²	97.4	51%	0.509	49%	0.486	S	S	.	.	H	α-helix	trans	-62.6	-46.7	173.3	-76.7	177.1	-174.5	172.8	0	112	H33 E34 L39 I40 I41	H33-K37 WeakPolarHBondContact O-CB 3.43Å; H33-K37 WeakPolarHBondContact O-CG 3.48Å; H33-K37 PolarHBondContact O-N 3.49Å; E34-K37 PolarHBondContact O-N 2.94Å; E34-K37 IonicContact OE2-NZ 2.75Å; K37-L39 VanDerWaalsContact C-N 3.25Å; K37-L39 PolarHBondContact O-N 2.96Å; K37-I40 PolarHBondContact O-N 3.47Å; K37-I41 WeakPolarHBondContact O-CB 3.08Å; K37-I41 VanDerWaalsContact O-CG1 3.24Å; K37-I41 WeakPolarHBondContact O-CG1 3.44Å; K37-I41 PolarHBondContact O-N 2.91Å
38	E	94.6	Very high	93.3	Very high	100 Å²	100	96.3 Å²	96.3	47%	0.467	48%	0.483	S	S	.	.	H	α-helix	trans	-60.6	-38.3	176.1	-80.3	-170.4	174.7	0	0	111.4	E34 K35 R42	E34-E38 WeakPolarHBondContact O-CB 3.44Å; E34-E38 WeakPolarHBondContact O-CG 3.38Å; E34-E38 PolarHBondContact O-N 2.9Å; K35-E38 PolarHBondContact O-N 3.14Å; E38-R42 WeakPolarHBondContact O-CB 3.27Å; E38-R42 PolarHBondContact O-N 3.14Å; E38-R42 PolarHBondContact O-NH1 3.4Å
39	L	93.4	Very high	93.7	Very high	87 Å²	87	96.8 Å²	96.8	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-51.2	174.9	-164.2	73.3	0	0	0	110.7	K35 D36 K37 I41 R42 D43	K35-L39 WeakPolarHBondContact O-CB 3.44Å; K35-L39 PolarHBondContact O-N 2.95Å; D36-L39 WeakPolarHBondContact O-CB 3.41Å; D36-L39 PolarHBondContact O-N 3.3Å; K37-L39 VanDerWaalsContact C-N 3.25Å; K37-L39 PolarHBondContact O-N 2.96Å; L39-I41 VanDerWaalsContact C-N 3.35Å; L39-I41 PolarHBondContact O-N 3.37Å; L39-R42 WeakPolarHBondContact O-CB 3.25Å; L39-R42 PolarHBondContact O-N 3.49Å; L39-R42 VanDerWaalsContact O-N 3.16Å; L39-D43 WeakPolarHBondContact O-CB 3.5Å; L39-D43 PolarHBondContact O-N 3.33Å
40	I	93.3	Very high	93.9	Very high	114 Å²	114	95.3 Å²	95.3	59%	0.585	49%	0.485	S	S	*	.	H	α-helix	trans	-61.5	-41.5	178.7	-66.3	163.2	0	0	0	111.6	D36 K37 D43 A44	D36-I40 VanDerWaalsContact O-CG1 3.26Å; D36-I40 WeakPolarHBondContact O-CG1 3.47Å; D36-I40 PolarHBondContact O-N 2.85Å; K37-I40 PolarHBondContact O-N 3.47Å; I40-D43 PolarHBondContact O-N 3.49Å; I40-A44 VanDerWaalsContact O-CB 3.26Å; I40-A44 WeakPolarHBondContact O-CB 3.14Å; I40-A44 PolarHBondContact O-N 2.83Å
41	I	95	Very high	93.9	Very high	91 Å²	91	95.8 Å²	95.8	47%	0.467	48%	0.484	S	S	.	.	H	α-helix	trans	-66.4	-40.2	177.6	-69.3	166.9	0	0	0	110.5	K37 L39 K45	K37-I41 WeakPolarHBondContact O-CB 3.08Å; K37-I41 VanDerWaalsContact O-CG1 3.24Å; K37-I41 WeakPolarHBondContact O-CG1 3.44Å; K37-I41 PolarHBondContact O-N 2.91Å; L39-I41 VanDerWaalsContact C-N 3.35Å; L39-I41 PolarHBondContact O-N 3.37Å; I41-K45 HydrophobicContact CG2-CD 4.07Å; I41-K45 HydrophobicContact CG2-CG 4.42Å; I41-K45 VanDerWaalsContact O-CB 3.31Å; I41-K45 WeakPolarHBondContact O-CB 3.23Å; I41-K45 VanDerWaalsContact O-CG 3.27Å; I41-K45 WeakPolarHBondContact O-CG 3.29Å; I41-K45 PolarHBondContact O-N 2.89Å
42	R	94.4	Very high	94.1	Very high	126 Å²	126	96.1 Å²	96.1	48%	0.475	49%	0.487	S	S	.	.	H	α-helix	trans	-63.6	-46.2	175.8	-173.9	-177.1	-63.4	97.5	0.9	110.5	E38 L39 K45 Q46	E38-R42 WeakPolarHBondContact O-CB 3.27Å; E38-R42 PolarHBondContact O-N 3.14Å; E38-R42 PolarHBondContact O-NH1 3.4Å; L39-R42 WeakPolarHBondContact O-CB 3.25Å; L39-R42 PolarHBondContact O-N 3.49Å; L39-R42 VanDerWaalsContact O-N 3.16Å; R42-K45 PolarHBondContact O-N 2.8Å; R42-Q46 VanDerWaalsContact O-CB 3.3Å; R42-Q46 WeakPolarHBondContact O-CB 3.4Å; R42-Q46 PolarHBondContact O-N 3.38Å
43	D	94.5	Very high	94.2	Very high	69 Å²	69	96 Å²	96	37%	0.369	49%	0.487	S	S	.	.	H	α-helix	trans	-63.1	-44.4	178.2	-68.3	-8.2	0	0	0	111.1	L39 I40 Q46 Q47	L39-D43 WeakPolarHBondContact O-CB 3.5Å; L39-D43 PolarHBondContact O-N 3.33Å; I40-D43 PolarHBondContact O-N 3.49Å; D43-Q46 PolarHBondContact O-N 3.18Å; D43-Q47 WeakPolarHBondContact O-CB 3.19Å; D43-Q47 VanDerWaalsContact O-CG 3.3Å; D43-Q47 WeakPolarHBondContact O-CG 3.36Å; D43-Q47 PolarHBondContact O-N 2.84Å
44	A	93.7	Very high	94.4	Very high	41 Å²	41	97 Å²	97	34%	0.339	49%	0.492	S	S	.	.	H	α-helix	trans	-64.3	-42.2	176.2	0	0	0	0	0	112.1	I40 Q47 I48	I40-A44 VanDerWaalsContact O-CB 3.26Å; I40-A44 WeakPolarHBondContact O-CB 3.14Å; I40-A44 PolarHBondContact O-N 2.83Å; A44-Q47 PolarHBondContact O-N 2.66Å; A44-I48 WeakPolarHBondContact O-CB 3.19Å; A44-I48 VanDerWaalsContact O-CG1 3.25Å; A44-I48 WeakPolarHBondContact O-CG1 3.38Å; A44-I48 PolarHBondContact O-N 3.29Å
45	K	95.8	Very high	94.4	Very high	145 Å²	145	98.9 Å²	98.9	63%	0.63	50%	0.498	S	S	*	.	H	α-helix	trans	-64.1	-41.4	174.7	-78.7	177.8	180	179.1	0	111.6	I41 R42 I48 S49	I41-K45 HydrophobicContact CG2-CD 4.07Å; I41-K45 HydrophobicContact CG2-CG 4.42Å; I41-K45 VanDerWaalsContact O-CB 3.31Å; I41-K45 WeakPolarHBondContact O-CB 3.23Å; I41-K45 VanDerWaalsContact O-CG 3.27Å; I41-K45 WeakPolarHBondContact O-CG 3.29Å; I41-K45 PolarHBondContact O-N 2.89Å; R42-K45 PolarHBondContact O-N 2.8Å; K45-I48 PolarHBondContact O-N 3.1Å; K45-S49 WeakPolarHBondContact O-CB 3.22Å; K45-S49 PolarHBondContact O-N 3.04Å
46	Q	94.8	Very high	94.5	Very high	118 Å²	118	98.7 Å²	98.7	55%	0.551	50%	0.499	S	S	*	.	H	α-helix	trans	-63.7	-44.7	175.9	-174.6	173	-5.9	0	0	110.5	R42 D43 I48 S49 C50	R42-Q46 VanDerWaalsContact O-CB 3.3Å; R42-Q46 WeakPolarHBondContact O-CB 3.4Å; R42-Q46 PolarHBondContact O-N 3.38Å; D43-Q46 PolarHBondContact O-N 3.18Å; Q46-I48 PolarHBondContact O-N 3.06Å; Q46-S49 PolarHBondContact O-N 3.34Å; Q46-C50 WeakPolarHBondContact O-CB 3.43Å; Q46-C50 PolarHBondContact O-N 3.36Å; Q46-C50 PolarHBondContact O-SG 3.49Å
47	Q	95.2	Very high	94.6	Very high	133 Å²	133	101.7 Å²	101.7	62%	0.621	51%	0.508	S	S	*	.	H	α-helix	trans	-61.3	-43.7	175.2	-75.4	177.2	8.2	0	0	112.4	D43 A44 S49 C50 T51	D43-Q47 WeakPolarHBondContact O-CB 3.19Å; D43-Q47 VanDerWaalsContact O-CG 3.3Å; D43-Q47 WeakPolarHBondContact O-CG 3.36Å; D43-Q47 PolarHBondContact O-N 2.84Å; A44-Q47 PolarHBondContact O-N 2.66Å; Q47-S49 VanDerWaalsContact C-N 3.34Å; Q47-S49 PolarHBondContact O-N 3.28Å; Q47-C50 PolarHBondContact O-N 3.34Å; Q47-T51 VanDerWaalsContact O-CB 3.32Å; Q47-T51 WeakPolarHBondContact O-CB 3.22Å; Q47-T51 PolarHBondContact O-N 2.98Å; Q47-T51 PolarHBondContact O-OG1 3.33Å
48	I	95.7	Very high	94.7	Very high	105 Å²	105	103.3 Å²	103.3	54%	0.538	52%	0.516	S	S	.	.	H	α-helix	trans	-62.8	-42.6	175.7	-70	165.5	0	0	0	110.5	A44 K45 Q46 T51 N52	A44-I48 WeakPolarHBondContact O-CB 3.19Å; A44-I48 VanDerWaalsContact O-CG1 3.25Å; A44-I48 WeakPolarHBondContact O-CG1 3.38Å; A44-I48 PolarHBondContact O-N 3.29Å; K45-I48 PolarHBondContact O-N 3.1Å; Q46-I48 PolarHBondContact O-N 3.06Å; I48-T51 PolarHBondContact O-N 3.2Å; I48-N52 VanDerWaalsContact O-CB 3.3Å; I48-N52 WeakPolarHBondContact O-CB 3.48Å; I48-N52 VanDerWaalsContact O-CG 3.31Å; I48-N52 PolarHBondContact O-N 3.25Å; I48-N52 PolarHBondContact O-ND2 3.13Å
49	S	95.6	Very high	94.8	Very high	77 Å²	77	101.1 Å²	101.1	54%	0.538	51%	0.511	S	S	.	.	H	α-helix	trans	-64.8	-44.2	177	-178.8	0	0	0	0	112	K45 Q46 Q47 N52 S53	K45-S49 WeakPolarHBondContact O-CB 3.22Å; K45-S49 PolarHBondContact O-N 3.04Å; Q46-S49 PolarHBondContact O-N 3.34Å; Q47-S49 VanDerWaalsContact C-N 3.34Å; Q47-S49 PolarHBondContact O-N 3.28Å; S49-N52 PolarHBondContact O-N 2.87Å; S49-S53 WeakPolarHBondContact O-CB 3.32Å; S49-S53 PolarHBondContact O-N 3.39Å
50	C	93.3	Very high	94.9	Very high	63 Å²	63	101 Å²	101	43%	0.426	51%	0.511	S	S	.	.	H	α-helix	trans	-60.5	-48	174.3	-71.9	0	0	0	0	111	Q46 Q47 N52 S53 E54	Q46-C50 WeakPolarHBondContact O-CB 3.43Å; Q46-C50 PolarHBondContact O-N 3.36Å; Q46-C50 PolarHBondContact O-SG 3.49Å; Q47-C50 PolarHBondContact O-N 3.34Å; C50-N52 PolarHBondContact O-N 3.46Å; C50-S53 PolarHBondContact O-N 2.85Å; C50-E54 WeakPolarHBondContact O-CG 3.4Å; C50-E54 PolarHBondContact O-N 3.26Å
51	T	94.4	Very high	95	Very high	82 Å²	82	99.9 Å²	99.9	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-63.1	-40.1	178.9	-55.3	0	0	0	0	111.9	Q47 I48 E54 K55	Q47-T51 VanDerWaalsContact O-CB 3.32Å; Q47-T51 WeakPolarHBondContact O-CB 3.22Å; Q47-T51 PolarHBondContact O-N 2.98Å; Q47-T51 PolarHBondContact O-OG1 3.33Å; I48-T51 PolarHBondContact O-N 3.2Å; T51-E54 PolarHBondContact O-N 2.92Å; T51-K55 WeakPolarHBondContact O-CB 3.22Å; T51-K55 PolarHBondContact O-N 3.11Å
52	N	95.6	Very high	95	Very high	90 Å²	90	99.9 Å²	99.9	48%	0.481	50%	0.501	S	S	.	.	H	α-helix	trans	-67	-40.7	176.2	-80.2	-22.4	0	0	0	111.8	I48 S49 C50 E54 K55 E56	I48-N52 VanDerWaalsContact O-CB 3.3Å; I48-N52 WeakPolarHBondContact O-CB 3.48Å; I48-N52 VanDerWaalsContact O-CG 3.31Å; I48-N52 PolarHBondContact O-N 3.25Å; I48-N52 PolarHBondContact O-ND2 3.13Å; S49-N52 PolarHBondContact O-N 2.87Å; C50-N52 PolarHBondContact O-N 3.46Å; N52-E54 VanDerWaalsContact C-N 3.31Å; N52-E54 PolarHBondContact O-N 2.88Å; N52-K55 PolarHBondContact O-N 2.79Å; N52-E56 WeakPolarHBondContact O-CB 3.47Å; N52-E56 PolarHBondContact O-N 3.42Å
53	S	94.7	Very high	95.1	Very high	49 Å²	49	99.2 Å²	99.2	34%	0.343	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-40	174	-174.9	0	0	0	0	111.5	S49 C50 K57	S49-S53 WeakPolarHBondContact O-CB 3.32Å; S49-S53 PolarHBondContact O-N 3.39Å; C50-S53 PolarHBondContact O-N 2.85Å; S53-K57 VanDerWaalsContact O-CG 3.27Å; S53-K57 WeakPolarHBondContact O-CG 3.5Å; S53-K57 PolarHBondContact O-N 3.49Å
54	E	95.1	Very high	95.2	Very high	122 Å²	122	99.7 Å²	99.7	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-65.3	-43.8	174.3	-72.6	176.3	-175.3	0	0	112.1	C50 T51 N52 E56 K57 K58	C50-E54 WeakPolarHBondContact O-CG 3.4Å; C50-E54 PolarHBondContact O-N 3.26Å; T51-E54 PolarHBondContact O-N 2.92Å; N52-E54 VanDerWaalsContact C-N 3.31Å; N52-E54 PolarHBondContact O-N 2.88Å; E54-E56 PolarHBondContact O-N 3.38Å; E54-K57 PolarHBondContact O-N 3.47Å; E54-K58 WeakPolarHBondContact O-CG 3.45Å; E54-K58 PolarHBondContact O-N 2.82Å
55	K	94.2	Very high	95.2	Very high	137 Å²	137	101.2 Å²	101.2	60%	0.596	50%	0.504	S	S	*	.	H	α-helix	trans	-59.5	-45.4	175.8	-177.3	-175.4	174.1	-176.1	0	111.5	T51 N52 K58 C59	T51-K55 WeakPolarHBondContact O-CB 3.22Å; T51-K55 PolarHBondContact O-N 3.11Å; N52-K55 PolarHBondContact O-N 2.79Å; K55-K58 PolarHBondContact O-N 3.41Å; K55-C59 PolarHBondContact O-N 3.45Å; K55-C59 PolarHBondContact O-SG 2.82Å; K55-C59 VanDerWaalsContact O-SG 3.4Å
56	E	96.4	Very high	95.2	Very high	128 Å²	128	99.6 Å²	99.6	60%	0.598	50%	0.499	S	S	*	.	H	α-helix	trans	-61.9	-46.7	178.6	-171.3	169.1	-159.3	0	0	111.3	N52 E54 K58 C59 D60	N52-E56 WeakPolarHBondContact O-CB 3.47Å; N52-E56 PolarHBondContact O-N 3.42Å; E54-E56 PolarHBondContact O-N 3.38Å; E56-K58 VanDerWaalsContact C-N 3.28Å; E56-K58 PolarHBondContact O-N 2.91Å; E56-C59 WeakPolarHBondContact O-CB 3.16Å; E56-C59 PolarHBondContact O-N 2.89Å; E56-C59 VanDerWaalsContact O-N 3.1Å; E56-D60 PolarHBondContact O-N 3.1Å
57	K	95.1	Very high	95.1	Very high	141 Å²	141	101.1 Å²	101.1	61%	0.613	50%	0.499	S	S	*	.	H	α-helix	trans	-56.9	-40.3	173.4	-71.2	170.8	-175.2	176.4	0	112.5	S53 E54 K61	S53-K57 VanDerWaalsContact O-CG 3.27Å; S53-K57 WeakPolarHBondContact O-CG 3.5Å; S53-K57 PolarHBondContact O-N 3.49Å; E54-K57 PolarHBondContact O-N 3.47Å; K57-K61 WeakPolarHBondContact O-CB 3.12Å; K57-K61 PolarHBondContact O-N 3.01Å
58	K	94.7	Very high	95.1	Very high	152 Å²	152	98.6 Å²	98.6	66%	0.661	49%	0.488	S	S	*	.	H	α-helix	trans	-69.2	-40.4	175.9	-67.4	-62.5	-174.2	-178	0	111.9	E54 K55 E56 D60 K61 I62	E54-K58 WeakPolarHBondContact O-CG 3.45Å; E54-K58 PolarHBondContact O-N 2.82Å; K55-K58 PolarHBondContact O-N 3.41Å; E56-K58 VanDerWaalsContact C-N 3.28Å; E56-K58 PolarHBondContact O-N 2.91Å; K58-D60 VanDerWaalsContact C-N 3.35Å; K58-K61 PolarHBondContact O-N 2.96Å; K58-I62 VanDerWaalsContact O-CG1 3.26Å; K58-I62 WeakPolarHBondContact O-CG1 3.49Å; K58-I62 PolarHBondContact O-N 2.91Å
59	C	95.9	Very high	95	Very high	54 Å²	54	98.1 Å²	98.1	37%	0.365	49%	0.485	S	S	.	.	H	α-helix	trans	-61.6	-41.7	174.9	-75.4	0	0	0	0	112	K55 E56 I62 K63	K55-C59 PolarHBondContact O-N 3.45Å; K55-C59 PolarHBondContact O-SG 2.82Å; K55-C59 VanDerWaalsContact O-SG 3.4Å; E56-C59 WeakPolarHBondContact O-CB 3.16Å; E56-C59 PolarHBondContact O-N 2.89Å; E56-C59 VanDerWaalsContact O-N 3.1Å; C59-I62 PolarHBondContact O-N 3.41Å; C59-K63 WeakPolarHBondContact O-CG 3.29Å; C59-K63 PolarHBondContact O-N 3.26Å
60	D	95.8	Very high	94.9	Very high	85 Å²	85	101.1 Å²	101.1	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-68.5	-38.2	176.5	-70.7	-21.1	0	0	0	112	E56 K58 I62 K63 E64	E56-D60 PolarHBondContact O-N 3.1Å; K58-D60 VanDerWaalsContact C-N 3.35Å; D60-I62 VanDerWaalsContact C-N 3.33Å; D60-I62 PolarHBondContact O-N 3.29Å; D60-K63 PolarHBondContact O-N 3.01Å; D60-K63 IonicContact OD1-NZ 3.64Å; D60-E64 PolarHBondContact O-N 3.4Å
61	K	95.5	Very high	94.9	Very high	90 Å²	90	103.2 Å²	103.2	39%	0.391	50%	0.496	S	S	.	.	H	α-helix	trans	-64.5	-38.3	173.5	-171.2	65	-159.9	162.9	0	112	K57 K58 E64 L65 E68	K57-K61 WeakPolarHBondContact O-CB 3.12Å; K57-K61 PolarHBondContact O-N 3.01Å; K58-K61 PolarHBondContact O-N 2.96Å; K61-E64 WeakPolarHBondContact CD-OE2 3.36Å; K61-E64 IonicContact NZ-OE2 2.7Å; K61-E64 PolarHBondContact NZ-OE2 3.34Å; K61-E64 PolarHBondContact O-N 2.83Å; K61-L65 HydrophobicContact CG-CD1 4.33Å; K61-L65 VanDerWaalsContact O-CG 3.29Å; K61-L65 WeakPolarHBondContact O-CG 3.34Å; K61-L65 PolarHBondContact O-N 3.47Å; K61-E68 IonicContact NZ-OE1 2.94Å
62	I	95.6	Very high	94.8	Very high	90 Å²	90	104 Å²	104	46%	0.462	50%	0.497	S	S	.	.	H	α-helix	trans	-61.1	-45.9	174.3	-71.8	164.4	0	0	0	110.4	K58 C59 D60 E64 L65 E66	K58-I62 VanDerWaalsContact O-CG1 3.26Å; K58-I62 WeakPolarHBondContact O-CG1 3.49Å; K58-I62 PolarHBondContact O-N 2.91Å; C59-I62 PolarHBondContact O-N 3.41Å; D60-I62 VanDerWaalsContact C-N 3.33Å; D60-I62 PolarHBondContact O-N 3.29Å; I62-E64 VanDerWaalsContact C-N 3.3Å; I62-E64 PolarHBondContact O-N 3.3Å; I62-L65 PolarHBondContact O-N 3.19Å; I62-E66 HydrophobicContact CG2-CG 4.38Å; I62-E66 WeakPolarHBondContact O-CG 3.43Å; I62-E66 PolarHBondContact O-N 2.89Å
63	K	96	Very high	94.8	Very high	112 Å²	112	103.4 Å²	103.4	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-64.1	-32.7	176.8	-68.9	172	-172.3	164.5	0	113.6	C59 D60 R67	C59-K63 WeakPolarHBondContact O-CG 3.29Å; C59-K63 PolarHBondContact O-N 3.26Å; D60-K63 PolarHBondContact O-N 3.01Å; D60-K63 IonicContact OD1-NZ 3.64Å; K63-R67 WeakPolarHBondContact O-CG 3.19Å; K63-R67 PolarHBondContact O-N 3.47Å; K63-R67 PolarHBondContact O-NE 2.8Å
64	E	95.3	Very high	94.7	Very high	80 Å²	80	108 Å²	108	37%	0.374	51%	0.509	S	S	.	.	H	α-helix	trans	-67.5	-46.2	173.5	-168.4	176.7	-141.2	0	0	110.7	D60 K61 I62 E66 R67 E68	D60-E64 PolarHBondContact O-N 3.4Å; K61-E64 WeakPolarHBondContact CD-OE2 3.36Å; K61-E64 IonicContact NZ-OE2 2.7Å; K61-E64 PolarHBondContact NZ-OE2 3.34Å; K61-E64 PolarHBondContact O-N 2.83Å; I62-E64 VanDerWaalsContact C-N 3.3Å; I62-E64 PolarHBondContact O-N 3.3Å; E64-E66 VanDerWaalsContact C-N 3.35Å; E64-E66 PolarHBondContact O-N 3Å; E64-R67 WeakPolarHBondContact O-CB 3.45Å; E64-R67 PolarHBondContact O-N 3.15Å; E64-E68 WeakPolarHBondContact O-CG 3.29Å; E64-E68 PolarHBondContact O-N 3.38Å
65	L	94.4	Very high	94.6	Very high	73 Å²	73	109.7 Å²	109.7	38%	0.382	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-38.1	175.7	-68	172.7	0	0	0	112.5	K61 I62 R67 E68 I69	K61-L65 HydrophobicContact CG-CD1 4.33Å; K61-L65 VanDerWaalsContact O-CG 3.29Å; K61-L65 WeakPolarHBondContact O-CG 3.34Å; K61-L65 PolarHBondContact O-N 3.47Å; I62-L65 PolarHBondContact O-N 3.19Å; L65-R67 VanDerWaalsContact C-N 3.34Å; L65-R67 PolarHBondContact O-N 3.13Å; L65-E68 PolarHBondContact O-N 2.91Å; L65-I69 WeakPolarHBondContact O-CB 3.46Å; L65-I69 VanDerWaalsContact O-CG1 3.23Å; L65-I69 WeakPolarHBondContact O-CG1 3.29Å; L65-I69 PolarHBondContact O-N 2.8Å
66	E	95.7	Very high	94.6	Very high	110 Å²	110	108.8 Å²	108.8	51%	0.514	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-40.5	174.1	-74.8	171.5	170.2	0	0	111.7	I62 E64 I69 M70	I62-E66 HydrophobicContact CG2-CG 4.38Å; I62-E66 WeakPolarHBondContact O-CG 3.43Å; I62-E66 PolarHBondContact O-N 2.89Å; E64-E66 VanDerWaalsContact C-N 3.35Å; E64-E66 PolarHBondContact O-N 3Å; E66-I69 PolarHBondContact O-N 2.92Å; E66-M70 WeakPolarHBondContact O-CG 3.37Å; E66-M70 PolarHBondContact O-N 2.83Å
67	R	94.1	Very high	94.5	Very high	150 Å²	150	106.4 Å²	106.4	57%	0.566	51%	0.505	S	S	*	.	H	α-helix	trans	-66.6	-41.9	174	-76.4	-178.1	-72	151.2	-2	112.1	K63 E64 L65 I69 M70 Q71	K63-R67 WeakPolarHBondContact O-CG 3.19Å; K63-R67 PolarHBondContact O-N 3.47Å; K63-R67 PolarHBondContact O-NE 2.8Å; E64-R67 WeakPolarHBondContact O-CB 3.45Å; E64-R67 PolarHBondContact O-N 3.15Å; L65-R67 VanDerWaalsContact C-N 3.34Å; L65-R67 PolarHBondContact O-N 3.13Å; R67-I69 VanDerWaalsContact C-N 3.32Å; R67-I69 PolarHBondContact O-N 3.28Å; R67-M70 PolarHBondContact O-N 2.69Å; R67-Q71 WeakPolarHBondContact O-CG 3.35Å; R67-Q71 PolarHBondContact O-N 3.14Å
68	E	93.5	Very high	94.5	Very high	81 Å²	81	103.3 Å²	103.3	38%	0.379	49%	0.493	S	S	.	.	H	α-helix	trans	-60.1	-42.7	174	-72.3	173	-157.6	0	0	110.8	K61 E64 L65 Q71 L72	K61-E68 IonicContact NZ-OE1 2.94Å; E64-E68 WeakPolarHBondContact O-CG 3.29Å; E64-E68 PolarHBondContact O-N 3.38Å; L65-E68 PolarHBondContact O-N 2.91Å; E68-Q71 PolarHBondContact O-N 3.09Å; E68-L72 VanDerWaalsContact O-CG 3.27Å; E68-L72 WeakPolarHBondContact O-CG 3.32Å; E68-L72 PolarHBondContact O-N 3.15Å
69	I	94.9	Very high	94.5	Very high	95 Å²	95	104.2 Å²	104.2	49%	0.487	49%	0.492	S	S	.	.	H	α-helix	trans	-63.4	-44	176.4	-70.4	165.2	0	0	0	111.4	L65 E66 R67 Q71 L72 D73	L65-I69 WeakPolarHBondContact O-CB 3.46Å; L65-I69 VanDerWaalsContact O-CG1 3.23Å; L65-I69 WeakPolarHBondContact O-CG1 3.29Å; L65-I69 PolarHBondContact O-N 2.8Å; E66-I69 PolarHBondContact O-N 2.92Å; R67-I69 VanDerWaalsContact C-N 3.32Å; R67-I69 PolarHBondContact O-N 3.28Å; I69-Q71 VanDerWaalsContact C-N 3.34Å; I69-Q71 PolarHBondContact O-N 3.39Å; I69-L72 WeakPolarHBondContact O-CB 3.27Å; I69-L72 PolarHBondContact O-N 3.43Å; I69-L72 VanDerWaalsContact O-N 3.16Å; I69-D73 PolarHBondContact O-N 3.49Å
70	M	93.1	Very high	94.4	Very high	140 Å²	140	106.6 Å²	106.6	69%	0.69	50%	0.5	S	S	*	.	H	α-helix	trans	-60.7	-43.1	176	-74.5	-176.6	68.8	0	0	112.2	E66 R67 L72 D73 E74	E66-M70 WeakPolarHBondContact O-CG 3.37Å; E66-M70 PolarHBondContact O-N 2.83Å; R67-M70 PolarHBondContact O-N 2.69Å; M70-L72 VanDerWaalsContact C-N 3.32Å; M70-L72 PolarHBondContact O-N 3.43Å; M70-D73 PolarHBondContact O-N 3.25Å; M70-E74 PolarHBondContact O-N 3.18Å; M70-E74 VanDerWaalsContact O-N 3.08Å
71	Q	93.1	Very high	94.4	Very high	107 Å²	107	109.1 Å²	109.1	50%	0.5	50%	0.503	S	S	.	.	H	α-helix	trans	-62.5	-41.3	174.5	-72	176.5	1.2	0	0	111.1	R67 E68 I69 D73 E74 Y75	R67-Q71 WeakPolarHBondContact O-CG 3.35Å; R67-Q71 PolarHBondContact O-N 3.14Å; E68-Q71 PolarHBondContact O-N 3.09Å; I69-Q71 VanDerWaalsContact C-N 3.34Å; I69-Q71 PolarHBondContact O-N 3.39Å; Q71-D73 VanDerWaalsContact C-N 3.29Å; Q71-D73 PolarHBondContact O-N 3.4Å; Q71-E74 PolarHBondContact O-N 3.14Å; Q71-Y75 HydrophobicContact CB-CD2 4.39Å; Q71-Y75 HydrophobicContact CB-CE2 4.26Å; Q71-Y75 WeakPolarHBondContact O-CD2 3.46Å; Q71-Y75 PolarHBondContact O-N 3.31Å
72	L	93.3	Very high	94.4	Very high	99 Å²	99	107.1 Å²	107.1	52%	0.518	50%	0.499	S	S	.	.	H	α-helix	trans	-61.4	-35.2	175.8	-72.7	172.9	0	0	0	112.6	E68 I69 M70 K76	E68-L72 VanDerWaalsContact O-CG 3.27Å; E68-L72 WeakPolarHBondContact O-CG 3.32Å; E68-L72 PolarHBondContact O-N 3.15Å; I69-L72 WeakPolarHBondContact O-CB 3.27Å; I69-L72 PolarHBondContact O-N 3.43Å; I69-L72 VanDerWaalsContact O-N 3.16Å; M70-L72 VanDerWaalsContact C-N 3.32Å; M70-L72 PolarHBondContact O-N 3.43Å; L72-K76 VanDerWaalsContact O-CG 3.25Å; L72-K76 WeakPolarHBondContact O-CG 3.26Å; L72-K76 PolarHBondContact O-N 3.34Å
73	D	93.7	Very high	94.5	Very high	76 Å²	76	105.8 Å²	105.8	41%	0.406	49%	0.493	S	S	.	.	H	α-helix	trans	-72.7	-33.6	175.6	-73.2	-21.9	0	0	0	112.9	I69 M70 Q71 K76 S77	I69-D73 PolarHBondContact O-N 3.49Å; M70-D73 PolarHBondContact O-N 3.25Å; Q71-D73 VanDerWaalsContact C-N 3.29Å; Q71-D73 PolarHBondContact O-N 3.4Å; D73-K76 PolarHBondContact O-N 3.38Å; D73-K76 IonicContact OD1-NZ 3.25Å; D73-K76 PolarHBondContact OD1-NZ 3.31Å; D73-S77 PolarHBondContact O-N 3.2Å; D73-S77 PolarHBondContact O-OG 2.74Å
74	E	94	Very high	94.5	Very high	145 Å²	145	104.1 Å²	104.1	68%	0.678	49%	0.489	S	S	*	.	H	α-helix	trans	-65.5	-46.1	169.8	-171.3	171.8	-165.5	0	0	111	M70 Q71 K76 S77 E78	M70-E74 PolarHBondContact O-N 3.18Å; M70-E74 VanDerWaalsContact O-N 3.08Å; Q71-E74 PolarHBondContact O-N 3.14Å; E74-K76 VanDerWaalsContact C-N 3.29Å; E74-K76 PolarHBondContact O-N 3.31Å; E74-S77 PolarHBondContact O-N 2.79Å; E74-S77 VanDerWaalsContact O-N 3.09Å; E74-E78 PolarHBondContact O-N 3.4Å
75	Y	92.7	Very high	94.5	Very high	158 Å²	158	104.6 Å²	104.6	62%	0.62	49%	0.491	S	S	*	.	H	α-helix	trans	-59.9	-36.5	173.4	-77.9	-64.2	0	0	0	112.6	Q71 R79	Q71-Y75 HydrophobicContact CB-CD2 4.39Å; Q71-Y75 HydrophobicContact CB-CE2 4.26Å; Q71-Y75 WeakPolarHBondContact O-CD2 3.46Å; Q71-Y75 PolarHBondContact O-N 3.31Å; Y75-R79 WeakPolarHBondContact O-CB 3.19Å; Y75-R79 PolarHBondContact O-N 3.5Å
76	K	93.9	Very high	94.5	Very high	118 Å²	118	104.4 Å²	104.4	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-43.1	173.3	-75.2	170.4	-160.1	160.7	0	111.6	L72 D73 E74 R79 I80	L72-K76 VanDerWaalsContact O-CG 3.25Å; L72-K76 WeakPolarHBondContact O-CG 3.26Å; L72-K76 PolarHBondContact O-N 3.34Å; D73-K76 PolarHBondContact O-N 3.38Å; D73-K76 IonicContact OD1-NZ 3.25Å; D73-K76 PolarHBondContact OD1-NZ 3.31Å; E74-K76 VanDerWaalsContact C-N 3.29Å; E74-K76 PolarHBondContact O-N 3.31Å; K76-R79 PolarHBondContact O-N 2.82Å; K76-I80 VanDerWaalsContact O-CG1 3.27Å; K76-I80 WeakPolarHBondContact O-CG1 3.14Å; K76-I80 PolarHBondContact O-N 3.43Å
77	S	94.2	Very high	94.5	Very high	79 Å²	79	104.8 Å²	104.8	55%	0.552	49%	0.49	S	S	*	.	H	α-helix	trans	-65.6	-44.5	179.4	-58.2	0	0	0	0	111.3	D73 E74 I80 R81	D73-S77 PolarHBondContact O-N 3.2Å; D73-S77 PolarHBondContact O-OG 2.74Å; E74-S77 PolarHBondContact O-N 2.79Å; E74-S77 VanDerWaalsContact O-N 3.09Å; S77-I80 PolarHBondContact O-N 3.06Å; S77-R81 PolarHBondContact O-N 2.96Å
78	E	95.5	Very high	94.5	Very high	76 Å²	76	103.4 Å²	103.4	36%	0.355	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-42.4	175.4	-170.9	56.9	-144.1	0	0	111.2	E74 I80 R81 T82	E74-E78 PolarHBondContact O-N 3.4Å; E78-I80 VanDerWaalsContact C-N 3.32Å; E78-I80 PolarHBondContact O-N 3.17Å; E78-R81 WeakPolarHBondContact O-CA 3.49Å; E78-R81 WeakPolarHBondContact O-CB 3.36Å; E78-R81 PolarHBondContact O-N 3.13Å; E78-R81 VanDerWaalsContact O-N 3.09Å; E78-R81 IonicContact OE1-CZ 3.22Å; E78-R81 VanDerWaalsContact OE1-CZ 3.22Å; E78-R81 IonicContact OE1-NE 2.95Å; E78-R81 PolarHBondContact OE1-NE 2.97Å; E78-R81 IonicContact OE1-NH2 2.69Å; E78-R81 PolarHBondContact OE1-NH2 2.87Å; E78-R81 IonicContact OE2-CZ 3.58Å; E78-R81 IonicContact OE2-NE 3.25Å; E78-R81 PolarHBondContact OE2-NE 3.24Å; E78-R81 IonicContact OE2-NH2 3.46Å; E78-R81 PolarHBondContact OE2-NH2 3.43Å; E78-T82 HydrophobicContact CG-CG2 4.45Å; E78-T82 WeakPolarHBondContact O-CG2 3.33Å; E78-T82 PolarHBondContact O-N 2.77Å; E78-T82 PolarHBondContact O-OG1 3.48Å
79	R	94.5	Very high	94.6	Very high	171 Å²	171	104.5 Å²	104.5	65%	0.645	50%	0.498	S	S	*	.	H	α-helix	trans	-58.6	-42.3	174.9	-177.1	-179.9	177.1	-165.2	2.6	112.1	Y75 K76 R81 T82 D83	Y75-R79 WeakPolarHBondContact O-CB 3.19Å; Y75-R79 PolarHBondContact O-N 3.5Å; K76-R79 PolarHBondContact O-N 2.82Å; R79-R81 VanDerWaalsContact C-N 3.33Å; R79-T82 WeakPolarHBondContact CA-OG1 3.31Å; R79-T82 PolarHBondContact O-OG1 2.84Å; R79-D83 WeakPolarHBondContact O-CB 3.45Å; R79-D83 VanDerWaalsContact O-CG 3.22Å; R79-D83 PolarHBondContact O-N 2.95Å
80	I	94.5	Very high	94.6	Very high	103 Å²	103	108.1 Å²	108.1	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-64.2	-41	176	-68.9	163.8	0	0	0	110.6	K76 S77 E78 D83 N84	K76-I80 VanDerWaalsContact O-CG1 3.27Å; K76-I80 WeakPolarHBondContact O-CG1 3.14Å; K76-I80 PolarHBondContact O-N 3.43Å; S77-I80 PolarHBondContact O-N 3.06Å; E78-I80 VanDerWaalsContact C-N 3.32Å; E78-I80 PolarHBondContact O-N 3.17Å; I80-D83 PolarHBondContact O-N 3.37Å; I80-N84 WeakPolarHBondContact O-CB 3.3Å; I80-N84 PolarHBondContact O-N 3.18Å; I80-N84 PolarHBondContact O-ND2 2.91Å
81	R	96.2	Very high	94.7	Very high	138 Å²	138	106.4 Å²	106.4	52%	0.521	50%	0.499	S	S	.	.	H	α-helix	trans	-61	-53.3	176	-172.8	178.1	79.7	140	2.9	111.2	S77 E78 R79 D83 N84 E85	S77-R81 PolarHBondContact O-N 2.96Å; E78-R81 WeakPolarHBondContact O-CA 3.49Å; E78-R81 WeakPolarHBondContact O-CB 3.36Å; E78-R81 PolarHBondContact O-N 3.13Å; E78-R81 VanDerWaalsContact O-N 3.09Å; E78-R81 IonicContact OE1-CZ 3.22Å; E78-R81 VanDerWaalsContact OE1-CZ 3.22Å; E78-R81 IonicContact OE1-NE 2.95Å; E78-R81 PolarHBondContact OE1-NE 2.97Å; E78-R81 IonicContact OE1-NH2 2.69Å; E78-R81 PolarHBondContact OE1-NH2 2.87Å; E78-R81 IonicContact OE2-CZ 3.58Å; E78-R81 IonicContact OE2-NE 3.25Å; E78-R81 PolarHBondContact OE2-NE 3.24Å; E78-R81 IonicContact OE2-NH2 3.46Å; E78-R81 PolarHBondContact OE2-NH2 3.43Å; R79-R81 VanDerWaalsContact C-N 3.33Å; R81-D83 VanDerWaalsContact C-N 3.32Å; R81-D83 PolarHBondContact O-N 3.33Å; R81-N84 PolarHBondContact O-N 2.86Å; R81-N84 VanDerWaalsContact O-N 3.15Å; R81-E85 PolarHBondContact O-N 3.28Å
82	T	95	Very high	94.9	Very high	49 Å²	49	106.6 Å²	106.6	30%	0.301	50%	0.5	S	S	.	.	H	α-helix	trans	-63.7	-37.4	178.9	59.1	0	0	0	0	111.9	E78 R79 N84 E85 I86	E78-T82 HydrophobicContact CG-CG2 4.45Å; E78-T82 WeakPolarHBondContact O-CG2 3.33Å; E78-T82 PolarHBondContact O-N 2.77Å; E78-T82 PolarHBondContact O-OG1 3.48Å; R79-T82 WeakPolarHBondContact CA-OG1 3.31Å; R79-T82 PolarHBondContact O-OG1 2.84Å; T82-N84 VanDerWaalsContact C-N 3.31Å; T82-N84 PolarHBondContact O-N 3.32Å; T82-E85 PolarHBondContact O-N 3.37Å; T82-I86 WeakPolarHBondContact O-CB 3.26Å; T82-I86 WeakPolarHBondContact O-CD1 3.39Å; T82-I86 WeakPolarHBondContact O-CG1 3.3Å; T82-I86 PolarHBondContact O-N 2.96Å
83	D	96.2	Very high	95	Very high	62 Å²	62	106.2 Å²	106.2	33%	0.332	50%	0.502	S	S	.	.	H	α-helix	trans	-64.7	-35.8	176	-82.9	-15.5	0	0	0	111.5	R79 I80 R81 K87	R79-D83 WeakPolarHBondContact O-CB 3.45Å; R79-D83 VanDerWaalsContact O-CG 3.22Å; R79-D83 PolarHBondContact O-N 2.95Å; I80-D83 PolarHBondContact O-N 3.37Å; R81-D83 VanDerWaalsContact C-N 3.32Å; R81-D83 PolarHBondContact O-N 3.33Å; D83-K87 WeakPolarHBondContact O-CB 3.44Å; D83-K87 WeakPolarHBondContact O-CG 3.19Å; D83-K87 PolarHBondContact O-N 2.84Å
84	N	96	Very high	95	Very high	77 Å²	77	107.9 Å²	107.9	41%	0.412	51%	0.507	S	S	.	.	H	α-helix	trans	-71.1	-41.4	175.6	-71.4	-23.3	0	0	0	112	I80 R81 T82 K87 Q88	I80-N84 WeakPolarHBondContact O-CB 3.3Å; I80-N84 PolarHBondContact O-N 3.18Å; I80-N84 PolarHBondContact O-ND2 2.91Å; R81-N84 PolarHBondContact O-N 2.86Å; R81-N84 VanDerWaalsContact O-N 3.15Å; T82-N84 VanDerWaalsContact C-N 3.31Å; T82-N84 PolarHBondContact O-N 3.32Å; N84-K87 PolarHBondContact O-N 3.47Å; N84-Q88 WeakPolarHBondContact O-CG 3.4Å; N84-Q88 PolarHBondContact O-N 2.84Å
85	E	95.3	Very high	95	Very high	89 Å²	89	106.2 Å²	106.2	42%	0.416	50%	0.503	S	S	.	.	H	α-helix	trans	-62.9	-43.4	173.7	-69.9	172.3	-170.8	0	0	111.2	R81 T82 K87 Q88 L89	R81-E85 PolarHBondContact O-N 3.28Å; T82-E85 PolarHBondContact O-N 3.37Å; E85-K87 VanDerWaalsContact C-N 3.31Å; E85-K87 PolarHBondContact O-N 3.41Å; E85-Q88 PolarHBondContact O-N 3.43Å; E85-L89 WeakPolarHBondContact O-CG 3.32Å; E85-L89 PolarHBondContact O-N 2.87Å
86	I	95	Very high	95.1	Very high	70 Å²	70	104.6 Å²	104.6	36%	0.359	50%	0.501	S	S	.	.	H	α-helix	trans	-61	-40.9	174.4	-72.2	166.9	0	0	0	110.9	T82 R90	T82-I86 WeakPolarHBondContact O-CB 3.26Å; T82-I86 WeakPolarHBondContact O-CD1 3.39Å; T82-I86 WeakPolarHBondContact O-CG1 3.3Å; T82-I86 PolarHBondContact O-N 2.96Å; I86-R90 HydrophobicContact CG2-CG 4.42Å; I86-R90 WeakPolarHBondContact O-CB 3.33Å; I86-R90 WeakPolarHBondContact O-CG 3.39Å; I86-R90 PolarHBondContact O-N 2.78Å
87	K	95.4	Very high	95.1	Very high	117 Å²	117	104.2 Å²	104.2	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-46.2	175.5	-77.2	169.1	-172.4	171.8	0	111.7	D83 N84 E85 L89 R90 D91	D83-K87 WeakPolarHBondContact O-CB 3.44Å; D83-K87 WeakPolarHBondContact O-CG 3.19Å; D83-K87 PolarHBondContact O-N 2.84Å; N84-K87 PolarHBondContact O-N 3.47Å; E85-K87 VanDerWaalsContact C-N 3.31Å; E85-K87 PolarHBondContact O-N 3.41Å; K87-L89 PolarHBondContact O-N 3.33Å; K87-R90 WeakPolarHBondContact O-CB 3.34Å; K87-R90 PolarHBondContact O-N 2.87Å; K87-D91 PolarHBondContact O-N 2.91Å
88	Q	95.2	Very high	95	Very high	122 Å²	122	103 Å²	103	57%	0.57	49%	0.49	S	S	*	.	H	α-helix	trans	-58.9	-46.5	176.9	-73.3	176.1	-6.6	0	0	111.6	N84 E85 R90 D91 E92	N84-Q88 WeakPolarHBondContact O-CG 3.4Å; N84-Q88 PolarHBondContact O-N 2.84Å; E85-Q88 PolarHBondContact O-N 3.43Å; Q88-R90 VanDerWaalsContact C-N 3.33Å; Q88-R90 PolarHBondContact O-N 3.32Å; Q88-D91 PolarHBondContact O-N 3.29Å; Q88-E92 WeakPolarHBondContact O-CG 3.45Å; Q88-E92 PolarHBondContact O-N 3.33Å
89	L	95.2	Very high	94.9	Very high	104 Å²	104	104.7 Å²	104.7	55%	0.545	50%	0.501	S	S	.	.	H	α-helix	trans	-63.5	-37.4	176.3	-70.7	172.8	0	0	0	112.5	E85 K87 E92 V93	E85-L89 WeakPolarHBondContact O-CG 3.32Å; E85-L89 PolarHBondContact O-N 2.87Å; K87-L89 PolarHBondContact O-N 3.33Å; L89-E92 PolarHBondContact O-N 2.89Å; L89-V93 WeakPolarHBondContact O-CB 3.44Å; L89-V93 WeakPolarHBondContact O-CG2 3.47Å; L89-V93 PolarHBondContact O-N 3.39Å
