A0A3Q0KEZ6_SCHMA Loading...

GINS complex subunit 4

AlphaFold DB , UniProt , Accession A0A3Q0KEZ6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 163 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44	Very low	43.1	Very low	205 Å²	205	162 Å²	162	100%	1.01	75%	0.75	S	S	*	*				0	88.5	0	-159	-175.2	-118.8	0	0	106.8
2	I	40.1	Very low	44	Very low	147 Å²	147	158.7 Å²	158.7	75%	0.754	74%	0.74	S	S	*	*			trans	-101.9	115.5	-173.5	-62	175.4	0	0	0	107.4	Y4	I2-Y4 PolarHBondContact O-N 3.18Å
3	Y	39	Very low	44.5	Very low	183 Å²	183	151.4 Å²	151.4	72%	0.718	72%	0.724	S	S	*	*			trans	-77.2	110.3	-179.9	-69.1	-89.2	0	0	0	109.5	Y5	Y3-Y5 PolarHBondContact O-N 3.02Å
4	Y	40.5	Very low	44.7	Very low	213 Å²	213	148.4 Å²	148.4	84%	0.835	71%	0.713	S	S	*	*			trans	-74.9	106.9	168	-71.7	-84.5	0	0	0	108.4	I2 R6	I2-Y4 PolarHBondContact O-N 3.18Å; Y4-R6 PolarHBondContact O-N 2.92Å
5	Y	37.1	Very low	45.1	Very low	211 Å²	211	148.9 Å²	148.9	83%	0.827	71%	0.711	S	S	*	*			trans	-61.6	104.4	165.1	-82.9	-85.7	0	0	0	108	Y3 Y7	Y3-Y5 PolarHBondContact O-N 3.02Å; Y5-Y7 PolarHBondContact O-N 3.36Å
6	R	41.3	Very low	45.5	Very low	240 Å²	240	144.1 Å²	144.1	91%	0.906	70%	0.704	S	S	*	*			trans	-62.2	99.7	170.4	-167	177.7	-163.5	-174.6	4.3	106.8	Y4 S8	Y4-R6 PolarHBondContact O-N 2.92Å; R6-S8 PolarHBondContact O-N 3.1Å
7	Y	43.3	Very low	45.5	Very low	218 Å²	218	144 Å²	144	86%	0.855	71%	0.706	S	S	*	*			trans	-57.2	104.3	169.2	-84.2	-90.7	0	0	0	107.7	Y5 N9	Y5-Y7 PolarHBondContact O-N 3.36Å; Y7-N9 PolarHBondContact O-N 3.46Å; Y7-N9 VanDerWaalsContact O-N 3.1Å
8	S	47.6	Very low	45.6	Very low	114 Å²	114	144.8 Å²	144.8	80%	0.797	71%	0.707	S	S	*	*			trans	-56.4	115.2	169.4	-105.6	0	0	0	0	107.7	R6 P10	R6-S8 PolarHBondContact O-N 3.1Å; S8-P10 WeakPolarHBondContact O-CD 3.38Å
9	N	41	Very low	45.6	Very low	95 Å²	95	142.7 Å²	142.7	51%	0.508	71%	0.709	S	S	.	*			trans	-60.3	119.6	-178.8	-173.4	-22.5	0	0	0	109.3	Y7 S11 I12	Y7-N9 PolarHBondContact O-N 3.46Å; Y7-N9 VanDerWaalsContact O-N 3.1Å; N9-S11 PolarHBondContact O-N 2.91Å; N9-S11 WeakPolarHBondContact OD1-CB 3Å; N9-S11 PolarHBondContact OD1-N 3.49Å; N9-S11 VanDerWaalsContact OD1-N 3.13Å; N9-I12 HydrophobicContact CB-CD1 4.45Å; N9-I12 PolarHBondContact O-N 3.21Å
10	P	53.1	Low	45.3	Very low	95 Å²	95	142.4 Å²	142.4	62%	0.617	71%	0.71	S	S	*	*	H	α-helix	trans	-61.2	-17.2	-177.1	22.7	-32.3	0	0	0	113.4	S8 I12 A13 L14	S8-P10 WeakPolarHBondContact O-CD 3.38Å; P10-I12 VanDerWaalsContact C-N 3.28Å; P10-I12 PolarHBondContact O-N 2.84Å; P10-A13 PolarHBondContact O-N 3.45Å; P10-L14 PolarHBondContact O-N 3.42Å