90	R	94.6	Very high	95	Very high	171 Å²	171	101.1 Å²	101.1	65%	0.645	49%	0.493	S	S	*	.	H	α-helix	trans	-63.8	-42.1	173.9	-76.8	174.3	-172.4	-170.9	5.2	111.7	I86 K87 Q88 V93 Q94	I86-R90 HydrophobicContact CG2-CG 4.42Å; I86-R90 WeakPolarHBondContact O-CB 3.33Å; I86-R90 WeakPolarHBondContact O-CG 3.39Å; I86-R90 PolarHBondContact O-N 2.78Å; K87-R90 WeakPolarHBondContact O-CB 3.34Å; K87-R90 PolarHBondContact O-N 2.87Å; Q88-R90 VanDerWaalsContact C-N 3.33Å; Q88-R90 PolarHBondContact O-N 3.32Å; R90-V93 PolarHBondContact O-N 3.28Å; R90-Q94 VanDerWaalsContact O-CB 3.26Å; R90-Q94 WeakPolarHBondContact O-CB 3.31Å; R90-Q94 PolarHBondContact O-N 3.43Å
91	D	95.4	Very high	95	Very high	103 Å²	103	100.4 Å²	100.4	55%	0.551	49%	0.488	S	S	*	.	H	α-helix	trans	-67.2	-39.9	178.4	-68.5	-18.5	0	0	0	111.2	K87 Q88 Q94 N95	K87-D91 PolarHBondContact O-N 2.91Å; Q88-D91 PolarHBondContact O-N 3.29Å; D91-Q94 PolarHBondContact O-N 2.95Å; D91-N95 WeakPolarHBondContact O-CB 3.36Å; D91-N95 PolarHBondContact O-N 3.23Å; D91-N95 PolarHBondContact O-ND2 2.96Å
92	E	96.4	Very high	94.9	Very high	111 Å²	111	97.8 Å²	97.8	52%	0.519	48%	0.484	S	S	.	.	H	α-helix	trans	-63.2	-46.8	173.8	-73.7	177.9	-172.2	0	0	112.2	Q88 L89 Q94 N95 Q96	Q88-E92 WeakPolarHBondContact O-CG 3.45Å; Q88-E92 PolarHBondContact O-N 3.33Å; L89-E92 PolarHBondContact O-N 2.89Å; E92-Q94 VanDerWaalsContact C-N 3.32Å; E92-Q94 PolarHBondContact O-N 3.06Å; E92-N95 PolarHBondContact O-N 3.32Å; E92-Q96 WeakPolarHBondContact O-CB 3.37Å; E92-Q96 WeakPolarHBondContact O-CG 3.47Å; E92-Q96 PolarHBondContact O-N 2.95Å
93	V	95.2	Very high	94.7	Very high	92 Å²	92	99.4 Å²	99.4	56%	0.558	49%	0.49	S	S	*	.	H	α-helix	trans	-61.8	-41.5	175.9	170.4	0	0	0	0	110.7	L89 R90 Q96 K97	L89-V93 WeakPolarHBondContact O-CB 3.44Å; L89-V93 WeakPolarHBondContact O-CG2 3.47Å; L89-V93 PolarHBondContact O-N 3.39Å; R90-V93 PolarHBondContact O-N 3.28Å; V93-Q96 PolarHBondContact O-N 3.04Å; V93-K97 VanDerWaalsContact O-CB 3.32Å; V93-K97 WeakPolarHBondContact O-CB 3.38Å; V93-K97 PolarHBondContact O-N 3.48Å
94	Q	94.5	Very high	94.5	Very high	111 Å²	111	101 Å²	101	52%	0.519	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-40.7	177.7	-176.8	61.8	14.4	0	0	111.8	R90 D91 E92 K97 C98	R90-Q94 VanDerWaalsContact O-CB 3.26Å; R90-Q94 WeakPolarHBondContact O-CB 3.31Å; R90-Q94 PolarHBondContact O-N 3.43Å; D91-Q94 PolarHBondContact O-N 2.95Å; E92-Q94 VanDerWaalsContact C-N 3.32Å; E92-Q94 PolarHBondContact O-N 3.06Å; Q94-K97 PolarHBondContact O-N 2.9Å; Q94-C98 WeakPolarHBondContact O-CB 3.41Å; Q94-C98 PolarHBondContact O-N 2.94Å
95	N	94.9	Very high	94.4	Very high	110 Å²	110	100.7 Å²	100.7	59%	0.588	50%	0.496	S	S	*	.	H	α-helix	trans	-64.5	-42.2	175	-74.8	-28.2	0	0	0	111.7	D91 E92 C98 L99	D91-N95 WeakPolarHBondContact O-CB 3.36Å; D91-N95 PolarHBondContact O-N 3.23Å; D91-N95 PolarHBondContact O-ND2 2.96Å; E92-N95 PolarHBondContact O-N 3.32Å; N95-C98 PolarHBondContact O-N 3.25Å; N95-L99 PolarHBondContact O-N 3.41Å
96	Q	94.7	Very high	94.3	Very high	123 Å²	123	102.7 Å²	102.7	58%	0.575	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-41.9	174.4	-73.6	179.6	-9.4	0	0	111.9	E92 V93 L99 I100	E92-Q96 WeakPolarHBondContact O-CB 3.37Å; E92-Q96 WeakPolarHBondContact O-CG 3.47Å; E92-Q96 PolarHBondContact O-N 2.95Å; V93-Q96 PolarHBondContact O-N 3.04Å; Q96-L99 WeakPolarHBondContact O-CB 3.27Å; Q96-L99 PolarHBondContact O-N 3.34Å; Q96-I100 VanDerWaalsContact O-CG1 3.3Å; Q96-I100 WeakPolarHBondContact O-CG1 3.39Å; Q96-I100 PolarHBondContact O-N 3.42Å
97	K	94.1	Very high	94.2	Very high	110 Å²	110	105.1 Å²	105.1	48%	0.478	51%	0.511	S	S	.	.	H	α-helix	trans	-60.4	-45.9	175	-172.1	-178.9	-180	-170.4	0	111.5	V93 Q94 L99 I100 E101	V93-K97 VanDerWaalsContact O-CB 3.32Å; V93-K97 WeakPolarHBondContact O-CB 3.38Å; V93-K97 PolarHBondContact O-N 3.48Å; Q94-K97 PolarHBondContact O-N 2.9Å; K97-L99 VanDerWaalsContact C-N 3.32Å; K97-L99 PolarHBondContact O-N 2.95Å; K97-I100 PolarHBondContact O-N 2.99Å; K97-E101 WeakPolarHBondContact CE-OE1 3.43Å; K97-E101 WeakPolarHBondContact O-CG 3.38Å; K97-E101 PolarHBondContact O-N 3.44Å
98	C	92.1	Very high	94	Very high	54 Å²	54	105.7 Å²	105.7	37%	0.365	51%	0.514	S	S	.	.	H	α-helix	trans	-60.9	-40	175.1	-176.5	0	0	0	0	111.9	Q94 N95 E101 N102	Q94-C98 WeakPolarHBondContact O-CB 3.41Å; Q94-C98 PolarHBondContact O-N 2.94Å; N95-C98 PolarHBondContact O-N 3.25Å; C98-E101 PolarHBondContact O-N 3.4Å; C98-N102 VanDerWaalsContact O-CB 3.31Å; C98-N102 WeakPolarHBondContact O-CB 3.38Å; C98-N102 PolarHBondContact O-N 2.96Å; C98-N102 PolarHBondContact O-ND2 2.8Å; C98-N102 VanDerWaalsContact O-ND2 3.15Å
99	L	93.4	Very high	93.9	Very high	112 Å²	112	106.3 Å²	106.3	59%	0.586	52%	0.517	S	S	*	.	H	α-helix	trans	-64.4	-42.7	175.1	-175.8	64.6	0	0	0	111.8	N95 Q96 K97 N102 M103	N95-L99 PolarHBondContact O-N 3.41Å; Q96-L99 WeakPolarHBondContact O-CB 3.27Å; Q96-L99 PolarHBondContact O-N 3.34Å; K97-L99 VanDerWaalsContact C-N 3.32Å; K97-L99 PolarHBondContact O-N 2.95Å; L99-N102 PolarHBondContact O-N 2.7Å; L99-M103 WeakPolarHBondContact O-CB 3.48Å; L99-M103 VanDerWaalsContact O-CG 3.26Å; L99-M103 WeakPolarHBondContact O-CG 3.48Å; L99-M103 PolarHBondContact O-N 3.38Å
100	I	95.6	Very high	93.9	Very high	95 Å²	95	107.2 Å²	107.2	49%	0.487	52%	0.518	S	S	.	.	H	α-helix	trans	-63.4	-49	176.1	-68	165.5	0	0	0	110.1	Q96 K97 N102 M103 E104	Q96-I100 VanDerWaalsContact O-CG1 3.3Å; Q96-I100 WeakPolarHBondContact O-CG1 3.39Å; Q96-I100 PolarHBondContact O-N 3.42Å; K97-I100 PolarHBondContact O-N 2.99Å; I100-N102 VanDerWaalsContact C-N 3.32Å; I100-N102 PolarHBondContact O-N 3.35Å; I100-M103 CarbonylContact O-C 3.55Å; I100-M103 PolarHBondContact O-N 2.86Å; I100-M103 VanDerWaalsContact O-N 3.07Å; I100-E104 HydrophobicContact CG2-CG 4.11Å; I100-E104 WeakPolarHBondContact O-CB 3.49Å; I100-E104 WeakPolarHBondContact O-CG 3.29Å; I100-E104 PolarHBondContact O-N 3.36Å
101	E	93.8	Very high	93.8	Very high	88 Å²	88	104.1 Å²	104.1	41%	0.411	51%	0.51	S	S	.	.	H	α-helix	trans	-59.1	-40.8	177.3	-74.1	174.9	-173.9	0	0	111.9	K97 C98 M103 E104 T105	K97-E101 WeakPolarHBondContact CE-OE1 3.43Å; K97-E101 WeakPolarHBondContact O-CG 3.38Å; K97-E101 PolarHBondContact O-N 3.44Å; C98-E101 PolarHBondContact O-N 3.4Å; E101-M103 VanDerWaalsContact C-N 3.34Å; E101-M103 PolarHBondContact O-N 3.15Å; E101-E104 PolarHBondContact O-N 3.25Å; E101-T105 WeakPolarHBondContact O-CB 3.36Å; E101-T105 VanDerWaalsContact O-CG2 3.3Å; E101-T105 WeakPolarHBondContact O-CG2 3.42Å; E101-T105 PolarHBondContact O-N 2.87Å; E101-T105 PolarHBondContact O-OG1 3.13Å
102	N	94.3	Very high	93.7	Very high	83 Å²	83	104 Å²	104	44%	0.444	51%	0.508	S	S	.	.	H	α-helix	trans	-67	-33.6	175.4	-75.8	-29.5	0	0	0	112.9	C98 L99 I100 T105 K106	C98-N102 VanDerWaalsContact O-CB 3.31Å; C98-N102 WeakPolarHBondContact O-CB 3.38Å; C98-N102 PolarHBondContact O-N 2.96Å; C98-N102 PolarHBondContact O-ND2 2.8Å; C98-N102 VanDerWaalsContact O-ND2 3.15Å; L99-N102 PolarHBondContact O-N 2.7Å; I100-N102 VanDerWaalsContact C-N 3.32Å; I100-N102 PolarHBondContact O-N 3.35Å; N102-T105 VanDerWaalsContact CA-OG1 3.31Å; N102-T105 WeakPolarHBondContact CA-OG1 3.48Å; N102-T105 PolarHBondContact O-OG1 3.39Å; N102-K106 WeakPolarHBondContact O-CD 3.37Å; N102-K106 VanDerWaalsContact O-CG 3.24Å; N102-K106 WeakPolarHBondContact O-CG 3.43Å; N102-K106 PolarHBondContact O-N 2.92Å
103	M	92.4	Very high	93.6	Very high	84 Å²	84	106.1 Å²	106.1	41%	0.414	52%	0.516	S	S	.	.	H	α-helix	trans	-74.4	-42.3	173.6	-72.4	-64.5	-61.1	0	0	111	L99 I100 E101 K106 F107	L99-M103 WeakPolarHBondContact O-CB 3.48Å; L99-M103 VanDerWaalsContact O-CG 3.26Å; L99-M103 WeakPolarHBondContact O-CG 3.48Å; L99-M103 PolarHBondContact O-N 3.38Å; I100-M103 CarbonylContact O-C 3.55Å; I100-M103 PolarHBondContact O-N 2.86Å; I100-M103 VanDerWaalsContact O-N 3.07Å; E101-M103 VanDerWaalsContact C-N 3.34Å; E101-M103 PolarHBondContact O-N 3.15Å; M103-K106 PolarHBondContact O-N 3.38Å; M103-F107 HydrophobicContact CB-CD2 4.35Å; M103-F107 HydrophobicContact CB-CE2 4.3Å; M103-F107 HydrophobicContact CE-CD2 4.48Å; M103-F107 HydrophobicContact CE-CE2 3.62Å; M103-F107 HydrophobicContact CE-CZ 3.99Å; M103-F107 WeakPolarHBondContact O-CB 3.21Å; M103-F107 WeakPolarHBondContact O-CD2 3.21Å; M103-F107 WeakPolarHBondContact O-CG 3.26Å; M103-F107 PolarHBondContact O-N 2.82Å
104	E	91	Very high	93.4	Very high	96 Å²	96	107.1 Å²	107.1	45%	0.449	52%	0.516	S	S	.	.	H	α-helix	trans	-60.3	-47.6	176.4	-76.9	-179.3	173.7	0	0	111.4	I100 E101 K106 F107 F108	I100-E104 HydrophobicContact CG2-CG 4.11Å; I100-E104 WeakPolarHBondContact O-CB 3.49Å; I100-E104 WeakPolarHBondContact O-CG 3.29Å; I100-E104 PolarHBondContact O-N 3.36Å; E101-E104 PolarHBondContact O-N 3.25Å; E104-K106 PolarHBondContact O-N 3.46Å; E104-F107 CarbonylContact O-C 3.59Å; E104-F107 PolarHBondContact O-N 3.44Å; E104-F108 HydrophobicContact CB-CD2 4.24Å; E104-F108 HydrophobicContact CB-CE2 4.11Å; E104-F108 WeakPolarHBondContact O-CB 3.29Å; E104-F108 WeakPolarHBondContact O-CD2 3.43Å; E104-F108 WeakPolarHBondContact O-CG 3.33Å; E104-F108 PolarHBondContact O-N 2.87Å
105	T	93.3	Very high	93.3	Very high	70 Å²	70	108 Å²	108	43%	0.429	52%	0.515	S	S	.	.	H	α-helix	trans	-58.3	-47	175.1	46.6	0	0	0	0	111.5	E101 N102 F107 F108 E109	E101-T105 WeakPolarHBondContact O-CB 3.36Å; E101-T105 VanDerWaalsContact O-CG2 3.3Å; E101-T105 WeakPolarHBondContact O-CG2 3.42Å; E101-T105 PolarHBondContact O-N 2.87Å; E101-T105 PolarHBondContact O-OG1 3.13Å; N102-T105 VanDerWaalsContact CA-OG1 3.31Å; N102-T105 WeakPolarHBondContact CA-OG1 3.48Å; N102-T105 PolarHBondContact O-OG1 3.39Å; T105-F107 PolarHBondContact O-N 2.85Å; T105-F108 PolarHBondContact O-N 3.29Å; T105-E109 WeakPolarHBondContact O-CB 3.39Å; T105-E109 WeakPolarHBondContact O-CG 3.33Å; T105-E109 PolarHBondContact O-N 3.12Å
106	K	94.7	Very high	93.2	Very high	130 Å²	130	107.4 Å²	107.4	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-60.1	-43	173.7	-73.3	174.9	-176.3	179.5	0	112.6	N102 M103 E104 E109 E110	N102-K106 WeakPolarHBondContact O-CD 3.37Å; N102-K106 VanDerWaalsContact O-CG 3.24Å; N102-K106 WeakPolarHBondContact O-CG 3.43Å; N102-K106 PolarHBondContact O-N 2.92Å; M103-K106 PolarHBondContact O-N 3.38Å; E104-K106 PolarHBondContact O-N 3.46Å; K106-E109 PolarHBondContact O-N 3.36Å; K106-E110 WeakPolarHBondContact O-CB 3.28Å; K106-E110 PolarHBondContact O-N 2.88Å
107	F	92.8	Very high	93.2	Very high	122 Å²	122	104.2 Å²	104.2	54%	0.535	50%	0.499	S	S	.	.	H	α-helix	trans	-66	-37.2	175.3	-79.5	-60.4	0	0	0	112.1	M103 E104 T105 K111	M103-F107 HydrophobicContact CB-CD2 4.35Å; M103-F107 HydrophobicContact CB-CE2 4.3Å; M103-F107 HydrophobicContact CE-CD2 4.48Å; M103-F107 HydrophobicContact CE-CE2 3.62Å; M103-F107 HydrophobicContact CE-CZ 3.99Å; M103-F107 WeakPolarHBondContact O-CB 3.21Å; M103-F107 WeakPolarHBondContact O-CD2 3.21Å; M103-F107 WeakPolarHBondContact O-CG 3.26Å; M103-F107 PolarHBondContact O-N 2.82Å; E104-F107 CarbonylContact O-C 3.59Å; E104-F107 PolarHBondContact O-N 3.44Å; T105-F107 PolarHBondContact O-N 2.85Å; F107-K111 WeakPolarHBondContact O-CB 3.47Å; F107-K111 PolarHBondContact O-N 3.05Å
108	F	91.1	Very high	93.1	Very high	128 Å²	128	101.5 Å²	101.5	56%	0.561	49%	0.494	S	S	*	.	H	α-helix	trans	-68	-42.3	175.8	-79.3	-60.5	0	0	0	111.3	E104 T105 K111 L112	E104-F108 HydrophobicContact CB-CD2 4.24Å; E104-F108 HydrophobicContact CB-CE2 4.11Å; E104-F108 WeakPolarHBondContact O-CB 3.29Å; E104-F108 WeakPolarHBondContact O-CD2 3.43Å; E104-F108 WeakPolarHBondContact O-CG 3.33Å; E104-F108 PolarHBondContact O-N 2.87Å; T105-F108 PolarHBondContact O-N 3.29Å; F108-K111 PolarHBondContact O-N 3.49Å; F108-L112 WeakPolarHBondContact O-CB 3.34Å; F108-L112 PolarHBondContact O-N 3.37Å
109	E	92.6	Very high	93.2	Very high	136 Å²	136	103 Å²	103	64%	0.636	50%	0.498	S	S	*	.	H	α-helix	trans	-62.1	-47.5	174.2	-74.7	177.6	-175.4	0	0	111.4	T105 K106 L112 K113	T105-E109 WeakPolarHBondContact O-CB 3.39Å; T105-E109 WeakPolarHBondContact O-CG 3.33Å; T105-E109 PolarHBondContact O-N 3.12Å; K106-E109 PolarHBondContact O-N 3.36Å; E109-L112 PolarHBondContact O-N 2.97Å; E109-K113 WeakPolarHBondContact O-CB 3.39Å; E109-K113 PolarHBondContact O-N 3.36Å
110	E	94.7	Very high	93.2	Very high	122 Å²	122	104 Å²	104	57%	0.57	50%	0.498	S	S	*	.	H	α-helix	trans	-64	-43.5	176.8	-174.8	171.6	-169.5	0	0	111.4	K106 L112 K113 M114	K106-E110 WeakPolarHBondContact O-CB 3.28Å; K106-E110 PolarHBondContact O-N 2.88Å; E110-L112 VanDerWaalsContact C-N 3.33Å; E110-L112 PolarHBondContact O-N 2.96Å; E110-K113 PolarHBondContact O-N 3.38Å; E110-M114 WeakPolarHBondContact O-CB 3.42Å; E110-M114 WeakPolarHBondContact O-CG 3.38Å; E110-M114 PolarHBondContact O-N 3.17Å
111	K	93.8	Very high	93.1	Very high	107 Å²	107	104.2 Å²	104.2	47%	0.465	50%	0.5	S	S	.	.	H	α-helix	trans	-63.8	-38	175.6	-169.3	-179.7	-165.4	176.4	0	111.8	F107 F108 R115	F107-K111 WeakPolarHBondContact O-CB 3.47Å; F107-K111 PolarHBondContact O-N 3.05Å; F108-K111 PolarHBondContact O-N 3.49Å; K111-R115 VanDerWaalsContact CE-NH2 3.3Å; K111-R115 WeakPolarHBondContact O-CB 3.34Å; K111-R115 VanDerWaalsContact O-CG 3.29Å; K111-R115 WeakPolarHBondContact O-CG 3.43Å; K111-R115 PolarHBondContact O-N 3.43Å
112	L	92.2	Very high	93.1	Very high	100 Å²	100	105.3 Å²	105.3	52%	0.524	51%	0.507	S	S	.	.	H	α-helix	trans	-66.5	-46.3	175.1	-170.4	72.6	0	0	0	110.1	F108 E109 E110 M114 R115 E116	F108-L112 WeakPolarHBondContact O-CB 3.34Å; F108-L112 PolarHBondContact O-N 3.37Å; E109-L112 PolarHBondContact O-N 2.97Å; E110-L112 VanDerWaalsContact C-N 3.33Å; E110-L112 PolarHBondContact O-N 2.96Å; L112-M114 PolarHBondContact O-N 3.5Å; L112-R115 PolarHBondContact O-N 2.86Å; L112-E116 WeakPolarHBondContact O-CB 3.36Å; L112-E116 WeakPolarHBondContact O-CG 3.46Å; L112-E116 PolarHBondContact O-N 2.92Å
113	K	94.3	Very high	93	Very high	156 Å²	156	107.5 Å²	107.5	68%	0.678	51%	0.513	S	S	*	.	H	α-helix	trans	-61	-43.1	176.6	-171.4	179.4	179	-177.1	0	112.1	E109 E110 E116 S117	E109-K113 WeakPolarHBondContact O-CB 3.39Å; E109-K113 PolarHBondContact O-N 3.36Å; E110-K113 PolarHBondContact O-N 3.38Å; K113-E116 PolarHBondContact O-N 3.31Å; K113-S117 WeakPolarHBondContact O-CB 3.39Å; K113-S117 PolarHBondContact O-N 3.43Å
114	M	91.2	Very high	93	Very high	113 Å²	113	106.1 Å²	106.1	56%	0.557	52%	0.515	S	S	*	.	H	α-helix	trans	-65.7	-39.2	175.3	-75.1	-57.1	-61.2	0	0	112.2	E110 L112 S118	E110-M114 WeakPolarHBondContact O-CB 3.42Å; E110-M114 WeakPolarHBondContact O-CG 3.38Å; E110-M114 PolarHBondContact O-N 3.17Å; L112-M114 PolarHBondContact O-N 3.5Å; M114-S118 WeakPolarHBondContact O-CB 3.43Å; M114-S118 PolarHBondContact O-N 2.99Å; M114-S118 PolarHBondContact O-OG 3.36Å
115	R	92	Very high	93.1	Very high	130 Å²	130	107.3 Å²	107.3	49%	0.491	52%	0.524	S	S	.	.	H	α-helix	trans	-67.3	-43	173.6	-79.6	-172.5	-177.2	128.4	-14.6	112.4	K111 L112 S117 S118 I119	K111-R115 VanDerWaalsContact CE-NH2 3.3Å; K111-R115 WeakPolarHBondContact O-CB 3.34Å; K111-R115 VanDerWaalsContact O-CG 3.29Å; K111-R115 WeakPolarHBondContact O-CG 3.43Å; K111-R115 PolarHBondContact O-N 3.43Å; L112-R115 PolarHBondContact O-N 2.86Å; R115-S117 VanDerWaalsContact C-N 3.33Å; R115-S117 PolarHBondContact O-N 2.77Å; R115-S118 PolarHBondContact O-N 3.25Å; R115-I119 WeakPolarHBondContact O-CB 3.2Å; R115-I119 WeakPolarHBondContact O-CG1 3.29Å; R115-I119 PolarHBondContact O-N 2.92Å
116	E	93.6	Very high	93	Very high	97 Å²	97	106.1 Å²	106.1	45%	0.453	52%	0.521	S	S	.	.	H	α-helix	trans	-61.8	-41.9	175.3	-77.6	-173	178.4	0	0	111.5	L112 K113 I119 K120	L112-E116 WeakPolarHBondContact O-CB 3.36Å; L112-E116 WeakPolarHBondContact O-CG 3.46Å; L112-E116 PolarHBondContact O-N 2.92Å; K113-E116 PolarHBondContact O-N 3.31Å; E116-I119 PolarHBondContact O-N 2.86Å; E116-K120 WeakPolarHBondContact O-CB 3.46Å; E116-K120 VanDerWaalsContact O-CG 3.23Å; E116-K120 WeakPolarHBondContact O-CG 3.23Å; E116-K120 PolarHBondContact O-N 3.3Å
117	S	93.4	Very high	92.8	Very high	55 Å²	55	105.2 Å²	105.2	39%	0.385	52%	0.518	S	S	.	.	H	α-helix	trans	-60.1	-51.2	173.1	-164.4	0	0	0	0	110.6	K113 R115 I119 K120 D121	K113-S117 WeakPolarHBondContact O-CB 3.39Å; K113-S117 PolarHBondContact O-N 3.43Å; R115-S117 VanDerWaalsContact C-N 3.33Å; R115-S117 PolarHBondContact O-N 2.77Å; S117-I119 VanDerWaalsContact C-N 3.32Å; S117-I119 PolarHBondContact O-N 3.26Å; S117-K120 WeakPolarHBondContact O-CB 3.42Å; S117-K120 PolarHBondContact O-N 3.47Å; S117-K120 VanDerWaalsContact O-N 3.09Å; S117-D121 PolarHBondContact O-N 2.93Å
118	S	92.6	Very high	92.6	Very high	54 Å²	54	105 Å²	105	38%	0.378	52%	0.519	S	S	.	.	H	α-helix	trans	-60.8	-39.9	179.3	-55.7	0	0	0	0	112.2	M114 R115 D121 I122	M114-S118 WeakPolarHBondContact O-CB 3.43Å; M114-S118 PolarHBondContact O-N 2.99Å; M114-S118 PolarHBondContact O-OG 3.36Å; R115-S118 PolarHBondContact O-N 3.25Å; S118-D121 PolarHBondContact O-N 3.45Å; S118-I122 WeakPolarHBondContact O-CB 3.29Å; S118-I122 WeakPolarHBondContact O-CD1 3.07Å; S118-I122 WeakPolarHBondContact O-CG1 3.46Å; S118-I122 PolarHBondContact O-N 3.32Å
119	I	94.1	Very high	92.3	Very high	85 Å²	85	101.3 Å²	101.3	44%	0.436	51%	0.512	S	S	.	.	H	α-helix	trans	-67.2	-39.8	176	-71.5	166	0	0	0	110.7	R115 E116 S117 D121 K123	R115-I119 WeakPolarHBondContact O-CB 3.2Å; R115-I119 WeakPolarHBondContact O-CG1 3.29Å; R115-I119 PolarHBondContact O-N 2.92Å; E116-I119 PolarHBondContact O-N 2.86Å; S117-I119 VanDerWaalsContact C-N 3.32Å; S117-I119 PolarHBondContact O-N 3.26Å; I119-D121 VanDerWaalsContact C-N 3.34Å; I119-K123 HydrophobicContact CG2-CD 4.05Å; I119-K123 HydrophobicContact CG2-CG 4.36Å; I119-K123 VanDerWaalsContact O-CB 3.3Å; I119-K123 WeakPolarHBondContact O-CB 3.36Å; I119-K123 VanDerWaalsContact O-CG 3.24Å; I119-K123 WeakPolarHBondContact O-CG 3.39Å; I119-K123 PolarHBondContact O-N 3.01Å
120	K	93.5	Very high	91.9	Very high	134 Å²	134	100.1 Å²	100.1	58%	0.583	51%	0.506	S	S	*	.	H	α-helix	trans	-62.6	-43.2	174.2	-76.1	168.9	-177.1	169.9	0	110.5	E116 S117 K123 A124	E116-K120 WeakPolarHBondContact O-CB 3.46Å; E116-K120 VanDerWaalsContact O-CG 3.23Å; E116-K120 WeakPolarHBondContact O-CG 3.23Å; E116-K120 PolarHBondContact O-N 3.3Å; S117-K120 WeakPolarHBondContact O-CB 3.42Å; S117-K120 PolarHBondContact O-N 3.47Å; S117-K120 VanDerWaalsContact O-N 3.09Å; K120-K123 PolarHBondContact O-N 2.9Å; K120-A124 WeakPolarHBondContact O-CB 3.3Å; K120-A124 PolarHBondContact O-N 2.98Å
121	D	94	Very high	91.5	Very high	99 Å²	99	99.8 Å²	99.8	53%	0.529	50%	0.503	S	S	.	.	H	α-helix	trans	-65.4	-44.4	177.8	-60.9	-25.8	0	0	0	111.3	S117 S118 I119 K123 A124 L125	S117-D121 PolarHBondContact O-N 2.93Å; S118-D121 PolarHBondContact O-N 3.45Å; I119-D121 VanDerWaalsContact C-N 3.34Å; D121-K123 PolarHBondContact O-N 3.47Å; D121-A124 PolarHBondContact O-N 3.47Å; D121-L125 WeakPolarHBondContact O-CB 3.25Å; D121-L125 PolarHBondContact O-N 2.96Å
122	I	92.8	Very high	91	Very high	111 Å²	111	98.3 Å²	98.3	57%	0.569	50%	0.499	S	S	*	.	H	α-helix	trans	-61.8	-43.2	174.1	-69.3	163.4	0	0	0	110.9	S118 L125 A126	S118-I122 WeakPolarHBondContact O-CB 3.29Å; S118-I122 WeakPolarHBondContact O-CD1 3.07Å; S118-I122 WeakPolarHBondContact O-CG1 3.46Å; S118-I122 PolarHBondContact O-N 3.32Å; I122-L125 PolarHBondContact O-N 2.9Å; I122-A126 VanDerWaalsContact O-CB 3.23Å; I122-A126 WeakPolarHBondContact O-CB 3.23Å; I122-A126 PolarHBondContact O-N 3.28Å
123	K	93.4	Very high	90.5	Very high	128 Å²	128	96.7 Å²	96.7	56%	0.557	50%	0.496	S	S	*	.	H	α-helix	trans	-63.7	-44.4	176.6	-78.8	176.2	-179.7	179.2	0	111.3	I119 K120 D121 A126 E127	I119-K123 HydrophobicContact CG2-CD 4.05Å; I119-K123 HydrophobicContact CG2-CG 4.36Å; I119-K123 VanDerWaalsContact O-CB 3.3Å; I119-K123 WeakPolarHBondContact O-CB 3.36Å; I119-K123 VanDerWaalsContact O-CG 3.24Å; I119-K123 WeakPolarHBondContact O-CG 3.39Å; I119-K123 PolarHBondContact O-N 3.01Å; K120-K123 PolarHBondContact O-N 2.9Å; D121-K123 PolarHBondContact O-N 3.47Å; K123-A126 PolarHBondContact O-N 3.25Å; K123-E127 WeakPolarHBondContact O-CB 3.36Å; K123-E127 WeakPolarHBondContact O-CG 3.46Å; K123-E127 PolarHBondContact O-N 2.84Å
124	A	92.6	Very high	89.7	Confident	56 Å²	56	92.2 Å²	92.2	46%	0.463	48%	0.479	S	S	.	.	H	α-helix	trans	-61.3	-45.4	177.2	0	0	0	0	0	111.2	K120 D121 E127 E128	K120-A124 WeakPolarHBondContact O-CB 3.3Å; K120-A124 PolarHBondContact O-N 2.98Å; D121-A124 PolarHBondContact O-N 3.47Å; A124-E127 PolarHBondContact O-N 3.13Å; A124-E128 WeakPolarHBondContact O-CB 3.33Å; A124-E128 PolarHBondContact O-N 2.81Å
125	L	92.4	Very high	89.1	Confident	121 Å²	121	95.3 Å²	95.3	63%	0.634	49%	0.485	S	S	*	.	H	α-helix	trans	-62.9	-42.7	175.4	-164.9	84.3	0	0	0	111.7	D121 I122 E128 A129	D121-L125 WeakPolarHBondContact O-CB 3.25Å; D121-L125 PolarHBondContact O-N 2.96Å; I122-L125 PolarHBondContact O-N 2.9Å; L125-E128 PolarHBondContact O-N 3.39Å; L125-A129 VanDerWaalsContact O-CB 3.29Å; L125-A129 WeakPolarHBondContact O-CB 3.31Å; L125-A129 PolarHBondContact O-N 3.22Å
126	A	90.9	Very high	88.6	Confident	44 Å²	44	95.2 Å²	95.2	36%	0.364	49%	0.494	S	S	.	.	H	α-helix	trans	-64.8	-39.6	176.6	0	0	0	0	0	111.7	I122 K123 H130	I122-A126 VanDerWaalsContact O-CB 3.23Å; I122-A126 WeakPolarHBondContact O-CB 3.23Å; I122-A126 PolarHBondContact O-N 3.28Å; K123-A126 PolarHBondContact O-N 3.25Å; A126-H130 VanDerWaalsContact O-CB 3.26Å; A126-H130 WeakPolarHBondContact O-CB 3.34Å; A126-H130 PolarHBondContact O-CD2 3.45Å; A126-H130 PolarHBondContact O-N 2.85Å
127	E	90.2	Very high	88	Confident	111 Å²	111	93.4 Å²	93.4	52%	0.519	49%	0.487	S	S	.	.	H	α-helix	trans	-65.4	-41.4	174	-77.5	-179.3	-160.8	0	0	112	K123 A124 H130 K131	K123-E127 WeakPolarHBondContact O-CB 3.36Å; K123-E127 WeakPolarHBondContact O-CG 3.46Å; K123-E127 PolarHBondContact O-N 2.84Å; A124-E127 PolarHBondContact O-N 3.13Å; E127-H130 PolarHBondContact O-N 2.88Å; E127-K131 WeakPolarHBondContact O-CB 3.4Å; E127-K131 WeakPolarHBondContact O-CG 3.26Å; E127-K131 PolarHBondContact O-N 3.29Å; E127-K131 IonicContact OE2-NZ 3.93Å
128	E	88.9	Confident	87.6	Confident	119 Å²	119	96.6 Å²	96.6	56%	0.556	50%	0.5	S	S	*	.	H	α-helix	trans	-64.9	-46.9	175.9	-173.2	169.3	-164.1	0	0	111.2	A124 L125 H130 K131 I132	A124-E128 WeakPolarHBondContact O-CB 3.33Å; A124-E128 PolarHBondContact O-N 2.81Å; L125-E128 PolarHBondContact O-N 3.39Å; E128-H130 VanDerWaalsContact C-N 3.35Å; E128-H130 PolarHBondContact O-N 3.34Å; E128-K131 PolarHBondContact O-N 3.34Å; E128-I132 HydrophobicContact CG-CD1 4.08Å; E128-I132 VanDerWaalsContact O-CG1 3.32Å; E128-I132 WeakPolarHBondContact O-CG1 3.28Å; E128-I132 PolarHBondContact O-N 2.9Å
129	A	85.8	Confident	87.3	Confident	50 Å²	50	99.9 Å²	99.9	41%	0.413	51%	0.513	S	S	.	.	H	α-helix	trans	-60.7	-41.9	174.8	0	0	0	0	0	112.1	L125 I132 S133	L125-A129 VanDerWaalsContact O-CB 3.29Å; L125-A129 WeakPolarHBondContact O-CB 3.31Å; L125-A129 PolarHBondContact O-N 3.22Å; A129-I132 PolarHBondContact O-N 2.64Å; A129-S133 WeakPolarHBondContact O-CB 3.33Å; A129-S133 PolarHBondContact O-N 3.2Å; A129-S133 PolarHBondContact O-OG 3.34Å
130	H	84.6	Confident	86.9	Confident	111 Å²	111	100.6 Å²	100.6	51%	0.514	53%	0.526	S	S	.	.	H	α-helix	trans	-65.5	-42	174.4	-90	-62.3	0	0	0	112	A126 E127 E128 S133 I134	A126-H130 VanDerWaalsContact O-CB 3.26Å; A126-H130 WeakPolarHBondContact O-CB 3.34Å; A126-H130 PolarHBondContact O-CD2 3.45Å; A126-H130 PolarHBondContact O-N 2.85Å; E127-H130 PolarHBondContact O-N 2.88Å; E128-H130 VanDerWaalsContact C-N 3.35Å; E128-H130 PolarHBondContact O-N 3.34Å; H130-S133 PolarHBondContact O-N 3.46Å; H130-I134 WeakPolarHBondContact O-CB 3.48Å; H130-I134 VanDerWaalsContact O-CG1 3.26Å; H130-I134 WeakPolarHBondContact O-CG1 3.39Å; H130-I134 PolarHBondContact O-N 2.89Å
131	K	84.6	Confident	86.6	Confident	114 Å²	114	97.4 Å²	97.4	50%	0.496	52%	0.517	S	S	.	.	H	α-helix	trans	-61.5	-44.4	176.3	-76.7	166.4	-171.9	165.6	0	111.2	E127 E128 I134 R135	E127-K131 WeakPolarHBondContact O-CB 3.4Å; E127-K131 WeakPolarHBondContact O-CG 3.26Å; E127-K131 PolarHBondContact O-N 3.29Å; E127-K131 IonicContact OE2-NZ 3.93Å; E128-K131 PolarHBondContact O-N 3.34Å; K131-I134 PolarHBondContact O-N 2.84Å; K131-R135 WeakPolarHBondContact O-CG 3.49Å; K131-R135 PolarHBondContact O-N 3.2Å
132	I	83.6	Confident	86.3	Confident	76 Å²	76	95.6 Å²	95.6	39%	0.39	51%	0.505	S	S	.	.	H	α-helix	trans	-63.4	-45.9	175.9	-65.5	164.9	0	0	0	110.3	E128 A129 I134 R135 N136	E128-I132 HydrophobicContact CG-CD1 4.08Å; E128-I132 VanDerWaalsContact O-CG1 3.32Å; E128-I132 WeakPolarHBondContact O-CG1 3.28Å; E128-I132 PolarHBondContact O-N 2.9Å; A129-I132 PolarHBondContact O-N 2.64Å; I132-I134 PolarHBondContact O-N 3.47Å; I132-R135 PolarHBondContact O-N 2.87Å; I132-N136 PolarHBondContact O-N 3.37Å
133	S	81.3	Confident	86.1	Confident	66 Å²	66	96.1 Å²	96.1	46%	0.462	51%	0.508	S	S	.	.	H	α-helix	trans	-57.8	-47	177.6	-60.4	0	0	0	0	111.3	A129 H130 R135 N136 L137	A129-S133 WeakPolarHBondContact O-CB 3.33Å; A129-S133 PolarHBondContact O-N 3.2Å; A129-S133 PolarHBondContact O-OG 3.34Å; H130-S133 PolarHBondContact O-N 3.46Å; S133-R135 PolarHBondContact O-N 2.92Å; S133-N136 PolarHBondContact O-N 2.91Å; S133-L137 WeakPolarHBondContact O-CG 3.36Å; S133-L137 PolarHBondContact O-N 3.38Å
134	I	78.1	Confident	85.8	Confident	62 Å²	62	92.6 Å²	92.6	32%	0.318	50%	0.5	S	S	.	.	H	α-helix	trans	-64.9	-37.2	179.2	-67.3	165.4	0	0	0	112	H130 K131 I132 N136 L137 K142 F145	H130-I134 WeakPolarHBondContact O-CB 3.48Å; H130-I134 VanDerWaalsContact O-CG1 3.26Å; H130-I134 WeakPolarHBondContact O-CG1 3.39Å; H130-I134 PolarHBondContact O-N 2.89Å; K131-I134 PolarHBondContact O-N 2.84Å; I132-I134 PolarHBondContact O-N 3.47Å; I134-N136 VanDerWaalsContact C-N 3.26Å; I134-N136 PolarHBondContact O-N 3.41Å; I134-L137 PolarHBondContact O-N 2.89Å; I134-K142 HydrophobicContact CG2-CG 4.39Å; I134-K142 WeakPolarHBondContact O-CE 3.37Å; I134-F145 HydrophobicContact CD1-CE1 4.03Å
135	R	79.2	Confident	85.5	Confident	178 Å²	178	93.9 Å²	93.9	67%	0.672	50%	0.495	S	S	*	.	H	α-helix	trans	-62.5	-34.9	176.3	-73.3	177.6	-152	157.2	5.2	112.3	K131 I132 S133 L137	K131-R135 WeakPolarHBondContact O-CG 3.49Å; K131-R135 PolarHBondContact O-N 3.2Å; I132-R135 PolarHBondContact O-N 2.87Å; S133-R135 PolarHBondContact O-N 2.92Å; R135-L137 VanDerWaalsContact C-N 3.34Å
136	N	81.5	Confident	85.3	Confident	128 Å²	128	92.7 Å²	92.7	68%	0.684	49%	0.492	S	S	*	.	H	α-helix	trans	-82.3	-10.4	-178.4	-64.7	-9.8	0	0	0	113.6	I132 S133 I134	I132-N136 PolarHBondContact O-N 3.37Å; S133-N136 PolarHBondContact O-N 2.91Å; I134-N136 VanDerWaalsContact C-N 3.26Å; I134-N136 PolarHBondContact O-N 3.41Å
137	L	81.4	Confident	85.4	Confident	60 Å²	60	96.6 Å²	96.6	31%	0.314	50%	0.503	S	S	.	.	S	Bend	trans	-77	144.4	177.2	-70.9	175.9	0	0	0	111.2	S133 I134 R135 V141 K142	S133-L137 WeakPolarHBondContact O-CG 3.36Å; S133-L137 PolarHBondContact O-N 3.38Å; I134-L137 PolarHBondContact O-N 2.89Å; R135-L137 VanDerWaalsContact C-N 3.34Å; L137-V141 HydrophobicContact CB-CB 4.25Å; L137-V141 HydrophobicContact CD1-CG1 4.01Å; L137-V141 HydrophobicContact CD2-CB 4.18Å; L137-V141 HydrophobicContact CD2-CG1 3.75Å; L137-V141 HydrophobicContact CG-CG1 4.29Å; L137-K142 HydrophobicContact CB-CG 3.92Å; L137-K142 WeakPolarHBondContact O-CE 3.26Å; L137-K142 PolarHBondContact O-NZ 2.86Å
138	D	85.2	Confident	85.4	Confident	122 Å²	122	94.4 Å²	94.4	65%	0.652	50%	0.495	S	S	*	.			trans	-64.8	152.6	167.9	-59.2	-43.3	0	0	0	110.7	S140 V141 K142	D138-S140 PolarHBondContact O-N 2.79Å; D138-S140 VanDerWaalsContact O-N 3.14Å; D138-V141 HydrophobicContact CB-CG2 4.49Å; D138-V141 PolarHBondContact O-N 2.93Å; D138-K142 PolarHBondContact O-N 3.23Å
139	D	84.5	Confident	85.5	Confident	123 Å²	123	90.8 Å²	90.8	66%	0.658	48%	0.481	S	S	*	.	H	α-helix	trans	-59.9	-30.7	-174.8	-67.9	-20.6	0	0	0	113.2	K142 L143	D139-K142 PolarHBondContact O-N 2.84Å; D139-K142 IonicContact OD1-NZ 2.72Å; D139-K142 PolarHBondContact OD1-NZ 2.92Å; D139-L143 PolarHBondContact O-N 3.4Å
140	S	86.7	Confident	85.9	Confident	99 Å²	99	90.2 Å²	90.2	69%	0.692	48%	0.476	S	S	*	.	H	α-helix	trans	-62.8	-41.8	171.8	-175.3	0	0	0	0	112.5	D138 S144	D138-S140 PolarHBondContact O-N 2.79Å; D138-S140 VanDerWaalsContact O-N 3.14Å; S140-S144 PolarHBondContact O-N 2.86Å; S140-S144 VanDerWaalsContact O-N 3.15Å
141	V	87.4	Confident	86.4	Confident	67 Å²	67	89.7 Å²	89.7	41%	0.406	48%	0.475	S	S	.	.	H	α-helix	trans	-73.8	-35.8	179.8	-171.1	0	0	0	0	110.4	L137 D138 S144 F145	L137-V141 HydrophobicContact CB-CB 4.25Å; L137-V141 HydrophobicContact CD1-CG1 4.01Å; L137-V141 HydrophobicContact CD2-CB 4.18Å; L137-V141 HydrophobicContact CD2-CG1 3.75Å; L137-V141 HydrophobicContact CG-CG1 4.29Å; D138-V141 HydrophobicContact CB-CG2 4.49Å; D138-V141 PolarHBondContact O-N 2.93Å; V141-S144 PolarHBondContact O-N 2.94Å; V141-F145 WeakPolarHBondContact O-CB 3.42Å; V141-F145 PolarHBondContact O-N 2.86Å
142	K	87.3	Confident	86.9	Confident	61 Å²	61	92.9 Å²	92.9	27%	0.265	48%	0.484	S	S	.	.	H	α-helix	trans	-60.1	-45.5	172.5	-66.7	-180	-170.1	132.5	0	111.9	I134 L137 D138 D139 F145 V146	I134-K142 HydrophobicContact CG2-CG 4.39Å; I134-K142 WeakPolarHBondContact O-CE 3.37Å; L137-K142 HydrophobicContact CB-CG 3.92Å; L137-K142 WeakPolarHBondContact O-CE 3.26Å; L137-K142 PolarHBondContact O-NZ 2.86Å; D138-K142 PolarHBondContact O-N 3.23Å; D139-K142 PolarHBondContact O-N 2.84Å; D139-K142 IonicContact OD1-NZ 2.72Å; D139-K142 PolarHBondContact OD1-NZ 2.92Å; K142-F145 WeakPolarHBondContact O-CB 3.26Å; K142-F145 PolarHBondContact O-N 3.42Å; K142-V146 WeakPolarHBondContact O-CG2 3.41Å; K142-V146 PolarHBondContact O-N 3.4Å
143	L	87.8	Confident	87.4	Confident	122 Å²	122	97.9 Å²	97.9	64%	0.639	50%	0.498	S	S	*	.	H	α-helix	trans	-61.9	-45.3	178.1	-176.7	61.3	0	0	0	111.4	D139 F145 V146 Q147	D139-L143 PolarHBondContact O-N 3.4Å; L143-F145 VanDerWaalsContact C-N 3.32Å; L143-F145 PolarHBondContact O-N 2.85Å; L143-V146 PolarHBondContact O-N 2.83Å; L143-Q147 PolarHBondContact O-N 3.14Å
144	S	88.1	Confident	88.2	Confident	55 Å²	55	101.2 Å²	101.2	39%	0.385	50%	0.504	S	S	.	.	H	α-helix	trans	-59.5	-40.3	174.1	-179.3	0	0	0	0	112.2	S140 V141 Q147 N148	S140-S144 PolarHBondContact O-N 2.86Å; S140-S144 VanDerWaalsContact O-N 3.15Å; V141-S144 PolarHBondContact O-N 2.94Å; S144-Q147 PolarHBondContact O-N 3.34Å; S144-N148 WeakPolarHBondContact O-CB 3.31Å; S144-N148 VanDerWaalsContact O-CG 3.26Å; S144-N148 PolarHBondContact O-N 3.34Å; S144-N148 PolarHBondContact O-ND2 3.47Å
145	F	86.9	Confident	89.1	Confident	83 Å²	83	103 Å²	103	36%	0.364	51%	0.514	S	S	.	.	H	α-helix	trans	-63.6	-47.3	175.9	-179.8	-96.6	0	0	0	112.6	I134 V141 K142 L143 Q147 N148 V149	I134-F145 HydrophobicContact CD1-CE1 4.03Å; V141-F145 WeakPolarHBondContact O-CB 3.42Å; V141-F145 PolarHBondContact O-N 2.86Å; K142-F145 WeakPolarHBondContact O-CB 3.26Å; K142-F145 PolarHBondContact O-N 3.42Å; L143-F145 VanDerWaalsContact C-N 3.32Å; L143-F145 PolarHBondContact O-N 2.85Å; F145-Q147 VanDerWaalsContact C-N 3.3Å; F145-Q147 PolarHBondContact O-N 3.28Å; F145-N148 PolarHBondContact O-N 2.85Å; F145-V149 HydrophobicContact CD1-CG2 4.13Å; F145-V149 HydrophobicContact CE1-CG2 3.68Å; F145-V149 HydrophobicContact CE2-CG2 4.18Å; F145-V149 HydrophobicContact CZ-CG2 3.71Å; F145-V149 WeakPolarHBondContact O-CG2 3.34Å; F145-V149 PolarHBondContact O-N 3.48Å
146	V	88.1	Confident	89.9	Confident	95 Å²	95	99.1 Å²	99.1	58%	0.576	51%	0.51	S	S	*	.	H	α-helix	trans	-59.2	-43.7	177.1	172.2	0	0	0	0	110.6	K142 L143 V149 A150	K142-V146 WeakPolarHBondContact O-CG2 3.41Å; K142-V146 PolarHBondContact O-N 3.4Å; L143-V146 PolarHBondContact O-N 2.83Å; V146-V149 PolarHBondContact O-N 3.37Å; V146-A150 WeakPolarHBondContact O-CB 3.47Å; V146-A150 PolarHBondContact O-N 3.08Å
147	Q	91.5	Very high	90.6	Very high	127 Å²	127	98.8 Å²	98.8	59%	0.593	50%	0.502	S	S	*	.	H	α-helix	trans	-61.5	-44.3	175.5	-173.3	178.8	5.4	0	0	111.8	L143 S144 F145 V149 A150 M151	L143-Q147 PolarHBondContact O-N 3.14Å; S144-Q147 PolarHBondContact O-N 3.34Å; F145-Q147 VanDerWaalsContact C-N 3.3Å; F145-Q147 PolarHBondContact O-N 3.28Å; Q147-V149 PolarHBondContact O-N 2.7Å; Q147-A150 PolarHBondContact O-N 3.36Å; Q147-M151 WeakPolarHBondContact O-CB 3.2Å; Q147-M151 PolarHBondContact O-N 2.9Å
148	N	91.8	Very high	91.3	Very high	64 Å²	64	101 Å²	101	34%	0.342	51%	0.514	S	S	.	.	H	α-helix	trans	-63.4	-39.5	177.3	-77.4	-32.7	0	0	0	112.6	S144 F145 M151 R152	S144-N148 WeakPolarHBondContact O-CB 3.31Å; S144-N148 VanDerWaalsContact O-CG 3.26Å; S144-N148 PolarHBondContact O-N 3.34Å; S144-N148 PolarHBondContact O-ND2 3.47Å; F145-N148 PolarHBondContact O-N 2.85Å; N148-M151 PolarHBondContact O-N 3.26Å; N148-R152 WeakPolarHBondContact O-CB 3.26Å; N148-R152 VanDerWaalsContact O-CG 3.29Å; N148-R152 WeakPolarHBondContact O-CG 3.4Å; N148-R152 PolarHBondContact O-N 2.88Å
149	V	90	Very high	91.9	Very high	44 Å²	44	103.9 Å²	103.9	27%	0.267	52%	0.516	S	S	.	.	H	α-helix	trans	-66.4	-44.6	175	172.7	0	0	0	0	110.9	F145 V146 Q147 M151 R152 R153	F145-V149 HydrophobicContact CD1-CG2 4.13Å; F145-V149 HydrophobicContact CE1-CG2 3.68Å; F145-V149 HydrophobicContact CE2-CG2 4.18Å; F145-V149 HydrophobicContact CZ-CG2 3.71Å; F145-V149 WeakPolarHBondContact O-CG2 3.34Å; F145-V149 PolarHBondContact O-N 3.48Å; V146-V149 PolarHBondContact O-N 3.37Å; Q147-V149 PolarHBondContact O-N 2.7Å; V149-M151 VanDerWaalsContact C-N 3.34Å; V149-M151 PolarHBondContact O-N 2.92Å; V149-R152 PolarHBondContact O-N 2.9Å; V149-R153 WeakPolarHBondContact O-CG 3.36Å; V149-R153 PolarHBondContact O-N 2.87Å
150	A	94.3	Very high	92.5	Very high	38 Å²	38	107.7 Å²	107.7	31%	0.314	52%	0.521	S	S	.	.	H	α-helix	trans	-59.4	-46.1	174.9	0	0	0	0	0	110.9	V146 Q147 R152 R153 F154	V146-A150 WeakPolarHBondContact O-CB 3.47Å; V146-A150 PolarHBondContact O-N 3.08Å; Q147-A150 PolarHBondContact O-N 3.36Å; A150-R152 PolarHBondContact O-N 3.45Å; A150-R153 WeakPolarHBondContact O-CB 3.49Å; A150-R153 PolarHBondContact O-N 3.48Å; A150-F154 HydrophobicContact CB-CE2 4.47Å; A150-F154 WeakPolarHBondContact O-CD2 3.14Å; A150-F154 PolarHBondContact O-N 3.26Å
151	M	95.5	Very high	93	Very high	99 Å²	99	107.6 Å²	107.6	49%	0.488	51%	0.509	S	S	.	.	H	α-helix	trans	-62.3	-43.6	178	-173.1	164.6	65.3	0	0	112.3	Q147 N148 V149 R153 F154 I155	Q147-M151 WeakPolarHBondContact O-CB 3.2Å; Q147-M151 PolarHBondContact O-N 2.9Å; N148-M151 PolarHBondContact O-N 3.26Å; V149-M151 VanDerWaalsContact C-N 3.34Å; V149-M151 PolarHBondContact O-N 2.92Å; M151-R153 VanDerWaalsContact C-N 3.3Å; M151-R153 PolarHBondContact O-N 3.41Å; M151-F154 PolarHBondContact O-N 3.49Å; M151-I155 HydrophobicContact CG-CD1 3.95Å; M151-I155 HydrophobicContact CG-CG1 4.46Å; M151-I155 VanDerWaalsContact O-CG1 3.29Å; M151-I155 WeakPolarHBondContact O-CG1 3.28Å; M151-I155 PolarHBondContact O-N 3.37Å
152	R	95.4	Very high	93.4	Very high	181 Å²	181	109.1 Å²	109.1	68%	0.683	52%	0.515	S	S	*	.	H	α-helix	trans	-61.1	-39.1	174.7	-74.5	176	-169.9	-87.2	0.6	112.1	N148 V149 A150 T156	N148-R152 WeakPolarHBondContact O-CB 3.26Å; N148-R152 VanDerWaalsContact O-CG 3.29Å; N148-R152 WeakPolarHBondContact O-CG 3.4Å; N148-R152 PolarHBondContact O-N 2.88Å; V149-R152 PolarHBondContact O-N 2.9Å; A150-R152 PolarHBondContact O-N 3.45Å; R152-T156 WeakPolarHBondContact O-CB 3.45Å; R152-T156 PolarHBondContact O-N 2.86Å; R152-T156 PolarHBondContact O-OG1 3.34Å
153	R	94.3	Very high	93.9	Very high	181 Å²	181	109.2 Å²	109.2	68%	0.683	52%	0.52	S	S	*	.	H	α-helix	trans	-63.9	-45.9	174.2	-73.9	175.7	174.9	150.9	-0.8	111.5	V149 A150 M151 T156 F157	V149-R153 WeakPolarHBondContact O-CG 3.36Å; V149-R153 PolarHBondContact O-N 2.87Å; A150-R153 WeakPolarHBondContact O-CB 3.49Å; A150-R153 PolarHBondContact O-N 3.48Å; M151-R153 VanDerWaalsContact C-N 3.3Å; M151-R153 PolarHBondContact O-N 3.41Å; R153-T156 PolarHBondContact O-N 2.94Å; R153-F157 WeakPolarHBondContact O-CB 3.23Å; R153-F157 PolarHBondContact O-N 3.25Å
154	F	96.6	Very high	94.3	Very high	136 Å²	136	107 Å²	107	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-60.8	-45.9	175.4	-78.1	-64.6	0	0	0	112.2	A150 M151 T156 F157 L158	A150-F154 HydrophobicContact CB-CE2 4.47Å; A150-F154 WeakPolarHBondContact O-CD2 3.14Å; A150-F154 PolarHBondContact O-N 3.26Å; M151-F154 PolarHBondContact O-N 3.49Å; F154-T156 VanDerWaalsContact C-N 3.33Å; F154-T156 PolarHBondContact O-N 3.02Å; F154-F157 WeakPolarHBondContact O-CB 3.36Å; F154-F157 PolarHBondContact O-N 2.71Å; F154-L158 WeakPolarHBondContact O-CB 3.49Å; F154-L158 WeakPolarHBondContact O-CG 3.48Å; F154-L158 PolarHBondContact O-N 3.22Å
155	I	96.8	Very high	94.8	Very high	101 Å²	101	107.1 Å²	107.1	52%	0.518	52%	0.519	S	S	.	.	H	α-helix	trans	-59.5	-45	176.3	-69.2	166.2	0	0	0	110.9	M151 F157 L158 R159	M151-I155 HydrophobicContact CG-CD1 3.95Å; M151-I155 HydrophobicContact CG-CG1 4.46Å; M151-I155 VanDerWaalsContact O-CG1 3.29Å; M151-I155 WeakPolarHBondContact O-CG1 3.28Å; M151-I155 PolarHBondContact O-N 3.37Å; I155-F157 VanDerWaalsContact C-N 3.33Å; I155-F157 PolarHBondContact O-N 2.87Å; I155-L158 PolarHBondContact O-N 3.47Å; I155-R159 WeakPolarHBondContact O-CB 3.34Å; I155-R159 PolarHBondContact O-N 3.23Å
156	T	96.5	Very high	95.3	Very high	95 Å²	95	107.6 Å²	107.6	58%	0.583	52%	0.523	S	S	*	.	H	α-helix	trans	-63.2	-41.3	178.7	-55.2	0	0	0	0	111.3	R152 R153 F154 R159 R160	R152-T156 WeakPolarHBondContact O-CB 3.45Å; R152-T156 PolarHBondContact O-N 2.86Å; R152-T156 PolarHBondContact O-OG1 3.34Å; R153-T156 PolarHBondContact O-N 2.94Å; F154-T156 VanDerWaalsContact C-N 3.33Å; F154-T156 PolarHBondContact O-N 3.02Å; T156-R159 PolarHBondContact O-N 3.22Å; T156-R160 PolarHBondContact O-N 3.48Å
157	F	96.3	Very high	95.7	Very high	121 Å²	121	106.7 Å²	106.7	53%	0.531	52%	0.515	S	S	.	.	H	α-helix	trans	-63.9	-46.8	176.2	175.1	-111.7	0	0	0	112.2	R153 F154 I155 R159 R160 Q161	R153-F157 WeakPolarHBondContact O-CB 3.23Å; R153-F157 PolarHBondContact O-N 3.25Å; F154-F157 WeakPolarHBondContact O-CB 3.36Å; F154-F157 PolarHBondContact O-N 2.71Å; I155-F157 VanDerWaalsContact C-N 3.33Å; I155-F157 PolarHBondContact O-N 2.87Å; F157-R159 VanDerWaalsContact C-N 3.34Å; F157-R159 PolarHBondContact O-N 2.85Å; F157-R160 PolarHBondContact O-N 3.39Å; F157-Q161 VanDerWaalsContact CD1-NE2 3.34Å; F157-Q161 HydrophobicContact CE2-CG 4.39Å; F157-Q161 HydrophobicContact CZ-CG 4.34Å; F157-Q161 PolarHBondContact O-N 3.3Å
158	L	97.3	Very high	96	Very high	106 Å²	106	106.5 Å²	106.5	56%	0.555	52%	0.517	S	S	*	.	H	α-helix	trans	-61.9	-41.3	175.9	-70.2	175.5	0	0	0	111.7	F154 I155 R160 Q161 L162	F154-L158 WeakPolarHBondContact O-CB 3.49Å; F154-L158 WeakPolarHBondContact O-CG 3.48Å; F154-L158 PolarHBondContact O-N 3.22Å; I155-L158 PolarHBondContact O-N 3.47Å; L158-R160 PolarHBondContact O-N 2.9Å; L158-Q161 PolarHBondContact O-N 2.88Å; L158-L162 WeakPolarHBondContact O-CB 3.5Å; L158-L162 PolarHBondContact O-N 2.87Å
159	R	96.9	Very high	96.2	Very high	184 Å²	184	106.4 Å²	106.4	69%	0.694	52%	0.521	S	S	*	.	H	α-helix	trans	-61.3	-43.3	175.4	-176	177.6	178	173.2	0.4	111.9	I155 T156 F157 Q161 L162 V163	I155-R159 WeakPolarHBondContact O-CB 3.34Å; I155-R159 PolarHBondContact O-N 3.23Å; T156-R159 PolarHBondContact O-N 3.22Å; F157-R159 VanDerWaalsContact C-N 3.34Å; F157-R159 PolarHBondContact O-N 2.85Å; R159-Q161 VanDerWaalsContact C-N 3.35Å; R159-L162 PolarHBondContact O-N 2.92Å; R159-V163 WeakPolarHBondContact O-CG2 3.46Å; R159-V163 PolarHBondContact O-N 3.33Å
160	R	96.8	Very high	96.6	Very high	202 Å²	202	110 Å²	110	76%	0.762	53%	0.53	S	S	*	.	H	α-helix	trans	-63	-42.6	177	-177.4	178	177.5	-179.8	-0.5	111.6	T156 F157 L158 S164	T156-R160 PolarHBondContact O-N 3.48Å; F157-R160 PolarHBondContact O-N 3.39Å; L158-R160 PolarHBondContact O-N 2.9Å; R160-S164 WeakPolarHBondContact O-CB 3.36Å; R160-S164 PolarHBondContact O-N 3.42Å
161	Q	96.9	Very high	96.8	Very high	97 Å²	97	111.3 Å²	111.3	45%	0.453	54%	0.537	S	S	.	.	H	α-helix	trans	-64.2	-42.2	175.6	-75.9	-171.2	81.1	0	0	112.1	F157 L158 R159 S164 A165	F157-Q161 VanDerWaalsContact CD1-NE2 3.34Å; F157-Q161 HydrophobicContact CE2-CG 4.39Å; F157-Q161 HydrophobicContact CZ-CG 4.34Å; F157-Q161 PolarHBondContact O-N 3.3Å; L158-Q161 PolarHBondContact O-N 2.88Å; R159-Q161 VanDerWaalsContact C-N 3.35Å; Q161-S164 PolarHBondContact O-N 2.94Å; Q161-A165 WeakPolarHBondContact O-CB 3.4Å; Q161-A165 PolarHBondContact O-N 2.92Å
162	L	97.3	Very high	96.9	Very high	100 Å²	100	111 Å²	111	52%	0.524	54%	0.537	S	S	.	.	H	α-helix	trans	-59.6	-49.7	176.7	-178.6	66.1	0	0	0	111.1	L158 R159 S164 A165 E166	L158-L162 WeakPolarHBondContact O-CB 3.5Å; L158-L162 PolarHBondContact O-N 2.87Å; R159-L162 PolarHBondContact O-N 2.92Å; L162-S164 VanDerWaalsContact C-N 3.33Å; L162-S164 PolarHBondContact O-N 3.41Å; L162-A165 PolarHBondContact O-N 3.24Å; L162-E166 HydrophobicContact CD1-CG 4.46Å; L162-E166 WeakPolarHBondContact O-CB 3.46Å; L162-E166 WeakPolarHBondContact O-CG 3.49Å; L162-E166 PolarHBondContact O-N 3.45Å
163	V	97.1	Very high	97	Very high	62 Å²	62	106.4 Å²	106.4	38%	0.376	53%	0.526	S	S	.	.	H	α-helix	trans	-59.3	-44.8	176.8	172.7	0	0	0	0	110.9	R159 A165 E166 D167	R159-V163 WeakPolarHBondContact O-CG2 3.46Å; R159-V163 PolarHBondContact O-N 3.33Å; V163-A165 VanDerWaalsContact C-N 3.33Å; V163-A165 PolarHBondContact O-N 3.38Å; V163-E166 PolarHBondContact O-N 2.92Å; V163-D167 WeakPolarHBondContact O-CB 3.48Å; V163-D167 PolarHBondContact O-N 3.48Å
164	S	96.7	Very high	97.2	Very high	76 Å²	76	102.4 Å²	102.4	53%	0.531	52%	0.515	S	S	.	.	H	α-helix	trans	-63.1	-37.4	177.6	-172.3	0	0	0	0	113	R160 Q161 L162 L168	R160-S164 WeakPolarHBondContact O-CB 3.36Å; R160-S164 PolarHBondContact O-N 3.42Å; Q161-S164 PolarHBondContact O-N 2.94Å; L162-S164 VanDerWaalsContact C-N 3.33Å; L162-S164 PolarHBondContact O-N 3.41Å; S164-L168 WeakPolarHBondContact O-CB 3.21Å; S164-L168 PolarHBondContact O-N 2.85Å
165	A	97.2	Very high	97.2	Very high	57 Å²	57	101 Å²	101	47%	0.471	51%	0.51	S	S	.	.	H	α-helix	trans	-71.5	-38.3	176.7	0	0	0	0	0	111.6	Q161 L162 V163 S169	Q161-A165 WeakPolarHBondContact O-CB 3.4Å; Q161-A165 PolarHBondContact O-N 2.92Å; L162-A165 PolarHBondContact O-N 3.24Å; V163-A165 VanDerWaalsContact C-N 3.33Å; V163-A165 PolarHBondContact O-N 3.38Å; A165-S169 VanDerWaalsContact O-CB 3.24Å; A165-S169 WeakPolarHBondContact O-CB 3.25Å; A165-S169 PolarHBondContact O-N 3.11Å
166	E	97.3	Very high	97.3	Very high	94 Å²	94	99.9 Å²	99.9	44%	0.439	51%	0.505	S	S	.	.	H	α-helix	trans	-64.6	-43.5	173.2	-75.4	175.2	-176.8	0	0	111.7	L162 V163 S169 R170	L162-E166 HydrophobicContact CD1-CG 4.46Å; L162-E166 WeakPolarHBondContact O-CB 3.46Å; L162-E166 WeakPolarHBondContact O-CG 3.49Å; L162-E166 PolarHBondContact O-N 3.45Å; V163-E166 PolarHBondContact O-N 2.92Å; E166-S169 PolarHBondContact O-N 3.3Å; E166-R170 VanDerWaalsContact O-CB 3.29Å; E166-R170 WeakPolarHBondContact O-CB 3.37Å; E166-R170 PolarHBondContact O-N 3.36Å
167	D	97.1	Very high	97.4	Very high	75 Å²	75	102.1 Å²	102.1	40%	0.401	51%	0.507	S	S	.	.	H	α-helix	trans	-63.8	-43.3	177.1	-69.4	-19.5	0	0	0	111.2	V163 R170 S171	V163-D167 WeakPolarHBondContact O-CB 3.48Å; V163-D167 PolarHBondContact O-N 3.48Å; D167-R170 PolarHBondContact O-N 3.4Å; D167-R170 IonicContact OD1-CZ 2.84Å; D167-R170 IonicContact OD1-NH1 2.64Å; D167-R170 PolarHBondContact OD1-NH1 3.42Å; D167-R170 IonicContact OD1-NH2 3.22Å; D167-S171 WeakPolarHBondContact O-CB 3.29Å; D167-S171 PolarHBondContact O-N 3.43Å
168	L	97.4	Very high	97.4	Very high	123 Å²	123	103 Å²	103	64%	0.644	51%	0.51	S	S	*	.	H	α-helix	trans	-64.1	-44.8	174.9	-177.4	62.6	0	0	0	111.7	S164 R170 S171 L172	S164-L168 WeakPolarHBondContact O-CB 3.21Å; S164-L168 PolarHBondContact O-N 2.85Å; L168-R170 VanDerWaalsContact C-N 3.31Å; L168-R170 PolarHBondContact O-N 3.04Å; L168-S171 PolarHBondContact O-N 3.26Å; L168-L172 WeakPolarHBondContact O-CB 3.49Å; L168-L172 PolarHBondContact O-N 2.87Å
169	S	97.7	Very high	97.5	Very high	62 Å²	62	102 Å²	102	43%	0.434	51%	0.505	S	S	.	.	H	α-helix	trans	-61	-39.9	175.2	-180	0	0	0	0	111.7	A165 E166 N173	A165-S169 VanDerWaalsContact O-CB 3.24Å; A165-S169 WeakPolarHBondContact O-CB 3.25Å; A165-S169 PolarHBondContact O-N 3.11Å; E166-S169 PolarHBondContact O-N 3.3Å; S169-N173 WeakPolarHBondContact O-CB 3.35Å; S169-N173 VanDerWaalsContact O-CG 3.29Å; S169-N173 PolarHBondContact O-N 3.38Å; S169-N173 PolarHBondContact O-ND2 2.92Å
170	R	97.8	Very high	97.5	Very high	120 Å²	120	96.7 Å²	96.7	45%	0.453	49%	0.493	S	S	.	.	H	α-helix	trans	-64.7	-48.5	175.9	-165.6	-178.7	-53.7	106.3	6.3	111.2	E166 D167 L168 L172 N173 E174	E166-R170 VanDerWaalsContact O-CB 3.29Å; E166-R170 WeakPolarHBondContact O-CB 3.37Å; E166-R170 PolarHBondContact O-N 3.36Å; D167-R170 PolarHBondContact O-N 3.4Å; D167-R170 IonicContact OD1-CZ 2.84Å; D167-R170 IonicContact OD1-NH1 2.64Å; D167-R170 PolarHBondContact OD1-NH1 3.42Å; D167-R170 IonicContact OD1-NH2 3.22Å; L168-R170 VanDerWaalsContact C-N 3.31Å; L168-R170 PolarHBondContact O-N 3.04Å; R170-L172 PolarHBondContact O-N 3.4Å; R170-N173 PolarHBondContact O-N 2.92Å; R170-E174 WeakPolarHBondContact O-CG 3.41Å; R170-E174 PolarHBondContact O-N 3.25Å
171	S	97.8	Very high	97.6	Very high	65 Å²	65	92.1 Å²	92.1	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-58.8	-46.1	177.1	-173.2	0	0	0	0	111.9	D167 L168 N173 E174 E175	D167-S171 WeakPolarHBondContact O-CB 3.29Å; D167-S171 PolarHBondContact O-N 3.43Å; L168-S171 PolarHBondContact O-N 3.26Å; S171-N173 VanDerWaalsContact C-N 3.33Å; S171-N173 PolarHBondContact O-N 2.69Å; S171-E174 PolarHBondContact O-N 2.93Å; S171-E175 PolarHBondContact O-N 3.38Å
172	L	98.2	Very high	97.6	Very high	93 Å²	93	92.8 Å²	92.8	49%	0.487	49%	0.486	S	S	.	.	H	α-helix	trans	-65	-37.5	178.8	-174.5	64.5	0	0	0	111.8	L168 R170 E175 N176	L168-L172 WeakPolarHBondContact O-CB 3.49Å; L168-L172 PolarHBondContact O-N 2.87Å; R170-L172 PolarHBondContact O-N 3.4Å; L172-E175 PolarHBondContact O-N 2.82Å; L172-N176 WeakPolarHBondContact O-CB 3.47Å; L172-N176 PolarHBondContact O-N 2.85Å; L172-N176 PolarHBondContact O-ND2 3.45Å
173	N	98	Very high	97.7	Very high	84 Å²	84	93.9 Å²	93.9	45%	0.449	49%	0.487	S	S	.	.	H	α-helix	trans	-67.8	-38.4	175.1	-80.7	-45.5	0	0	0	112.6	S169 R170 S171 K177	S169-N173 WeakPolarHBondContact O-CB 3.35Å; S169-N173 VanDerWaalsContact O-CG 3.29Å; S169-N173 PolarHBondContact O-N 3.38Å; S169-N173 PolarHBondContact O-ND2 2.92Å; R170-N173 PolarHBondContact O-N 2.92Å; S171-N173 VanDerWaalsContact C-N 3.33Å; S171-N173 PolarHBondContact O-N 2.69Å; N173-K177 WeakPolarHBondContact O-CB 3.22Å; N173-K177 VanDerWaalsContact O-CG 3.26Å; N173-K177 WeakPolarHBondContact O-CG 3.42Å; N173-K177 PolarHBondContact O-N 3.41Å
174	E	97.3	Very high	97.7	Very high	98 Å²	98	96.7 Å²	96.7	46%	0.458	50%	0.496	S	S	.	.	H	α-helix	trans	-65	-42.1	174.4	-73.3	173.1	-165.7	0	0	111.7	R170 S171 K177 K178	R170-E174 WeakPolarHBondContact O-CG 3.41Å; R170-E174 PolarHBondContact O-N 3.25Å; S171-E174 PolarHBondContact O-N 2.93Å; E174-K177 PolarHBondContact O-N 3.18Å; E174-K178 WeakPolarHBondContact O-CG 3.47Å; E174-K178 PolarHBondContact O-N 3.22Å
175	E	97.9	Very high	97.7	Very high	106 Å²	106	97.6 Å²	97.6	50%	0.495	50%	0.499	S	S	.	.	H	α-helix	trans	-63.8	-46.8	175.3	-171.3	178.8	172.5	0	0	111.6	S171 L172 K177 K178 L179	S171-E175 PolarHBondContact O-N 3.38Å; L172-E175 PolarHBondContact O-N 2.82Å; E175-K177 VanDerWaalsContact C-N 3.27Å; E175-K177 PolarHBondContact O-N 3.39Å; E175-K178 WeakPolarHBondContact O-CB 3.5Å; E175-K178 PolarHBondContact O-N 3.42Å; E175-L179 HydrophobicContact CG-CD1 4.09Å; E175-L179 HydrophobicContact CG-CG 4.42Å; E175-L179 WeakPolarHBondContact O-CG 3.4Å; E175-L179 PolarHBondContact O-N 2.99Å
176	N	97.8	Very high	97.8	Very high	78 Å²	78	99.5 Å²	99.5	42%	0.417	50%	0.5	S	S	.	.	H	α-helix	trans	-58.8	-38.5	174.8	-79.7	-46.3	0	0	0	112.3	L172 L179 T180	L172-N176 WeakPolarHBondContact O-CB 3.47Å; L172-N176 PolarHBondContact O-N 2.85Å; L172-N176 PolarHBondContact O-ND2 3.45Å; N176-L179 PolarHBondContact O-N 3.48Å; N176-T180 WeakPolarHBondContact O-CB 3.42Å; N176-T180 VanDerWaalsContact O-CG2 3.28Å; N176-T180 WeakPolarHBondContact O-CG2 3.47Å; N176-T180 PolarHBondContact O-N 3.31Å; N176-T180 PolarHBondContact O-OG1 2.88Å
177	K	98	Very high	97.8	Very high	141 Å²	141	100 Å²	100	61%	0.613	50%	0.503	S	S	*	.	H	α-helix	trans	-64.3	-40.7	173.5	-75.7	173	-177.1	180	0	112.3	N173 E174 E175 T180 L181	N173-K177 WeakPolarHBondContact O-CB 3.22Å; N173-K177 VanDerWaalsContact O-CG 3.26Å; N173-K177 WeakPolarHBondContact O-CG 3.42Å; N173-K177 PolarHBondContact O-N 3.41Å; E174-K177 PolarHBondContact O-N 3.18Å; E175-K177 VanDerWaalsContact C-N 3.27Å; E175-K177 PolarHBondContact O-N 3.39Å; K177-T180 VanDerWaalsContact CA-OG1 3.26Å; K177-T180 WeakPolarHBondContact CA-OG1 3.32Å; K177-T180 PolarHBondContact O-OG1 3Å; K177-L181 VanDerWaalsContact O-CG 3.32Å; K177-L181 WeakPolarHBondContact O-CG 2.84Å; K177-L181 PolarHBondContact O-N 2.93Å; K177-L181 VanDerWaalsContact O-N 3.13Å
178	K	97.9	Very high	97.8	Very high	140 Å²	140	98.4 Å²	98.4	61%	0.609	50%	0.504	S	S	*	.	H	α-helix	trans	-64.9	-46.9	175.8	-70.9	171	-175.4	174.9	0	111.2	E174 E175 T180 L181 E182	E174-K178 WeakPolarHBondContact O-CG 3.47Å; E174-K178 PolarHBondContact O-N 3.22Å; E175-K178 WeakPolarHBondContact O-CB 3.5Å; E175-K178 PolarHBondContact O-N 3.42Å; K178-T180 PolarHBondContact O-N 2.88Å; K178-L181 PolarHBondContact O-N 3.45Å; K178-E182 WeakPolarHBondContact O-CB 3.36Å; K178-E182 PolarHBondContact O-N 2.95Å
179	L	98.2	Very high	97.8	Very high	86 Å²	86	97.3 Å²	97.3	45%	0.45	50%	0.498	S	S	.	.	H	α-helix	trans	-64.8	-37.3	179.6	-71	173.2	0	0	0	112.5	E175 N176 E182 K183	E175-L179 HydrophobicContact CG-CD1 4.09Å; E175-L179 HydrophobicContact CG-CG 4.42Å; E175-L179 WeakPolarHBondContact O-CG 3.4Å; E175-L179 PolarHBondContact O-N 2.99Å; N176-L179 PolarHBondContact O-N 3.48Å; L179-E182 PolarHBondContact O-N 3.23Å; L179-K183 VanDerWaalsContact O-CB 3.26Å; L179-K183 WeakPolarHBondContact O-CB 3.23Å; L179-K183 PolarHBondContact O-N 3.34Å
180	T	98.2	Very high	97.8	Very high	71 Å²	71	100.2 Å²	100.2	44%	0.436	51%	0.508	S	S	.	.	H	α-helix	trans	-65.6	-45.5	175	43	0	0	0	0	111.7	N176 K177 K178 K183 E184	N176-T180 WeakPolarHBondContact O-CB 3.42Å; N176-T180 VanDerWaalsContact O-CG2 3.28Å; N176-T180 WeakPolarHBondContact O-CG2 3.47Å; N176-T180 PolarHBondContact O-N 3.31Å; N176-T180 PolarHBondContact O-OG1 2.88Å; K177-T180 VanDerWaalsContact CA-OG1 3.26Å; K177-T180 WeakPolarHBondContact CA-OG1 3.32Å; K177-T180 PolarHBondContact O-OG1 3Å; K178-T180 PolarHBondContact O-N 2.88Å; T180-K183 PolarHBondContact O-N 3.18Å; T180-E184 WeakPolarHBondContact O-CG 3.44Å; T180-E184 PolarHBondContact O-N 3.03Å
181	L	97.5	Very high	97.8	Very high	106 Å²	106	99.7 Å²	99.7	56%	0.555	51%	0.514	S	S	*	.	H	α-helix	trans	-61.9	-44.4	174	-69.6	173	0	0	0	112.1	K177 K178 K183 E184 T185	K177-L181 VanDerWaalsContact O-CG 3.32Å; K177-L181 WeakPolarHBondContact O-CG 2.84Å; K177-L181 PolarHBondContact O-N 2.93Å; K177-L181 VanDerWaalsContact O-N 3.13Å; K178-L181 PolarHBondContact O-N 3.45Å; L181-K183 VanDerWaalsContact C-N 3.35Å; L181-K183 PolarHBondContact O-N 2.94Å; L181-E184 PolarHBondContact O-N 3.08Å; L181-T185 VanDerWaalsContact O-CG2 3.29Å; L181-T185 WeakPolarHBondContact O-CG2 3.35Å; L181-T185 PolarHBondContact O-N 3.43Å; L181-T185 PolarHBondContact O-OG1 3.06Å
182	E	98	Very high	97.8	Very high	111 Å²	111	99.9 Å²	99.9	52%	0.519	52%	0.515	S	S	.	.	H	α-helix	trans	-59.4	-46.9	176.5	-175.8	176.2	179.2	0	0	111	K178 L179 E184 T185 L186	K178-E182 WeakPolarHBondContact O-CB 3.36Å; K178-E182 PolarHBondContact O-N 2.95Å; L179-E182 PolarHBondContact O-N 3.23Å; E182-E184 PolarHBondContact O-N 3.37Å; E182-T185 WeakPolarHBondContact CA-OG1 3.45Å; E182-T185 PolarHBondContact O-N 2.84Å; E182-T185 PolarHBondContact O-OG1 3.25Å; E182-L186 HydrophobicContact CG-CD1 4.11Å; E182-L186 HydrophobicContact CG-CG 4.48Å; E182-L186 WeakPolarHBondContact O-CG 3.38Å; E182-L186 PolarHBondContact O-N 2.98Å
183	K	98.1	Very high	97.7	Very high	124 Å²	124	100.5 Å²	100.5	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-56.3	-49.1	175	179.6	-176.2	169.1	-174.6	0	111.8	L179 T180 L181 T185 L186 E187	L179-K183 VanDerWaalsContact O-CB 3.26Å; L179-K183 WeakPolarHBondContact O-CB 3.23Å; L179-K183 PolarHBondContact O-N 3.34Å; T180-K183 PolarHBondContact O-N 3.18Å; L181-K183 VanDerWaalsContact C-N 3.35Å; L181-K183 PolarHBondContact O-N 2.94Å; K183-T185 VanDerWaalsContact C-N 3.32Å; K183-T185 PolarHBondContact O-N 3.42Å; K183-L186 PolarHBondContact O-N 3.38Å; K183-E187 WeakPolarHBondContact CE-OE1 3.4Å; K183-E187 HydrophobicContact CG-CG 4.42Å; K183-E187 IonicContact NZ-OE1 3.89Å; K183-E187 WeakPolarHBondContact O-CB 3.26Å; K183-E187 WeakPolarHBondContact O-CG 3.26Å; K183-E187 PolarHBondContact O-N 3.44Å
184	E	97.7	Very high	97.7	Very high	121 Å²	121	99.1 Å²	99.1	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-60.2	-41.8	178.5	-73.4	172.4	-176.2	0	0	111.9	T180 L181 E182 E187 G188	T180-E184 WeakPolarHBondContact O-CG 3.44Å; T180-E184 PolarHBondContact O-N 3.03Å; L181-E184 PolarHBondContact O-N 3.08Å; E182-E184 PolarHBondContact O-N 3.37Å; E184-E187 PolarHBondContact O-N 3.41Å; E184-G188 PolarHBondContact O-N 3.13Å
185	T	97.2	Very high	97.7	Very high	95 Å²	95	98.5 Å²	98.5	58%	0.583	51%	0.51	S	S	*	.	H	α-helix	trans	-65.9	-40.9	177.1	62	0	0	0	0	112.5	L181 E182 K183 G188 L189	L181-T185 VanDerWaalsContact O-CG2 3.29Å; L181-T185 WeakPolarHBondContact O-CG2 3.35Å; L181-T185 PolarHBondContact O-N 3.43Å; L181-T185 PolarHBondContact O-OG1 3.06Å; E182-T185 WeakPolarHBondContact CA-OG1 3.45Å; E182-T185 PolarHBondContact O-N 2.84Å; E182-T185 PolarHBondContact O-OG1 3.25Å; K183-T185 VanDerWaalsContact C-N 3.32Å; K183-T185 PolarHBondContact O-N 3.42Å; T185-G188 PolarHBondContact O-N 2.91Å; T185-L189 WeakPolarHBondContact O-CB 3.49Å; T185-L189 PolarHBondContact O-N 3.01Å
186	L	97.8	Very high	97.7	Very high	97 Å²	97	97.6 Å²	97.6	51%	0.508	51%	0.506	S	S	.	.	H	α-helix	trans	-68	-39.9	177.1	-71.8	175.7	0	0	0	111.7	E182 K183 L189 L190	E182-L186 HydrophobicContact CG-CD1 4.11Å; E182-L186 HydrophobicContact CG-CG 4.48Å; E182-L186 WeakPolarHBondContact O-CG 3.38Å; E182-L186 PolarHBondContact O-N 2.98Å; K183-L186 PolarHBondContact O-N 3.38Å; L186-L189 PolarHBondContact O-N 2.95Å; L186-L190 VanDerWaalsContact O-CB 3.23Å; L186-L190 WeakPolarHBondContact O-CB 3.45Å; L186-L190 PolarHBondContact O-N 3.26Å
187	E	98	Very high	97.7	Very high	105 Å²	105	97.2 Å²	97.2	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-42.9	174.2	-75.2	177.8	172.1	0	0	111.5	K183 E184 L190 L191	K183-E187 WeakPolarHBondContact CE-OE1 3.4Å; K183-E187 HydrophobicContact CG-CG 4.42Å; K183-E187 IonicContact NZ-OE1 3.89Å; K183-E187 WeakPolarHBondContact O-CB 3.26Å; K183-E187 WeakPolarHBondContact O-CG 3.26Å; K183-E187 PolarHBondContact O-N 3.44Å; E184-E187 PolarHBondContact O-N 3.41Å; E187-L190 PolarHBondContact O-N 2.96Å; E187-L191 WeakPolarHBondContact O-CB 3.29Å; E187-L191 PolarHBondContact O-N 3.36Å
188	G	97.6	Very high	97.7	Very high	41 Å²	41	96 Å²	96	42%	0.423	50%	0.503	S	S	.	.	H	α-helix	trans	-62.5	-43.2	174.3	0	0	0	0	0	113	E184 T185 L191 S192	E184-G188 PolarHBondContact O-N 3.13Å; T185-G188 PolarHBondContact O-N 2.91Å; G188-L191 PolarHBondContact O-N 2.98Å; G188-S192 WeakPolarHBondContact O-CB 3.36Å; G188-S192 PolarHBondContact O-N 2.94Å
189	L	97.6	Very high	97.7	Very high	99 Å²	99	96.6 Å²	96.6	52%	0.518	51%	0.506	S	S	.	.	H	α-helix	trans	-64.9	-43.7	175.5	-179.5	61.8	0	0	0	111.6	T185 L186 L191 S192 K193	T185-L189 WeakPolarHBondContact O-CB 3.49Å; T185-L189 PolarHBondContact O-N 3.01Å; L186-L189 PolarHBondContact O-N 2.95Å; L189-L191 VanDerWaalsContact C-N 3.33Å; L189-L191 PolarHBondContact O-N 3.44Å; L189-S192 PolarHBondContact O-N 3.25Å; L189-K193 HydrophobicContact CD1-CG 4.28Å; L189-K193 WeakPolarHBondContact O-CB 3.28Å; L189-K193 WeakPolarHBondContact O-CG 3.41Å; L189-K193 PolarHBondContact O-N 3.3Å
190	L	97.7	Very high	97.6	Very high	124 Å²	124	96.7 Å²	96.7	65%	0.649	51%	0.506	S	S	*	.	H	α-helix	trans	-61.3	-42.5	177.2	179.8	64.1	0	0	0	111.1	L186 E187 K193 S194	L186-L190 VanDerWaalsContact O-CB 3.23Å; L186-L190 WeakPolarHBondContact O-CB 3.45Å; L186-L190 PolarHBondContact O-N 3.26Å; E187-L190 PolarHBondContact O-N 2.96Å; L190-K193 PolarHBondContact O-N 2.95Å; L190-S194 WeakPolarHBondContact O-CB 3.26Å; L190-S194 PolarHBondContact O-N 3.34Å
191	L	97.8	Very high	97.6	Very high	109 Å²	109	100.6 Å²	100.6	57%	0.571	52%	0.517	S	S	*	.	H	α-helix	trans	-62.7	-46.7	175.7	-179.2	61.6	0	0	0	111.3	E187 G188 L189 K193 S194 L195	E187-L191 WeakPolarHBondContact O-CB 3.29Å; E187-L191 PolarHBondContact O-N 3.36Å; G188-L191 PolarHBondContact O-N 2.98Å; L189-L191 VanDerWaalsContact C-N 3.33Å; L189-L191 PolarHBondContact O-N 3.44Å; L191-K193 PolarHBondContact O-N 2.86Å; L191-S194 WeakPolarHBondContact O-CB 3.47Å; L191-S194 PolarHBondContact O-N 3.46Å; L191-L195 HydrophobicContact CG-CD1 4.45Å; L191-L195 WeakPolarHBondContact O-CG 3.32Å; L191-L195 PolarHBondContact O-N 3.38Å
192	S	96.6	Very high	97.7	Very high	69 Å²	69	101 Å²	101	48%	0.483	52%	0.516	S	S	.	.	H	α-helix	trans	-58.3	-46.9	176.7	-177.9	0	0	0	0	111.8	G188 L189 L195 E196	G188-S192 WeakPolarHBondContact O-CB 3.36Å; G188-S192 PolarHBondContact O-N 2.94Å; L189-S192 PolarHBondContact O-N 3.25Å; S192-L195 PolarHBondContact O-N 3.29Å; S192-E196 PolarHBondContact O-N 3.27Å
193	K	97.5	Very high	97.7	Very high	106 Å²	106	99.7 Å²	99.7	46%	0.461	51%	0.512	S	S	.	.	H	α-helix	trans	-67	-37.8	176.7	-70.5	-60.9	179.3	-172.7	0	112.9	L189 L190 L191 L195 E196 C197	L189-K193 HydrophobicContact CD1-CG 4.28Å; L189-K193 WeakPolarHBondContact O-CB 3.28Å; L189-K193 WeakPolarHBondContact O-CG 3.41Å; L189-K193 PolarHBondContact O-N 3.3Å; L190-K193 PolarHBondContact O-N 2.95Å; L191-K193 PolarHBondContact O-N 2.86Å; K193-L195 VanDerWaalsContact C-N 3.32Å; K193-L195 PolarHBondContact O-N 3.29Å; K193-E196 WeakPolarHBondContact CD-OE2 3.36Å; K193-E196 IonicContact NZ-OE1 2.9Å; K193-E196 IonicContact NZ-OE2 3.91Å; K193-E196 PolarHBondContact NZ-OE2 3.43Å; K193-E196 PolarHBondContact O-N 3.46Å; K193-C197 WeakPolarHBondContact O-CB 3.34Å; K193-C197 PolarHBondContact O-N 2.79Å; K193-C197 PolarHBondContact O-SG 2.89Å
194	S	97.9	Very high	97.7	Very high	54 Å²	54	98.4 Å²	98.4	38%	0.378	51%	0.51	S	S	.	.	H	α-helix	trans	-60.2	-43	173.3	-173.5	0	0	0	0	111.5	L190 L191 C197 K198	L190-S194 WeakPolarHBondContact O-CB 3.26Å; L190-S194 PolarHBondContact O-N 3.34Å; L191-S194 WeakPolarHBondContact O-CB 3.47Å; L191-S194 PolarHBondContact O-N 3.46Å; S194-C197 PolarHBondContact O-N 3.44Å; S194-K198 WeakPolarHBondContact O-CG 3.46Å; S194-K198 PolarHBondContact O-N 2.82Å
195	L	97.2	Very high	97.7	Very high	85 Å²	85	98.1 Å²	98.1	45%	0.445	51%	0.509	S	S	.	.	H	α-helix	trans	-66.1	-41.7	175.6	-69.5	173.6	0	0	0	112.3	L191 S192 K193 K198 K199	L191-L195 HydrophobicContact CG-CD1 4.45Å; L191-L195 WeakPolarHBondContact O-CG 3.32Å; L191-L195 PolarHBondContact O-N 3.38Å; S192-L195 PolarHBondContact O-N 3.29Å; K193-L195 VanDerWaalsContact C-N 3.32Å; K193-L195 PolarHBondContact O-N 3.29Å; L195-K198 PolarHBondContact O-N 3Å; L195-K199 WeakPolarHBondContact O-CG 3.33Å; L195-K199 PolarHBondContact O-N 2.95Å
196	E	97.6	Very high	97.7	Very high	87 Å²	87	98.3 Å²	98.3	41%	0.407	50%	0.503	S	S	.	.	H	α-helix	trans	-60.2	-47	174	-171.6	-178.5	175.5	0	0	111.2	S192 K193 K198 K199 L200	S192-E196 PolarHBondContact O-N 3.27Å; K193-E196 WeakPolarHBondContact CD-OE2 3.36Å; K193-E196 IonicContact NZ-OE1 2.9Å; K193-E196 IonicContact NZ-OE2 3.91Å; K193-E196 PolarHBondContact NZ-OE2 3.43Å; K193-E196 PolarHBondContact O-N 3.46Å; E196-K198 VanDerWaalsContact C-N 3.29Å; E196-K198 PolarHBondContact O-N 3.47Å; E196-K199 PolarHBondContact O-N 3.43Å; E196-L200 HydrophobicContact CG-CD1 4.33Å; E196-L200 WeakPolarHBondContact O-CG 3.46Å; E196-L200 PolarHBondContact O-N 3.46Å
197	C	97.4	Very high	97.7	Very high	70 Å²	70	99 Å²	99	47%	0.473	50%	0.502	S	S	.	.	H	α-helix	trans	-60.2	-36.6	175.4	-70.6	0	0	0	0	112.6	K193 S194 K201	K193-C197 WeakPolarHBondContact O-CB 3.34Å; K193-C197 PolarHBondContact O-N 2.79Å; K193-C197 PolarHBondContact O-SG 2.89Å; S194-C197 PolarHBondContact O-N 3.44Å; C197-K201 WeakPolarHBondContact O-CB 3.33Å; C197-K201 VanDerWaalsContact O-CG 3.29Å; C197-K201 WeakPolarHBondContact O-CG 3.45Å; C197-K201 PolarHBondContact O-N 2.94Å
198	K	97.8	Very high	97.7	Very high	116 Å²	116	98.5 Å²	98.5	50%	0.504	50%	0.503	S	S	.	.	H	α-helix	trans	-64	-49.3	174.6	-75.2	176.7	-177.8	-177.1	0	111.7	S194 L195 E196 L200 K201 E202	S194-K198 WeakPolarHBondContact O-CG 3.46Å; S194-K198 PolarHBondContact O-N 2.82Å; L195-K198 PolarHBondContact O-N 3Å; E196-K198 VanDerWaalsContact C-N 3.29Å; E196-K198 PolarHBondContact O-N 3.47Å; K198-L200 VanDerWaalsContact C-N 3.3Å; K198-L200 PolarHBondContact O-N 2.88Å; K198-K201 WeakPolarHBondContact O-CB 3.39Å; K198-K201 PolarHBondContact O-N 2.73Å; K198-K201 VanDerWaalsContact O-N 3.13Å; K198-E202 WeakPolarHBondContact O-CG 3.4Å; K198-E202 PolarHBondContact O-N 3.26Å
199	K	97.5	Very high	97.7	Very high	153 Å²	153	101.4 Å²	101.4	67%	0.665	51%	0.505	S	S	*	.	H	α-helix	trans	-59	-40.9	177.1	-68.5	177.1	-179.4	-178	0	112.4	L195 E196 E202 L203	L195-K199 WeakPolarHBondContact O-CG 3.33Å; L195-K199 PolarHBondContact O-N 2.95Å; E196-K199 PolarHBondContact O-N 3.43Å; K199-E202 PolarHBondContact O-N 2.92Å; K199-L203 WeakPolarHBondContact O-CB 3.35Å; K199-L203 PolarHBondContact O-N 3.42Å
200	L	97.8	Very high	97.7	Very high	88 Å²	88	101.4 Å²	101.4	46%	0.461	50%	0.501	S	S	.	.	H	α-helix	trans	-66.2	-39.6	176.7	-71.3	174.1	0	0	0	111.9	E196 K198 L203 I204	E196-L200 HydrophobicContact CG-CD1 4.33Å; E196-L200 WeakPolarHBondContact O-CG 3.46Å; E196-L200 PolarHBondContact O-N 3.46Å; K198-L200 VanDerWaalsContact C-N 3.3Å; K198-L200 PolarHBondContact O-N 2.88Å; L200-L203 PolarHBondContact O-N 3.13Å; L200-I204 VanDerWaalsContact O-CG1 3.25Å; L200-I204 WeakPolarHBondContact O-CG1 3.38Å; L200-I204 PolarHBondContact O-N 3.34Å
201	K	98.1	Very high	97.7	Very high	153 Å²	153	99.9 Å²	99.9	67%	0.665	49%	0.493	S	S	*	.	H	α-helix	trans	-63.4	-42.8	174.5	-76.6	177.5	179.7	-171.7	0	112.2	C197 K198 I204 Q205	C197-K201 WeakPolarHBondContact O-CB 3.33Å; C197-K201 VanDerWaalsContact O-CG 3.29Å; C197-K201 WeakPolarHBondContact O-CG 3.45Å; C197-K201 PolarHBondContact O-N 2.94Å; K198-K201 WeakPolarHBondContact O-CB 3.39Å; K198-K201 PolarHBondContact O-N 2.73Å; K198-K201 VanDerWaalsContact O-N 3.13Å; K201-I204 PolarHBondContact O-N 3.38Å; K201-Q205 WeakPolarHBondContact O-CB 3.41Å; K201-Q205 PolarHBondContact O-N 2.87Å
202	E	97.9	Very high	97.7	Very high	114 Å²	114	101 Å²	101	53%	0.533	50%	0.496	S	S	.	.	H	α-helix	trans	-60.3	-46.1	174.8	-71.2	165.7	-178.1	0	0	111	K198 K199 I204 Q205 E206	K198-E202 WeakPolarHBondContact O-CG 3.4Å; K198-E202 PolarHBondContact O-N 3.26Å; K199-E202 PolarHBondContact O-N 2.92Å; E202-I204 PolarHBondContact O-N 3.44Å; E202-Q205 WeakPolarHBondContact O-CB 3.24Å; E202-Q205 PolarHBondContact O-N 3.29Å; E202-E206 WeakPolarHBondContact O-CG 3.39Å; E202-E206 PolarHBondContact O-N 2.95Å
203	L	97.9	Very high	97.7	Very high	83 Å²	83	103.4 Å²	103.4	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-62.1	-42	176.7	-179	64.5	0	0	0	112.4	K199 L200 Q205 E206 K207	K199-L203 WeakPolarHBondContact O-CB 3.35Å; K199-L203 PolarHBondContact O-N 3.42Å; L200-L203 PolarHBondContact O-N 3.13Å; L203-Q205 VanDerWaalsContact C-N 3.35Å; L203-E206 PolarHBondContact O-N 3.35Å; L203-K207 WeakPolarHBondContact O-CG 3.42Å; L203-K207 PolarHBondContact O-N 3.37Å; L203-K207 VanDerWaalsContact O-N 3.08Å
204	I	98	Very high	97.7	Very high	97 Å²	97	104.9 Å²	104.9	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-60.7	-47.5	175.6	-71.5	164.9	0	0	0	109.6	L200 K201 E202 E206 K207 D208	L200-I204 VanDerWaalsContact O-CG1 3.25Å; L200-I204 WeakPolarHBondContact O-CG1 3.38Å; L200-I204 PolarHBondContact O-N 3.34Å; K201-I204 PolarHBondContact O-N 3.38Å; E202-I204 PolarHBondContact O-N 3.44Å; I204-E206 VanDerWaalsContact C-N 3.34Å; I204-E206 PolarHBondContact O-N 2.72Å; I204-K207 PolarHBondContact O-N 3.23Å; I204-D208 WeakPolarHBondContact CG2-OD2 3.37Å; I204-D208 PolarHBondContact O-N 2.9Å
205	Q	98	Very high	97.7	Very high	116 Å²	116	107.7 Å²	107.7	54%	0.542	51%	0.513	S	S	.	.	H	α-helix	trans	-59.2	-42.6	178.5	-173.3	178.5	4	0	0	112.4	K201 E202 L203 K207 D208 Q209	K201-Q205 WeakPolarHBondContact O-CB 3.41Å; K201-Q205 PolarHBondContact O-N 2.87Å; E202-Q205 WeakPolarHBondContact O-CB 3.24Å; E202-Q205 PolarHBondContact O-N 3.29Å; L203-Q205 VanDerWaalsContact C-N 3.35Å; Q205-K207 VanDerWaalsContact C-N 3.29Å; Q205-K207 PolarHBondContact O-N 2.94Å; Q205-D208 PolarHBondContact O-N 2.75Å; Q205-Q209 WeakPolarHBondContact O-CB 3.38Å; Q205-Q209 VanDerWaalsContact O-CG 3.28Å; Q205-Q209 WeakPolarHBondContact O-CG 3.45Å; Q205-Q209 PolarHBondContact O-N 3.47Å
206	E	97.5	Very high	97.7	Very high	99 Å²	99	107.5 Å²	107.5	46%	0.463	52%	0.518	S	S	.	.	H	α-helix	trans	-62.4	-36	174.6	-73	-179	-170.4	0	0	112.8	E202 L203 I204 K210	E202-E206 WeakPolarHBondContact O-CG 3.39Å; E202-E206 PolarHBondContact O-N 2.95Å; L203-E206 PolarHBondContact O-N 3.35Å; I204-E206 VanDerWaalsContact C-N 3.34Å; I204-E206 PolarHBondContact O-N 2.72Å; E206-K210 WeakPolarHBondContact O-CG 3.46Å; E206-K210 PolarHBondContact O-N 2.88Å
207	K	97.5	Very high	97.7	Very high	112 Å²	112	108.8 Å²	108.8	49%	0.487	52%	0.524	S	S	.	.	H	α-helix	trans	-73.8	-42	178.7	-66.8	-69.7	177.9	173.7	0	111.1	L203 I204 Q205 K210 L211	L203-K207 WeakPolarHBondContact O-CG 3.42Å; L203-K207 PolarHBondContact O-N 3.37Å; L203-K207 VanDerWaalsContact O-N 3.08Å; I204-K207 PolarHBondContact O-N 3.23Å; Q205-K207 VanDerWaalsContact C-N 3.29Å; Q205-K207 PolarHBondContact O-N 2.94Å; K207-K210 PolarHBondContact O-N 3.5Å; K207-L211 WeakPolarHBondContact O-CG 3.36Å; K207-L211 PolarHBondContact O-N 3.47Å
208	D	98.1	Very high	97.7	Very high	93 Å²	93	110.5 Å²	110.5	50%	0.497	53%	0.527	S	S	.	.	H	α-helix	trans	-61.8	-43.7	176.4	-69.2	-20.9	0	0	0	111	I204 Q205 K210 L211 E212	I204-D208 WeakPolarHBondContact CG2-OD2 3.37Å; I204-D208 PolarHBondContact O-N 2.9Å; Q205-D208 PolarHBondContact O-N 2.75Å; D208-K210 VanDerWaalsContact C-N 3.33Å; D208-K210 PolarHBondContact O-N 2.9Å; D208-L211 PolarHBondContact O-N 3.49Å; D208-E212 WeakPolarHBondContact O-CB 3.43Å; D208-E212 PolarHBondContact O-N 3.08Å
209	Q	97.6	Very high	97.7	Very high	102 Å²	102	111.3 Å²	111.3	48%	0.477	53%	0.533	S	S	.	.	H	α-helix	trans	-58.6	-42.8	173.2	-74.3	173.1	-1.9	0	0	112.4	Q205 E212 L213	Q205-Q209 WeakPolarHBondContact O-CB 3.38Å; Q205-Q209 VanDerWaalsContact O-CG 3.28Å; Q205-Q209 WeakPolarHBondContact O-CG 3.45Å; Q205-Q209 PolarHBondContact O-N 3.47Å; Q209-E212 PolarHBondContact O-N 2.89Å; Q209-L213 WeakPolarHBondContact O-CG 3.45Å; Q209-L213 PolarHBondContact O-N 3.38Å
210	K	97.6	Very high	97.7	Very high	99 Å²	99	109 Å²	109	43%	0.43	52%	0.524	S	S	.	.	H	α-helix	trans	-66.6	-39.2	176.8	-74.6	172.1	-177	171	0	112	E206 K207 D208 E212 L213 Y214	E206-K210 WeakPolarHBondContact O-CG 3.46Å; E206-K210 PolarHBondContact O-N 2.88Å; K207-K210 PolarHBondContact O-N 3.5Å; D208-K210 VanDerWaalsContact C-N 3.33Å; D208-K210 PolarHBondContact O-N 2.9Å; K210-E212 VanDerWaalsContact C-N 3.35Å; K210-L213 PolarHBondContact O-N 3.32Å; K210-Y214 HydrophobicContact CB-CE2 4.37Å; K210-Y214 WeakPolarHBondContact O-CD2 3.29Å; K210-Y214 PolarHBondContact O-N 3.15Å
211	L	97.5	Very high	97.7	Very high	93 Å²	93	109.2 Å²	109.2	49%	0.487	53%	0.525	S	S	.	.	H	α-helix	trans	-64.2	-41.5	176.1	-73	172.9	0	0	0	111.2	K207 D208 Y214 Q215	K207-L211 WeakPolarHBondContact O-CG 3.36Å; K207-L211 PolarHBondContact O-N 3.47Å; D208-L211 PolarHBondContact O-N 3.49Å; L211-Y214 PolarHBondContact O-N 3.4Å; L211-Q215 WeakPolarHBondContact O-CB 3.4Å; L211-Q215 VanDerWaalsContact O-CG 3.23Å; L211-Q215 WeakPolarHBondContact O-CG 3.41Å; L211-Q215 PolarHBondContact O-N 3.37Å
212	E	97.7	Very high	97.7	Very high	132 Å²	132	105.1 Å²	105.1	62%	0.617	51%	0.513	S	S	*	.	H	α-helix	trans	-61.8	-42.9	175.5	-172.3	175	-168.8	0	0	111.6	D208 Q209 K210 Q215 C216	D208-E212 WeakPolarHBondContact O-CB 3.43Å; D208-E212 PolarHBondContact O-N 3.08Å; Q209-E212 PolarHBondContact O-N 2.89Å; K210-E212 VanDerWaalsContact C-N 3.35Å; E212-Q215 PolarHBondContact O-N 3.44Å; E212-C216 WeakPolarHBondContact O-CB 3.45Å; E212-C216 PolarHBondContact O-N 3.16Å
213	L	97.7	Very high	97.7	Very high	120 Å²	120	104.7 Å²	104.7	63%	0.628	51%	0.511	S	S	*	.	H	α-helix	trans	-61.7	-46.2	174.3	-69.6	174.6	0	0	0	112.3	Q209 K210 C216 E217	Q209-L213 WeakPolarHBondContact O-CG 3.45Å; Q209-L213 PolarHBondContact O-N 3.38Å; K210-L213 PolarHBondContact O-N 3.32Å; L213-C216 PolarHBondContact O-N 3.44Å; L213-E217 WeakPolarHBondContact O-CB 3.41Å; L213-E217 PolarHBondContact O-N 3.31Å
214	Y	98	Very high	97.6	Very high	136 Å²	136	103.3 Å²	103.3	53%	0.533	50%	0.504	S	S	.	.	H	α-helix	trans	-67.3	-36.1	177.9	-66.9	-41	0	0	0	112.6	K210 L211 E217 I218	K210-Y214 HydrophobicContact CB-CE2 4.37Å; K210-Y214 WeakPolarHBondContact O-CD2 3.29Å; K210-Y214 PolarHBondContact O-N 3.15Å; L211-Y214 PolarHBondContact O-N 3.4Å; Y214-E217 PolarHBondContact O-N 3.34Å; Y214-I218 WeakPolarHBondContact O-CB 3.35Å; Y214-I218 WeakPolarHBondContact O-CD1 3.45Å; Y214-I218 WeakPolarHBondContact O-CG1 3.41Å; Y214-I218 PolarHBondContact O-N 2.84Å
215	Q	97.5	Very high	97.6	Very high	114 Å²	114	103.8 Å²	103.8	53%	0.533	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-48.4	173.6	-77.3	171	-8.5	0	0	110.5	L211 E212 E217 I218 E219	L211-Q215 WeakPolarHBondContact O-CB 3.4Å; L211-Q215 VanDerWaalsContact O-CG 3.23Å; L211-Q215 WeakPolarHBondContact O-CG 3.41Å; L211-Q215 PolarHBondContact O-N 3.37Å; E212-Q215 PolarHBondContact O-N 3.44Å; Q215-E217 VanDerWaalsContact C-N 3.34Å; Q215-E217 PolarHBondContact O-N 2.92Å; Q215-I218 PolarHBondContact O-N 3.05Å; Q215-E219 WeakPolarHBondContact O-CB 3.43Å; Q215-E219 VanDerWaalsContact O-CG 3.31Å; Q215-E219 WeakPolarHBondContact O-CG 3.37Å; Q215-E219 PolarHBondContact O-N 2.97Å
216	C	97.3	Very high	97.5	Very high	80 Å²	80	102.5 Å²	102.5	54%	0.541	50%	0.504	S	S	.	.	H	α-helix	trans	-59.7	-42.4	176.1	-174.8	0	0	0	0	112.2	E212 L213 E219 H220	E212-C216 WeakPolarHBondContact O-CB 3.45Å; E212-C216 PolarHBondContact O-N 3.16Å; L213-C216 PolarHBondContact O-N 3.44Å; C216-E219 PolarHBondContact O-N 2.91Å; C216-H220 WeakPolarHBondContact O-CB 3.33Å; C216-H220 PolarHBondContact O-N 2.98Å
217	E	97.7	Very high	97.5	Very high	114 Å²	114	102.4 Å²	102.4	53%	0.533	50%	0.502	S	S	.	.	H	α-helix	trans	-63.7	-43.9	176.2	-175.3	172.6	-170.2	0	0	112	L213 Y214 Q215 H220 L221	L213-E217 WeakPolarHBondContact O-CB 3.41Å; L213-E217 PolarHBondContact O-N 3.31Å; Y214-E217 PolarHBondContact O-N 3.34Å; Q215-E217 VanDerWaalsContact C-N 3.34Å; Q215-E217 PolarHBondContact O-N 2.92Å; E217-H220 PolarHBondContact O-N 3Å; E217-L221 HydrophobicContact CG-CD1 4.14Å; E217-L221 WeakPolarHBondContact O-CB 3.36Å; E217-L221 VanDerWaalsContact O-CG 3.26Å; E217-L221 WeakPolarHBondContact O-CG 3.5Å; E217-L221 PolarHBondContact O-N 2.88Å
218	I	97.7	Very high	97.5	Very high	106 Å²	106	103 Å²	103	54%	0.544	51%	0.507	S	S	.	.	H	α-helix	trans	-64.9	-43.4	176.8	-70.6	165.8	0	0	0	111	Y214 Q215 L221 T222	Y214-I218 WeakPolarHBondContact O-CB 3.35Å; Y214-I218 WeakPolarHBondContact O-CD1 3.45Å; Y214-I218 WeakPolarHBondContact O-CG1 3.41Å; Y214-I218 PolarHBondContact O-N 2.84Å; Q215-I218 PolarHBondContact O-N 3.05Å; I218-L221 PolarHBondContact O-N 3.22Å; I218-T222 VanDerWaalsContact O-CB 3.26Å; I218-T222 WeakPolarHBondContact O-CB 3.41Å; I218-T222 PolarHBondContact O-N 3.03Å; I218-T222 PolarHBondContact O-OG1 2.98Å
219	E	97.8	Very high	97.4	Very high	134 Å²	134	104.7 Å²	104.7	63%	0.626	51%	0.51	S	S	*	.	H	α-helix	trans	-59.5	-48.2	176.9	-76.7	174.5	-173.7	0	0	110.8	Q215 C216 T222 E223	Q215-E219 WeakPolarHBondContact O-CB 3.43Å; Q215-E219 VanDerWaalsContact O-CG 3.31Å; Q215-E219 WeakPolarHBondContact O-CG 3.37Å; Q215-E219 PolarHBondContact O-N 2.97Å; C216-E219 PolarHBondContact O-N 2.91Å; E219-T222 PolarHBondContact O-N 3.42Å; E219-E223 WeakPolarHBondContact O-CB 3.08Å; E219-E223 PolarHBondContact O-N 3.48Å
220	H	97.2	Very high	97.4	Very high	105 Å²	105	103.3 Å²	103.3	49%	0.486	51%	0.509	S	S	.	.	H	α-helix	trans	-60.4	-48.3	176.6	-176.7	-79.3	0	0	0	112.1	C216 E217 T222 E223 D224	C216-H220 WeakPolarHBondContact O-CB 3.33Å; C216-H220 PolarHBondContact O-N 2.98Å; E217-H220 PolarHBondContact O-N 3Å; H220-T222 VanDerWaalsContact C-N 3.28Å; H220-T222 PolarHBondContact O-N 3.46Å; H220-E223 PolarHBondContact O-N 2.98Å; H220-D224 IonicContact CE1-OD1 3.39Å; H220-D224 IonicContact CE1-OD2 3.63Å; H220-D224 PolarHBondContact CE1-OD2 3.39Å; H220-D224 IonicContact ND1-OD2 3.69Å; H220-D224 PolarHBondContact ND1-OD2 3.05Å; H220-D224 IonicContact NE2-OD2 2.67Å; H220-D224 PolarHBondContact O-N 3.32Å
221	L	97.6	Very high	97.3	Very high	91 Å²	91	103.5 Å²	103.5	48%	0.476	51%	0.513	S	S	.	.	H	α-helix	trans	-62.1	-37.4	177.4	-72.3	173.9	0	0	0	112.1	E217 I218 L225	E217-L221 HydrophobicContact CG-CD1 4.14Å; E217-L221 WeakPolarHBondContact O-CB 3.36Å; E217-L221 VanDerWaalsContact O-CG 3.26Å; E217-L221 WeakPolarHBondContact O-CG 3.5Å; E217-L221 PolarHBondContact O-N 2.88Å; I218-L221 PolarHBondContact O-N 3.22Å; L221-L225 WeakPolarHBondContact O-CB 3.29Å; L221-L225 VanDerWaalsContact O-CG 3.26Å; L221-L225 WeakPolarHBondContact O-CG 3.49Å; L221-L225 PolarHBondContact O-N 3.06Å
222	T	97.3	Very high	97.3	Very high	68 Å²	68	105 Å²	105	42%	0.417	52%	0.516	S	S	.	.	H	α-helix	trans	-67.9	-41.1	177.1	-57.5	0	0	0	0	110.8	I218 E219 H220 L225 N226	I218-T222 VanDerWaalsContact O-CB 3.26Å; I218-T222 WeakPolarHBondContact O-CB 3.41Å; I218-T222 PolarHBondContact O-N 3.03Å; I218-T222 PolarHBondContact O-OG1 2.98Å; E219-T222 PolarHBondContact O-N 3.42Å; H220-T222 VanDerWaalsContact C-N 3.28Å; H220-T222 PolarHBondContact O-N 3.46Å; T222-L225 PolarHBondContact O-N 2.76Å; T222-N226 WeakPolarHBondContact O-CB 3.27Å; T222-N226 VanDerWaalsContact O-CG 3.24Å; T222-N226 PolarHBondContact O-N 2.93Å; T222-N226 PolarHBondContact O-ND2 3.45Å; T222-N226 VanDerWaalsContact O-ND2 3.11Å
223	E	97.7	Very high	97.3	Very high	104 Å²	104	102.5 Å²	102.5	49%	0.486	51%	0.507	S	S	.	.	H	α-helix	trans	-63.5	-45.2	175.3	-162.8	-171.3	152	0	0	111.4	E219 H220 N226 K227	E219-E223 WeakPolarHBondContact O-CB 3.08Å; E219-E223 PolarHBondContact O-N 3.48Å; H220-E223 PolarHBondContact O-N 2.98Å; E223-N226 PolarHBondContact O-N 2.96Å; E223-K227 WeakPolarHBondContact O-CG 3.33Å; E223-K227 PolarHBondContact O-N 3.37Å; E223-K227 WeakPolarHBondContact OE1-CE 3.41Å; E223-K227 IonicContact OE1-NZ 2.7Å; E223-K227 PolarHBondContact OE1-NZ 3.41Å
224	D	97.4	Very high	97.2	Very high	54 Å²	54	102.4 Å²	102.4	29%	0.289	50%	0.503	S	S	.	.	H	α-helix	trans	-62.1	-44	176.4	-79	-11.6	0	0	0	112.3	H220 N226 K227 Q228	H220-D224 IonicContact CE1-OD1 3.39Å; H220-D224 IonicContact CE1-OD2 3.63Å; H220-D224 PolarHBondContact CE1-OD2 3.39Å; H220-D224 IonicContact ND1-OD2 3.69Å; H220-D224 PolarHBondContact ND1-OD2 3.05Å; H220-D224 IonicContact NE2-OD2 2.67Å; H220-D224 PolarHBondContact O-N 3.32Å; D224-N226 VanDerWaalsContact C-N 3.32Å; D224-N226 PolarHBondContact O-N 3.16Å; D224-K227 PolarHBondContact O-N 3.47Å; D224-Q228 WeakPolarHBondContact O-CG 3.41Å; D224-Q228 PolarHBondContact O-N 2.96Å
225	L	97	Very high	97.2	Very high	108 Å²	108	100.6 Å²	100.6	57%	0.565	50%	0.5	S	S	*	.	H	α-helix	trans	-63	-39.6	174.9	-76.9	174.1	0	0	0	111.7	L221 T222 Q228 K229	L221-L225 WeakPolarHBondContact O-CB 3.29Å; L221-L225 VanDerWaalsContact O-CG 3.26Å; L221-L225 WeakPolarHBondContact O-CG 3.49Å; L221-L225 PolarHBondContact O-N 3.06Å; T222-L225 PolarHBondContact O-N 2.76Å; L225-Q228 PolarHBondContact O-N 2.97Å; L225-K229 VanDerWaalsContact O-CB 3.26Å; L225-K229 WeakPolarHBondContact O-CB 3.38Å; L225-K229 PolarHBondContact O-N 3.36Å
226	N	96.6	Very high	97.1	Very high	89 Å²	89	97.8 Å²	97.8	48%	0.476	49%	0.49	S	S	.	.	H	α-helix	trans	-64.4	-44.2	175.6	-77.1	-34.1	0	0	0	111.2	T222 E223 D224 Q228 K229 T230	T222-N226 WeakPolarHBondContact O-CB 3.27Å; T222-N226 VanDerWaalsContact O-CG 3.24Å; T222-N226 PolarHBondContact O-N 2.93Å; T222-N226 PolarHBondContact O-ND2 3.45Å; T222-N226 VanDerWaalsContact O-ND2 3.11Å; E223-N226 PolarHBondContact O-N 2.96Å; D224-N226 VanDerWaalsContact C-N 3.32Å; D224-N226 PolarHBondContact O-N 3.16Å; N226-Q228 PolarHBondContact O-N 3.34Å; N226-K229 WeakPolarHBondContact O-CB 3.49Å; N226-K229 PolarHBondContact O-N 3.06Å; N226-T230 WeakPolarHBondContact O-CG2 3.41Å; N226-T230 PolarHBondContact O-N 3.29Å; N226-T230 PolarHBondContact O-OG1 3.49Å
227	K	96.9	Very high	97.1	Very high	97 Å²	97	98 Å²	98	42%	0.422	49%	0.489	S	S	.	.	H	α-helix	trans	-59.7	-44.2	173.9	-71.5	168	-176.4	158.7	0	112	E223 D224 K229 T230 I231	E223-K227 WeakPolarHBondContact O-CG 3.33Å; E223-K227 PolarHBondContact O-N 3.37Å; E223-K227 WeakPolarHBondContact OE1-CE 3.41Å; E223-K227 IonicContact OE1-NZ 2.7Å; E223-K227 PolarHBondContact OE1-NZ 3.41Å; D224-K227 PolarHBondContact O-N 3.47Å; K227-K229 VanDerWaalsContact C-N 3.33Å; K227-K229 PolarHBondContact O-N 3.23Å; K227-T230 PolarHBondContact O-N 2.97Å; K227-T230 PolarHBondContact O-OG1 3.45Å; K227-I231 VanDerWaalsContact O-CG1 3.3Å; K227-I231 WeakPolarHBondContact O-CG1 3.29Å; K227-I231 PolarHBondContact O-N 3.34Å; K227-I231 VanDerWaalsContact O-N 3.08Å
228	Q	97.1	Very high	97	Very high	125 Å²	125	97.8 Å²	97.8	58%	0.584	49%	0.491	S	S	*	.	H	α-helix	trans	-63.3	-41.3	176.1	-73.3	178.9	7.5	0	0	111.5	D224 L225 N226 I231 F232	D224-Q228 WeakPolarHBondContact O-CG 3.41Å; D224-Q228 PolarHBondContact O-N 2.96Å; L225-Q228 PolarHBondContact O-N 2.97Å; N226-Q228 PolarHBondContact O-N 3.34Å; Q228-I231 PolarHBondContact O-N 3.34Å; Q228-F232 VanDerWaalsContact O-CB 3.28Å; Q228-F232 WeakPolarHBondContact O-CB 3.47Å; Q228-F232 PolarHBondContact O-N 3.37Å
229	K	96.7	Very high	96.9	Very high	127 Å²	127	97.5 Å²	97.5	55%	0.552	49%	0.487	S	S	*	.	H	α-helix	trans	-64.6	-40.2	177	-175	179	178.7	-178.2	0	112	L225 N226 K227 F232 N233	L225-K229 VanDerWaalsContact O-CB 3.26Å; L225-K229 WeakPolarHBondContact O-CB 3.38Å; L225-K229 PolarHBondContact O-N 3.36Å; N226-K229 WeakPolarHBondContact O-CB 3.49Å; N226-K229 PolarHBondContact O-N 3.06Å; K227-K229 VanDerWaalsContact C-N 3.33Å; K227-K229 PolarHBondContact O-N 3.23Å; K229-F232 PolarHBondContact O-N 2.88Å; K229-N233 WeakPolarHBondContact O-CB 3.44Å; K229-N233 PolarHBondContact O-N 3.35Å; K229-N233 PolarHBondContact O-ND2 3.02Å
230	T	96.6	Very high	96.8	Very high	74 Å²	74	95.1 Å²	95.1	45%	0.454	48%	0.482	S	S	.	.	H	α-helix	trans	-64.8	-47.1	176.2	57	0	0	0	0	111.1	N226 K227 F232 N233 E234	N226-T230 WeakPolarHBondContact O-CG2 3.41Å; N226-T230 PolarHBondContact O-N 3.29Å; N226-T230 PolarHBondContact O-OG1 3.49Å; K227-T230 PolarHBondContact O-N 2.97Å; K227-T230 PolarHBondContact O-OG1 3.45Å; T230-F232 VanDerWaalsContact C-N 3.33Å; T230-F232 PolarHBondContact O-N 2.91Å; T230-N233 PolarHBondContact O-N 2.89Å; T230-E234 WeakPolarHBondContact O-CG 3.41Å; T230-E234 PolarHBondContact O-N 3.1Å
231	I	97.1	Very high	96.8	Very high	103 Å²	103	93.6 Å²	93.6	53%	0.528	48%	0.48	S	S	.	.	H	α-helix	trans	-59.8	-44.7	176.9	-66	165.8	0	0	0	110.9	K227 Q228 E234 Q235	K227-I231 VanDerWaalsContact O-CG1 3.3Å; K227-I231 WeakPolarHBondContact O-CG1 3.29Å; K227-I231 PolarHBondContact O-N 3.34Å; K227-I231 VanDerWaalsContact O-N 3.08Å; Q228-I231 PolarHBondContact O-N 3.34Å; I231-E234 PolarHBondContact O-N 3.49Å; I231-Q235 WeakPolarHBondContact O-CB 3.08Å; I231-Q235 PolarHBondContact O-N 2.8Å
232	F	97	Very high	96.7	Very high	124 Å²	124	95.1 Å²	95.1	54%	0.544	49%	0.485	S	S	.	.	H	α-helix	trans	-63.2	-43.9	178.5	-179.3	-100	0	0	0	111.9	Q228 K229 T230 Q235 V236	Q228-F232 VanDerWaalsContact O-CB 3.28Å; Q228-F232 WeakPolarHBondContact O-CB 3.47Å; Q228-F232 PolarHBondContact O-N 3.37Å; K229-F232 PolarHBondContact O-N 2.88Å; T230-F232 VanDerWaalsContact C-N 3.33Å; T230-F232 PolarHBondContact O-N 2.91Å; F232-Q235 PolarHBondContact O-N 3Å; F232-V236 HydrophobicContact CD1-CG2 4.11Å; F232-V236 HydrophobicContact CE1-CG2 3.67Å; F232-V236 HydrophobicContact CE2-CG2 4.15Å; F232-V236 HydrophobicContact CZ-CG2 3.69Å; F232-V236 WeakPolarHBondContact O-CG2 3.49Å; F232-V236 PolarHBondContact O-N 3.43Å
233	N	97.1	Very high	96.6	Very high	79 Å²	79	94.9 Å²	94.9	42%	0.422	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-42.2	176.6	-75	-19.6	0	0	0	111.8	K229 T230 Q235 V236 T237	K229-N233 WeakPolarHBondContact O-CB 3.44Å; K229-N233 PolarHBondContact O-N 3.35Å; K229-N233 PolarHBondContact O-ND2 3.02Å; T230-N233 PolarHBondContact O-N 2.89Å; N233-Q235 VanDerWaalsContact C-N 3.33Å; N233-Q235 PolarHBondContact O-N 3.25Å; N233-V236 PolarHBondContact O-N 3.49Å; N233-T237 WeakPolarHBondContact O-CB 3.39Å; N233-T237 VanDerWaalsContact O-CG2 3.25Å; N233-T237 WeakPolarHBondContact O-CG2 3.39Å; N233-T237 PolarHBondContact O-N 2.95Å; N233-T237 PolarHBondContact O-OG1 2.89Å
234	E	96.5	Very high	96.6	Very high	119 Å²	119	93.4 Å²	93.4	56%	0.556	49%	0.487	S	S	*	.	H	α-helix	trans	-59.2	-44.6	173.2	-73.9	172.7	-171.7	0	0	111.2	T230 I231 T237 L238	T230-E234 WeakPolarHBondContact O-CG 3.41Å; T230-E234 PolarHBondContact O-N 3.1Å; I231-E234 PolarHBondContact O-N 3.49Å; E234-T237 WeakPolarHBondContact CA-OG1 3.43Å; E234-T237 PolarHBondContact O-N 3.06Å; E234-T237 PolarHBondContact O-OG1 2.76Å; E234-L238 WeakPolarHBondContact O-CB 3.39Å; E234-L238 VanDerWaalsContact O-CG 3.29Å; E234-L238 WeakPolarHBondContact O-CG 3.25Å; E234-L238 PolarHBondContact O-N 2.97Å
235	Q	96.8	Very high	96.5	Very high	98 Å²	98	96.7 Å²	96.7	46%	0.458	50%	0.498	S	S	.	.	H	α-helix	trans	-62.8	-45.1	176.2	-175.7	177.7	-7.4	0	0	112.4	I231 F232 N233 L238 Q239	I231-Q235 WeakPolarHBondContact O-CB 3.08Å; I231-Q235 PolarHBondContact O-N 2.8Å; F232-Q235 PolarHBondContact O-N 3Å; N233-Q235 VanDerWaalsContact C-N 3.33Å; N233-Q235 PolarHBondContact O-N 3.25Å; Q235-L238 PolarHBondContact O-N 3.26Å; Q235-Q239 WeakPolarHBondContact O-CB 3.31Å; Q235-Q239 WeakPolarHBondContact O-CG 3.21Å; Q235-Q239 PolarHBondContact O-N 3.09Å
236	V	95.6	Very high	96.5	Very high	55 Å²	55	95.2 Å²	95.2	33%	0.333	49%	0.494	S	S	.	.	H	α-helix	trans	-64	-42.9	178.4	169.2	0	0	0	0	110.9	F232 N233 Q239 T240	F232-V236 HydrophobicContact CD1-CG2 4.11Å; F232-V236 HydrophobicContact CE1-CG2 3.67Å; F232-V236 HydrophobicContact CE2-CG2 4.15Å; F232-V236 HydrophobicContact CZ-CG2 3.69Å; F232-V236 WeakPolarHBondContact O-CG2 3.49Å; F232-V236 PolarHBondContact O-N 3.43Å; N233-V236 PolarHBondContact O-N 3.49Å; V236-Q239 PolarHBondContact O-N 3.22Å; V236-T240 VanDerWaalsContact O-CB 3.31Å; V236-T240 WeakPolarHBondContact O-CB 3.47Å; V236-T240 PolarHBondContact O-N 2.83Å; V236-T240 PolarHBondContact O-OG1 3.18Å
237	T	97	Very high	96.4	Very high	83 Å²	83	96 Å²	96	51%	0.509	50%	0.497	S	S	.	.	H	α-helix	trans	-63.8	-43.4	177.2	55.1	0	0	0	0	111.7	N233 E234 T240 V241	N233-T237 WeakPolarHBondContact O-CB 3.39Å; N233-T237 VanDerWaalsContact O-CG2 3.25Å; N233-T237 WeakPolarHBondContact O-CG2 3.39Å; N233-T237 PolarHBondContact O-N 2.95Å; N233-T237 PolarHBondContact O-OG1 2.89Å; E234-T237 WeakPolarHBondContact CA-OG1 3.43Å; E234-T237 PolarHBondContact O-N 3.06Å; E234-T237 PolarHBondContact O-OG1 2.76Å; T237-T240 PolarHBondContact O-N 2.83Å; T237-V241 VanDerWaalsContact O-CG2 3.29Å; T237-V241 WeakPolarHBondContact O-CG2 3.42Å; T237-V241 PolarHBondContact O-N 2.87Å
238	L	96.1	Very high	96.4	Very high	111 Å²	111	95.7 Å²	95.7	58%	0.581	50%	0.497	S	S	*	.	H	α-helix	trans	-59.6	-50.5	173.9	-74.1	172.1	0	0	0	111.8	E234 Q235 T240 V241 E242	E234-L238 WeakPolarHBondContact O-CB 3.39Å; E234-L238 VanDerWaalsContact O-CG 3.29Å; E234-L238 WeakPolarHBondContact O-CG 3.25Å; E234-L238 PolarHBondContact O-N 2.97Å; Q235-L238 PolarHBondContact O-N 3.26Å; L238-T240 VanDerWaalsContact C-N 3.28Å; L238-T240 PolarHBondContact O-N 3.27Å; L238-V241 PolarHBondContact O-N 3.4Å; L238-V241 VanDerWaalsContact O-N 3.14Å; L238-E242 WeakPolarHBondContact O-CG 3.37Å; L238-E242 PolarHBondContact O-N 3.3Å
239	Q	96.1	Very high	96.4	Very high	99 Å²	99	94 Å²	94	46%	0.463	49%	0.492	S	S	.	.	H	α-helix	trans	-61.5	-36.8	178.2	-75	-177.7	-10.1	0	0	112.6	Q235 V236 S243	Q235-Q239 WeakPolarHBondContact O-CB 3.31Å; Q235-Q239 WeakPolarHBondContact O-CG 3.21Å; Q235-Q239 PolarHBondContact O-N 3.09Å; V236-Q239 PolarHBondContact O-N 3.22Å; Q239-S243 VanDerWaalsContact O-CB 3.23Å; Q239-S243 WeakPolarHBondContact O-CB 3.47Å; Q239-S243 PolarHBondContact O-N 3.05Å; Q239-S243 PolarHBondContact O-OG 2.67Å
240	T	96.3	Very high	96.3	Very high	85 Å²	85	93.1 Å²	93.1	52%	0.521	49%	0.493	S	S	.	.	H	α-helix	trans	-65.3	-43.3	175.7	-58.2	0	0	0	0	110.7	V236 T237 L238 S244	V236-T240 VanDerWaalsContact O-CB 3.31Å; V236-T240 WeakPolarHBondContact O-CB 3.47Å; V236-T240 PolarHBondContact O-N 2.83Å; V236-T240 PolarHBondContact O-OG1 3.18Å; T237-T240 PolarHBondContact O-N 2.83Å; L238-T240 VanDerWaalsContact C-N 3.28Å; L238-T240 PolarHBondContact O-N 3.27Å; T240-S244 VanDerWaalsContact O-CB 3.23Å; T240-S244 WeakPolarHBondContact O-CB 3.46Å; T240-S244 PolarHBondContact O-N 3.34Å
241	V	96.7	Very high	96.3	Very high	73 Å²	73	92.7 Å²	92.7	44%	0.442	49%	0.49	S	S	.	.	H	α-helix	trans	-65.3	-44	176.6	170.2	0	0	0	0	111.3	T237 L238 S244 K245	T237-V241 VanDerWaalsContact O-CG2 3.29Å; T237-V241 WeakPolarHBondContact O-CG2 3.42Å; T237-V241 PolarHBondContact O-N 2.87Å; L238-V241 PolarHBondContact O-N 3.4Å; L238-V241 VanDerWaalsContact O-N 3.14Å; V241-S244 PolarHBondContact O-N 3.41Å; V241-K245 HydrophobicContact CG1-CD 4.22Å; V241-K245 WeakPolarHBondContact O-CG 3.48Å; V241-K245 PolarHBondContact O-N 2.86Å
242	E	95.6	Very high	96.3	Very high	123 Å²	123	93.2 Å²	93.2	58%	0.575	49%	0.486	S	S	*	.	H	α-helix	trans	-63	-46.2	176.4	-72.5	-179.5	166.5	0	0	111.8	L238 S244 K245 T246	L238-E242 WeakPolarHBondContact O-CG 3.37Å; L238-E242 PolarHBondContact O-N 3.3Å; E242-S244 VanDerWaalsContact C-N 3.33Å; E242-S244 PolarHBondContact O-N 3Å; E242-K245 PolarHBondContact O-N 2.97Å; E242-T246 WeakPolarHBondContact O-CG2 3.33Å; E242-T246 PolarHBondContact O-N 3.05Å; E242-T246 PolarHBondContact O-OG1 3.28Å
243	S	94.3	Very high	96.2	Very high	63 Å²	63	91 Å²	91	44%	0.441	48%	0.483	S	S	.	.	H	α-helix	trans	-61.8	-42.1	176.1	-60.7	0	0	0	0	111.2	Q239 T246 I247	Q239-S243 VanDerWaalsContact O-CB 3.23Å; Q239-S243 WeakPolarHBondContact O-CB 3.47Å; Q239-S243 PolarHBondContact O-N 3.05Å; Q239-S243 PolarHBondContact O-OG 2.67Å; S243-T246 WeakPolarHBondContact CA-OG1 3.26Å; S243-T246 PolarHBondContact O-N 2.95Å; S243-T246 PolarHBondContact O-OG1 3.04Å; S243-I247 WeakPolarHBondContact O-CB 3.27Å; S243-I247 WeakPolarHBondContact O-CD1 3.45Å; S243-I247 WeakPolarHBondContact O-CG1 3.34Å; S243-I247 PolarHBondContact O-N 3.37Å
244	S	97.5	Very high	96.1	Very high	72 Å²	72	93 Å²	93	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-61.2	-46.7	175.5	-175.4	0	0	0	0	111.9	T240 V241 E242 T246 I247 E248	T240-S244 VanDerWaalsContact O-CB 3.23Å; T240-S244 WeakPolarHBondContact O-CB 3.46Å; T240-S244 PolarHBondContact O-N 3.34Å; V241-S244 PolarHBondContact O-N 3.41Å; E242-S244 VanDerWaalsContact C-N 3.33Å; E242-S244 PolarHBondContact O-N 3Å; S244-T246 PolarHBondContact O-N 3.18Å; S244-I247 PolarHBondContact O-N 3.05Å; S244-E248 WeakPolarHBondContact O-CB 3.14Å; S244-E248 PolarHBondContact O-N 3.07Å
245	K	96.5	Very high	96.1	Very high	123 Å²	123	92.6 Å²	92.6	54%	0.535	49%	0.491	S	S	.	.	H	α-helix	trans	-61.3	-42.5	175.8	-74.3	175.4	-179.3	177.3	0	112.4	V241 E242 E248 N249	V241-K245 HydrophobicContact CG1-CD 4.22Å; V241-K245 WeakPolarHBondContact O-CG 3.48Å; V241-K245 PolarHBondContact O-N 2.86Å; E242-K245 PolarHBondContact O-N 2.97Å; K245-E248 PolarHBondContact O-N 3.47Å; K245-N249 WeakPolarHBondContact O-CB 3.34Å; K245-N249 PolarHBondContact O-N 3.01Å; K245-N249 PolarHBondContact O-ND2 3.48Å
246	T	96.1	Very high	96.1	Very high	78 Å²	78	93 Å²	93	48%	0.479	49%	0.491	S	S	.	.	H	α-helix	trans	-67.4	-40.9	178.4	56.2	0	0	0	0	111.7	E242 S243 S244 N249 L250	E242-T246 WeakPolarHBondContact O-CG2 3.33Å; E242-T246 PolarHBondContact O-N 3.05Å; E242-T246 PolarHBondContact O-OG1 3.28Å; S243-T246 WeakPolarHBondContact CA-OG1 3.26Å; S243-T246 PolarHBondContact O-N 2.95Å; S243-T246 PolarHBondContact O-OG1 3.04Å; S244-T246 PolarHBondContact O-N 3.18Å; T246-N249 PolarHBondContact O-N 3.09Å; T246-L250 WeakPolarHBondContact O-CB 3.02Å; T246-L250 VanDerWaalsContact O-CG 3.28Å; T246-L250 WeakPolarHBondContact O-CG 3.24Å; T246-L250 PolarHBondContact O-N 3.42Å
247	I	95.7	Very high	96	Very high	105 Å²	105	96 Å²	96	54%	0.538	50%	0.501	S	S	.	.	H	α-helix	trans	-59	-48.2	172.6	-70.3	165.1	0	0	0	110	S243 S244 N249 L250 T251	S243-I247 WeakPolarHBondContact O-CB 3.27Å; S243-I247 WeakPolarHBondContact O-CD1 3.45Å; S243-I247 WeakPolarHBondContact O-CG1 3.34Å; S243-I247 PolarHBondContact O-N 3.37Å; S244-I247 PolarHBondContact O-N 3.05Å; I247-N249 VanDerWaalsContact C-N 3.33Å; I247-N249 PolarHBondContact O-N 3.42Å; I247-L250 PolarHBondContact O-N 3.44Å; I247-T251 HydrophobicContact CG2-CG2 4.32Å; I247-T251 WeakPolarHBondContact O-CG2 3.25Å; I247-T251 PolarHBondContact O-N 3.3Å; I247-T251 PolarHBondContact O-OG1 3.47Å
248	E	96.3	Very high	95.9	Very high	90 Å²	90	100.7 Å²	100.7	42%	0.421	51%	0.51	S	S	.	.	H	α-helix	trans	-62.7	-38.3	179.9	-161.6	-165.2	-163.2	0	0	112.6	S244 K245 T251 R252	S244-E248 WeakPolarHBondContact O-CB 3.14Å; S244-E248 PolarHBondContact O-N 3.07Å; K245-E248 PolarHBondContact O-N 3.47Å; E248-T251 WeakPolarHBondContact CA-OG1 3.34Å; E248-T251 PolarHBondContact O-OG1 3.27Å; E248-R252 VanDerWaalsContact O-CG 3.29Å; E248-R252 WeakPolarHBondContact O-CG 3.18Å; E248-R252 PolarHBondContact O-N 3.01Å; E248-R252 VanDerWaalsContact O-N 3.13Å; E248-R252 IonicContact OE1-CZ 3.95Å; E248-R252 IonicContact OE1-NH1 2.97Å; E248-R252 IonicContact OE1-NH2 2.96Å; E248-R252 PolarHBondContact OE1-NH2 2.86Å; E248-R252 IonicContact OE2-CZ 3.17Å; E248-R252 IonicContact OE2-NH1 2.82Å; E248-R252 PolarHBondContact OE2-NH1 2.84Å; E248-R252 IonicContact OE2-NH2 3.29Å; E248-R252 PolarHBondContact OE2-NH2 3.23Å
249	N	96.4	Very high	95.9	Very high	90 Å²	90	101 Å²	101	48%	0.481	51%	0.506	S	S	.	.	H	α-helix	trans	-67.2	-43.7	174.4	-70.8	-21.1	0	0	0	111.4	K245 T246 I247 R252 T253	K245-N249 WeakPolarHBondContact O-CB 3.34Å; K245-N249 PolarHBondContact O-N 3.01Å; K245-N249 PolarHBondContact O-ND2 3.48Å; T246-N249 PolarHBondContact O-N 3.09Å; I247-N249 VanDerWaalsContact C-N 3.33Å; I247-N249 PolarHBondContact O-N 3.42Å; N249-R252 PolarHBondContact O-N 3.02Å; N249-R252 PolarHBondContact OD1-NH1 3.42Å; N249-T253 WeakPolarHBondContact O-CG2 3.33Å; N249-T253 PolarHBondContact O-N 3.38Å; N249-T253 PolarHBondContact O-OG1 2.91Å
250	L	95.7	Very high	95.7	Very high	108 Å²	108	99.1 Å²	99.1	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-63.6	-42.3	177.5	-73.3	172.3	0	0	0	111.7	T246 I247 R252 T253 L254	T246-L250 WeakPolarHBondContact O-CB 3.02Å; T246-L250 VanDerWaalsContact O-CG 3.28Å; T246-L250 WeakPolarHBondContact O-CG 3.24Å; T246-L250 PolarHBondContact O-N 3.42Å; I247-L250 PolarHBondContact O-N 3.44Å; L250-R252 PolarHBondContact O-N 2.88Å; L250-T253 WeakPolarHBondContact CA-OG1 3.28Å; L250-T253 PolarHBondContact O-N 3.02Å; L250-T253 PolarHBondContact O-OG1 3.37Å; L250-L254 WeakPolarHBondContact O-CB 3.32Å; L250-L254 WeakPolarHBondContact O-CG 3.41Å; L250-L254 PolarHBondContact O-N 3.27Å
251	T	96.7	Very high	95.7	Very high	65 Å²	65	101.4 Å²	101.4	40%	0.399	50%	0.504	S	S	.	.	H	α-helix	trans	-62.1	-43.9	176.6	54.7	0	0	0	0	111.5	I247 E248 T253 L254 E255	I247-T251 HydrophobicContact CG2-CG2 4.32Å; I247-T251 WeakPolarHBondContact O-CG2 3.25Å; I247-T251 PolarHBondContact O-N 3.3Å; I247-T251 PolarHBondContact O-OG1 3.47Å; E248-T251 WeakPolarHBondContact CA-OG1 3.34Å; E248-T251 PolarHBondContact O-OG1 3.27Å; T251-T253 PolarHBondContact O-N 3.46Å; T251-L254 PolarHBondContact O-N 3.45Å; T251-E255 WeakPolarHBondContact O-CG 3.37Å; T251-E255 PolarHBondContact O-N 3.28Å
252	R	95.5	Very high	95.6	Very high	115 Å²	115	102.9 Å²	102.9	43%	0.434	51%	0.508	S	S	.	.	H	α-helix	trans	-58.6	-45.6	173.6	-72.7	174.6	-177.8	120.5	1.3	112.5	E248 N249 L250 E255 F256	E248-R252 VanDerWaalsContact O-CG 3.29Å; E248-R252 WeakPolarHBondContact O-CG 3.18Å; E248-R252 PolarHBondContact O-N 3.01Å; E248-R252 VanDerWaalsContact O-N 3.13Å; E248-R252 IonicContact OE1-CZ 3.95Å; E248-R252 IonicContact OE1-NH1 2.97Å; E248-R252 IonicContact OE1-NH2 2.96Å; E248-R252 PolarHBondContact OE1-NH2 2.86Å; E248-R252 IonicContact OE2-CZ 3.17Å; E248-R252 IonicContact OE2-NH1 2.82Å; E248-R252 PolarHBondContact OE2-NH1 2.84Å; E248-R252 IonicContact OE2-NH2 3.29Å; E248-R252 PolarHBondContact OE2-NH2 3.23Å; N249-R252 PolarHBondContact O-N 3.02Å; N249-R252 PolarHBondContact OD1-NH1 3.42Å; L250-R252 PolarHBondContact O-N 2.88Å; R252-E255 PolarHBondContact O-N 3.46Å; R252-F256 PolarHBondContact O-N 3.03Å
253	T	96.5	Very high	95.5	Very high	78 Å²	78	104.3 Å²	104.3	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-40.8	178.3	60	0	0	0	0	111.9	N249 L250 T251 E255 F256 E257	N249-T253 WeakPolarHBondContact O-CG2 3.33Å; N249-T253 PolarHBondContact O-N 3.38Å; N249-T253 PolarHBondContact O-OG1 2.91Å; L250-T253 WeakPolarHBondContact CA-OG1 3.28Å; L250-T253 PolarHBondContact O-N 3.02Å; L250-T253 PolarHBondContact O-OG1 3.37Å; T251-T253 PolarHBondContact O-N 3.46Å; T253-E255 PolarHBondContact O-N 3.22Å; T253-F256 PolarHBondContact O-N 3.06Å; T253-E257 WeakPolarHBondContact O-CG 3.47Å; T253-E257 PolarHBondContact O-N 3.37Å
254	L	95.2	Very high	95.6	Very high	120 Å²	120	106.8 Å²	106.8	63%	0.628	52%	0.515	S	S	*	.	H	α-helix	trans	-62.7	-40.8	175.3	-76.5	173.4	0	0	0	112.1	L250 T251 R258	L250-L254 WeakPolarHBondContact O-CB 3.32Å; L250-L254 WeakPolarHBondContact O-CG 3.41Å; L250-L254 PolarHBondContact O-N 3.27Å; T251-L254 PolarHBondContact O-N 3.45Å; L254-R258 WeakPolarHBondContact O-CB 3.36Å; L254-R258 PolarHBondContact O-N 3.13Å
255	E	96.4	Very high	95.4	Very high	111 Å²	111	106.2 Å²	106.2	52%	0.519	51%	0.511	S	S	.	.	H	α-helix	trans	-63.8	-41.3	175.1	-74.9	-176.4	-177.3	0	0	112.4	T251 R252 T253 R258 K259	T251-E255 WeakPolarHBondContact O-CG 3.37Å; T251-E255 PolarHBondContact O-N 3.28Å; R252-E255 PolarHBondContact O-N 3.46Å; T253-E255 PolarHBondContact O-N 3.22Å; E255-R258 PolarHBondContact O-N 2.96Å; E255-K259 WeakPolarHBondContact O-CG 3.35Å; E255-K259 PolarHBondContact O-N 3.48Å
256	F	95	Very high	95.3	Very high	107 Å²	107	103.7 Å²	103.7	47%	0.469	51%	0.51	S	S	.	.	H	α-helix	trans	-63.8	-50.1	176.8	-178	-96.8	0	0	0	111.4	R252 T253 R258 K259 Q260	R252-F256 PolarHBondContact O-N 3.03Å; T253-F256 PolarHBondContact O-N 3.06Å; F256-R258 VanDerWaalsContact C-N 3.28Å; F256-R258 PolarHBondContact O-N 3.17Å; F256-K259 WeakPolarHBondContact O-CB 3.45Å; F256-K259 PolarHBondContact O-N 3.21Å; F256-K259 VanDerWaalsContact O-N 3.12Å; F256-Q260 HydrophobicContact CD1-CG 4.07Å; F256-Q260 HydrophobicContact CE1-CG 3.67Å; F256-Q260 HydrophobicContact CE2-CG 4.45Å; F256-Q260 HydrophobicContact CZ-CG 3.89Å; F256-Q260 WeakPolarHBondContact O-CG 3.26Å; F256-Q260 PolarHBondContact O-N 3.23Å
257	E	94.3	Very high	95.2	Very high	117 Å²	117	104.1 Å²	104.1	55%	0.547	51%	0.509	S	S	.	.	H	α-helix	trans	-59.6	-40	176.7	-75.4	-58.4	150.6	0	0	111.7	T253 K259 Q260 M261	T253-E257 WeakPolarHBondContact O-CG 3.47Å; T253-E257 PolarHBondContact O-N 3.37Å; E257-K259 PolarHBondContact O-N 3.38Å; E257-Q260 PolarHBondContact O-N 3.4Å; E257-M261 VanDerWaalsContact O-CB 3.29Å; E257-M261 WeakPolarHBondContact O-CB 3.35Å; E257-M261 PolarHBondContact O-N 2.76Å
258	R	94.9	Very high	95.1	Very high	182 Å²	182	101.2 Å²	101.2	69%	0.687	50%	0.5	S	S	*	.	H	α-helix	trans	-62.2	-43.3	174.8	-172.3	175.8	-179.1	174.3	0.5	111.9	L254 E255 F256 M261 I262	L254-R258 WeakPolarHBondContact O-CB 3.36Å; L254-R258 PolarHBondContact O-N 3.13Å; E255-R258 PolarHBondContact O-N 2.96Å; F256-R258 VanDerWaalsContact C-N 3.28Å; F256-R258 PolarHBondContact O-N 3.17Å; R258-M261 PolarHBondContact O-N 2.83Å; R258-I262 HydrophobicContact CG-CD1 4.22Å; R258-I262 VanDerWaalsContact O-CG1 3.26Å; R258-I262 WeakPolarHBondContact O-CG1 3.34Å; R258-I262 PolarHBondContact O-N 3.47Å
259	K	95.2	Very high	95	Very high	117 Å²	117	101.5 Å²	101.5	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-63.1	-42.6	175.7	-74.2	169.4	-176.1	167.8	0	111.4	E255 F256 E257 I262 R263	E255-K259 WeakPolarHBondContact O-CG 3.35Å; E255-K259 PolarHBondContact O-N 3.48Å; F256-K259 WeakPolarHBondContact O-CB 3.45Å; F256-K259 PolarHBondContact O-N 3.21Å; F256-K259 VanDerWaalsContact O-N 3.12Å; E257-K259 PolarHBondContact O-N 3.38Å; K259-I262 PolarHBondContact O-N 2.91Å; K259-R263 WeakPolarHBondContact O-CG 3.39Å; K259-R263 PolarHBondContact O-N 3.49Å
260	Q	93.3	Very high	94.8	Very high	60 Å²	60	104.5 Å²	104.5	28%	0.28	51%	0.509	S	S	.	.	H	α-helix	trans	-64.1	-43.4	176.5	-68.4	-66.5	88	0	0	111.6	F256 E257 I262 R263 I264	F256-Q260 HydrophobicContact CD1-CG 4.07Å; F256-Q260 HydrophobicContact CE1-CG 3.67Å; F256-Q260 HydrophobicContact CE2-CG 4.45Å; F256-Q260 HydrophobicContact CZ-CG 3.89Å; F256-Q260 WeakPolarHBondContact O-CG 3.26Å; F256-Q260 PolarHBondContact O-N 3.23Å; E257-Q260 PolarHBondContact O-N 3.4Å; Q260-I262 VanDerWaalsContact C-N 3.34Å; Q260-I262 PolarHBondContact O-N 3.31Å; Q260-R263 WeakPolarHBondContact O-CB 2.99Å; Q260-R263 PolarHBondContact O-N 3.31Å; Q260-R263 VanDerWaalsContact O-N 3.17Å; Q260-I264 WeakPolarHBondContact O-CG1 2.92Å; Q260-I264 PolarHBondContact O-N 3.47Å
261	M	94.8	Very high	94.5	Very high	133 Å²	133	103.7 Å²	103.7	66%	0.655	50%	0.504	S	S	*	.	H	α-helix	trans	-60.5	-42.3	175.6	-173.7	178.7	-67.1	0	0	112	E257 R258 R263 I264 S265	E257-M261 VanDerWaalsContact O-CB 3.29Å; E257-M261 WeakPolarHBondContact O-CB 3.35Å; E257-M261 PolarHBondContact O-N 2.76Å; R258-M261 PolarHBondContact O-N 2.83Å; M261-R263 VanDerWaalsContact C-N 3.35Å; M261-R263 PolarHBondContact O-N 2.92Å; M261-I264 PolarHBondContact O-N 2.9Å; M261-S265 WeakPolarHBondContact O-CB 3.26Å; M261-S265 PolarHBondContact O-N 3.02Å
262	I	95.1	Very high	94.2	Very high	104 Å²	104	105.4 Å²	105.4	53%	0.533	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-42.4	175.2	-69	163.7	0	0	0	111	R258 K259 Q260 S265 S266	R258-I262 HydrophobicContact CG-CD1 4.22Å; R258-I262 VanDerWaalsContact O-CG1 3.26Å; R258-I262 WeakPolarHBondContact O-CG1 3.34Å; R258-I262 PolarHBondContact O-N 3.47Å; K259-I262 PolarHBondContact O-N 2.91Å; Q260-I262 VanDerWaalsContact C-N 3.34Å; Q260-I262 PolarHBondContact O-N 3.31Å; I262-S265 PolarHBondContact O-N 3.43Å; I262-S266 WeakPolarHBondContact O-CB 3.49Å; I262-S266 PolarHBondContact O-N 3.18Å; I262-S266 PolarHBondContact O-OG 3.42Å
263	R	94.9	Very high	94	Very high	152 Å²	152	104.9 Å²	104.9	57%	0.574	51%	0.513	S	S	*	.	H	α-helix	trans	-64.5	-42.4	176.8	-70.8	170.2	180	173.5	-4.1	112.4	K259 Q260 M261 S266 L267	K259-R263 WeakPolarHBondContact O-CG 3.39Å; K259-R263 PolarHBondContact O-N 3.49Å; Q260-R263 WeakPolarHBondContact O-CB 2.99Å; Q260-R263 PolarHBondContact O-N 3.31Å; Q260-R263 VanDerWaalsContact O-N 3.17Å; M261-R263 VanDerWaalsContact C-N 3.35Å; M261-R263 PolarHBondContact O-N 2.92Å; R263-S266 PolarHBondContact O-N 2.89Å; R263-S266 PolarHBondContact O-OG 3.22Å; R263-L267 WeakPolarHBondContact O-CB 3.18Å; R263-L267 PolarHBondContact O-N 3.42Å
264	I	94.8	Very high	93.7	Very high	115 Å²	115	105.8 Å²	105.8	59%	0.59	51%	0.512	S	S	*	.	H	α-helix	trans	-66	-42.7	176.2	-67.7	168.5	0	0	0	109.9	Q260 M261 L267 A268	Q260-I264 WeakPolarHBondContact O-CG1 2.92Å; Q260-I264 PolarHBondContact O-N 3.47Å; M261-I264 PolarHBondContact O-N 2.9Å; I264-L267 PolarHBondContact O-N 3.18Å; I264-A268 VanDerWaalsContact O-CB 3.27Å; I264-A268 WeakPolarHBondContact O-CB 3.26Å; I264-A268 PolarHBondContact O-N 2.9Å
265	S	94.4	Very high	93.2	Very high	60 Å²	60	105 Å²	105	42%	0.42	50%	0.5	S	S	.	.	H	α-helix	trans	-61.2	-44.9	176.6	-178.8	0	0	0	0	111.8	M261 I262 A268 N269	M261-S265 WeakPolarHBondContact O-CB 3.26Å; M261-S265 PolarHBondContact O-N 3.02Å; I262-S265 PolarHBondContact O-N 3.43Å; S265-A268 PolarHBondContact O-N 3.35Å; S265-N269 WeakPolarHBondContact O-CB 3.26Å; S265-N269 VanDerWaalsContact O-CG 3.28Å; S265-N269 PolarHBondContact O-N 3.49Å; S265-N269 PolarHBondContact O-ND2 3.12Å
266	S	94.3	Very high	92.9	Very high	71 Å²	71	103.6 Å²	103.6	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-66.6	-39.4	177.2	69.2	0	0	0	0	112.4	I262 R263 N269 R270	I262-S266 WeakPolarHBondContact O-CB 3.49Å; I262-S266 PolarHBondContact O-N 3.18Å; I262-S266 PolarHBondContact O-OG 3.42Å; R263-S266 PolarHBondContact O-N 2.89Å; R263-S266 PolarHBondContact O-OG 3.22Å; S266-N269 PolarHBondContact O-N 3.15Å; S266-R270 WeakPolarHBondContact O-CB 3.44Å; S266-R270 PolarHBondContact O-N 3.44Å
267	L	94.4	Very high	92.7	Very high	87 Å²	87	103.4 Å²	103.4	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-63.2	-45.9	173.5	-173.6	110	0	0	0	111.4	R263 I264 R270 I271	R263-L267 WeakPolarHBondContact O-CB 3.18Å; R263-L267 PolarHBondContact O-N 3.42Å; I264-L267 PolarHBondContact O-N 3.18Å; L267-R270 PolarHBondContact O-N 2.89Å; L267-I271 HydrophobicContact CD2-CD1 3.78Å; L267-I271 HydrophobicContact CG-CD1 4.06Å; L267-I271 WeakPolarHBondContact O-CG1 3.44Å; L267-I271 PolarHBondContact O-N 3.38Å
268	A	92.4	Very high	92.4	Very high	43 Å²	43	101.8 Å²	101.8	36%	0.355	49%	0.492	S	S	.	.	H	α-helix	trans	-60.8	-45.3	177.1	0	0	0	0	0	111.1	I264 S265 R270 I271 L272	I264-A268 VanDerWaalsContact O-CB 3.27Å; I264-A268 WeakPolarHBondContact O-CB 3.26Å; I264-A268 PolarHBondContact O-N 2.9Å; S265-A268 PolarHBondContact O-N 3.35Å; A268-R270 VanDerWaalsContact C-N 3.34Å; A268-R270 PolarHBondContact O-N 3.17Å; A268-I271 PolarHBondContact O-N 3Å; A268-L272 WeakPolarHBondContact O-CB 3.47Å; A268-L272 VanDerWaalsContact O-CG 3.31Å; A268-L272 WeakPolarHBondContact O-CG 3.32Å; A268-L272 PolarHBondContact O-N 3.41Å
269	N	93.8	Very high	91.9	Very high	97 Å²	97	95.1 Å²	95.1	52%	0.519	47%	0.468	S	S	.	.	H	α-helix	trans	-61.5	-40.3	175.1	-74.7	-21.6	0	0	0	111.9	S265 S266 L272 Q273	S265-N269 WeakPolarHBondContact O-CB 3.26Å; S265-N269 VanDerWaalsContact O-CG 3.28Å; S265-N269 PolarHBondContact O-N 3.49Å; S265-N269 PolarHBondContact O-ND2 3.12Å; S266-N269 PolarHBondContact O-N 3.15Å; N269-L272 PolarHBondContact O-N 3.31Å; N269-Q273 WeakPolarHBondContact O-CB 3.27Å; N269-Q273 PolarHBondContact O-N 3.36Å
270	R	93.4	Very high	91.6	Very high	152 Å²	152	95.2 Å²	95.2	57%	0.574	47%	0.47	S	S	*	.	H	α-helix	trans	-64.8	-43.6	175.6	-172.5	175.6	70.4	166.5	1.7	112.3	S266 L267 A268 L272 Q273 Q274	S266-R270 WeakPolarHBondContact O-CB 3.44Å; S266-R270 PolarHBondContact O-N 3.44Å; L267-R270 PolarHBondContact O-N 2.89Å; A268-R270 VanDerWaalsContact C-N 3.34Å; A268-R270 PolarHBondContact O-N 3.17Å; R270-L272 VanDerWaalsContact C-N 3.33Å; R270-Q273 PolarHBondContact O-N 3Å; R270-Q274 WeakPolarHBondContact O-CG 3.33Å; R270-Q274 PolarHBondContact O-N 3.11Å
271	I	90.1	Very high	91.4	Very high	91 Å²	91	98.6 Å²	98.6	47%	0.467	48%	0.484	S	S	.	.	H	α-helix	trans	-63.7	-41.9	176.9	-68.8	167.7	0	0	0	110.3	L267 A268 Q273 R275	L267-I271 HydrophobicContact CD2-CD1 3.78Å; L267-I271 HydrophobicContact CG-CD1 4.06Å; L267-I271 WeakPolarHBondContact O-CG1 3.44Å; L267-I271 PolarHBondContact O-N 3.38Å; A268-I271 PolarHBondContact O-N 3Å; I271-Q273 VanDerWaalsContact C-N 3.34Å; I271-R275 VanDerWaalsContact O-CB 3.26Å; I271-R275 WeakPolarHBondContact O-CB 3.45Å; I271-R275 PolarHBondContact O-N 3.4Å
272	L	89.6	Confident	91	Very high	102 Å²	102	93.7 Å²	93.7	53%	0.534	46%	0.459	S	S	.	.	H	α-helix	trans	-61.4	-42.6	174.5	-75	172.2	0	0	0	111.6	A268 N269 R270 R275 N276	A268-L272 WeakPolarHBondContact O-CB 3.47Å; A268-L272 VanDerWaalsContact O-CG 3.31Å; A268-L272 WeakPolarHBondContact O-CG 3.32Å; A268-L272 PolarHBondContact O-N 3.41Å; N269-L272 PolarHBondContact O-N 3.31Å; R270-L272 VanDerWaalsContact C-N 3.33Å; L272-R275 PolarHBondContact O-N 3.49Å; L272-N276 WeakPolarHBondContact O-CB 3.45Å; L272-N276 PolarHBondContact O-N 2.96Å
273	Q	91.3	Very high	90.7	Very high	103 Å²	103	92.7 Å²	92.7	48%	0.481	45%	0.454	S	S	.	.	H	α-helix	trans	-63	-49.9	177.5	-173.7	64.5	21	0	0	112	N269 R270 I271 R275 N276 E277	N269-Q273 WeakPolarHBondContact O-CB 3.27Å; N269-Q273 PolarHBondContact O-N 3.36Å; R270-Q273 PolarHBondContact O-N 3Å; I271-Q273 VanDerWaalsContact C-N 3.34Å; Q273-R275 PolarHBondContact O-N 3.49Å; Q273-N276 WeakPolarHBondContact O-CB 3.42Å; Q273-N276 PolarHBondContact O-N 2.98Å; Q273-E277 WeakPolarHBondContact O-CG 3.42Å; Q273-E277 PolarHBondContact O-N 3.44Å
274	Q	89.9	Confident	90.6	Very high	97 Å²	97	89.4 Å²	89.4	45%	0.453	45%	0.451	S	S	.	.	H	α-helix	trans	-58.7	-39.6	176.2	-72.9	178.9	-25.9	0	0	111.8	R270 E277 I278	R270-Q274 WeakPolarHBondContact O-CG 3.33Å; R270-Q274 PolarHBondContact O-N 3.11Å; Q274-E277 PolarHBondContact O-N 3.15Å; Q274-I278 VanDerWaalsContact O-CG1 3.29Å; Q274-I278 WeakPolarHBondContact O-CG1 3.45Å; Q274-I278 PolarHBondContact O-N 3.19Å
275	R	85.7	Confident	90.4	Very high	103 Å²	103	85.2 Å²	85.2	39%	0.389	43%	0.432	S	S	.	.	H	α-helix	trans	-65.3	-41.3	175.5	178.6	177.9	167.8	-176.7	-6.2	111.5	I271 L272 Q273 E277 I278 E279 K379	I271-R275 VanDerWaalsContact O-CB 3.26Å; I271-R275 WeakPolarHBondContact O-CB 3.45Å; I271-R275 PolarHBondContact O-N 3.4Å; L272-R275 PolarHBondContact O-N 3.49Å; Q273-R275 PolarHBondContact O-N 3.49Å; R275-E277 VanDerWaalsContact C-N 3.34Å; R275-I278 PolarHBondContact O-N 3.12Å; R275-E279 HydrophobicContact CG-CG 4.35Å; R275-E279 IonicContact CZ-OE1 2.8Å; R275-E279 VanDerWaalsContact CZ-OE1 3.29Å; R275-E279 IonicContact NE-OE1 2.76Å; R275-E279 PolarHBondContact NE-OE1 3.45Å; R275-E279 IonicContact NH2-OE1 3.78Å; R275-E279 PolarHBondContact NH2-OE1 2.98Å; R275-E279 WeakPolarHBondContact O-CB 3.46Å; R275-E279 VanDerWaalsContact O-CG 3.3Å; R275-E279 WeakPolarHBondContact O-CG 3.3Å; R275-E279 PolarHBondContact O-N 3.49Å; R275-K379 VanDerWaalsContact CZ-NZ 3.34Å; R275-K379 VanDerWaalsContact NE-NZ 3.16Å; R275-K379 VanDerWaalsContact NH2-NZ 3.15Å
276	N	89.8	Confident	90.1	Very high	83 Å²	83	83 Å²	83	44%	0.444	42%	0.415	S	S	.	.	H	α-helix	trans	-61.3	-43.4	176.6	-167.2	54.6	0	0	0	111	L272 Q273 I278 E279 E280	L272-N276 WeakPolarHBondContact O-CB 3.45Å; L272-N276 PolarHBondContact O-N 2.96Å; Q273-N276 WeakPolarHBondContact O-CB 3.42Å; Q273-N276 PolarHBondContact O-N 2.98Å; N276-I278 PolarHBondContact O-N 2.88Å; N276-E279 PolarHBondContact O-N 3Å; N276-E280 WeakPolarHBondContact O-CB 3.46Å; N276-E280 PolarHBondContact O-N 2.83Å
277	E	89.5	Confident	89.9	Confident	103 Å²	103	83.1 Å²	83.1	48%	0.481	41%	0.41	S	S	.	.	H	α-helix	trans	-61.5	-42.7	175.3	-69.7	167.9	-162.4	0	0	112.4	Q273 Q274 R275 E280 F281	Q273-E277 WeakPolarHBondContact O-CG 3.42Å; Q273-E277 PolarHBondContact O-N 3.44Å; Q274-E277 PolarHBondContact O-N 3.15Å; R275-E277 VanDerWaalsContact C-N 3.34Å; E277-E280 PolarHBondContact O-N 2.9Å; E277-F281 WeakPolarHBondContact O-CB 3.26Å; E277-F281 PolarHBondContact O-N 2.9Å
278	I	88.5	Confident	89.8	Confident	83 Å²	83	85.2 Å²	85.2	43%	0.426	41%	0.413	S	S	.	.	H	α-helix	trans	-66.2	-42.4	176.3	-68.4	165.6	0	0	0	110.8	Q274 R275 N276 F281 F282 M375	Q274-I278 VanDerWaalsContact O-CG1 3.29Å; Q274-I278 WeakPolarHBondContact O-CG1 3.45Å; Q274-I278 PolarHBondContact O-N 3.19Å; R275-I278 PolarHBondContact O-N 3.12Å; N276-I278 PolarHBondContact O-N 2.88Å; I278-F281 PolarHBondContact O-N 3.09Å; I278-F282 HydrophobicContact CG2-CD2 3.58Å; I278-F282 HydrophobicContact CG2-CE2 3.46Å; I278-F282 VanDerWaalsContact CG2-CE2 3.46Å; I278-F282 WeakPolarHBondContact O-CD2 3.39Å; I278-F282 PolarHBondContact O-N 3.4Å; I278-M375 HydrophobicContact CG2-CE 4.39Å; I278-M375 HydrophobicContact CG2-SD 4.1Å
279	E	84.1	Confident	89.6	Confident	42 Å²	42	83.7 Å²	83.7	20%	0.196	40%	0.399	C	S	.	.	H	α-helix	trans	-63.2	-43.7	177.2	-74.8	175.3	177.7	0	0	110.9	R275 N276 F282 I283 F372 K379	R275-E279 HydrophobicContact CG-CG 4.35Å; R275-E279 IonicContact CZ-OE1 2.8Å; R275-E279 VanDerWaalsContact CZ-OE1 3.29Å; R275-E279 IonicContact NE-OE1 2.76Å; R275-E279 PolarHBondContact NE-OE1 3.45Å; R275-E279 IonicContact NH2-OE1 3.78Å; R275-E279 PolarHBondContact NH2-OE1 2.98Å; R275-E279 WeakPolarHBondContact O-CB 3.46Å; R275-E279 VanDerWaalsContact O-CG 3.3Å; R275-E279 WeakPolarHBondContact O-CG 3.3Å; R275-E279 PolarHBondContact O-N 3.49Å; N276-E279 PolarHBondContact O-N 3Å; E279-F282 PolarHBondContact O-N 3.26Å; E279-I283 WeakPolarHBondContact O-CB 3.19Å; E279-I283 WeakPolarHBondContact O-CD1 3.24Å; E279-I283 WeakPolarHBondContact O-CG1 3.42Å; E279-I283 PolarHBondContact O-N 3.32Å; E279-F372 HydrophobicContact CG-CE2 4.33Å; E279-K379 IonicContact OE1-NZ 3.88Å; E279-K379 PolarHBondContact OE1-NZ 3.29Å
280	E	90.3	Very high	89.3	Confident	118 Å²	118	84.1 Å²	84.1	55%	0.551	39%	0.394	S	S	*	.	H	α-helix	trans	-61.4	-44	173.8	-175.4	174.8	-176	0	0	112.1	N276 E277 I283 T284	N276-E280 WeakPolarHBondContact O-CB 3.46Å; N276-E280 PolarHBondContact O-N 2.83Å; E277-E280 PolarHBondContact O-N 2.9Å; E280-I283 PolarHBondContact O-N 3.48Å; E280-T284 WeakPolarHBondContact O-CB 3.43Å; E280-T284 PolarHBondContact O-N 3.04Å; E280-T284 PolarHBondContact O-OG1 3.43Å
281	F	88.6	Confident	89.2	Confident	131 Å²	131	80.7 Å²	80.7	58%	0.575	39%	0.387	S	S	*	.	H	α-helix	trans	-61.2	-44.9	176.1	174.3	-99.3	0	0	0	112.3	E277 I278 T284 S285	E277-F281 WeakPolarHBondContact O-CB 3.26Å; E277-F281 PolarHBondContact O-N 2.9Å; I278-F281 PolarHBondContact O-N 3.09Å; F281-T284 PolarHBondContact O-N 3.29Å; F281-S285 VanDerWaalsContact O-CB 3.29Å; F281-S285 WeakPolarHBondContact O-CB 3.25Å; F281-S285 PolarHBondContact O-N 2.84Å; F281-S285 PolarHBondContact O-OG 2.85Å
282	F	86.8	Confident	89.2	Confident	30 Å²	30	79 Å²	79	13%	0.132	38%	0.377	C	S	.	.	H	α-helix	trans	-67	-40.3	178	-83.8	-62.8	0	0	0	112.4	I278 E279 S285 L286 L368 L371 F372 M375	I278-F282 HydrophobicContact CG2-CD2 3.58Å; I278-F282 HydrophobicContact CG2-CE2 3.46Å; I278-F282 VanDerWaalsContact CG2-CE2 3.46Å; I278-F282 WeakPolarHBondContact O-CD2 3.39Å; I278-F282 PolarHBondContact O-N 3.4Å; E279-F282 PolarHBondContact O-N 3.26Å; F282-S285 PolarHBondContact O-N 2.82Å; F282-L286 WeakPolarHBondContact O-CB 3.49Å; F282-L286 WeakPolarHBondContact O-CG 3.4Å; F282-L286 PolarHBondContact O-N 3.4Å; F282-L368 HydrophobicContact CE1-CD2 4.38Å; F282-L371 HydrophobicContact CE1-CD2 3.76Å; F282-L371 HydrophobicContact CE1-CG 4.32Å; F282-L371 HydrophobicContact CZ-CD2 3.97Å; F282-L371 HydrophobicContact CZ-CG 4.37Å; F282-F372 HydrophobicContact CB-CD2 3.75Å; F282-F372 HydrophobicContact CB-CE2 4.15Å; F282-F372 HydrophobicContact CD2-CD2 4.36Å; F282-F372 HydrophobicContact CG-CD2 4.14Å; F282-M375 HydrophobicContact CD2-CE 3.62Å; F282-M375 HydrophobicContact CD2-SD 4.27Å; F282-M375 HydrophobicContact CE2-CE 3.76Å; F282-M375 HydrophobicContact CE2-SD 3.81Å
283	I	88	Confident	89.1	Confident	84 Å²	84	74.8 Å²	74.8	43%	0.431	36%	0.355	S	S	.	.	H	α-helix	trans	-62.6	-46.7	175.8	-69.7	165.7	0	0	0	109.8	E279 E280 S285 L286 N287	E279-I283 WeakPolarHBondContact O-CB 3.19Å; E279-I283 WeakPolarHBondContact O-CD1 3.24Å; E279-I283 WeakPolarHBondContact O-CG1 3.42Å; E279-I283 PolarHBondContact O-N 3.32Å; E280-I283 PolarHBondContact O-N 3.48Å; I283-S285 PolarHBondContact O-N 3.46Å; I283-L286 PolarHBondContact O-N 2.91Å; I283-N287 WeakPolarHBondContact O-CB 3.32Å; I283-N287 PolarHBondContact O-N 3.47Å; I283-N287 PolarHBondContact O-ND2 3.31Å
284	T	92.1	Very high	88.8	Confident	82 Å²	82	75.3 Å²	75.3	50%	0.503	36%	0.356	S	S	.	.	H	α-helix	trans	-62.4	-43.3	177.9	-56.1	0	0	0	0	111.4	E280 F281 N287 Y288	E280-T284 WeakPolarHBondContact O-CB 3.43Å; E280-T284 PolarHBondContact O-N 3.04Å; E280-T284 PolarHBondContact O-OG1 3.43Å; F281-T284 PolarHBondContact O-N 3.29Å; T284-N287 PolarHBondContact O-N 3Å; T284-Y288 WeakPolarHBondContact O-CB 3.34Å; T284-Y288 PolarHBondContact O-N 2.9Å
285	S	90.6	Very high	88.9	Confident	27 Å²	27	74 Å²	74	19%	0.189	35%	0.354	C	S	.	.	H	α-helix	trans	-65.4	-41.3	177.2	-61.2	0	0	0	0	112.3	F281 F282 I283 N287 Y288 V289	F281-S285 VanDerWaalsContact O-CB 3.29Å; F281-S285 WeakPolarHBondContact O-CB 3.25Å; F281-S285 PolarHBondContact O-N 2.84Å; F281-S285 PolarHBondContact O-OG 2.85Å; F282-S285 PolarHBondContact O-N 2.82Å; I283-S285 PolarHBondContact O-N 3.46Å; S285-N287 VanDerWaalsContact C-N 3.35Å; S285-Y288 PolarHBondContact O-N 3.34Å; S285-V289 WeakPolarHBondContact O-CG2 3.18Å; S285-V289 PolarHBondContact O-N 2.88Å
286	L	89	Confident	89	Confident	14 Å²	14	72.2 Å²	72.2	7%	0.073	35%	0.352	C	S	.	.	H	α-helix	trans	-64.2	-41.1	174.7	-81.5	170.2	0	0	0	111.3	F282 I283 V289 R290 E365 L368	F282-L286 WeakPolarHBondContact O-CB 3.49Å; F282-L286 WeakPolarHBondContact O-CG 3.4Å; F282-L286 PolarHBondContact O-N 3.4Å; I283-L286 PolarHBondContact O-N 2.91Å; L286-V289 PolarHBondContact O-N 3.14Å; L286-R290 VanDerWaalsContact O-CB 3.3Å; L286-R290 WeakPolarHBondContact O-CB 3.23Å; L286-R290 WeakPolarHBondContact O-CG 3.2Å; L286-R290 PolarHBondContact O-N 2.86Å; L286-E365 HydrophobicContact CD2-CG 4.21Å; L286-L368 HydrophobicContact CD2-CB 3.57Å; L286-L368 HydrophobicContact CD2-CD1 4.42Å; L286-L368 HydrophobicContact CG-CB 4.26Å
287	N	90.1	Very high	88.8	Confident	73 Å²	73	70.3 Å²	70.3	39%	0.39	34%	0.341	S	S	.	.	H	α-helix	trans	-62.6	-46.6	174.9	-70.6	-20.9	0	0	0	110.9	I283 T284 S285 V289 R290 D291	I283-N287 WeakPolarHBondContact O-CB 3.32Å; I283-N287 PolarHBondContact O-N 3.47Å; I283-N287 PolarHBondContact O-ND2 3.31Å; T284-N287 PolarHBondContact O-N 3Å; S285-N287 VanDerWaalsContact C-N 3.35Å; N287-V289 PolarHBondContact O-N 2.99Å; N287-R290 PolarHBondContact O-N 3.43Å; N287-D291 VanDerWaalsContact O-CG 3.3Å; N287-D291 PolarHBondContact O-N 3.3Å
288	Y	91.9	Very high	88.8	Confident	132 Å²	132	70.3 Å²	70.3	52%	0.518	34%	0.344	S	S	.	.	H	α-helix	trans	-58.1	-49.8	176.3	-179	-105.2	0	0	0	112.1	T284 S285 R290 D291 E292 W361	T284-Y288 WeakPolarHBondContact O-CB 3.34Å; T284-Y288 PolarHBondContact O-N 2.9Å; S285-Y288 PolarHBondContact O-N 3.34Å; Y288-R290 VanDerWaalsContact C-N 3.34Å; Y288-R290 PolarHBondContact O-N 2.86Å; Y288-D291 PolarHBondContact O-N 3.4Å; Y288-E292 HydrophobicContact CD1-CG 4.33Å; Y288-E292 HydrophobicContact CE1-CG 3.82Å; Y288-E292 HydrophobicContact CE2-CG 4.04Å; Y288-E292 WeakPolarHBondContact O-CG 3.3Å; Y288-E292 PolarHBondContact O-N 3.23Å; Y288-E292 PolarHBondContact OH-OE1 3.37Å; Y288-W361 HydrophobicContact CE1-CH2 4.49Å
289	V	88.8	Confident	88.9	Confident	10 Å²	10	70.5 Å²	70.5	6%	0.061	35%	0.346	C	S	.	.	H	α-helix	trans	-63.6	-40.2	178	174.1	0	0	0	0	111.4	S285 L286 N287 D291 E292 I293 W361 K364 E365 L368	S285-V289 WeakPolarHBondContact O-CG2 3.18Å; S285-V289 PolarHBondContact O-N 2.88Å; L286-V289 PolarHBondContact O-N 3.14Å; N287-V289 PolarHBondContact O-N 2.99Å; V289-D291 VanDerWaalsContact C-N 3.27Å; V289-D291 PolarHBondContact O-N 3.49Å; V289-E292 PolarHBondContact O-N 2.95Å; V289-I293 HydrophobicContact CG1-CD1 3.95Å; V289-I293 HydrophobicContact CG1-CG1 4.28Å; V289-I293 WeakPolarHBondContact O-CB 3.34Å; V289-I293 VanDerWaalsContact O-CG1 3.22Å; V289-I293 WeakPolarHBondContact O-CG1 3.45Å; V289-I293 PolarHBondContact O-N 2.78Å; V289-W361 HydrophobicContact CG1-CE3 4.14Å; V289-W361 HydrophobicContact CG2-CE3 4.34Å; V289-W361 HydrophobicContact CG2-CZ3 4.16Å; V289-K364 HydrophobicContact CG1-CB 4.4Å; V289-E365 HydrophobicContact CG1-CB 3.72Å; V289-E365 HydrophobicContact CG1-CG 4.39Å; V289-L368 HydrophobicContact CB-CD1 4.48Å; V289-L368 HydrophobicContact CG2-CD1 3.79Å
290	R	88.3	Confident	89	Confident	106 Å²	106	73.2 Å²	73.2	40%	0.4	36%	0.355	S	S	.	.	H	α-helix	trans	-61.6	-38	175.6	-78.3	174.2	-176.7	162	2.5	111.9	L286 N287 Y288 K294 E365	L286-R290 VanDerWaalsContact O-CB 3.3Å; L286-R290 WeakPolarHBondContact O-CB 3.23Å; L286-R290 WeakPolarHBondContact O-CG 3.2Å; L286-R290 PolarHBondContact O-N 2.86Å; N287-R290 PolarHBondContact O-N 3.43Å; Y288-R290 VanDerWaalsContact C-N 3.34Å; Y288-R290 PolarHBondContact O-N 2.86Å; R290-K294 VanDerWaalsContact O-CG 3.31Å; R290-K294 WeakPolarHBondContact O-CG 3.4Å; R290-K294 PolarHBondContact O-N 2.86Å; R290-K294 VanDerWaalsContact O-N 3.13Å; R290-E365 HydrophobicContact CG-CG 4.09Å; R290-E365 IonicContact CZ-OE1 2.73Å; R290-E365 IonicContact NE-OE1 3.78Å; R290-E365 PolarHBondContact NE-OE1 2.85Å; R290-E365 IonicContact NH2-OE1 3.62Å
291	D	90.9	Very high	88.8	Confident	81 Å²	81	69.1 Å²	69.1	43%	0.433	34%	0.337	S	S	.	.	H	α-helix	trans	-71.7	-41	177.9	-68.1	-23	0	0	0	111.4	N287 Y288 V289 I293 K294 V295	N287-D291 VanDerWaalsContact O-CG 3.3Å; N287-D291 PolarHBondContact O-N 3.3Å; Y288-D291 PolarHBondContact O-N 3.4Å; V289-D291 VanDerWaalsContact C-N 3.27Å; V289-D291 PolarHBondContact O-N 3.49Å; D291-I293 PolarHBondContact O-N 3.27Å; D291-K294 WeakPolarHBondContact O-CB 3.23Å; D291-K294 PolarHBondContact O-N 3.4Å; D291-K294 IonicContact OD1-NZ 2.76Å; D291-K294 PolarHBondContact OD1-NZ 2.79Å; D291-V295 WeakPolarHBondContact O-CG2 3.24Å; D291-V295 PolarHBondContact O-N 3.36Å
292	E	90.2	Very high	88.8	Confident	54 Å²	54	68.8 Å²	68.8	25%	0.252	34%	0.336	S	S	.	.	H	α-helix	trans	-64.1	-37.1	172.5	-70.1	-62.3	157.6	0	0	112.8	Y288 V289 K294 V295 N296 W361	Y288-E292 HydrophobicContact CD1-CG 4.33Å; Y288-E292 HydrophobicContact CE1-CG 3.82Å; Y288-E292 HydrophobicContact CE2-CG 4.04Å; Y288-E292 WeakPolarHBondContact O-CG 3.3Å; Y288-E292 PolarHBondContact O-N 3.23Å; Y288-E292 PolarHBondContact OH-OE1 3.37Å; V289-E292 PolarHBondContact O-N 2.95Å; E292-K294 VanDerWaalsContact C-N 3.34Å; E292-V295 PolarHBondContact O-N 2.86Å; E292-N296 VanDerWaalsContact O-CB 3.28Å; E292-N296 WeakPolarHBondContact O-CB 3.49Å; E292-N296 PolarHBondContact O-N 3.15Å; E292-W361 HydrophobicContact CB-CD2 4.16Å; E292-W361 HydrophobicContact CB-CE3 4.31Å; E292-W361 HydrophobicContact CB-CZ2 4.43Å; E292-W361 HydrophobicContact CG-CH2 4.43Å; E292-W361 HydrophobicContact CG-CZ2 4.47Å
293	I	85.9	Confident	88.9	Confident	14 Å²	14	72 Å²	72	7%	0.072	36%	0.355	C	S	.	.	H	α-helix	trans	-58.9	-48.3	172	-72.9	167.6	0	0	0	109.9	V289 D291 V295 N296 Q297 W361 E362 E365	V289-I293 HydrophobicContact CG1-CD1 3.95Å; V289-I293 HydrophobicContact CG1-CG1 4.28Å; V289-I293 WeakPolarHBondContact O-CB 3.34Å; V289-I293 VanDerWaalsContact O-CG1 3.22Å; V289-I293 WeakPolarHBondContact O-CG1 3.45Å; V289-I293 PolarHBondContact O-N 2.78Å; D291-I293 PolarHBondContact O-N 3.27Å; I293-V295 VanDerWaalsContact C-N 3.29Å; I293-V295 PolarHBondContact O-N 2.82Å; I293-N296 PolarHBondContact O-N 2.86Å; I293-Q297 HydrophobicContact CG2-CG 4.06Å; I293-Q297 VanDerWaalsContact O-CB 3.32Å; I293-Q297 WeakPolarHBondContact O-CB 3.47Å; I293-Q297 VanDerWaalsContact O-CG 3.22Å; I293-Q297 WeakPolarHBondContact O-CG 3.36Å; I293-Q297 PolarHBondContact O-N 3.32Å; I293-W361 WeakPolarHBondContact CD1-O 3.44Å; I293-W361 HydrophobicContact CG1-CB 3.54Å; I293-E362 HydrophobicContact CD1-CG 4.43Å; I293-E362 HydrophobicContact CG1-CG 4.41Å; I293-E362 HydrophobicContact CG2-CG 4.05Å; I293-E365 HydrophobicContact CD1-CB 3.49Å; I293-E365 VanDerWaalsContact CD1-CB 3.49Å; I293-E365 HydrophobicContact CD1-CG 4.07Å
294	K	86.8	Confident	88.8	Confident	115 Å²	115	68.6 Å²	68.6	50%	0.5	34%	0.339	S	S	.	.	H	α-helix	trans	-59.1	-44.2	178.6	-68.7	167.6	-163.8	158.6	0	110.7	R290 D291 E292 N298	R290-K294 VanDerWaalsContact O-CG 3.31Å; R290-K294 WeakPolarHBondContact O-CG 3.4Å; R290-K294 PolarHBondContact O-N 2.86Å; R290-K294 VanDerWaalsContact O-N 3.13Å; D291-K294 WeakPolarHBondContact O-CB 3.23Å; D291-K294 PolarHBondContact O-N 3.4Å; D291-K294 IonicContact OD1-NZ 2.76Å; D291-K294 PolarHBondContact OD1-NZ 2.79Å; E292-K294 VanDerWaalsContact C-N 3.34Å; K294-N298 WeakPolarHBondContact O-CB 3.38Å; K294-N298 PolarHBondContact O-N 2.84Å; K294-N298 PolarHBondContact O-ND2 3.3Å; K294-N298 VanDerWaalsContact O-ND2 3.15Å
295	V	90.3	Very high	88.6	Confident	70 Å²	70	69.5 Å²	69.5	42%	0.424	34%	0.336	S	S	.	.	H	α-helix	trans	-62.4	-48.5	177.2	173.8	0	0	0	0	111.1	D291 E292 I293 N298 N299	D291-V295 WeakPolarHBondContact O-CG2 3.24Å; D291-V295 PolarHBondContact O-N 3.36Å; E292-V295 PolarHBondContact O-N 2.86Å; I293-V295 VanDerWaalsContact C-N 3.29Å; I293-V295 PolarHBondContact O-N 2.82Å; V295-N298 WeakPolarHBondContact O-CB 3.42Å; V295-N298 PolarHBondContact O-N 3.22Å; V295-N299 VanDerWaalsContact O-CG 3.3Å; V295-N299 PolarHBondContact O-N 2.85Å
296	N	88.6	Confident	88.5	Confident	65 Å²	65	70.9 Å²	70.9	35%	0.348	35%	0.346	S	S	.	.	H	α-helix	trans	-64.5	-42.2	-179.4	-173.8	52.9	0	0	0	112.5	E292 I293 N298 N299 Y300	E292-N296 VanDerWaalsContact O-CB 3.28Å; E292-N296 WeakPolarHBondContact O-CB 3.49Å; E292-N296 PolarHBondContact O-N 3.15Å; I293-N296 PolarHBondContact O-N 2.86Å; N296-N298 VanDerWaalsContact C-N 3.33Å; N296-N298 PolarHBondContact O-N 2.91Å; N296-N299 PolarHBondContact O-N 2.79Å; N296-Y300 WeakPolarHBondContact O-CB 3.29Å; N296-Y300 PolarHBondContact O-N 3.29Å
297	Q	86.6	Confident	88.4	Confident	43 Å²	43	72.7 Å²	72.7	20%	0.201	36%	0.363	C	S	.	.	H	α-helix	trans	-62	-42.2	174.9	-72.7	178.4	-3.1	0	0	111.1	I293 Y300 I301 F342 E362	I293-Q297 HydrophobicContact CG2-CG 4.06Å; I293-Q297 VanDerWaalsContact O-CB 3.32Å; I293-Q297 WeakPolarHBondContact O-CB 3.47Å; I293-Q297 VanDerWaalsContact O-CG 3.22Å; I293-Q297 WeakPolarHBondContact O-CG 3.36Å; I293-Q297 PolarHBondContact O-N 3.32Å; Q297-Y300 PolarHBondContact O-N 3.31Å; Q297-I301 WeakPolarHBondContact O-CB 3.34Å; Q297-I301 WeakPolarHBondContact O-CD1 3.31Å; Q297-I301 WeakPolarHBondContact O-CG1 3.27Å; Q297-I301 PolarHBondContact O-N 3.19Å; Q297-F342 HydrophobicContact CB-CE1 4.01Å; Q297-F342 HydrophobicContact CB-CE2 4.09Å; Q297-F342 HydrophobicContact CB-CZ 3.69Å; Q297-F342 HydrophobicContact CG-CD1 3.89Å; Q297-F342 HydrophobicContact CG-CD2 4.33Å; Q297-F342 HydrophobicContact CG-CE1 3.69Å; Q297-F342 HydrophobicContact CG-CE2 4.16Å; Q297-F342 HydrophobicContact CG-CG 4.21Å; Q297-F342 HydrophobicContact CG-CZ 3.82Å; Q297-E362 WeakPolarHBondContact CG-OE1 3.39Å; Q297-E362 PolarHBondContact NE2-OE1 3.07Å
298	N	88.8	Confident	88.2	Confident	102 Å²	102	71.5 Å²	71.5	55%	0.545	35%	0.353	S	S	.	.	H	α-helix	trans	-62.9	-44.6	175.6	-72.8	-22.6	0	0	0	112	K294 V295 N296 I301 H302	K294-N298 WeakPolarHBondContact O-CB 3.38Å; K294-N298 PolarHBondContact O-N 2.84Å; K294-N298 PolarHBondContact O-ND2 3.3Å; K294-N298 VanDerWaalsContact O-ND2 3.15Å; V295-N298 WeakPolarHBondContact O-CB 3.42Å; V295-N298 PolarHBondContact O-N 3.22Å; N296-N298 VanDerWaalsContact C-N 3.33Å; N296-N298 PolarHBondContact O-N 2.91Å; N298-I301 PolarHBondContact O-N 3.45Å; N298-H302 WeakPolarHBondContact O-CB 3.43Å; N298-H302 PolarHBondContact O-N 3.4Å
299	N	89.4	Confident	88	Confident	88 Å²	88	69 Å²	69	47%	0.471	35%	0.347	S	S	.	.	H	α-helix	trans	-63.5	-43.5	176.6	-69.2	-12.2	0	0	0	111.4	V295 N296 I301 H302 D303	V295-N299 VanDerWaalsContact O-CG 3.3Å; V295-N299 PolarHBondContact O-N 2.85Å; N296-N299 PolarHBondContact O-N 2.79Å; N299-I301 PolarHBondContact O-N 3.42Å; N299-H302 WeakPolarHBondContact O-CB 3.32Å; N299-H302 PolarHBondContact O-N 3.2Å; N299-D303 WeakPolarHBondContact O-CB 3.33Å; N299-D303 PolarHBondContact O-N 2.99Å
300	Y	87.6	Confident	87.9	Confident	99 Å²	99	70.4 Å²	70.4	39%	0.388	36%	0.359	S	S	.	.	H	α-helix	trans	-63.9	-42.2	177.5	-172.6	-99.1	0	0	0	112.3	N296 Q297 H302 A304 R326 I338 D341 F342	N296-Y300 WeakPolarHBondContact O-CB 3.29Å; N296-Y300 PolarHBondContact O-N 3.29Å; Q297-Y300 PolarHBondContact O-N 3.31Å; Y300-H302 VanDerWaalsContact C-N 3.3Å; Y300-H302 PolarHBondContact O-N 3.31Å; Y300-A304 WeakPolarHBondContact O-CB 3.33Å; Y300-A304 PolarHBondContact O-N 3.4Å; Y300-R326 PolarHBondContact OH-NH2 3.23Å; Y300-I338 HydrophobicContact CD1-CD1 3.81Å; Y300-I338 HydrophobicContact CD1-CG1 3.93Å; Y300-I338 HydrophobicContact CE1-CD1 3.66Å; Y300-I338 HydrophobicContact CE1-CG1 3.67Å; Y300-D341 HydrophobicContact CE1-CB 4.36Å; Y300-F342 AromaticContact CD1-CE1 3.66Å; Y300-F342 HydrophobicContact CD1-CE1 3.66Å; Y300-F342 AromaticContact CD1-CZ 3.99Å; Y300-F342 HydrophobicContact CD1-CZ 3.99Å; Y300-F342 HydrophobicContact CE1-CE1 4.49Å; Y300-F342 HydrophobicContact CG-CE1 4.21Å
301	I	86.6	Confident	87.7	Confident	32 Å²	32	67.6 Å²	67.6	16%	0.164	36%	0.356	C	S	.	.	H	α-helix	trans	-58.7	-46.2	173.2	-70.8	161.3	0	0	0	110	Q297 N298 N299 K305 F328 I338 F342	Q297-I301 WeakPolarHBondContact O-CB 3.34Å; Q297-I301 WeakPolarHBondContact O-CD1 3.31Å; Q297-I301 WeakPolarHBondContact O-CG1 3.27Å; Q297-I301 PolarHBondContact O-N 3.19Å; N298-I301 PolarHBondContact O-N 3.45Å; N299-I301 PolarHBondContact O-N 3.42Å; I301-K305 WeakPolarHBondContact O-CB 3.3Å; I301-K305 PolarHBondContact O-N 2.88Å; I301-F328 HydrophobicContact CG2-CD1 4.43Å; I301-I338 HydrophobicContact CG1-CG2 4.37Å; I301-F342 HydrophobicContact CD1-CE2 3.96Å; I301-F342 HydrophobicContact CD1-CZ 4.13Å; I301-F342 HydrophobicContact CG1-CE2 4.01Å; I301-F342 HydrophobicContact CG1-CZ 3.83Å
302	H	87.7	Confident	87.4	Confident	123 Å²	123	66 Å²	66	57%	0.569	35%	0.346	S	S	*	.	H	α-helix	trans	-62.3	-50.4	-179.9	-179.5	-83.9	0	0	0	112.1	N298 N299 Y300 K305 S306	N298-H302 WeakPolarHBondContact O-CB 3.43Å; N298-H302 PolarHBondContact O-N 3.4Å; N299-H302 WeakPolarHBondContact O-CB 3.32Å; N299-H302 PolarHBondContact O-N 3.2Å; Y300-H302 VanDerWaalsContact C-N 3.3Å; Y300-H302 PolarHBondContact O-N 3.31Å; H302-K305 PolarHBondContact O-N 3.2Å; H302-S306 WeakPolarHBondContact O-CB 3.47Å; H302-S306 PolarHBondContact O-N 3.22Å
303	D	89.1	Confident	87.2	Confident	99 Å²	99	70.2 Å²	70.2	53%	0.529	36%	0.36	S	S	.	.	H	α-helix	trans	-68.5	-42.3	-177	-69.2	-13.4	0	0	0	112	N299 K305 S306 A307	N299-D303 WeakPolarHBondContact O-CB 3.33Å; N299-D303 PolarHBondContact O-N 2.99Å; D303-K305 VanDerWaalsContact C-N 3.31Å; D303-K305 PolarHBondContact O-N 2.84Å; D303-S306 PolarHBondContact O-N 3.06Å; D303-A307 WeakPolarHBondContact O-CB 3.49Å; D303-A307 PolarHBondContact O-N 3.41Å
304	A	86.5	Confident	87.2	Confident	11 Å²	11	73.6 Å²	73.6	9%	0.091	38%	0.378	C	S	.	.	H	α-helix	trans	-65.2	-36	175.6	0	0	0	0	0	112	Y300 Y308 F328 I338	Y300-A304 WeakPolarHBondContact O-CB 3.33Å; Y300-A304 PolarHBondContact O-N 3.4Å; A304-Y308 VanDerWaalsContact O-CB 3.25Å; A304-Y308 WeakPolarHBondContact O-CB 3.3Å; A304-Y308 PolarHBondContact O-N 3.46Å; A304-F328 HydrophobicContact CB-CE1 4.02Å; A304-I338 HydrophobicContact CB-CD1 3.27Å
305	K	86.4	Confident	86.9	Confident	102 Å²	102	68.4 Å²	68.4	44%	0.443	36%	0.357	S	S	.	.	H	α-helix	trans	-64.9	-47.6	173	-175.4	-177.1	174.6	-169	0	110.9	I301 H302 D303 A307 Y308 E309 F328	I301-K305 WeakPolarHBondContact O-CB 3.3Å; I301-K305 PolarHBondContact O-N 2.88Å; H302-K305 PolarHBondContact O-N 3.2Å; D303-K305 VanDerWaalsContact C-N 3.31Å; D303-K305 PolarHBondContact O-N 2.84Å; K305-A307 PolarHBondContact O-N 3.32Å; K305-Y308 PolarHBondContact O-N 3.01Å; K305-E309 WeakPolarHBondContact CE-OE1 3.38Å; K305-E309 WeakPolarHBondContact O-CB 3.27Å; K305-E309 VanDerWaalsContact O-CG 3.31Å; K305-E309 WeakPolarHBondContact O-CG 3.43Å; K305-E309 PolarHBondContact O-N 3.39Å; K305-F328 VanDerWaalsContact CA-CZ 3.42Å; K305-F328 HydrophobicContact CB-CD1 4.06Å; K305-F328 HydrophobicContact CB-CE1 3.8Å; K305-F328 HydrophobicContact CB-CE2 4.33Å; K305-F328 HydrophobicContact CB-CG 4.44Å; K305-F328 HydrophobicContact CB-CZ 3.96Å; K305-F328 HydrophobicContact CG-CD2 4.39Å; K305-F328 HydrophobicContact CG-CE2 4.32Å; K305-F328 HydrophobicContact CG-CZ 4.43Å
306	S	89	Confident	86.3	Confident	55 Å²	55	71.3 Å²	71.3	39%	0.385	37%	0.365	S	S	.	.	H	α-helix	trans	-60.5	-44	177.2	-173.4	0	0	0	0	112.3	H302 D303 E309 A310	H302-S306 WeakPolarHBondContact O-CB 3.47Å; H302-S306 PolarHBondContact O-N 3.22Å; D303-S306 PolarHBondContact O-N 3.06Å; S306-E309 PolarHBondContact O-N 3.49Å; S306-A310 WeakPolarHBondContact O-CB 3.29Å; S306-A310 PolarHBondContact O-N 2.85Å
307	A	86.9	Confident	86.1	Confident	53 Å²	53	73.8 Å²	73.8	44%	0.438	38%	0.378	S	S	.	.	H	α-helix	trans	-67.2	-38.1	177.6	0	0	0	0	0	112.8	D303 K305 A310 S311	D303-A307 WeakPolarHBondContact O-CB 3.49Å; D303-A307 PolarHBondContact O-N 3.41Å; K305-A307 PolarHBondContact O-N 3.32Å; A307-A310 PolarHBondContact O-N 3.25Å; A307-S311 WeakPolarHBondContact O-CB 3.23Å; A307-S311 PolarHBondContact O-N 2.89Å; A307-S311 PolarHBondContact O-OG 2.83Å
308	Y	85.9	Confident	85.7	Confident	47 Å²	47	75 Å²	75	18%	0.184	40%	0.401	C	S	.	.	H	α-helix	trans	-64.8	-45.9	173.8	179.6	-105.6	0	0	0	111.2	A304 K305 A310 S311 I312 P323 R326 F328	A304-Y308 VanDerWaalsContact O-CB 3.25Å; A304-Y308 WeakPolarHBondContact O-CB 3.3Å; A304-Y308 PolarHBondContact O-N 3.46Å; K305-Y308 PolarHBondContact O-N 3.01Å; Y308-A310 VanDerWaalsContact C-N 3.33Å; Y308-A310 PolarHBondContact O-N 2.93Å; Y308-S311 PolarHBondContact O-N 3.38Å; Y308-I312 HydrophobicContact CD1-CD1 3.7Å; Y308-I312 HydrophobicContact CE1-CD1 3.2Å; Y308-I312 HydrophobicContact CE1-CG1 4.28Å; Y308-I312 HydrophobicContact CE2-CD1 4.16Å; Y308-I312 HydrophobicContact CG-CD1 4.37Å; Y308-I312 VanDerWaalsContact CZ-CD1 3.46Å; Y308-I312 WeakPolarHBondContact O-CG1 3.47Å; Y308-I312 PolarHBondContact O-N 3.16Å; Y308-P323 HydrophobicContact CD2-CB 4.19Å; Y308-P323 HydrophobicContact CD2-CG 3.86Å; Y308-P323 HydrophobicContact CE2-CB 4.11Å; Y308-P323 HydrophobicContact CE2-CG 3.72Å; Y308-R326 HydrophobicContact CD2-CB 4.29Å; Y308-R326 HydrophobicContact CE2-CB 4.24Å; Y308-F328 AromaticContact CD1-CE2 3.9Å; Y308-F328 HydrophobicContact CD1-CE2 3.9Å; Y308-F328 HydrophobicContact CD1-CZ 4.41Å; Y308-F328 HydrophobicContact CG-CE2 4.25Å; Y308-F328 HydrophobicContact CG-CZ 4.32Å
309	E	86.8	Confident	85.2	Confident	81 Å²	81	77.9 Å²	77.9	38%	0.379	41%	0.409	S	S	.	.	H	α-helix	trans	-62.1	-38.4	174.5	-72.3	174.6	-173.8	0	0	112.3	K305 S306 R313	K305-E309 WeakPolarHBondContact CE-OE1 3.38Å; K305-E309 WeakPolarHBondContact O-CB 3.27Å; K305-E309 VanDerWaalsContact O-CG 3.31Å; K305-E309 WeakPolarHBondContact O-CG 3.43Å; K305-E309 PolarHBondContact O-N 3.39Å; S306-E309 PolarHBondContact O-N 3.49Å; E309-R313 WeakPolarHBondContact O-CB 3.27Å; E309-R313 WeakPolarHBondContact O-CG 3.44Å; E309-R313 PolarHBondContact O-N 2.85Å; E309-R313 PolarHBondContact O-NE 3.38Å
310	A	86.8	Confident	84.8	Confident	38 Å²	38	76.1 Å²	76.1	31%	0.314	40%	0.403	S	S	.	.	H	α-helix	trans	-65.9	-42.6	174	0	0	0	0	0	112.1	S306 A307 Y308 R313 L314	S306-A310 WeakPolarHBondContact O-CB 3.29Å; S306-A310 PolarHBondContact O-N 2.85Å; A307-A310 PolarHBondContact O-N 3.25Å; Y308-A310 VanDerWaalsContact C-N 3.33Å; Y308-A310 PolarHBondContact O-N 2.93Å; A310-R313 WeakPolarHBondContact O-CB 3.26Å; A310-R313 PolarHBondContact O-N 3.3Å; A310-L314 WeakPolarHBondContact O-CG 3.45Å; A310-L314 PolarHBondContact O-N 3.4Å
311	S	85.3	Confident	84.5	Confident	48 Å²	48	78.7 Å²	78.7	34%	0.336	42%	0.424	S	S	.	.	H	α-helix	trans	-66.4	-40	178.2	-59.3	0	0	0	0	111.9	A307 Y308 R313 L314 A315	A307-S311 WeakPolarHBondContact O-CB 3.23Å; A307-S311 PolarHBondContact O-N 2.89Å; A307-S311 PolarHBondContact O-OG 2.83Å; Y308-S311 PolarHBondContact O-N 3.38Å; S311-R313 VanDerWaalsContact C-N 3.34Å; S311-L314 PolarHBondContact O-N 2.85Å; S311-A315 WeakPolarHBondContact O-CB 3.22Å; S311-A315 PolarHBondContact O-N 2.88Å
312	I	84.4	Confident	84.1	Confident	46 Å²	46	83.7 Å²	83.7	24%	0.236	44%	0.442	C	S	.	.	H	α-helix	trans	-60.1	-45.5	171.2	-74.6	174.7	0	0	0	110.6	Y308 A315 H316 P323	Y308-I312 HydrophobicContact CD1-CD1 3.7Å; Y308-I312 HydrophobicContact CE1-CD1 3.2Å; Y308-I312 HydrophobicContact CE1-CG1 4.28Å; Y308-I312 HydrophobicContact CE2-CD1 4.16Å; Y308-I312 HydrophobicContact CG-CD1 4.37Å; Y308-I312 VanDerWaalsContact CZ-CD1 3.46Å; Y308-I312 WeakPolarHBondContact O-CG1 3.47Å; Y308-I312 PolarHBondContact O-N 3.16Å; I312-A315 PolarHBondContact O-N 2.9Å; I312-H316 WeakPolarHBondContact O-CB 3.21Å; I312-H316 PolarHBondContact O-CD2 3.39Å; I312-H316 PolarHBondContact O-N 3.31Å; I312-P323 HydrophobicContact CG1-CG 3.95Å
313	R	86.6	Confident	83.8	Confident	143 Å²	143	79.5 Å²	79.5	54%	0.54	43%	0.426	S	S	.	.	H	α-helix	trans	-59.4	-48.4	177	-78.8	-178.9	-81.2	-150.6	-1.7	111.3	E309 A310 S311 A315 H316 L317	E309-R313 WeakPolarHBondContact O-CB 3.27Å; E309-R313 WeakPolarHBondContact O-CG 3.44Å; E309-R313 PolarHBondContact O-N 2.85Å; E309-R313 PolarHBondContact O-NE 3.38Å; A310-R313 WeakPolarHBondContact O-CB 3.26Å; A310-R313 PolarHBondContact O-N 3.3Å; S311-R313 VanDerWaalsContact C-N 3.34Å; R313-A315 VanDerWaalsContact C-N 3.32Å; R313-A315 PolarHBondContact O-N 3.41Å; R313-H316 WeakPolarHBondContact O-CB 3.19Å; R313-H316 PolarHBondContact O-N 2.9Å; R313-L317 WeakPolarHBondContact O-CD1 3.32Å; R313-L317 PolarHBondContact O-N 2.83Å; R313-L317 VanDerWaalsContact O-N 3.11Å
314	L	84.8	Confident	83.3	Confident	85 Å²	85	79.8 Å²	79.8	45%	0.445	43%	0.433	S	S	.	.	H	α-helix	trans	-62.9	-37.3	178.2	-72.7	171.6	0	0	0	113.2	A310 S311 L317 G318 K319	A310-L314 WeakPolarHBondContact O-CG 3.45Å; A310-L314 PolarHBondContact O-N 3.4Å; S311-L314 PolarHBondContact O-N 2.85Å; L314-L317 PolarHBondContact O-N 3.31Å; L314-G318 PolarHBondContact O-N 3.41Å; L314-K319 HydrophobicContact CD2-CD 4.43Å; L314-K319 PolarHBondContact O-N 3.5Å; L314-K319 VanDerWaalsContact O-N 3.15Å
315	A	80.1	Confident	82.9	Confident	7 Å²	7	85.6 Å²	85.6	6%	0.058	46%	0.461	C	S	.	.	H	α-helix	trans	-67.3	-39.4	175.5	0	0	0	0	0	112.2	S311 I312 R313 L317 G318 S320 Y322	S311-A315 WeakPolarHBondContact O-CB 3.22Å; S311-A315 PolarHBondContact O-N 2.88Å; I312-A315 PolarHBondContact O-N 2.9Å; R313-A315 VanDerWaalsContact C-N 3.32Å; R313-A315 PolarHBondContact O-N 3.41Å; A315-L317 PolarHBondContact O-N 2.81Å; A315-G318 PolarHBondContact O-N 3.26Å; A315-S320 WeakPolarHBondContact CA-O 3.26Å; A315-S320 WeakPolarHBondContact CB-O 3.33Å; A315-S320 PolarHBondContact N-OG 2.76Å; A315-Y322 HydrophobicContact CB-CD1 3.89Å; A315-Y322 HydrophobicContact CB-CD2 4.12Å; A315-Y322 HydrophobicContact CB-CE1 4.13Å; A315-Y322 HydrophobicContact CB-CE2 4.33Å; A315-Y322 HydrophobicContact CB-CG 3.89Å
316	H	78.1	Confident	82.4	Confident	130 Å²	130	83.6 Å²	83.6	60%	0.602	45%	0.45	S	S	*	.	H	α-helix	trans	-60.6	-31	171	-95	-77.2	0	0	0	113.1	I312 R313 G318 Y322	I312-H316 WeakPolarHBondContact O-CB 3.21Å; I312-H316 PolarHBondContact O-CD2 3.39Å; I312-H316 PolarHBondContact O-N 3.31Å; R313-H316 WeakPolarHBondContact O-CB 3.19Å; R313-H316 PolarHBondContact O-N 2.9Å; H316-G318 PolarHBondContact O-N 3.39Å; H316-Y322 AromaticContact CD2-CE1 3.58Å; H316-Y322 AromaticContact CD2-CZ 3.84Å; H316-Y322 PolarHBondContact CD2-OH 3.36Å; H316-Y322 VanDerWaalsContact CD2-OH 3.23Å; H316-Y322 PolarHBondContact CE1-OH 3.46Å; H316-Y322 PolarHBondContact ND1-OH 2.89Å; H316-Y322 AromaticContact NE2-CE1 3.63Å; H316-Y322 AromaticContact NE2-CZ 3.82Å; H316-Y322 PolarHBondContact NE2-OH 3.3Å; H316-Y322 VanDerWaalsContact NE2-OH 3.11Å
317	L	84.2	Confident	82.1	Confident	118 Å²	118	82.9 Å²	82.9	62%	0.618	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	0.7	173.3	-83.9	85	0	0	0	113.4	R313 L314 A315 K319	R313-L317 WeakPolarHBondContact O-CD1 3.32Å; R313-L317 PolarHBondContact O-N 2.83Å; R313-L317 VanDerWaalsContact O-N 3.11Å; L314-L317 PolarHBondContact O-N 3.31Å; A315-L317 PolarHBondContact O-N 2.81Å; L317-K319 HydrophobicContact CB-CG 4.45Å; L317-K319 PolarHBondContact O-N 2.83Å
318	G	78.6	Confident	81.7	Confident	67 Å²	67	82.3 Å²	82.3	69%	0.691	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	9.5	-179.3	0	0	0	0	0	114.9	L314 A315 H316	L314-G318 PolarHBondContact O-N 3.41Å; A315-G318 PolarHBondContact O-N 3.26Å; H316-G318 PolarHBondContact O-N 3.39Å
319	K	78.8	Confident	81.3	Confident	164 Å²	164	85.8 Å²	85.8	71%	0.713	45%	0.45	S	S	*	.	S	Bend	trans	-84.7	-16	-179	-66	-172.3	179	-176.5	0	113.4	L314 L317	L314-K319 HydrophobicContact CD2-CD 4.43Å; L314-K319 PolarHBondContact O-N 3.5Å; L314-K319 VanDerWaalsContact O-N 3.15Å; L317-K319 HydrophobicContact CB-CG 4.45Å; L317-K319 PolarHBondContact O-N 2.83Å
320	S	80.1	Confident	80.4	Confident	50 Å²	50	87.6 Å²	87.6	35%	0.35	46%	0.462	S	S	.	.	S	Bend	trans	-152.2	166.1	179	62.5	0	0	0	0	111	A315	A315-S320 WeakPolarHBondContact CA-O 3.26Å; A315-S320 WeakPolarHBondContact CB-O 3.33Å; A315-S320 PolarHBondContact N-OG 2.76Å
321	N	80.8	Confident	79.6	Confident	154 Å²	154	92.3 Å²	92.3	82%	0.824	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-75.7	155.2	171.3	-68	-17.2	0	0	0	111.1
322	Y	79	Confident	78.5	Confident	137 Å²	137	97.9 Å²	97.9	54%	0.537	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-63.8	130.8	175.8	-79.7	-86.3	0	0	0	111.2	A315 H316	A315-Y322 HydrophobicContact CB-CD1 3.89Å; A315-Y322 HydrophobicContact CB-CD2 4.12Å; A315-Y322 HydrophobicContact CB-CE1 4.13Å; A315-Y322 HydrophobicContact CB-CE2 4.33Å; A315-Y322 HydrophobicContact CB-CG 3.89Å; H316-Y322 AromaticContact CD2-CE1 3.58Å; H316-Y322 AromaticContact CD2-CZ 3.84Å; H316-Y322 PolarHBondContact CD2-OH 3.36Å; H316-Y322 VanDerWaalsContact CD2-OH 3.23Å; H316-Y322 PolarHBondContact CE1-OH 3.46Å; H316-Y322 PolarHBondContact ND1-OH 2.89Å; H316-Y322 AromaticContact NE2-CE1 3.63Å; H316-Y322 AromaticContact NE2-CZ 3.82Å; H316-Y322 PolarHBondContact NE2-OH 3.3Å; H316-Y322 VanDerWaalsContact NE2-OH 3.11Å
323	P	81.2	Confident	77.7	Confident	35 Å²	35	103 Å²	103	23%	0.227	53%	0.527	C	S	.	.	P	Polyproline II helix	trans	-67.5	149.4	176.7	28.5	-34.8	0	0	0	111.1	Y308 I312	Y308-P323 HydrophobicContact CD2-CB 4.19Å; Y308-P323 HydrophobicContact CD2-CG 3.86Å; Y308-P323 HydrophobicContact CE2-CB 4.11Å; Y308-P323 HydrophobicContact CE2-CG 3.72Å; I312-P323 HydrophobicContact CG1-CG 3.95Å
324	P	79.2	Confident	76.6	Confident	104 Å²	104	97.4 Å²	97.4	68%	0.675	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-56	139.5	173.5	-21.5	31.5	0	0	0	111.3	R326	P324-R326 PolarHBondContact O-N 3.45Å; P324-R326 VanDerWaalsContact O-N 3.09Å
325	I	77.3	Confident	75.9	Confident	134 Å²	134	100.4 Å²	100.4	69%	0.687	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-54.8	119.6	-179.2	-60.5	171.6	0	0	0	109	N336	I325-N336 PolarHBondContact O-ND2 3.44Å
326	R	77.3	Confident	75.7	Confident	59 Å²	59	102.9 Å²	102.9	22%	0.223	55%	0.545	C	S	.	.			trans	-115.9	132.1	176.9	-165.3	174	-174.3	-171.9	-1	109	Y300 Y308 P324 D341	Y300-R326 PolarHBondContact OH-NH2 3.23Å; Y308-R326 HydrophobicContact CD2-CB 4.29Å; Y308-R326 HydrophobicContact CE2-CB 4.24Å; P324-R326 PolarHBondContact O-N 3.45Å; P324-R326 VanDerWaalsContact O-N 3.09Å; R326-D341 IonicContact CZ-OD2 3.92Å; R326-D341 IonicContact NE-OD2 3.96Å; R326-D341 IonicContact NH2-OD2 3.98Å; R326-D341 PolarHBondContact NH2-OD2 3.32Å
327	T	81	Confident	75.8	Confident	40 Å²	40	97 Å²	97	25%	0.245	52%	0.518	C	S	.	.	B	Isolated β-bridge	trans	-102.8	133.8	-178	58.1	0	0	0	0	112	S334 N336 N337 I338	T327-S334 WeakPolarHBondContact CB-OG 3.39Å; T327-S334 WeakPolarHBondContact CG2-OG 2.99Å; T327-S334 VanDerWaalsContact OG1-CB 3.27Å; T327-S334 WeakPolarHBondContact OG1-CB 3.41Å; T327-S334 PolarHBondContact OG1-OG 3.45Å; T327-N336 PolarHBondContact N-O 2.87Å; T327-N336 PolarHBondContact OG1-O 2.79Å; T327-N337 PolarHBondContact O-OD1 3.46Å; T327-N337 VanDerWaalsContact O-OD1 3.13Å; T327-N337 WeakPolarHBondContact OG1-CA 3.42Å; T327-I338 PolarHBondContact O-N 2.83Å
328	F	80.3	Confident	75.6	Confident	42 Å²	42	91.4 Å²	91.4	18%	0.184	49%	0.488	C	S	.	.			trans	-103.3	1.3	179.5	-60.5	-82	0	0	0	113.8	I301 A304 K305 Y308 I338	I301-F328 HydrophobicContact CG2-CD1 4.43Å; A304-F328 HydrophobicContact CB-CE1 4.02Å; K305-F328 VanDerWaalsContact CA-CZ 3.42Å; K305-F328 HydrophobicContact CB-CD1 4.06Å; K305-F328 HydrophobicContact CB-CE1 3.8Å; K305-F328 HydrophobicContact CB-CE2 4.33Å; K305-F328 HydrophobicContact CB-CG 4.44Å; K305-F328 HydrophobicContact CB-CZ 3.96Å; K305-F328 HydrophobicContact CG-CD2 4.39Å; K305-F328 HydrophobicContact CG-CE2 4.32Å; K305-F328 HydrophobicContact CG-CZ 4.43Å; Y308-F328 AromaticContact CD1-CE2 3.9Å; Y308-F328 HydrophobicContact CD1-CE2 3.9Å; Y308-F328 HydrophobicContact CD1-CZ 4.41Å; Y308-F328 HydrophobicContact CG-CE2 4.25Å; Y308-F328 HydrophobicContact CG-CZ 4.32Å; F328-I338 HydrophobicContact CD1-CB 4.44Å; F328-I338 HydrophobicContact CD1-CD1 4.01Å; F328-I338 HydrophobicContact CD1-CG2 4.15Å; F328-I338 HydrophobicContact CE1-CD1 3.75Å
329	Q	77	Confident	75.7	Confident	120 Å²	120	91.7 Å²	91.7	56%	0.561	47%	0.469	S	S	*	.	S	Bend	trans	-102.8	139.4	175	-65.6	178.4	-4.2	0	0	109.1	K331	Q329-K331 HydrophobicContact CB-CG 4.39Å; Q329-K331 PolarHBondContact O-N 2.82Å; Q329-K331 VanDerWaalsContact OE1-NZ 3.15Å
330	N	68.6	Low	75.7	Confident	119 Å²	119	86.4 Å²	86.4	64%	0.636	45%	0.449	S	S	*	.			trans	-74.3	71.4	177.8	-170.2	14.8	0	0	0	111	Y339	N330-Y339 HydrophobicContact CB-CD2 3.84Å; N330-Y339 HydrophobicContact CB-CE1 4.43Å; N330-Y339 HydrophobicContact CB-CE2 3.71Å; N330-Y339 HydrophobicContact CB-CG 4.31Å
331	K	68.2	Low	75.6	Confident	136 Å²	136	86.2 Å²	86.2	59%	0.591	44%	0.444	S	S	*	.			trans	-106.3	136.6	174.7	-69.1	-178.1	178.4	172.7	0	109.8	Q329 N333	Q329-K331 HydrophobicContact CB-CG 4.39Å; Q329-K331 PolarHBondContact O-N 2.82Å; Q329-K331 VanDerWaalsContact OE1-NZ 3.15Å; K331-N333 VanDerWaalsContact C-N 3.29Å; K331-N333 PolarHBondContact O-N 2.84Å
332	I	63.5	Low	75.7	Confident	165 Å²	165	79.5 Å²	79.5	85%	0.846	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-29.5	-168.6	-61.5	160.4	0	0	0	113
333	N	66.2	Low	75.5	Confident	153 Å²	153	78.5 Å²	78.5	82%	0.818	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	12.5	-169	-60.2	31.1	0	0	0	113.8	K331	K331-N333 VanDerWaalsContact C-N 3.29Å; K331-N333 PolarHBondContact O-N 2.84Å
334	S	65.1	Low	75.2	Confident	27 Å²	27	81.9 Å²	81.9	19%	0.189	42%	0.421	C	S	.	.			trans	-87.9	129.3	178.7	-165.8	0	0	0	0	110.7	T327	T327-S334 WeakPolarHBondContact CB-OG 3.39Å; T327-S334 WeakPolarHBondContact CG2-OG 2.99Å; T327-S334 VanDerWaalsContact OG1-CB 3.27Å; T327-S334 WeakPolarHBondContact OG1-CB 3.41Å; T327-S334 PolarHBondContact OG1-OG 3.45Å
335	T	69.8	Low	74.9	Confident	147 Å²	147	78.1 Å²	78.1	90%	0.902	40%	0.398	S	S	*	.	S	Bend	trans	-83.9	-13.9	-179.9	52.3	0	0	0	0	113.3
336	N	75.7	Confident	74.7	Confident	60 Å²	60	76.4 Å²	76.4	32%	0.321	39%	0.387	S	S	.	.	S	Bend	trans	-138.2	76.1	-179.7	-174.5	22.3	0	0	0	110.3	I325 T327	I325-N336 PolarHBondContact O-ND2 3.44Å; T327-N336 PolarHBondContact N-O 2.87Å; T327-N336 PolarHBondContact OG1-O 2.79Å
337	N	80.4	Confident	74.4	Confident	7 Å²	7	80.9 Å²	80.9	4%	0.037	41%	0.409	C	S	.	.	B	Isolated β-bridge	trans	-106.4	135	-174.8	-168.6	-12.2	0	0	0	111.6	T327 Y339 D340	T327-N337 PolarHBondContact O-OD1 3.46Å; T327-N337 VanDerWaalsContact O-OD1 3.13Å; T327-N337 WeakPolarHBondContact OG1-CA 3.42Å; N337-Y339 PolarHBondContact O-N 3.48Å; N337-Y339 VanDerWaalsContact OD1-CD2 3.25Å; N337-Y339 WeakPolarHBondContact OD1-CD2 3.4Å; N337-Y339 PolarHBondContact OD1-N 2.89Å; N337-Y339 VanDerWaalsContact OD1-N 3.1Å; N337-D340 WeakPolarHBondContact O-CB 3.3Å; N337-D340 PolarHBondContact O-N 3.31Å
338	I	79.9	Confident	73.6	Confident	0 Å²	0	82.8 Å²	82.8	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-60.1	-27.9	175	-163.1	148.3	0	0	0	113.4	Y300 I301 A304 T327 F328 D340 D341	Y300-I338 HydrophobicContact CD1-CD1 3.81Å; Y300-I338 HydrophobicContact CD1-CG1 3.93Å; Y300-I338 HydrophobicContact CE1-CD1 3.66Å; Y300-I338 HydrophobicContact CE1-CG1 3.67Å; I301-I338 HydrophobicContact CG1-CG2 4.37Å; A304-I338 HydrophobicContact CB-CD1 3.27Å; T327-I338 PolarHBondContact O-N 2.83Å; F328-I338 HydrophobicContact CD1-CB 4.44Å; F328-I338 HydrophobicContact CD1-CD1 4.01Å; F328-I338 HydrophobicContact CD1-CG2 4.15Å; F328-I338 HydrophobicContact CE1-CD1 3.75Å; I338-D340 PolarHBondContact O-N 2.81Å; I338-D341 VanDerWaalsContact O-CB 3.28Å; I338-D341 WeakPolarHBondContact O-CB 3.43Å; I338-D341 PolarHBondContact O-N 2.89Å; I338-D341 VanDerWaalsContact O-N 3.08Å
339	Y	80.3	Confident	72.9	Confident	73 Å²	73	83.7 Å²	83.7	29%	0.286	43%	0.427	S	S	.	.	H	α-helix	trans	-68.3	-22.3	175.8	-69	-85.2	0	0	0	112.8	N330 N337 D341 F342 K343	N330-Y339 HydrophobicContact CB-CD2 3.84Å; N330-Y339 HydrophobicContact CB-CE1 4.43Å; N330-Y339 HydrophobicContact CB-CE2 3.71Å; N330-Y339 HydrophobicContact CB-CG 4.31Å; N337-Y339 PolarHBondContact O-N 3.48Å; N337-Y339 VanDerWaalsContact OD1-CD2 3.25Å; N337-Y339 WeakPolarHBondContact OD1-CD2 3.4Å; N337-Y339 PolarHBondContact OD1-N 2.89Å; N337-Y339 VanDerWaalsContact OD1-N 3.1Å; Y339-D341 VanDerWaalsContact C-N 3.28Å; Y339-F342 AromaticContact CD1-CD2 3.85Å; Y339-F342 HydrophobicContact CD1-CD2 3.85Å; Y339-F342 HydrophobicContact CD1-CE2 4.07Å; Y339-F342 HydrophobicContact CE1-CD2 4.48Å; Y339-F342 HydrophobicContact CE1-CE2 4.32Å; Y339-F342 HydrophobicContact CG-CD2 4.43Å; Y339-F342 PolarHBondContact O-N 2.85Å; Y339-K343 PolarHBondContact O-N 2.83Å
340	D	78.3	Confident	72.1	Confident	52 Å²	52	88.2 Å²	88.2	28%	0.278	44%	0.444	S	S	.	.	H	α-helix	trans	-71.3	-28.4	172.5	-65.6	-39.3	0	0	0	111.1	N337 I338 F342 K343 I344	N337-D340 WeakPolarHBondContact O-CB 3.3Å; N337-D340 PolarHBondContact O-N 3.31Å; I338-D340 PolarHBondContact O-N 2.81Å; D340-F342 VanDerWaalsContact C-N 3.31Å; D340-F342 PolarHBondContact O-N 3.29Å; D340-K343 WeakPolarHBondContact O-CB 3.41Å; D340-K343 PolarHBondContact O-N 3.34Å; D340-K343 IonicContact OD1-NZ 2.62Å; D340-K343 PolarHBondContact OD1-NZ 3.48Å; D340-I344 VanDerWaalsContact O-CG1 3.26Å; D340-I344 WeakPolarHBondContact O-CG1 3.29Å; D340-I344 PolarHBondContact O-N 3.31Å
341	D	79.1	Confident	71.4	Confident	46 Å²	46	86.1 Å²	86.1	25%	0.246	44%	0.439	C	S	.	.	H	α-helix	trans	-63.9	-36.7	171.5	-56.5	-43.3	0	0	0	111.6	Y300 R326 I338 Y339 I344 A345	Y300-D341 HydrophobicContact CE1-CB 4.36Å; R326-D341 IonicContact CZ-OD2 3.92Å; R326-D341 IonicContact NE-OD2 3.96Å; R326-D341 IonicContact NH2-OD2 3.98Å; R326-D341 PolarHBondContact NH2-OD2 3.32Å; I338-D341 VanDerWaalsContact O-CB 3.28Å; I338-D341 WeakPolarHBondContact O-CB 3.43Å; I338-D341 PolarHBondContact O-N 2.89Å; I338-D341 VanDerWaalsContact O-N 3.08Å; Y339-D341 VanDerWaalsContact C-N 3.28Å; D341-I344 CarbonylContact O-C 3.59Å; D341-I344 WeakPolarHBondContact O-CB 3.31Å; D341-I344 PolarHBondContact O-N 3.09Å; D341-A345 WeakPolarHBondContact O-CB 3.35Å; D341-A345 PolarHBondContact O-N 3.32Å
342	F	81.4	Confident	71	Confident	13 Å²	13	85.8 Å²	85.8	6%	0.057	45%	0.449	C	S	.	.	H	α-helix	trans	-66.5	-36.8	173.7	-59.1	-39.6	0	0	0	112.6	Q297 Y300 I301 Y339 D340 I344 A345 Q346	Q297-F342 HydrophobicContact CB-CE1 4.01Å; Q297-F342 HydrophobicContact CB-CE2 4.09Å; Q297-F342 HydrophobicContact CB-CZ 3.69Å; Q297-F342 HydrophobicContact CG-CD1 3.89Å; Q297-F342 HydrophobicContact CG-CD2 4.33Å; Q297-F342 HydrophobicContact CG-CE1 3.69Å; Q297-F342 HydrophobicContact CG-CE2 4.16Å; Q297-F342 HydrophobicContact CG-CG 4.21Å; Q297-F342 HydrophobicContact CG-CZ 3.82Å; Y300-F342 AromaticContact CD1-CE1 3.66Å; Y300-F342 HydrophobicContact CD1-CE1 3.66Å; Y300-F342 AromaticContact CD1-CZ 3.99Å; Y300-F342 HydrophobicContact CD1-CZ 3.99Å; Y300-F342 HydrophobicContact CE1-CE1 4.49Å; Y300-F342 HydrophobicContact CG-CE1 4.21Å; I301-F342 HydrophobicContact CD1-CE2 3.96Å; I301-F342 HydrophobicContact CD1-CZ 4.13Å; I301-F342 HydrophobicContact CG1-CE2 4.01Å; I301-F342 HydrophobicContact CG1-CZ 3.83Å; Y339-F342 AromaticContact CD1-CD2 3.85Å; Y339-F342 HydrophobicContact CD1-CD2 3.85Å; Y339-F342 HydrophobicContact CD1-CE2 4.07Å; Y339-F342 HydrophobicContact CE1-CD2 4.48Å; Y339-F342 HydrophobicContact CE1-CE2 4.32Å; Y339-F342 HydrophobicContact CG-CD2 4.43Å; Y339-F342 PolarHBondContact O-N 2.85Å; D340-F342 VanDerWaalsContact C-N 3.31Å; D340-F342 PolarHBondContact O-N 3.29Å; F342-I344 VanDerWaalsContact C-N 3.28Å; F342-I344 PolarHBondContact O-N 2.9Å; F342-A345 PolarHBondContact O-N 2.89Å; F342-Q346 WeakPolarHBondContact O-CG 3.04Å; F342-Q346 PolarHBondContact O-N 2.95Å
343	K	75.8	Confident	70.7	Confident	117 Å²	117	85.7 Å²	85.7	51%	0.509	44%	0.444	S	S	.	.	H	α-helix	trans	-66	-34.2	172.8	-64.6	176.1	-167.7	154.9	0	111.6	Y339 D340	Y339-K343 PolarHBondContact O-N 2.83Å; D340-K343 WeakPolarHBondContact O-CB 3.41Å; D340-K343 PolarHBondContact O-N 3.34Å; D340-K343 IonicContact OD1-NZ 2.62Å; D340-K343 PolarHBondContact OD1-NZ 3.48Å
344	I	73.9	Confident	70.5	Confident	105 Å²	105	81.7 Å²	81.7	54%	0.538	42%	0.422	S	S	.	.	H	α-helix	trans	-69.6	-43.8	174.1	-64.2	161.9	0	0	0	109.7	D340 D341 F342 Q346 K347	D340-I344 VanDerWaalsContact O-CG1 3.26Å; D340-I344 WeakPolarHBondContact O-CG1 3.29Å; D340-I344 PolarHBondContact O-N 3.31Å; D341-I344 CarbonylContact O-C 3.59Å; D341-I344 WeakPolarHBondContact O-CB 3.31Å; D341-I344 PolarHBondContact O-N 3.09Å; F342-I344 VanDerWaalsContact C-N 3.28Å; F342-I344 PolarHBondContact O-N 2.9Å; I344-Q346 VanDerWaalsContact C-N 3.25Å; I344-Q346 PolarHBondContact O-N 3.38Å; I344-K347 WeakPolarHBondContact O-CB 3.33Å; I344-K347 PolarHBondContact O-N 2.81Å
345	A	73.6	Confident	70.8	Confident	25 Å²	25	84.2 Å²	84.2	21%	0.207	44%	0.437	C	S	.	.	H	α-helix	trans	-60.6	-32.7	177.6	0	0	0	0	0	112.6	D341 F342 K347 T360 Q363	D341-A345 WeakPolarHBondContact O-CB 3.35Å; D341-A345 PolarHBondContact O-N 3.32Å; F342-A345 PolarHBondContact O-N 2.89Å; A345-K347 PolarHBondContact O-N 3.42Å; A345-T360 PolarHBondContact O-OG1 2.8Å; A345-Q363 VanDerWaalsContact O-CG 3.27Å; A345-Q363 WeakPolarHBondContact O-CG 3.34Å; A345-Q363 PolarHBondContact O-NE2 2.85Å
346	Q	73.2	Confident	70.7	Confident	98 Å²	98	83.8 Å²	83.8	46%	0.458	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-20.8	173.3	-75.3	172	28.8	0	0	113.9	F342 I344 I348 E362	F342-Q346 WeakPolarHBondContact O-CG 3.04Å; F342-Q346 PolarHBondContact O-N 2.95Å; I344-Q346 VanDerWaalsContact C-N 3.25Å; I344-Q346 PolarHBondContact O-N 3.38Å; Q346-I348 PolarHBondContact O-N 3.24Å; Q346-E362 HydrophobicContact CG-CB 3.81Å; Q346-E362 HydrophobicContact CG-CG 4.17Å
347	K	70.5	Confident	70.7	Confident	154 Å²	154	91.3 Å²	91.3	67%	0.67	45%	0.451	S	S	*	.	S	Bend	trans	-80.4	121.5	-180	-68.2	177.5	-178.7	175.7	0	110	I344 A345 Q363	I344-K347 WeakPolarHBondContact O-CB 3.33Å; I344-K347 PolarHBondContact O-N 2.81Å; A345-K347 PolarHBondContact O-N 3.42Å; K347-Q363 PolarHBondContact O-NE2 3.02Å; K347-Q363 VanDerWaalsContact O-NE2 3.15Å
348	I	65.8	Low	70.5	Confident	80 Å²	80	95.2 Å²	95.2	41%	0.41	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-72.6	130.4	-179.6	-57.6	170.1	0	0	0	109.6	Q346 L354 Q363	Q346-I348 PolarHBondContact O-N 3.24Å; I348-L354 HydrophobicContact CG2-CD1 4.39Å; I348-Q363 HydrophobicContact CG1-CG 4.3Å
349	P	64	Low	70.3	Confident	61 Å²	61	96.5 Å²	96.5	40%	0.396	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-67.5	139.3	174.1	19.9	-24.1	0	0	0	111.7	S351 L354	P349-S351 PolarHBondContact O-N 2.87Å; P349-L354 HydrophobicContact CG-CD1 3.87Å; P349-L354 HydrophobicContact CG-CD2 4.21Å; P349-L354 WeakPolarHBondContact O-CD1 3.38Å
350	K	59.8	Low	70.3	Confident	215 Å²	215	95.4 Å²	95.4	94%	0.935	48%	0.48	S	S	*	.			trans	-77.7	25.5	-175.1	-63.7	-178.1	178.8	177.3	0	114.7
351	S	55.1	Low	70.5	Confident	75 Å²	75	96.5 Å²	96.5	52%	0.524	48%	0.48	S	S	.	.			trans	-83.3	143.3	-174.3	-170	0	0	0	0	112.3	P349 H353	P349-S351 PolarHBondContact O-N 2.87Å; S351-H353 VanDerWaalsContact C-N 3.3Å; S351-H353 PolarHBondContact O-N 2.85Å
352	T	59.3	Low	70.6	Confident	129 Å²	129	94.7 Å²	94.7	79%	0.791	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-13.2	-174	47.4	0	0	0	0	114.4
353	H	56.7	Low	70.6	Confident	163 Å²	163	94.7 Å²	94.7	76%	0.755	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135	61	-176.2	-69.9	-72.8	0	0	0	112.9	S351	S351-H353 VanDerWaalsContact C-N 3.3Å; S351-H353 PolarHBondContact O-N 2.85Å
354	L	62.7	Low	71	Confident	68 Å²	68	91.4 Å²	91.4	36%	0.356	46%	0.456	S	S	.	.			trans	-86.1	126.8	171.5	-63.8	173.2	0	0	0	110.2	I348 P349 L359	I348-L354 HydrophobicContact CG2-CD1 4.39Å; P349-L354 HydrophobicContact CG-CD1 3.87Å; P349-L354 HydrophobicContact CG-CD2 4.21Å; P349-L354 WeakPolarHBondContact O-CD1 3.38Å; L354-L359 HydrophobicContact CD1-CD2 4.21Å
355	T	70.9	Confident	71.5	Confident	81 Å²	81	88.7 Å²	88.7	50%	0.497	44%	0.441	S	S	.	.			trans	-91.7	153.6	166.9	74	0	0	0	0	109.7	R357 D358	T355-R357 PolarHBondContact O-N 3.42Å; T355-D358 WeakPolarHBondContact CB-OD2 3.36Å; T355-D358 PolarHBondContact N-OD2 3.44Å; T355-D358 VanDerWaalsContact N-OD2 3.14Å; T355-D358 PolarHBondContact O-N 3.49Å; T355-D358 VanDerWaalsContact OG1-CG 3.25Å; T355-D358 PolarHBondContact OG1-OD2 3.48Å
356	I	68.6	Low	71.9	Confident	137 Å²	137	94 Å²	94	70%	0.703	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-56	-26.4	-178.1	-66.1	163.8	0	0	0	112.1	D358 K364	I356-D358 VanDerWaalsContact C-N 3.25Å; I356-D358 PolarHBondContact O-N 3.42Å; I356-K364 WeakPolarHBondContact O-CE 3.42Å
357	R	74.9	Confident	72.3	Confident	218 Å²	218	92.5 Å²	92.5	82%	0.823	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-69.3	-24.6	178.7	-162.9	173.5	73.8	175.1	4.3	112.8	T355 L359	T355-R357 PolarHBondContact O-N 3.42Å; R357-L359 VanDerWaalsContact C-N 3.35Å
358	D	77.1	Confident	73	Confident	90 Å²	90	87 Å²	87	48%	0.481	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-90	-2.7	-173.6	-48.5	-40	0	0	0	112.8	T355 I356	T355-D358 WeakPolarHBondContact CB-OD2 3.36Å; T355-D358 PolarHBondContact N-OD2 3.44Å; T355-D358 VanDerWaalsContact N-OD2 3.14Å; T355-D358 PolarHBondContact O-N 3.49Å; T355-D358 VanDerWaalsContact OG1-CG 3.25Å; T355-D358 PolarHBondContact OG1-OD2 3.48Å; I356-D358 VanDerWaalsContact C-N 3.25Å; I356-D358 PolarHBondContact O-N 3.42Å
359	L	76	Confident	73.8	Confident	27 Å²	27	84.7 Å²	84.7	14%	0.141	42%	0.422	C	S	.	.	S	Bend	trans	-89.9	140.2	-177.7	-62.5	175.6	0	0	0	111.9	L354 R357 Q363 K364	L354-L359 HydrophobicContact CD1-CD2 4.21Å; R357-L359 VanDerWaalsContact C-N 3.35Å; L359-Q363 HydrophobicContact CB-CB 4.14Å; L359-Q363 HydrophobicContact CD2-CB 4.28Å; L359-K364 HydrophobicContact CB-CG 3.98Å; L359-K364 VanDerWaalsContact O-CE 3.29Å; L359-K364 WeakPolarHBondContact O-CE 3.43Å
360	T	79.8	Confident	74.7	Confident	50 Å²	50	85.7 Å²	85.7	31%	0.307	42%	0.423	S	S	.	.			trans	-65.7	160.5	168.6	66.2	0	0	0	0	110.6	A345 E362 Q363 K364	A345-T360 PolarHBondContact O-OG1 2.8Å; T360-E362 VanDerWaalsContact C-N 3.28Å; T360-E362 PolarHBondContact O-N 3.35Å; T360-Q363 VanDerWaalsContact N-OE1 3.07Å; T360-Q363 WeakPolarHBondContact O-CB 3.49Å; T360-Q363 PolarHBondContact O-N 3.23Å; T360-Q363 VanDerWaalsContact O-N 3.14Å; T360-Q363 WeakPolarHBondContact OG1-CG 3.36Å; T360-Q363 PolarHBondContact OG1-N 2.89Å; T360-K364 WeakPolarHBondContact O-CG 3.48Å; T360-K364 PolarHBondContact O-N 3.21Å
361	W	82.3	Confident	75.8	Confident	74 Å²	74	79.6 Å²	79.6	28%	0.28	40%	0.4	S	S	.	.	H	α-helix	trans	-62	-37.7	179.5	-74.6	115.7	0	0	0	112.3	Y288 V289 E292 I293 Q363 K364 E365	Y288-W361 HydrophobicContact CE1-CH2 4.49Å; V289-W361 HydrophobicContact CG1-CE3 4.14Å; V289-W361 HydrophobicContact CG2-CE3 4.34Å; V289-W361 HydrophobicContact CG2-CZ3 4.16Å; E292-W361 HydrophobicContact CB-CD2 4.16Å; E292-W361 HydrophobicContact CB-CE3 4.31Å; E292-W361 HydrophobicContact CB-CZ2 4.43Å; E292-W361 HydrophobicContact CG-CH2 4.43Å; E292-W361 HydrophobicContact CG-CZ2 4.47Å; I293-W361 WeakPolarHBondContact CD1-O 3.44Å; I293-W361 HydrophobicContact CG1-CB 3.54Å; W361-Q363 VanDerWaalsContact C-N 3.32Å; W361-Q363 PolarHBondContact O-N 3.3Å; W361-K364 HydrophobicContact CD2-CD 4.37Å; W361-K364 HydrophobicContact CE3-CD 3.72Å; W361-K364 HydrophobicContact CZ3-CD 3.99Å; W361-K364 WeakPolarHBondContact O-CB 3.17Å; W361-K364 PolarHBondContact O-N 2.97Å; W361-K364 VanDerWaalsContact O-N 3.14Å; W361-E365 PolarHBondContact O-N 2.92Å
362	E	82.3	Confident	77.1	Confident	9 Å²	9	78.2 Å²	78.2	4%	0.042	39%	0.385	C	S	.	.	H	α-helix	trans	-61.4	-39.5	174.2	-64.7	82	177.6	0	0	112.2	I293 Q297 Q346 T360 E365 R366	I293-E362 HydrophobicContact CD1-CG 4.43Å; I293-E362 HydrophobicContact CG1-CG 4.41Å; I293-E362 HydrophobicContact CG2-CG 4.05Å; Q297-E362 WeakPolarHBondContact CG-OE1 3.39Å; Q297-E362 PolarHBondContact NE2-OE1 3.07Å; Q346-E362 HydrophobicContact CG-CB 3.81Å; Q346-E362 HydrophobicContact CG-CG 4.17Å; T360-E362 VanDerWaalsContact C-N 3.28Å; T360-E362 PolarHBondContact O-N 3.35Å; E362-E365 PolarHBondContact O-N 3.38Å; E362-R366 PolarHBondContact O-N 3.4Å; E362-R366 VanDerWaalsContact O-N 3.1Å
363	Q	80.8	Confident	78.1	Confident	13 Å²	13	76.6 Å²	76.6	6%	0.061	37%	0.369	C	S	.	.	H	α-helix	trans	-67.8	-39	174.6	-70	163.5	3.9	0	0	111.1	A345 K347 I348 L359 T360 W361 R366 V367	A345-Q363 VanDerWaalsContact O-CG 3.27Å; A345-Q363 WeakPolarHBondContact O-CG 3.34Å; A345-Q363 PolarHBondContact O-NE2 2.85Å; K347-Q363 PolarHBondContact O-NE2 3.02Å; K347-Q363 VanDerWaalsContact O-NE2 3.15Å; I348-Q363 HydrophobicContact CG1-CG 4.3Å; L359-Q363 HydrophobicContact CB-CB 4.14Å; L359-Q363 HydrophobicContact CD2-CB 4.28Å; T360-Q363 VanDerWaalsContact N-OE1 3.07Å; T360-Q363 WeakPolarHBondContact O-CB 3.49Å; T360-Q363 PolarHBondContact O-N 3.23Å; T360-Q363 VanDerWaalsContact O-N 3.14Å; T360-Q363 WeakPolarHBondContact OG1-CG 3.36Å; T360-Q363 PolarHBondContact OG1-N 2.89Å; W361-Q363 VanDerWaalsContact C-N 3.32Å; W361-Q363 PolarHBondContact O-N 3.3Å; Q363-R366 PolarHBondContact O-N 3.43Å; Q363-V367 WeakPolarHBondContact O-CB 3.5Å; Q363-V367 VanDerWaalsContact O-CG2 3.27Å; Q363-V367 WeakPolarHBondContact O-CG2 3.4Å; Q363-V367 PolarHBondContact O-N 2.72Å
364	K	83.5	Confident	79.3	Confident	47 Å²	47	75.9 Å²	75.9	20%	0.204	36%	0.363	C	S	.	.	H	α-helix	trans	-62.3	-41.6	175.1	-69	172.1	-177.9	170	0	111.8	V289 I356 L359 T360 W361 V367 L368	V289-K364 HydrophobicContact CG1-CB 4.4Å; I356-K364 WeakPolarHBondContact O-CE 3.42Å; L359-K364 HydrophobicContact CB-CG 3.98Å; L359-K364 VanDerWaalsContact O-CE 3.29Å; L359-K364 WeakPolarHBondContact O-CE 3.43Å; T360-K364 WeakPolarHBondContact O-CG 3.48Å; T360-K364 PolarHBondContact O-N 3.21Å; W361-K364 HydrophobicContact CD2-CD 4.37Å; W361-K364 HydrophobicContact CE3-CD 3.72Å; W361-K364 HydrophobicContact CZ3-CD 3.99Å; W361-K364 WeakPolarHBondContact O-CB 3.17Å; W361-K364 PolarHBondContact O-N 2.97Å; W361-K364 VanDerWaalsContact O-N 3.14Å; K364-V367 PolarHBondContact O-N 3.47Å; K364-L368 WeakPolarHBondContact O-CG 3.46Å; K364-L368 PolarHBondContact O-N 3.29Å
365	E	85.2	Confident	80	Confident	49 Å²	49	74.8 Å²	74.8	23%	0.229	36%	0.357	C	S	.	.	H	α-helix	trans	-65.4	-41.3	176	-167.1	-113.6	-176.2	0	0	112.5	L286 V289 R290 I293 W361 E362 V367 L368 S369	L286-E365 HydrophobicContact CD2-CG 4.21Å; V289-E365 HydrophobicContact CG1-CB 3.72Å; V289-E365 HydrophobicContact CG1-CG 4.39Å; R290-E365 HydrophobicContact CG-CG 4.09Å; R290-E365 IonicContact CZ-OE1 2.73Å; R290-E365 IonicContact NE-OE1 3.78Å; R290-E365 PolarHBondContact NE-OE1 2.85Å; R290-E365 IonicContact NH2-OE1 3.62Å; I293-E365 HydrophobicContact CD1-CB 3.49Å; I293-E365 VanDerWaalsContact CD1-CB 3.49Å; I293-E365 HydrophobicContact CD1-CG 4.07Å; W361-E365 PolarHBondContact O-N 2.92Å; E362-E365 PolarHBondContact O-N 3.38Å; E365-V367 VanDerWaalsContact C-N 3.35Å; E365-V367 PolarHBondContact O-N 3.34Å; E365-L368 PolarHBondContact O-N 2.95Å; E365-S369 VanDerWaalsContact O-CB 3.29Å; E365-S369 WeakPolarHBondContact O-CB 3.39Å; E365-S369 PolarHBondContact O-N 3.32Å; E365-S369 PolarHBondContact O-OG 3.48Å
366	R	81.3	Confident	80.2	Confident	136 Å²	136	72.9 Å²	72.9	51%	0.513	34%	0.344	S	S	.	.	H	α-helix	trans	-61.2	-44.9	174.6	-169.5	112	-175.8	100.4	0.6	111.1	E362 Q363 S369 I370	E362-R366 PolarHBondContact O-N 3.4Å; E362-R366 VanDerWaalsContact O-N 3.1Å; Q363-R366 PolarHBondContact O-N 3.43Å; R366-S369 PolarHBondContact O-N 3.47Å; R366-I370 HydrophobicContact CG-CD1 3.83Å; R366-I370 WeakPolarHBondContact O-CB 3.25Å; R366-I370 WeakPolarHBondContact O-CD1 3.12Å; R366-I370 WeakPolarHBondContact O-CG1 3.45Å; R366-I370 PolarHBondContact O-N 3.33Å
367	V	82.7	Confident	80.5	Confident	66 Å²	66	70.8 Å²	70.8	40%	0.4	33%	0.331	S	S	.	.	H	α-helix	trans	-62.8	-46.6	177.3	170.7	0	0	0	0	110.9	Q363 K364 E365 I370 L371	Q363-V367 WeakPolarHBondContact O-CB 3.5Å; Q363-V367 VanDerWaalsContact O-CG2 3.27Å; Q363-V367 WeakPolarHBondContact O-CG2 3.4Å; Q363-V367 PolarHBondContact O-N 2.72Å; K364-V367 PolarHBondContact O-N 3.47Å; E365-V367 VanDerWaalsContact C-N 3.35Å; E365-V367 PolarHBondContact O-N 3.34Å; V367-I370 PolarHBondContact O-N 2.88Å; V367-L371 VanDerWaalsContact O-CB 3.27Å; V367-L371 WeakPolarHBondContact O-CB 3.36Å; V367-L371 PolarHBondContact O-N 3.3Å
368	L	83.9	Confident	80.1	Confident	38 Å²	38	63.6 Å²	63.6	20%	0.199	31%	0.314	C	S	.	.	H	α-helix	trans	-64.2	-40.3	177.2	-73.5	176.4	0	0	0	112.6	F282 L286 V289 K364 E365 L371 F372	F282-L368 HydrophobicContact CE1-CD2 4.38Å; L286-L368 HydrophobicContact CD2-CB 3.57Å; L286-L368 HydrophobicContact CD2-CD1 4.42Å; L286-L368 HydrophobicContact CG-CB 4.26Å; V289-L368 HydrophobicContact CB-CD1 4.48Å; V289-L368 HydrophobicContact CG2-CD1 3.79Å; K364-L368 WeakPolarHBondContact O-CG 3.46Å; K364-L368 PolarHBondContact O-N 3.29Å; E365-L368 PolarHBondContact O-N 2.95Å; L368-L371 WeakPolarHBondContact O-CB 3.37Å; L368-L371 PolarHBondContact O-N 2.86Å; L368-F372 WeakPolarHBondContact O-CB 3.01Å; L368-F372 PolarHBondContact O-N 2.75Å
369	S	82.9	Confident	79.2	Confident	33 Å²	33	61.2 Å²	61.2	23%	0.231	30%	0.299	C	S	.	.	H	α-helix	trans	-66	-43.4	177.3	-63.1	0	0	0	0	111.4	E365 R366 L371 F372 E373	E365-S369 VanDerWaalsContact O-CB 3.29Å; E365-S369 WeakPolarHBondContact O-CB 3.39Å; E365-S369 PolarHBondContact O-N 3.32Å; E365-S369 PolarHBondContact O-OG 3.48Å; R366-S369 PolarHBondContact O-N 3.47Å; S369-L371 VanDerWaalsContact C-N 3.3Å; S369-L371 PolarHBondContact O-N 3.5Å; S369-F372 PolarHBondContact O-N 3.36Å; S369-E373 VanDerWaalsContact O-CB 3.23Å; S369-E373 WeakPolarHBondContact O-CB 3.43Å; S369-E373 PolarHBondContact O-N 3.44Å
370	I	82	Confident	78.3	Confident	82 Å²	82	65.6 Å²	65.6	42%	0.421	32%	0.32	S	S	.	.	H	α-helix	trans	-64.6	-37.9	174	-69.1	166.9	0	0	0	110.5	R366 V367 K374	R366-I370 HydrophobicContact CG-CD1 3.83Å; R366-I370 WeakPolarHBondContact O-CB 3.25Å; R366-I370 WeakPolarHBondContact O-CD1 3.12Å; R366-I370 WeakPolarHBondContact O-CG1 3.45Å; R366-I370 PolarHBondContact O-N 3.33Å; V367-I370 PolarHBondContact O-N 2.88Å; I370-K374 WeakPolarHBondContact O-CB 3.46Å; I370-K374 PolarHBondContact O-N 2.84Å
371	L	83.4	Confident	77.3	Confident	86 Å²	86	70.9 Å²	70.9	45%	0.45	34%	0.339	S	S	.	.	H	α-helix	trans	-65	-45.9	177.2	-177.2	61.9	0	0	0	111.3	F282 V367 L368 S369 K374 M375	F282-L371 HydrophobicContact CE1-CD2 3.76Å; F282-L371 HydrophobicContact CE1-CG 4.32Å; F282-L371 HydrophobicContact CZ-CD2 3.97Å; F282-L371 HydrophobicContact CZ-CG 4.37Å; V367-L371 VanDerWaalsContact O-CB 3.27Å; V367-L371 WeakPolarHBondContact O-CB 3.36Å; V367-L371 PolarHBondContact O-N 3.3Å; L368-L371 WeakPolarHBondContact O-CB 3.37Å; L368-L371 PolarHBondContact O-N 2.86Å; S369-L371 VanDerWaalsContact C-N 3.3Å; S369-L371 PolarHBondContact O-N 3.5Å; L371-K374 PolarHBondContact O-N 3.22Å; L371-M375 WeakPolarHBondContact O-CB 3.5Å; L371-M375 PolarHBondContact O-N 2.72Å
372	F	82.8	Confident	76.2	Confident	47 Å²	47	72.8 Å²	72.8	21%	0.206	35%	0.354	C	S	.	.	H	α-helix	trans	-63	-44.8	175.8	-171.5	-103.8	0	0	0	111.7	E279 F282 L368 S369 M375 N376	E279-F372 HydrophobicContact CG-CE2 4.33Å; F282-F372 HydrophobicContact CB-CD2 3.75Å; F282-F372 HydrophobicContact CB-CE2 4.15Å; F282-F372 HydrophobicContact CD2-CD2 4.36Å; F282-F372 HydrophobicContact CG-CD2 4.14Å; L368-F372 WeakPolarHBondContact O-CB 3.01Å; L368-F372 PolarHBondContact O-N 2.75Å; S369-F372 PolarHBondContact O-N 3.36Å; F372-M375 HydrophobicContact CD2-CE 3.64Å; F372-M375 HydrophobicContact CE2-CE 3.96Å; F372-M375 PolarHBondContact O-N 3.47Å; F372-N376 WeakPolarHBondContact CD1-ND2 3.27Å; F372-N376 WeakPolarHBondContact CE1-ND2 3.17Å; F372-N376 WeakPolarHBondContact CZ-ND2 3.48Å; F372-N376 PolarHBondContact O-N 3.39Å; F372-N376 PolarHBondContact O-ND2 3.49Å
373	E	81.4	Confident	74.9	Confident	95 Å²	95	76.6 Å²	76.6	44%	0.444	38%	0.375	S	S	.	.	H	α-helix	trans	-62.7	-47.8	176.4	-175.8	59.8	-150.7	0	0	111.3	S369 M375 N376 Q377	S369-E373 VanDerWaalsContact O-CB 3.23Å; S369-E373 WeakPolarHBondContact O-CB 3.43Å; S369-E373 PolarHBondContact O-N 3.44Å; E373-M375 VanDerWaalsContact C-N 3.3Å; E373-M375 PolarHBondContact O-N 2.85Å; E373-N376 CarbonylContact O-C 3.24Å; E373-N376 PolarHBondContact O-N 3.48Å; E373-Q377 HydrophobicContact CG-CG 4.27Å; E373-Q377 VanDerWaalsContact CG-NE2 3.31Å; E373-Q377 WeakPolarHBondContact O-CB 3.33Å; E373-Q377 VanDerWaalsContact O-CG 3.29Å; E373-Q377 WeakPolarHBondContact O-CG 3.18Å; E373-Q377 PolarHBondContact O-N 2.82Å; E373-Q377 WeakPolarHBondContact OE1-CG 3.46Å; E373-Q377 PolarHBondContact OE1-NE2 3.44Å
374	K	81.5	Confident	73.7	Confident	147 Å²	147	81.4 Å²	81.4	64%	0.639	40%	0.401	S	S	*	.	H	α-helix	trans	-63.7	-37.6	177.8	-173.5	170.3	-178.7	175.7	0	111.8	I370 L371 N376 S378	I370-K374 WeakPolarHBondContact O-CB 3.46Å; I370-K374 PolarHBondContact O-N 2.84Å; L371-K374 PolarHBondContact O-N 3.22Å; K374-N376 VanDerWaalsContact C-N 3.29Å; K374-N376 PolarHBondContact O-N 3.43Å; K374-S378 PolarHBondContact O-N 3.2Å; K374-S378 VanDerWaalsContact O-N 3.11Å; K374-S378 PolarHBondContact O-OG 2.93Å
375	M	76.7	Confident	72.4	Confident	46 Å²	46	85.6 Å²	85.6	23%	0.227	42%	0.419	C	S	.	.	H	α-helix	trans	-64.2	-33.2	173.4	-177.5	180	63.5	0	0	111.8	I278 F282 L371 F372 E373 S378 K379	I278-M375 HydrophobicContact CG2-CE 4.39Å; I278-M375 HydrophobicContact CG2-SD 4.1Å; F282-M375 HydrophobicContact CD2-CE 3.62Å; F282-M375 HydrophobicContact CD2-SD 4.27Å; F282-M375 HydrophobicContact CE2-CE 3.76Å; F282-M375 HydrophobicContact CE2-SD 3.81Å; L371-M375 WeakPolarHBondContact O-CB 3.5Å; L371-M375 PolarHBondContact O-N 2.72Å; F372-M375 HydrophobicContact CD2-CE 3.64Å; F372-M375 HydrophobicContact CE2-CE 3.96Å; F372-M375 PolarHBondContact O-N 3.47Å; E373-M375 VanDerWaalsContact C-N 3.3Å; E373-M375 PolarHBondContact O-N 2.85Å; M375-S378 PolarHBondContact O-OG 3.36Å; M375-S378 VanDerWaalsContact O-OG 3.04Å; M375-K379 VanDerWaalsContact O-CE 3.26Å; M375-K379 WeakPolarHBondContact O-CE 3.47Å; M375-K379 WeakPolarHBondContact O-CG 3.4Å
376	N	75.7	Confident	71	Confident	40 Å²	40	86.8 Å²	86.8	21%	0.214	43%	0.427	C	S	.	.	H	α-helix	trans	-83.6	-35.9	176.9	-71	-24.6	0	0	0	113.3	F372 E373 K374 K379 M380	F372-N376 WeakPolarHBondContact CD1-ND2 3.27Å; F372-N376 WeakPolarHBondContact CE1-ND2 3.17Å; F372-N376 WeakPolarHBondContact CZ-ND2 3.48Å; F372-N376 PolarHBondContact O-N 3.39Å; F372-N376 PolarHBondContact O-ND2 3.49Å; E373-N376 CarbonylContact O-C 3.24Å; E373-N376 PolarHBondContact O-N 3.48Å; K374-N376 VanDerWaalsContact C-N 3.29Å; K374-N376 PolarHBondContact O-N 3.43Å; N376-K379 VanDerWaalsContact O-CB 3.27Å; N376-K379 WeakPolarHBondContact O-CB 3.14Å; N376-K379 PolarHBondContact O-N 3.45Å; N376-K379 PolarHBondContact OD1-NZ 2.94Å; N376-M380 PolarHBondContact O-N 3.45Å
377	Q	74	Confident	69.6	Low	94 Å²	94	85.8 Å²	85.8	44%	0.439	43%	0.431	S	S	.	.	H	α-helix	trans	-68.4	-35.2	178.1	-73.1	-179.6	5.4	0	0	113.1	E373 K379 M380 K381	E373-Q377 HydrophobicContact CG-CG 4.27Å; E373-Q377 VanDerWaalsContact CG-NE2 3.31Å; E373-Q377 WeakPolarHBondContact O-CB 3.33Å; E373-Q377 VanDerWaalsContact O-CG 3.29Å; E373-Q377 WeakPolarHBondContact O-CG 3.18Å; E373-Q377 PolarHBondContact O-N 2.82Å; E373-Q377 WeakPolarHBondContact OE1-CG 3.46Å; E373-Q377 PolarHBondContact OE1-NE2 3.44Å; Q377-K379 PolarHBondContact O-N 2.76Å; Q377-M380 PolarHBondContact O-N 2.82Å; Q377-K381 PolarHBondContact O-N 2.91Å
378	S	66.8	Low	68.2	Low	66 Å²	66	86 Å²	86	46%	0.462	44%	0.435	S	S	.	.	H	α-helix	trans	-60	-32.1	173.1	63	0	0	0	0	111.7	K374 M375 L382	K374-S378 PolarHBondContact O-N 3.2Å; K374-S378 VanDerWaalsContact O-N 3.11Å; K374-S378 PolarHBondContact O-OG 2.93Å; M375-S378 PolarHBondContact O-OG 3.36Å; M375-S378 VanDerWaalsContact O-OG 3.04Å; S378-L382 PolarHBondContact O-N 3.44Å
379	K	58.2	Low	66.5	Low	41 Å²	41	89.6 Å²	89.6	18%	0.178	45%	0.452	C	S	.	.	H	α-helix	trans	-66.6	-44.9	176.5	-55.6	169.7	-175.5	166.5	0	112.3	R275 E279 M375 N376 Q377 K381 L382 N383	R275-K379 VanDerWaalsContact CZ-NZ 3.34Å; R275-K379 VanDerWaalsContact NE-NZ 3.16Å; R275-K379 VanDerWaalsContact NH2-NZ 3.15Å; E279-K379 IonicContact OE1-NZ 3.88Å; E279-K379 PolarHBondContact OE1-NZ 3.29Å; M375-K379 VanDerWaalsContact O-CE 3.26Å; M375-K379 WeakPolarHBondContact O-CE 3.47Å; M375-K379 WeakPolarHBondContact O-CG 3.4Å; N376-K379 VanDerWaalsContact O-CB 3.27Å; N376-K379 WeakPolarHBondContact O-CB 3.14Å; N376-K379 PolarHBondContact O-N 3.45Å; N376-K379 PolarHBondContact OD1-NZ 2.94Å; Q377-K379 PolarHBondContact O-N 2.76Å; K379-K381 VanDerWaalsContact C-N 3.33Å; K379-K381 PolarHBondContact O-N 2.84Å; K379-L382 PolarHBondContact O-N 3.19Å; K379-N383 PolarHBondContact O-N 3.45Å; K379-N383 VanDerWaalsContact O-N 3.14Å
380	M	56.6	Low	64.7	Low	118 Å²	118	96.2 Å²	96.2	58%	0.581	48%	0.476	S	S	*	.	H	α-helix	trans	-63	-38.7	179.8	-73.5	-70.5	110.5	0	0	112.3	N376 Q377 L382 N384	N376-M380 PolarHBondContact O-N 3.45Å; Q377-M380 PolarHBondContact O-N 2.82Å; M380-L382 PolarHBondContact O-N 2.82Å; M380-N384 PolarHBondContact O-N 3.29Å
381	K	59.1	Low	62.9	Low	161 Å²	161	97.6 Å²	97.6	70%	0.7	49%	0.493	S	S	*	.	H	α-helix	trans	-65.9	-37.5	177.9	-69.7	-176.6	-180	-178.7	0	112.7	Q377 K379 K385	Q377-K381 PolarHBondContact O-N 2.91Å; K379-K381 VanDerWaalsContact C-N 3.33Å; K379-K381 PolarHBondContact O-N 2.84Å; K381-K385 PolarHBondContact O-N 2.98Å
382	L	58.6	Low	60.7	Low	115 Å²	115	98 Å²	98	60%	0.602	50%	0.503	S	S	*	.	H	α-helix	trans	-73.6	-40.7	-178.8	-128.3	136.7	0	0	0	111.9	S378 K379 M380 N384 K385 I386	S378-L382 PolarHBondContact O-N 3.44Å; K379-L382 PolarHBondContact O-N 3.19Å; M380-L382 PolarHBondContact O-N 2.82Å; L382-N384 VanDerWaalsContact C-N 3.31Å; L382-N384 PolarHBondContact O-N 3.3Å; L382-K385 PolarHBondContact O-N 2.84Å; L382-K385 VanDerWaalsContact O-N 3.15Å; L382-I386 HydrophobicContact CD2-CD1 4.1Å; L382-I386 PolarHBondContact O-N 3.32Å
383	N	55.4	Low	58.2	Low	88 Å²	88	98.9 Å²	98.9	47%	0.471	53%	0.526	S	S	.	.	H	α-helix	trans	-62	-37.4	175.4	-79.5	-2.8	0	0	0	112.6	K379 K385 N387	K379-N383 PolarHBondContact O-N 3.45Å; K379-N383 VanDerWaalsContact O-N 3.14Å; N383-K385 VanDerWaalsContact C-N 3.28Å; N383-K385 PolarHBondContact O-N 3.33Å; N383-N387 PolarHBondContact O-N 2.91Å
384	N	57.1	Low	56	Low	115 Å²	115	104 Å²	104	62%	0.615	55%	0.546	S	S	*	.	H	α-helix	trans	-66	-31.5	176.6	-71.9	-7.1	0	0	0	112.6	M380 L382 S388	M380-N384 PolarHBondContact O-N 3.29Å; L382-N384 VanDerWaalsContact C-N 3.31Å; L382-N384 PolarHBondContact O-N 3.3Å; N384-S388 PolarHBondContact O-N 3.5Å
385	K	56	Low	53.8	Low	135 Å²	135	104.9 Å²	104.9	59%	0.587	56%	0.558	S	S	*	*	H	α-helix	trans	-74.6	-42.8	179.3	-154.2	175.2	-178	-174.9	0	112.2	K381 L382 N383 N387 S388 E389	K381-K385 PolarHBondContact O-N 2.98Å; L382-K385 PolarHBondContact O-N 2.84Å; L382-K385 VanDerWaalsContact O-N 3.15Å; N383-K385 VanDerWaalsContact C-N 3.28Å; N383-K385 PolarHBondContact O-N 3.33Å; K385-N387 VanDerWaalsContact C-N 3.31Å; K385-N387 PolarHBondContact O-N 2.78Å; K385-S388 PolarHBondContact O-N 2.79Å; K385-S388 VanDerWaalsContact O-N 3.09Å; K385-S388 PolarHBondContact O-OG 3.42Å; K385-E389 PolarHBondContact O-N 3.37Å; K385-E389 VanDerWaalsContact O-N 3.14Å
386	I	56	Low	51.8	Low	74 Å²	74	110.9 Å²	110.9	38%	0.379	59%	0.589	S	S	.	*	H	α-helix	trans	-63.5	-37.3	178.3	-64.1	169.1	0	0	0	111.6	L382 S388 E389 K390	L382-I386 HydrophobicContact CD2-CD1 4.1Å; L382-I386 PolarHBondContact O-N 3.32Å; I386-S388 VanDerWaalsContact C-N 3.28Å; I386-S388 PolarHBondContact O-N 2.91Å; I386-E389 PolarHBondContact O-N 2.78Å; I386-K390 PolarHBondContact O-N 3.21Å; I386-K390 VanDerWaalsContact O-N 3.15Å
387	N	50.4	Low	49.7	Very low	114 Å²	114	117.6 Å²	117.6	61%	0.61	62%	0.617	S	S	*	*	H	α-helix	trans	-67.9	-27.8	175.9	-73.6	-15.6	0	0	0	112.8	N383 K385	N383-N387 PolarHBondContact O-N 2.91Å; K385-N387 VanDerWaalsContact C-N 3.31Å; K385-N387 PolarHBondContact O-N 2.78Å
388	S	52.9	Low	47.8	Very low	70 Å²	70	119.9 Å²	119.9	49%	0.49	63%	0.631	S	S	.	*	H	α-helix	trans	-75.2	-35.2	173.8	72	0	0	0	0	113	N384 K385 I386 S391	N384-S388 PolarHBondContact O-N 3.5Å; K385-S388 PolarHBondContact O-N 2.79Å; K385-S388 VanDerWaalsContact O-N 3.09Å; K385-S388 PolarHBondContact O-OG 3.42Å; I386-S388 VanDerWaalsContact C-N 3.28Å; I386-S388 PolarHBondContact O-N 2.91Å; S388-S391 PolarHBondContact O-N 3.46Å
389	E	49.4	Very low	46.2	Very low	115 Å²	115	124.1 Å²	124.1	54%	0.537	65%	0.649	S	S	.	*	H	α-helix	trans	-77.8	-29.9	-178.3	-72.6	174	-170.8	0	0	112.7	K385 I386 S391 S392	K385-E389 PolarHBondContact O-N 3.37Å; K385-E389 VanDerWaalsContact O-N 3.14Å; I386-E389 PolarHBondContact O-N 2.78Å; E389-S391 PolarHBondContact O-N 2.83Å; E389-S392 CarbonylContact O-C 3.54Å; E389-S392 VanDerWaalsContact O-C 3.24Å; E389-S392 PolarHBondContact O-N 2.88Å
390	K	45.7	Very low	45.1	Very low	172 Å²	172	129.4 Å²	129.4	75%	0.748	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-21.9	171.9	-75.3	-173.6	178.7	-177.5	0	113.8	I386 S392	I386-K390 PolarHBondContact O-N 3.21Å; I386-K390 VanDerWaalsContact O-N 3.15Å; K390-S392 VanDerWaalsContact C-N 3.28Å
391	S	43.6	Very low	43.8	Very low	110 Å²	110	130.7 Å²	130.7	77%	0.769	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-10.7	171.7	-175.9	0	0	0	0	112.9	S388 E389	S388-S391 PolarHBondContact O-N 3.46Å; E389-S391 PolarHBondContact O-N 2.83Å
392	S	37.2	Very low	42.6	Very low	95 Å²	95	132.3 Å²	132.3	66%	0.664	69%	0.687	S	S	*	*	S	Bend	trans	-144.3	80	-167.8	163	0	0	0	0	110.9	E389 K390	E389-S392 CarbonylContact O-C 3.54Å; E389-S392 VanDerWaalsContact O-C 3.24Å; E389-S392 PolarHBondContact O-N 2.88Å; K390-S392 VanDerWaalsContact C-N 3.28Å
393	G	30.3	Very low	41.4	Very low	66 Å²	66	130 Å²	130	68%	0.68	69%	0.69	S	S	*	*			trans	155.9	90	165.1	0	0	0	0	0	112.9
394	K	34.6	Very low	40.3	Very low	202 Å²	202	133.8 Å²	133.8	88%	0.878	71%	0.709	S	S	*	*				61.1	104.3	103	-93.4	177.4	177.6	172.5	0	113.8	I396	K394-I396 PolarHBondContact O-N 2.84Å; K394-I396 VanDerWaalsContact O-N 3.13Å
395	N	34.7	Very low	39.4	Very low	166 Å²	166	135.1 Å²	135.1	89%	0.888	72%	0.716	S	S	*	*			trans	-36.6	109.4	166	-62.6	-56.8	0	0	0	111.7	F397	N395-F397 PolarHBondContact O-N 2.89Å; N395-F397 VanDerWaalsContact O-N 3.13Å
396	I	36.6	Very low	38.4	Very low	171 Å²	171	137.3 Å²	137.3	88%	0.877	73%	0.728	S	S	*	*			trans	-73.9	102	166.4	-64.8	170.3	0	0	0	105.8	K394	K394-I396 PolarHBondContact O-N 2.84Å; K394-I396 VanDerWaalsContact O-N 3.13Å
397	F	31	Very low	37.3	Very low	182 Å²	182	141.8 Å²	141.8	80%	0.798	75%	0.752	S	S	*	*			trans	-69.4	139.3	175.4	-159.1	-98.4	0	0	0	109.7	N395	N395-F397 PolarHBondContact O-N 2.89Å; N395-F397 VanDerWaalsContact O-N 3.13Å
398	L	34.5	Very low	36.8	Very low	141 Å²	141	142.9 Å²	142.9	74%	0.738	76%	0.758	S	S	*	*			trans	-54.9	127	-179.1	-67.8	146.8	0	0	0	112.6
399	N	32	Very low	36	Very low	155 Å²	155	148.8 Å²	148.8	83%	0.829	78%	0.778	S	S	*	*			trans	-132.4	79.6	154.9	-85.2	-13	0	0	0	107.5
400	N	35.1	Very low	35.4	Very low	153 Å²	153	151.7 Å²	151.7	82%	0.818	79%	0.794	S	S	*	*			trans	-111.9	87.2	161.2	-92.4	-10.2	0	0	0	106.8
401	E	29.6	Very low	35.3	Very low	145 Å²	145	149.7 Å²	149.7	68%	0.678	79%	0.791	S	S	*	*			trans	-91.8	144.7	169.3	-146.2	177.8	-156.7	0	0	108.2
402	Y	33.5	Very low	35.6	Very low	195 Å²	195	150.5 Å²	150.5	77%	0.765	79%	0.794	S	S	*	*			trans	85.5	93.4	171.2	-49.5	-72.3	0	0	0	118.9
403	G	33.5	Very low	36	Very low	66 Å²	66	155.5 Å²	155.5	68%	0.68	80%	0.804	S	S	*	*			trans	-167.9	39.9	158.4	0	0	0	0	0	111.8	N405	G403-N405 PolarHBondContact O-N 3.1Å
404	I	32.9	Very low	36.6	Very low	167 Å²	167	157.3 Å²	157.3	86%	0.856	81%	0.806	S	S	*	*			trans	-75.3	81.1	173.2	-55.3	177.7	0	0	0	107.1
405	N	37.3	Very low	36.8	Very low	144 Å²	144	154.7 Å²	154.7	77%	0.77	80%	0.8	S	S	*	*			trans	-83.6	119.1	165.4	-76.9	-22.4	0	0	0	108	G403 L407	G403-N405 PolarHBondContact O-N 3.1Å; N405-L407 PolarHBondContact O-N 2.95Å
406	Q	35.3	Very low	36.7	Very low	180 Å²	180	154.3 Å²	154.3	84%	0.841	80%	0.797	S	S	*	*			trans	-36.9	101.4	171.6	-64.7	163.7	6.9	0	0	111.4
407	L	34	Very low	36.8	Very low	168 Å²	168	156.2 Å²	156.2	88%	0.88	79%	0.794	S	S	*	*			trans	-94.3	104.1	161.2	-88.2	165.3	0	0	0	106.4	N405 E409	N405-L407 PolarHBondContact O-N 2.95Å; L407-E409 PolarHBondContact O-N 3.28Å
408	N	39.3	Very low	36.8	Very low	137 Å²	137	152.8 Å²	152.8	73%	0.733	79%	0.789	S	S	*	*			trans	-40.3	124.8	172.7	-68.8	-35.3	0	0	0	110.8	M410	N408-M410 PolarHBondContact O-N 3.37Å
409	E	36.6	Very low	36.9	Very low	194 Å²	194	151 Å²	151	91%	0.907	79%	0.788	S	S	*	*			trans	-16.3	88.8	147.7	-158.2	166.9	-152.2	0	0	112.2	L407	L407-E409 PolarHBondContact O-N 3.28Å
410	M	35.6	Very low	37.1	Very low	177 Å²	177	151.9 Å²	151.9	87%	0.872	79%	0.789	S	S	*	*			trans	-91.7	107	163	-76	-153	100.6	0	0	107.1	N408	N408-M410 PolarHBondContact O-N 3.37Å
411	D	43.3	Very low	37.3	Very low	130 Å²	130	152 Å²	152	70%	0.695	79%	0.79	S	S	*	*			trans	-49.2	123.8	175.2	-148.1	-6.7	0	0	0	110.2	K413	D411-K413 PolarHBondContact O-N 3.05Å
412	P	50	Low	37.6	Very low	126 Å²	126	152 Å²	152	82%	0.818	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	16.8	-167.9	5.2	2.2	0	0	0	115.5
413	K	45.8	Very low	37.6	Very low	201 Å²	201	151.4 Å²	151.4	87%	0.874	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	10.6	-178.8	-80.9	-175.7	177.1	178.2	0	115.4	D411	D411-K413 PolarHBondContact O-N 3.05Å
414	S	43.2	Very low	37.6	Very low	104 Å²	104	156.9 Å²	156.9	73%	0.727	81%	0.806	S	S	*	*			trans	-118.7	54.4	179.6	-166.6	0	0	0	0	113.4
415	I	39.1	Very low	37.7	Very low	146 Å²	146	153.8 Å²	153.8	75%	0.749	80%	0.799	S	S	*	*			trans	-137.3	78	157.2	-58.3	-177.9	0	0	0	107.7	Y417	I415-Y417 HydrophobicContact CG2-CD2 3.49Å; I415-Y417 VanDerWaalsContact CG2-CD2 3.49Å; I415-Y417 HydrophobicContact CG2-CE2 4.12Å; I415-Y417 PolarHBondContact O-N 2.89Å
416	L	33.4	Very low	37.6	Very low	158 Å²	158	154.8 Å²	154.8	83%	0.827	81%	0.805	S	S	*	*			trans	-82.8	84.3	165.8	-167.2	105.7	0	0	0	107.3	T418	L416-T418 HydrophobicContact CD2-CG2 4.26Å; L416-T418 PolarHBondContact O-N 3.44Å
417	Y	37	Very low	37.8	Very low	211 Å²	211	157.5 Å²	157.5	83%	0.827	81%	0.807	S	S	*	*			trans	-81.4	95.4	166.8	-103.7	-77.5	0	0	0	109.1	I415 S419	I415-Y417 HydrophobicContact CG2-CD2 3.49Å; I415-Y417 VanDerWaalsContact CG2-CD2 3.49Å; I415-Y417 HydrophobicContact CG2-CE2 4.12Å; I415-Y417 PolarHBondContact O-N 2.89Å; Y417-S419 PolarHBondContact O-N 3.18Å
418	T	32.2	Very low	37.8	Very low	110 Å²	110	152.8 Å²	152.8	68%	0.675	80%	0.799	S	S	*	*			trans	-57.9	112.1	152.9	35.9	0	0	0	0	110.1	L416	L416-T418 HydrophobicContact CD2-CG2 4.26Å; L416-T418 PolarHBondContact O-N 3.44Å
419	S	35.8	Very low	37.4	Very low	103 Å²	103	149.4 Å²	149.4	72%	0.72	80%	0.797	S	S	*	*			trans	175.8	89.2	138.7	-108.1	0	0	0	0	110.2	Y417	Y417-S419 PolarHBondContact O-N 3.18Å
420	M	37.5	Very low	37.4	Very low	174 Å²	174	149.5 Å²	149.5	86%	0.857	80%	0.797	S	S	*	*			trans	-142	82.6	151.6	-77.3	-61.2	-177.8	0	0	106	D422	M420-D422 VanDerWaalsContact C-N 3.34Å; M420-D422 PolarHBondContact O-N 3.17Å
421	N	38.7	Very low	37.2	Very low	157 Å²	157	147.9 Å²	147.9	84%	0.84	79%	0.792	S	S	*	*			trans	-80.3	87.2	164.7	-82.4	-23.3	0	0	0	106.9
422	D	36.7	Very low	36.7	Very low	144 Å²	144	150.6 Å²	150.6	77%	0.77	80%	0.798	S	S	*	*			trans	-104.9	119.3	160.3	-79.2	-35.1	0	0	0	108.7	M420 E424	M420-D422 VanDerWaalsContact C-N 3.34Å; M420-D422 PolarHBondContact O-N 3.17Å; D422-E424 PolarHBondContact O-N 2.84Å
423	H	33.1	Very low	35.8	Very low	183 Å²	183	148.7 Å²	148.7	85%	0.847	80%	0.801	S	S	*	*			trans	-48.3	129	166.6	-75	-93.7	0	0	0	110.5
424	E	32.6	Very low	35.1	Very low	181 Å²	181	147.4 Å²	147.4	85%	0.846	80%	0.798	S	S	*	*				-176.7	145.7	123.6	-103.7	174.6	-174.9	0	0	113	D422	D422-E424 PolarHBondContact O-N 2.84Å
425	S	35.9	Very low	34.8	Very low	102 Å²	102	150.9 Å²	150.9	71%	0.713	81%	0.805	S	S	*	*			trans	74.6	79	159.4	65.7	0	0	0	0	118.4	R427	S425-R427 PolarHBondContact O-N 3.2Å
426	N	35.5	Very low	34.6	Very low	164 Å²	164	150.6 Å²	150.6	88%	0.877	81%	0.805	S	S	*	*			trans	-27.4	92.8	132	-170.9	29.6	0	0	0	112.9
427	R	38.9	Very low	34.8	Very low	237 Å²	237	150.9 Å²	150.9	89%	0.894	81%	0.808	S	S	*	*			trans	-109.3	108	153.8	-90.7	-171.6	177.7	-173.4	0.6	107	S425	S425-R427 PolarHBondContact O-N 3.2Å
428	G	33.5	Very low	34.8	Very low	69 Å²	69	148.4 Å²	148.4	71%	0.711	81%	0.809	S	S	*	*			trans	-51.7	139.2	176.6	0	0	0	0	0	111.4
429	G	30.8	Very low	34.9	Very low	67 Å²	67	150.3 Å²	150.3	69%	0.691	82%	0.815	S	S	*	*			trans	-84.9	-149.4	172.1	0	0	0	0	0	112.5
430	Q	36.1	Very low	35.1	Very low	195 Å²	195	152.3 Å²	152.3	91%	0.911	82%	0.817	S	S	*	*			trans	82.4	131.6	-175.6	-59	-177.9	-33.2	0	0	113.5
431	D	33.2	Very low	35	Very low	144 Å²	144	150.1 Å²	150.1	77%	0.77	81%	0.809	S	S	*	*			cis	-166.5	159.7	-14.7	-160	-7.4	0	0	0	104.7
432	K	32.6	Very low	35.1	Very low	187 Å²	187	150 Å²	150	81%	0.813	81%	0.808	S	S	*	*			trans	-61.7	129.7	-176.4	-62.9	171.8	174	-178.2	0	111.8
433	G	31	Very low	35.1	Very low	86 Å²	86	150 Å²	150	89%	0.887	81%	0.808	S	S	*	*			trans	-120	76.3	161.6	0	0	0	0	0	109.2
434	E	30.8	Very low	35.1	Very low	174 Å²	174	148.6 Å²	148.6	81%	0.813	81%	0.807	S	S	*	*			trans	-95.2	119.2	164.7	-145.1	172.5	-160.9	0	0	105.2
435	M	36	Very low	35	Very low	176 Å²	176	145.3 Å²	145.3	87%	0.867	80%	0.8	S	S	*	*			trans	-166.5	98.1	161.4	-92.9	-104	177.7	0	0	110
436	D	36.4	Very low	35	Very low	140 Å²	140	147.8 Å²	147.8	75%	0.749	81%	0.805	S	S	*	*			trans	41.9	116	135.2	-63	-19.2	0	0	0	121.4	N438	D436-N438 PolarHBondContact O-N 3.27Å
437	D	36.4	Very low	34.6	Very low	165 Å²	165	146.7 Å²	146.7	88%	0.882	80%	0.799	S	S	*	*			trans	-41.9	119	149.8	-72	-47.4	0	0	0	112.4
438	N	36.5	Very low	34.3	Very low	158 Å²	158	140 Å²	140	85%	0.845	79%	0.789	S	S	*	*			trans	-137.3	84.9	155.4	-100.9	-37.5	0	0	0	110	D436 N440	D436-N438 PolarHBondContact O-N 3.27Å; N438-N440 PolarHBondContact O-N 3.49Å
439	N	35.8	Very low	34.1	Very low	150 Å²	150	143.6 Å²	143.6	80%	0.802	79%	0.792	S	S	*	*			trans	-76.3	101	162.1	-174.4	11.7	0	0	0	108.3
440	N	39.6	Very low	34.1	Very low	145 Å²	145	146.6 Å²	146.6	78%	0.775	79%	0.792	S	S	*	*			trans	-140.9	100.7	158.4	-149.4	0.3	0	0	0	111.5	N438 N442	N438-N440 PolarHBondContact O-N 3.49Å; N440-N442 PolarHBondContact O-N 3.16Å
441	N	35.8	Very low	33.9	Very low	128 Å²	128	143.7 Å²	143.7	68%	0.684	78%	0.782	S	S	*	*			trans	-67.6	114.1	171.4	-144.3	-4.1	0	0	0	108.6
442	N	41	Very low	33.7	Very low	155 Å²	155	144.3 Å²	144.3	83%	0.829	79%	0.786	S	S	*	*			trans	-149.6	96.8	157.4	-118.3	-10.9	0	0	0	111.1	N440 N444	N440-N442 PolarHBondContact O-N 3.16Å; N442-N444 PolarHBondContact O-N 2.89Å
443	N	35.2	Very low	33.6	Very low	143 Å²	143	140.9 Å²	140.9	77%	0.765	79%	0.786	S	S	*	*			trans	-59.1	120.2	159	-72.3	-38.8	0	0	0	109.1
444	N	33.8	Very low	33.5	Very low	154 Å²	154	144.4 Å²	144.4	82%	0.824	78%	0.784	S	S	*	*			trans	-153.4	121.7	136	-138.7	-2.4	0	0	0	113	N442	N442-N444 PolarHBondContact O-N 2.89Å
445	T	29.8	Very low	33.4	Very low	112 Å²	112	139.5 Å²	139.5	69%	0.687	78%	0.78	S	S	*	*			trans	-60	137.7	175.3	-28.8	0	0	0	0	111.7
446	N	35.6	Very low	33.2	Very low	155 Å²	155	138.7 Å²	138.7	83%	0.829	78%	0.779	S	S	*	*			trans	178.3	89.2	148.8	-86.8	-24.2	0	0	0	107.4
447	N	29	Very low	33.1	Very low	141 Å²	141	138.8 Å²	138.8	75%	0.754	78%	0.78	S	S	*	*				55.4	93.6	87	-161.2	29.7	0	0	0	114.8
448	S	31.5	Very low	33.2	Very low	96 Å²	96	138.6 Å²	138.6	67%	0.671	78%	0.779	S	S	*	*				166.5	121.4	121.5	-78.1	0	0	0	0	111.1
449	N	29.2	Very low	33.1	Very low	145 Å²	145	137.8 Å²	137.8	78%	0.775	78%	0.775	S	S	*	*			trans	18.5	134.6	134.4	-64.6	-15.3	0	0	0	116.3
450	N	31.3	Very low	33.5	Very low	130 Å²	130	137 Å²	137	70%	0.695	77%	0.77	S	S	*	*			cis	178.8	139.5	45.8	-142.6	-4.8	0	0	0	108.7
451	N	31.4	Very low	33.7	Very low	133 Å²	133	134.3 Å²	134.3	71%	0.711	76%	0.763	S	S	*	*			trans	34	110.8	144	-59.4	-14.1	0	0	0	120.6
452	N	29.2	Very low	34.5	Very low	157 Å²	157	135 Å²	135	84%	0.84	77%	0.766	S	S	*	*				162.7	119.8	109.7	-99.2	-8.3	0	0	0	109.7
453	S	30.3	Very low	35.1	Very low	116 Å²	116	133.5 Å²	133.5	81%	0.811	76%	0.755	S	S	*	*			trans	-179.4	123	134.7	-87	0	0	0	0	112.4
454	N	29.6	Very low	35.9	Very low	159 Å²	159	134.1 Å²	134.1	85%	0.85	75%	0.753	S	S	*	*			trans	40.7	109.4	137.3	-80.1	1.8	0	0	0	120.3
455	G	27.6	Very low	37.2	Very low	72 Å²	72	132.2 Å²	132.2	74%	0.742	74%	0.743	S	S	*	*				44.4	118.2	112.5	0	0	0	0	0	119.2
456	N	31.5	Very low	38.8	Very low	158 Å²	158	130.4 Å²	130.4	85%	0.845	74%	0.735	S	S	*	*				-172.4	151.9	112.8	-117.1	-16	0	0	0	111.7
457	N	34.9	Very low	40.5	Very low	143 Å²	143	127.9 Å²	127.9	77%	0.765	72%	0.721	S	S	*	*			trans	-45.2	146.1	177.3	-56.6	-44.7	0	0	0	114.8
458	N	37.9	Very low	42.7	Very low	160 Å²	160	127.8 Å²	127.8	86%	0.856	71%	0.714	S	S	*	*			trans	-152.4	140.2	146.6	-110.1	-10.2	0	0	0	112
459	D	36.4	Very low	44.9	Very low	142 Å²	142	127.8 Å²	127.8	76%	0.759	71%	0.706	S	S	*	*			trans	-60.7	130.8	-166.7	-65.8	-58.2	0	0	0	115.5
460	N	42.2	Very low	47.2	Very low	132 Å²	132	125.4 Å²	125.4	71%	0.706	70%	0.696	S	S	*	*			trans	-130.1	63.9	169.9	-113	13.4	0	0	0	110
461	S	45.8	Very low	49.3	Very low	89 Å²	89	124.1 Å²	124.1	62%	0.622	69%	0.687	S	S	*	*			trans	-97.9	0	178.2	48.7	0	0	0	0	114.5
462	N	51.4	Low	51.7	Low	142 Å²	142	122.1 Å²	122.1	76%	0.759	68%	0.676	S	S	*	*	S	Bend	trans	-94.9	-9.6	-179.2	-75.8	-23.5	0	0	0	115
463	E	52.7	Low	54.4	Low	125 Å²	125	121.2 Å²	121.2	58%	0.584	67%	0.665	S	S	*	*	H	α-helix	trans	-85.5	-25.4	179.7	-81.8	-174.6	156.5	0	0	113.9	N467	E463-N467 PolarHBondContact O-N 2.97Å; E463-N467 VanDerWaalsContact O-N 3.16Å; E463-N467 PolarHBondContact O-ND2 3.39Å
464	E	53.8	Low	57	Low	156 Å²	156	118.1 Å²	118.1	73%	0.729	64%	0.643	S	S	*	*	H	α-helix	trans	-68.2	-39.7	-177	-71.3	-167.5	164.6	0	0	112.8	N467 K468	E464-N467 PolarHBondContact O-N 3.49Å; E464-K468 PolarHBondContact O-N 2.84Å
465	D	60	Low	59.7	Low	114 Å²	114	115.2 Å²	115.2	61%	0.61	62%	0.624	S	S	*	*	H	α-helix	trans	-70.2	-36.6	179.9	-88.3	-20.7	0	0	0	112.6	K468 I469	D465-K468 PolarHBondContact O-N 3.34Å; D465-I469 WeakPolarHBondContact O-CG1 3.41Å; D465-I469 PolarHBondContact O-N 2.98Å; D465-I469 VanDerWaalsContact O-N 3.15Å
466	S	64.5	Low	62.7	Low	73 Å²	73	116.8 Å²	116.8	51%	0.51	61%	0.613	S	S	.	*	H	α-helix	trans	-66.3	-42.1	175.3	-73.4	0	0	0	0	111.7	K468 I469 V470	S466-K468 VanDerWaalsContact C-N 3.33Å; S466-K468 PolarHBondContact O-N 3.46Å; S466-I469 PolarHBondContact O-N 3.32Å; S466-V470 WeakPolarHBondContact O-CG2 3.45Å; S466-V470 PolarHBondContact O-N 2.91Å; S466-V470 VanDerWaalsContact O-N 3.08Å
467	N	69.6	Low	65.2	Low	103 Å²	103	114.5 Å²	114.5	55%	0.551	60%	0.6	S	S	*	*	H	α-helix	trans	-64	-37.5	176.8	-79.9	-29.4	0	0	0	112.2	E463 E464 V470 M471	E463-N467 PolarHBondContact O-N 2.97Å; E463-N467 VanDerWaalsContact O-N 3.16Å; E463-N467 PolarHBondContact O-ND2 3.39Å; E464-N467 PolarHBondContact O-N 3.49Å; N467-V470 PolarHBondContact O-N 3.37Å; N467-M471 WeakPolarHBondContact O-CB 3.41Å; N467-M471 WeakPolarHBondContact O-CG 3.36Å; N467-M471 PolarHBondContact O-N 2.98Å
468	K	75.2	Confident	67.8	Low	139 Å²	139	111.9 Å²	111.9	60%	0.604	59%	0.589	S	S	*	*	H	α-helix	trans	-65.9	-38.8	176.9	-161.9	172.1	-175.4	176.8	0	112.6	E464 D465 S466 N472	E464-K468 PolarHBondContact O-N 2.84Å; D465-K468 PolarHBondContact O-N 3.34Å; S466-K468 VanDerWaalsContact C-N 3.33Å; S466-K468 PolarHBondContact O-N 3.46Å; K468-N472 VanDerWaalsContact O-CG 3.25Å; K468-N472 PolarHBondContact O-N 2.85Å; K468-N472 PolarHBondContact O-ND2 3.21Å
469	I	78	Confident	70.4	Confident	96 Å²	96	111.2 Å²	111.2	49%	0.492	58%	0.579	S	S	.	*	H	α-helix	trans	-67.2	-41.1	176	-66.8	166.9	0	0	0	111.2	D465 S466 N472 K473	D465-I469 WeakPolarHBondContact O-CG1 3.41Å; D465-I469 PolarHBondContact O-N 2.98Å; D465-I469 VanDerWaalsContact O-N 3.15Å; S466-I469 PolarHBondContact O-N 3.32Å; I469-N472 PolarHBondContact O-N 3.08Å; I469-K473 PolarHBondContact O-N 3.42Å; I469-K473 VanDerWaalsContact O-N 3.16Å
470	V	77.9	Confident	73.1	Confident	94 Å²	94	110 Å²	110	57%	0.57	57%	0.566	S	S	*	*	H	α-helix	trans	-65.7	-42.4	177.9	173.2	0	0	0	0	111.1	S466 N467 K473 S474	S466-V470 WeakPolarHBondContact O-CG2 3.45Å; S466-V470 PolarHBondContact O-N 2.91Å; S466-V470 VanDerWaalsContact O-N 3.08Å; N467-V470 PolarHBondContact O-N 3.37Å; V470-K473 PolarHBondContact O-N 3.24Å; V470-S474 PolarHBondContact O-N 3.09Å
471	M	75.4	Confident	75.4	Confident	104 Å²	104	109 Å²	109	51%	0.512	56%	0.56	S	S	.	*	H	α-helix	trans	-62.7	-42.8	175.7	-75.3	-65.8	-69.6	0	0	112.5	N467 K473 S474 E475	N467-M471 WeakPolarHBondContact O-CB 3.41Å; N467-M471 WeakPolarHBondContact O-CG 3.36Å; N467-M471 PolarHBondContact O-N 2.98Å; M471-K473 VanDerWaalsContact C-N 3.32Å; M471-K473 PolarHBondContact O-N 3.02Å; M471-S474 PolarHBondContact O-N 3.37Å; M471-S474 PolarHBondContact O-OG 3.03Å; M471-E475 WeakPolarHBondContact O-CG 3.5Å; M471-E475 PolarHBondContact O-N 3.24Å
472	N	82.6	Confident	77.6	Confident	91 Å²	91	112.5 Å²	112.5	49%	0.487	56%	0.561	S	S	.	*	H	α-helix	trans	-62.8	-38.5	177	-72.2	-17.8	0	0	0	112.4	K468 I469 E476	K468-N472 VanDerWaalsContact O-CG 3.25Å; K468-N472 PolarHBondContact O-N 2.85Å; K468-N472 PolarHBondContact O-ND2 3.21Å; I469-N472 PolarHBondContact O-N 3.08Å; N472-E476 PolarHBondContact O-N 3.09Å
473	K	84.8	Confident	79.5	Confident	138 Å²	138	110.7 Å²	110.7	60%	0.6	55%	0.548	S	S	*	.	H	α-helix	trans	-67.8	-37.5	175.9	-75	178.7	179.8	175.4	0	112.3	I469 V470 M471 E476 L477	I469-K473 PolarHBondContact O-N 3.42Å; I469-K473 VanDerWaalsContact O-N 3.16Å; V470-K473 PolarHBondContact O-N 3.24Å; M471-K473 VanDerWaalsContact C-N 3.32Å; M471-K473 PolarHBondContact O-N 3.02Å; K473-E476 PolarHBondContact O-N 2.84Å; K473-L477 WeakPolarHBondContact O-CG 3.34Å; K473-L477 PolarHBondContact O-N 2.98Å
474	S	84.6	Confident	81.2	Confident	51 Å²	51	111.5 Å²	111.5	36%	0.357	55%	0.55	S	S	.	.	H	α-helix	trans	-69.7	-38.5	177.7	74.5	0	0	0	0	111.7	V470 M471 E476 L477 T478	V470-S474 PolarHBondContact O-N 3.09Å; M471-S474 PolarHBondContact O-N 3.37Å; M471-S474 PolarHBondContact O-OG 3.03Å; S474-E476 PolarHBondContact O-N 2.98Å; S474-L477 PolarHBondContact O-N 3.41Å; S474-T478 WeakPolarHBondContact O-CG2 3.43Å; S474-T478 PolarHBondContact O-N 2.81Å; S474-T478 PolarHBondContact O-OG1 3.36Å; S474-T478 VanDerWaalsContact O-OG1 3.1Å
475	E	87.3	Confident	82.8	Confident	97 Å²	97	109.5 Å²	109.5	45%	0.453	54%	0.544	S	S	.	.	H	α-helix	trans	-63.4	-38.4	172.4	-74.5	-175.8	-171.6	0	0	112.5	M471 T478 K479	M471-E475 WeakPolarHBondContact O-CG 3.5Å; M471-E475 PolarHBondContact O-N 3.24Å; E475-T478 WeakPolarHBondContact CA-OG1 3.3Å; E475-T478 PolarHBondContact O-OG1 2.84Å; E475-K479 WeakPolarHBondContact O-CG 3.5Å; E475-K479 PolarHBondContact O-N 3.44Å
476	E	89.5	Confident	84.2	Confident	106 Å²	106	108 Å²	108	50%	0.495	54%	0.535	S	S	.	.	H	α-helix	trans	-70.2	-37	177.3	-162	177.3	147.1	0	0	112.4	N472 K473 S474 K479 K480	N472-E476 PolarHBondContact O-N 3.09Å; K473-E476 PolarHBondContact O-N 2.84Å; S474-E476 PolarHBondContact O-N 2.98Å; E476-K479 PolarHBondContact O-N 3.39Å; E476-K480 WeakPolarHBondContact O-CG 3.02Å; E476-K480 PolarHBondContact O-N 3.34Å; E476-K480 WeakPolarHBondContact OE1-CE 3.48Å; E476-K480 IonicContact OE1-NZ 3.43Å; E476-K480 PolarHBondContact OE1-NZ 3.25Å
477	L	85	Confident	85.1	Confident	110 Å²	110	110.5 Å²	110.5	58%	0.576	54%	0.536	S	S	*	.	H	α-helix	trans	-66.6	-40.9	174.9	-73.8	171.8	0	0	0	112.2	K473 S474 K480 L481	K473-L477 WeakPolarHBondContact O-CG 3.34Å; K473-L477 PolarHBondContact O-N 2.98Å; S474-L477 PolarHBondContact O-N 3.41Å; L477-K480 PolarHBondContact O-N 3.48Å; L477-L481 PolarHBondContact O-N 3Å
478	T	90.2	Very high	85.7	Confident	87 Å²	87	112.7 Å²	112.7	53%	0.534	54%	0.541	S	S	.	.	H	α-helix	trans	-66.2	-39.5	176.5	51	0	0	0	0	111.8	S474 E475 L481 Y482	S474-T478 WeakPolarHBondContact O-CG2 3.43Å; S474-T478 PolarHBondContact O-N 2.81Å; S474-T478 PolarHBondContact O-OG1 3.36Å; S474-T478 VanDerWaalsContact O-OG1 3.1Å; E475-T478 WeakPolarHBondContact CA-OG1 3.3Å; E475-T478 PolarHBondContact O-OG1 2.84Å; T478-L481 PolarHBondContact O-N 2.92Å; T478-Y482 PolarHBondContact O-N 3.18Å
479	K	92.6	Very high	85.8	Confident	147 Å²	147	109.6 Å²	109.6	64%	0.639	54%	0.537	S	S	*	.	H	α-helix	trans	-59.9	-46.6	171.3	-78.2	178.4	-178.9	172.7	0	112.4	E475 E476 L481 Y482 E483	E475-K479 WeakPolarHBondContact O-CG 3.5Å; E475-K479 PolarHBondContact O-N 3.44Å; E476-K479 PolarHBondContact O-N 3.39Å; K479-L481 VanDerWaalsContact C-N 3.32Å; K479-L481 PolarHBondContact O-N 3.43Å; K479-Y482 PolarHBondContact O-N 3.47Å; K479-E483 PolarHBondContact O-N 2.94Å
480	K	92.2	Very high	85.8	Confident	115 Å²	115	109.3 Å²	109.3	50%	0.5	54%	0.537	S	S	.	.	H	α-helix	trans	-61.7	-38.4	177.3	-76.3	173.6	-175.3	161.9	0	112.4	E476 L477 K484	E476-K480 WeakPolarHBondContact O-CG 3.02Å; E476-K480 PolarHBondContact O-N 3.34Å; E476-K480 WeakPolarHBondContact OE1-CE 3.48Å; E476-K480 IonicContact OE1-NZ 3.43Å; E476-K480 PolarHBondContact OE1-NZ 3.25Å; L477-K480 PolarHBondContact O-N 3.48Å; K480-K484 WeakPolarHBondContact O-CB 3.44Å; K480-K484 PolarHBondContact O-N 2.93Å; K480-K484 VanDerWaalsContact O-N 3.09Å
481	L	90.3	Very high	85.5	Confident	111 Å²	111	110.6 Å²	110.6	58%	0.581	54%	0.536	S	S	*	.	H	α-helix	trans	-64.1	-45.2	174.2	-90.8	161.4	0	0	0	111.9	L477 T478 K479 E483 K484 L485	L477-L481 PolarHBondContact O-N 3Å; T478-L481 PolarHBondContact O-N 2.92Å; K479-L481 VanDerWaalsContact C-N 3.32Å; K479-L481 PolarHBondContact O-N 3.43Å; L481-E483 PolarHBondContact O-N 3.45Å; L481-K484 PolarHBondContact O-N 2.94Å; L481-L485 PolarHBondContact O-N 3.26Å
482	Y	91.6	Very high	85.2	Confident	163 Å²	163	112.7 Å²	112.7	64%	0.639	54%	0.543	S	S	*	.	H	α-helix	trans	-64.1	-41.5	179.4	-153.8	-96	0	0	0	111.9	T478 K479 K484 L485 I486	T478-Y482 PolarHBondContact O-N 3.18Å; K479-Y482 PolarHBondContact O-N 3.47Å; Y482-K484 VanDerWaalsContact C-N 3.32Å; Y482-K484 PolarHBondContact O-N 3.26Å; Y482-L485 WeakPolarHBondContact O-CB 3.26Å; Y482-L485 PolarHBondContact O-N 2.96Å; Y482-I486 HydrophobicContact CD1-CD1 3.75Å; Y482-I486 HydrophobicContact CD1-CG1 4.31Å; Y482-I486 HydrophobicContact CE1-CD1 3.86Å; Y482-I486 HydrophobicContact CE1-CG1 4.36Å; Y482-I486 WeakPolarHBondContact O-CG1 3.46Å; Y482-I486 PolarHBondContact O-N 3.42Å
483	E	91.6	Very high	84.2	Confident	104 Å²	104	115.3 Å²	115.3	49%	0.486	55%	0.549	S	S	.	.	H	α-helix	trans	-64.6	-37.3	176.6	-151.6	-165.8	142.9	0	0	112	K479 L481 I486 K487	K479-E483 PolarHBondContact O-N 2.94Å; L481-E483 PolarHBondContact O-N 3.45Å; E483-I486 PolarHBondContact O-N 3.45Å; E483-K487 WeakPolarHBondContact O-CG 3.31Å; E483-K487 PolarHBondContact O-N 2.88Å; E483-K487 WeakPolarHBondContact OE1-CE 3.39Å; E483-K487 IonicContact OE1-NZ 3.62Å; E483-K487 PolarHBondContact OE1-NZ 3.46Å
484	K	88.6	Confident	83.1	Confident	142 Å²	142	113.5 Å²	113.5	62%	0.617	55%	0.547	S	S	*	.	H	α-helix	trans	-67.7	-36.7	175.5	-161.1	172.7	-174.4	179	0	112	K480 L481 Y482 K487 F488	K480-K484 WeakPolarHBondContact O-CB 3.44Å; K480-K484 PolarHBondContact O-N 2.93Å; K480-K484 VanDerWaalsContact O-N 3.09Å; L481-K484 PolarHBondContact O-N 2.94Å; Y482-K484 VanDerWaalsContact C-N 3.32Å; Y482-K484 PolarHBondContact O-N 3.26Å; K484-K487 PolarHBondContact O-N 3.4Å; K484-F488 PolarHBondContact O-N 2.89Å
485	L	87.8	Confident	81.8	Confident	115 Å²	115	117 Å²	117	60%	0.602	56%	0.557	S	S	*	*	H	α-helix	trans	-64.5	-42.7	173.6	-86.4	154.9	0	0	0	112.2	L481 Y482 F488 S489	L481-L485 PolarHBondContact O-N 3.26Å; Y482-L485 WeakPolarHBondContact O-CB 3.26Å; Y482-L485 PolarHBondContact O-N 2.96Å; L485-F488 PolarHBondContact O-N 3.29Å; L485-S489 PolarHBondContact O-N 3.21Å
486	I	88.8	Confident	80.3	Confident	83 Å²	83	117.5 Å²	117.5	43%	0.426	56%	0.563	S	S	.	*	H	α-helix	trans	-62.2	-46	175.7	-67.6	168.8	0	0	0	110.6	Y482 E483 F488 S489 N490	Y482-I486 HydrophobicContact CD1-CD1 3.75Å; Y482-I486 HydrophobicContact CD1-CG1 4.31Å; Y482-I486 HydrophobicContact CE1-CD1 3.86Å; Y482-I486 HydrophobicContact CE1-CG1 4.36Å; Y482-I486 WeakPolarHBondContact O-CG1 3.46Å; Y482-I486 PolarHBondContact O-N 3.42Å; E483-I486 PolarHBondContact O-N 3.45Å; I486-F488 VanDerWaalsContact C-N 3.29Å; I486-F488 PolarHBondContact O-N 2.93Å; I486-S489 PolarHBondContact O-N 2.91Å; I486-N490 PolarHBondContact O-N 3.4Å
487	K	84.6	Confident	78.6	Confident	124 Å²	124	119 Å²	119	54%	0.539	57%	0.574	S	S	.	*	H	α-helix	trans	-58.6	-41.3	176.5	-73.1	172.6	-172.9	165.3	0	111.5	E483 K484 H491	E483-K487 WeakPolarHBondContact O-CG 3.31Å; E483-K487 PolarHBondContact O-N 2.88Å; E483-K487 WeakPolarHBondContact OE1-CE 3.39Å; E483-K487 IonicContact OE1-NZ 3.62Å; E483-K487 PolarHBondContact OE1-NZ 3.46Å; K484-K487 PolarHBondContact O-N 3.4Å; K487-H491 WeakPolarHBondContact O-CB 3.24Å; K487-H491 PolarHBondContact O-N 2.84Å
488	F	80.5	Confident	76.7	Confident	149 Å²	149	120.5 Å²	120.5	65%	0.654	58%	0.582	S	S	*	*	H	α-helix	trans	-64.9	-41.1	175.7	-114.8	-84	0	0	0	113.2	K484 L485 I486 H491 K492	K484-F488 PolarHBondContact O-N 2.89Å; L485-F488 PolarHBondContact O-N 3.29Å; I486-F488 VanDerWaalsContact C-N 3.29Å; I486-F488 PolarHBondContact O-N 2.93Å; F488-H491 PolarHBondContact O-N 3.17Å; F488-K492 PolarHBondContact O-N 2.86Å; F488-K492 VanDerWaalsContact O-N 3.09Å
489	S	76.9	Confident	74.4	Confident	75 Å²	75	121.4 Å²	121.4	52%	0.524	59%	0.588	S	S	.	*	H	α-helix	trans	-66.9	-40.1	-179.9	-156	0	0	0	0	111.9	L485 I486 K492 K493	L485-S489 PolarHBondContact O-N 3.21Å; I486-S489 PolarHBondContact O-N 2.91Å; S489-K492 PolarHBondContact O-N 2.89Å; S489-K493 PolarHBondContact O-N 2.95Å; S489-K493 VanDerWaalsContact O-N 3.17Å
490	N	78.6	Confident	72	Confident	89 Å²	89	122 Å²	122	48%	0.476	60%	0.598	S	S	.	*	H	α-helix	trans	-65.9	-44.1	174.8	-67.9	-13.1	0	0	0	111.4	I486 K492 K493 D494	I486-N490 PolarHBondContact O-N 3.4Å; N490-K492 PolarHBondContact O-N 3.22Å; N490-K493 WeakPolarHBondContact O-CB 3.49Å; N490-K493 PolarHBondContact O-N 3.41Å; N490-D494 PolarHBondContact O-N 2.91Å
491	H	72.4	Confident	69.4	Low	121 Å²	121	124.4 Å²	124.4	56%	0.56	61%	0.611	S	S	*	*	H	α-helix	trans	-62.8	-28.6	178.6	-148.1	-47.3	0	0	0	113	K487 F488 Q495	K487-H491 WeakPolarHBondContact O-CB 3.24Å; K487-H491 PolarHBondContact O-N 2.84Å; F488-H491 PolarHBondContact O-N 3.17Å; H491-Q495 VanDerWaalsContact O-CG 3.27Å; H491-Q495 WeakPolarHBondContact O-CG 3.4Å; H491-Q495 PolarHBondContact O-N 3.37Å
492	K	68.4	Low	66.8	Low	149 Å²	149	127.9 Å²	127.9	65%	0.648	62%	0.622	S	S	*	*	H	α-helix	trans	-77.1	-32.4	175.4	-152.8	173.9	-172.1	179.7	0	112.5	F488 S489 N490 N496	F488-K492 PolarHBondContact O-N 2.86Å; F488-K492 VanDerWaalsContact O-N 3.09Å; S489-K492 PolarHBondContact O-N 2.89Å; N490-K492 PolarHBondContact O-N 3.22Å; K492-N496 PolarHBondContact O-N 3.07Å; K492-N496 VanDerWaalsContact O-N 3.13Å
493	K	61.1	Low	64.2	Low	145 Å²	145	128 Å²	128	63%	0.63	63%	0.633	S	S	*	*	H	α-helix	trans	-66.6	-40.7	170.3	-87.5	-176.3	174.7	-179.4	0	111.8	S489 N490 Q495 N496 N497	S489-K493 PolarHBondContact O-N 2.95Å; S489-K493 VanDerWaalsContact O-N 3.17Å; N490-K493 WeakPolarHBondContact O-CB 3.49Å; N490-K493 PolarHBondContact O-N 3.41Å; K493-Q495 VanDerWaalsContact C-N 3.32Å; K493-Q495 PolarHBondContact O-N 2.74Å; K493-N496 PolarHBondContact O-N 2.95Å; K493-N497 PolarHBondContact O-N 3.15Å; K493-N497 VanDerWaalsContact O-N 3.12Å
494	D	62.7	Low	61.5	Low	101 Å²	101	130.3 Å²	130.3	54%	0.54	65%	0.649	S	S	.	*	H	α-helix	trans	-66.3	-35.9	178.6	-63.4	-25.3	0	0	0	112	N490	N490-D494 PolarHBondContact O-N 2.91Å
495	Q	56.1	Low	58.8	Low	125 Å²	125	130.6 Å²	130.6	58%	0.584	66%	0.657	S	S	*	*	H	α-helix	trans	-68	-39.6	173.9	-73.7	-95	-33.2	0	0	112.5	H491 K493 N497 L498 T499	H491-Q495 VanDerWaalsContact O-CG 3.27Å; H491-Q495 WeakPolarHBondContact O-CG 3.4Å; H491-Q495 PolarHBondContact O-N 3.37Å; K493-Q495 VanDerWaalsContact C-N 3.32Å; K493-Q495 PolarHBondContact O-N 2.74Å; Q495-N497 VanDerWaalsContact C-N 3.32Å; Q495-N497 PolarHBondContact O-N 3.31Å; Q495-L498 PolarHBondContact O-N 2.81Å; Q495-T499 PolarHBondContact O-OG1 2.69Å
496	N	57.9	Low	56.3	Low	107 Å²	107	134.2 Å²	134.2	57%	0.572	67%	0.671	S	S	*	*	H	α-helix	trans	-70.7	-27.6	179.3	-73	-2.5	0	0	0	112.9	K492 K493 L498	K492-N496 PolarHBondContact O-N 3.07Å; K492-N496 VanDerWaalsContact O-N 3.13Å; K493-N496 PolarHBondContact O-N 2.95Å; N496-L498 VanDerWaalsContact C-N 3.3Å; N496-L498 PolarHBondContact O-N 3.46Å
497	N	52.4	Low	53.6	Low	136 Å²	136	139.1 Å²	139.1	73%	0.727	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-10.6	175	-80.1	-4	0	0	0	113.8	K493 Q495	K493-N497 PolarHBondContact O-N 3.15Å; K493-N497 VanDerWaalsContact O-N 3.12Å; Q495-N497 VanDerWaalsContact C-N 3.32Å; Q495-N497 PolarHBondContact O-N 3.31Å
498	L	46.5	Very low	52	Low	142 Å²	142	137.5 Å²	137.5	74%	0.743	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-5.3	177.6	-116.3	87.7	0	0	0	114.2	Q495 N496	Q495-L498 PolarHBondContact O-N 2.81Å; N496-L498 VanDerWaalsContact C-N 3.3Å; N496-L498 PolarHBondContact O-N 3.46Å
499	T	41.7	Very low	49.8	Very low	107 Å²	107	138.3 Å²	138.3	66%	0.656	71%	0.705	S	S	*	*	S	Bend	trans	-98.1	-9	-174.4	-38.5	0	0	0	0	113.8	Q495 Q501	Q495-T499 PolarHBondContact O-OG1 2.69Å; T499-Q501 VanDerWaalsContact C-N 3.35Å; T499-Q501 PolarHBondContact O-N 3.25Å
500	D	42.1	Very low	47.5	Very low	159 Å²	159	143.3 Å²	143.3	85%	0.85	72%	0.72	S	S	*	*	S	Bend	trans	-94.3	22.7	-179.1	-84.4	-9.3	0	0	0	114
501	Q	37.7	Very low	45.4	Very low	166 Å²	166	150.3 Å²	150.3	78%	0.776	74%	0.74	S	S	*	*	S	Bend	trans	-132.6	42.1	-177.3	-141.7	168.3	23.7	0	0	114	T499	T499-Q501 VanDerWaalsContact C-N 3.35Å; T499-Q501 PolarHBondContact O-N 3.25Å
502	F	34	Very low	43.3	Very low	184 Å²	184	151.5 Å²	151.5	81%	0.807	75%	0.751	S	S	*	*			trans	-146.9	92.8	161.8	-72.1	-76.7	0	0	0	108.9
503	D	36.7	Very low	41.8	Very low	165 Å²	165	152 Å²	152	88%	0.882	76%	0.759	S	S	*	*			trans	175.3	65.2	146.9	-86.2	-18	0	0	0	108.5
504	N	35.8	Very low	40.3	Very low	152 Å²	152	151.6 Å²	151.6	81%	0.813	76%	0.763	S	S	*	*			trans	-123.1	111.5	159.4	-80	-50.2	0	0	0	106
505	D	32.8	Very low	38.9	Very low	148 Å²	148	152.5 Å²	152.5	79%	0.791	78%	0.778	S	S	*	*			trans	153	101.5	144.6	-77	-19.4	0	0	0	109
506	H	33.9	Very low	37.8	Very low	192 Å²	192	153.2 Å²	153.2	89%	0.889	78%	0.784	S	S	*	*				-174.1	106.6	129.6	-94.5	17.9	0	0	0	110.6
507	E	33.1	Very low	36.6	Very low	186 Å²	186	155.4 Å²	155.4	87%	0.869	79%	0.793	S	S	*	*			trans	-79.3	-179.1	168.1	-131.5	-149.2	171	0	0	110.6
508	P	50.7	Low	35.7	Very low	90 Å²	90	155.4 Å²	155.4	58%	0.584	79%	0.793	S	S	*	*				-108.4	144	-123.8	33.9	-16.2	0	0	0	114.1
509	N	33.2	Very low	35	Very low	166 Å²	166	155.7 Å²	155.7	89%	0.888	80%	0.795	S	S	*	*			trans	-96.9	96.9	164.6	-92.1	-37.1	0	0	0	110.4	R511	N509-R511 PolarHBondContact O-N 2.95Å
510	Q	30	Very low	34.7	Very low	179 Å²	179	159.6 Å²	159.6	84%	0.836	81%	0.806	S	S	*	*			trans	-64	120.5	159.4	-70.4	173.4	-13.5	0	0	109.4
511	R	33.4	Very low	34.4	Very low	236 Å²	236	158.6 Å²	158.6	89%	0.891	80%	0.799	S	S	*	*			trans	-136.1	111.2	152.2	-75.8	-167.6	-174.3	-175.9	2.8	109.4	N509 I513	N509-R511 PolarHBondContact O-N 2.95Å; R511-I513 PolarHBondContact O-N 2.86Å
512	N	28.2	Very low	34.3	Very low	147 Å²	147	158 Å²	158	79%	0.786	80%	0.801	S	S	*	*			trans	-43.9	126.2	160.1	-86.2	-16.6	0	0	0	111.1
513	I	36.9	Very low	34.5	Very low	160 Å²	160	156.6 Å²	156.6	82%	0.821	80%	0.797	S	S	*	*			trans	-139.1	105.4	137.9	-59.3	-175.8	0	0	0	106.3	R511 S515	R511-I513 PolarHBondContact O-N 2.86Å; I513-S515 PolarHBondContact O-N 3.02Å
514	D	30.2	Very low	34.6	Very low	135 Å²	135	155.6 Å²	155.6	72%	0.722	80%	0.797	S	S	*	*			trans	-58	126.4	162.6	-71.2	-50.3	0	0	0	109.6
515	S	34	Very low	34.7	Very low	120 Å²	120	156.8 Å²	156.8	84%	0.839	80%	0.795	S	S	*	*			trans	-158.1	81.1	149.8	-124.3	0	0	0	0	109	I513	I513-S515 PolarHBondContact O-N 3.02Å
516	I	32.5	Very low	34.9	Very low	141 Å²	141	155.2 Å²	155.2	72%	0.723	79%	0.79	S	S	*	*			trans	-68.2	125.8	158.1	-71.2	168	0	0	0	107.2
517	M	32.8	Very low	35.5	Very low	153 Å²	153	152.1 Å²	152.1	75%	0.754	79%	0.788	S	S	*	*			trans	173	106.2	130.2	-88.6	-57.2	173.7	0	0	110.4
518	D	33.6	Very low	35.9	Very low	136 Å²	136	153.3 Å²	153.3	73%	0.727	79%	0.786	S	S	*	*			trans	47.2	110.9	136	-61.8	-13.8	0	0	0	122
519	D	32.4	Very low	35.9	Very low	147 Å²	147	154.7 Å²	154.7	79%	0.786	79%	0.794	S	S	*	*				21.9	111.5	127	-75.9	-20.8	0	0	0	118.2
520	Q	35.1	Very low	36.4	Very low	190 Å²	190	152.4 Å²	152.4	89%	0.888	79%	0.791	S	S	*	*			trans	-155.4	115.2	131.1	-110.3	169.6	36.1	0	0	112.6	N522	Q520-N522 PolarHBondContact O-N 3.31Å
521	I	34.9	Very low	37.5	Very low	137 Å²	137	150 Å²	150	70%	0.703	79%	0.791	S	S	*	*			trans	-60.5	113.6	173.1	-64	161.4	0	0	0	109.4	Q523	I521-Q523 HydrophobicContact CG2-CG 3.9Å
522	N	36.9	Very low	38.4	Very low	155 Å²	155	151.8 Å²	151.8	83%	0.829	81%	0.81	S	S	*	*			trans	-112	101.5	161.2	-88.5	-31.4	0	0	0	109.7	Q520 T524	Q520-N522 PolarHBondContact O-N 3.31Å; N522-T524 PolarHBondContact O-N 3.15Å
523	Q	36.6	Very low	39	Very low	153 Å²	153	152 Å²	152	72%	0.715	81%	0.811	S	S	*	*			trans	-67.2	109.8	174	-65.6	174.8	16.4	0	0	110.2	I521 K525	I521-Q523 HydrophobicContact CG2-CG 3.9Å; Q523-K525 PolarHBondContact O-N 3.01Å
524	T	39.5	Very low	39.1	Very low	144 Å²	144	151.6 Å²	151.6	88%	0.883	81%	0.81	S	S	*	*			trans	-87.5	92.8	160.9	43.7	0	0	0	0	109.1	N522	N522-T524 PolarHBondContact O-N 3.15Å
525	K	37.8	Very low	39.6	Very low	177 Å²	177	152.5 Å²	152.5	77%	0.77	82%	0.815	S	S	*	*			trans	-118.2	105.3	166.2	-86.4	-175.8	177.9	177.9	0	109.3	Q523	Q523-K525 PolarHBondContact O-N 3.01Å
526	V	37.3	Very low	39.9	Very low	115 Å²	115	154.4 Å²	154.4	70%	0.697	81%	0.814	S	S	*	*			trans	-158	117.7	151.5	-114.4	0	0	0	0	110.1	Y528	V526-Y528 HydrophobicContact CG1-CD2 3.5Å; V526-Y528 VanDerWaalsContact CG1-CD2 3.5Å; V526-Y528 HydrophobicContact CG1-CE2 3.6Å
527	P	45.5	Very low	40.3	Very low	128 Å²	128	155.3 Å²	155.3	83%	0.831	82%	0.82	S	S	*	*				-131.1	110.6	129.5	19.5	-0.3	0	0	0	110.2
528	Y	41.5	Very low	40.8	Very low	211 Å²	211	155.4 Å²	155.4	83%	0.827	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-78.8	133.8	170.5	-89.8	-89	0	0	0	110.7	V526	V526-Y528 HydrophobicContact CG1-CD2 3.5Å; V526-Y528 VanDerWaalsContact CG1-CD2 3.5Å; V526-Y528 HydrophobicContact CG1-CE2 3.6Å
529	P	52	Low	41.4	Very low	118 Å²	118	156.8 Å²	156.8	77%	0.766	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-98.7	132.3	156.9	11.3	8.4	0	0	0	110.7
530	S	44.3	Very low	42.1	Very low	118 Å²	118	157.5 Å²	157.5	83%	0.825	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-65.1	149.5	-172.4	-63.2	0	0	0	0	115.2
531	P	51.9	Low	42.6	Very low	129 Å²	129	154.8 Å²	154.8	84%	0.838	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-85.1	134	174.2	4.3	15.1	0	0	0	112
532	Q	53.5	Low	43.3	Very low	273 Å²	273	156.5 Å²	156.5	100%	1.276	84%	0.842	S	S	*	*			trans	-120.3	0	150.2	-87.1	-173.5	-29	0	0	108.4

Retrieved 532 of 532 residues in 687.8 ms (Link to these results)

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