11	S	47.4	Very low	45	Very low	61 Å²	61	143.3 Å²	143.3	43%	0.427	72%	0.717	S	S	.	*	H	α-helix	trans	-64.8	-29.5	173.7	-167.7	0	0	0	0	113	N9 K15	N9-S11 PolarHBondContact O-N 2.91Å; N9-S11 WeakPolarHBondContact OD1-CB 3Å; N9-S11 PolarHBondContact OD1-N 3.49Å; N9-S11 VanDerWaalsContact OD1-N 3.13Å; S11-K15 WeakPolarHBondContact O-CG 3.44Å; S11-K15 PolarHBondContact O-N 2.92Å
12	I	53.5	Low	44.7	Very low	122 Å²	122	140.3 Å²	140.3	63%	0.626	71%	0.705	S	S	*	*	H	α-helix	trans	-73.8	-37.6	176.7	-57.4	175.4	0	0	0	110.4	N9 P10 L14 K15 A16	N9-I12 HydrophobicContact CB-CD1 4.45Å; N9-I12 PolarHBondContact O-N 3.21Å; P10-I12 VanDerWaalsContact C-N 3.28Å; P10-I12 PolarHBondContact O-N 2.84Å; I12-L14 VanDerWaalsContact C-N 3.34Å; I12-L14 PolarHBondContact O-N 3.26Å; I12-K15 PolarHBondContact O-N 3.31Å; I12-A16 PolarHBondContact O-N 3.08Å
13	A	51.4	Low	44.5	Very low	64 Å²	64	140.2 Å²	140.2	53%	0.529	71%	0.706	S	S	.	*	H	α-helix	trans	-64.7	-38.8	177.1	0	0	0	0	0	112	P10 A16 L17	P10-A13 PolarHBondContact O-N 3.45Å; A13-A16 PolarHBondContact O-N 3.04Å; A13-L17 PolarHBondContact O-N 3.31Å
14	L	46.1	Very low	44.4	Very low	110 Å²	110	138.8 Å²	138.8	58%	0.576	71%	0.71	S	S	*	*	H	α-helix	trans	-68.3	-35.2	174.9	-90.3	156.4	0	0	0	112.9	P10 I12 A16	P10-L14 PolarHBondContact O-N 3.42Å; I12-L14 VanDerWaalsContact C-N 3.34Å; I12-L14 PolarHBondContact O-N 3.26Å; L14-A16 VanDerWaalsContact C-N 3.35Å
15	K	50.8	Low	44.2	Very low	156 Å²	156	131.9 Å²	131.9	68%	0.678	70%	0.703	S	S	*	*	H	α-helix	trans	-69.7	-30.8	174.6	-74.9	-178.4	-179.9	-176	0	113	S11 I12 L17	S11-K15 WeakPolarHBondContact O-CG 3.44Å; S11-K15 PolarHBondContact O-N 2.92Å; I12-K15 PolarHBondContact O-N 3.31Å; K15-L17 VanDerWaalsContact C-N 3.33Å; K15-L17 PolarHBondContact O-N 3.45Å
16	A	51.7	Low	44.3	Very low	72 Å²	72	127.6 Å²	127.6	60%	0.595	70%	0.699	S	S	*	*	H	α-helix	trans	-70	-28	178.8	0	0	0	0	0	113.3	I12 A13 L14	I12-A16 PolarHBondContact O-N 3.08Å; A13-A16 PolarHBondContact O-N 3.04Å; L14-A16 VanDerWaalsContact C-N 3.35Å
17	L	46.7	Very low	44.6	Very low	142 Å²	142	123.7 Å²	123.7	74%	0.743	70%	0.702	S	S	*	*	H	α-helix	trans	-80.4	-24.7	179.3	-72.2	172.4	0	0	0	113.6	A13 K15	A13-L17 PolarHBondContact O-N 3.31Å; K15-L17 VanDerWaalsContact C-N 3.33Å; K15-L17 PolarHBondContact O-N 3.45Å
18	H	46.1	Very low	44.6	Very low	158 Å²	158	115.6 Å²	115.6	73%	0.731	69%	0.685	S	S	*	*	H	α-helix	trans	-91.3	-7.2	-177.6	-74.5	170.2	0	0	0	115	N20	H18-N20 VanDerWaalsContact C-N 3.34Å; H18-N20 PolarHBondContact O-N 3.28Å
19	S	46.9	Very low	44.6	Very low	105 Å²	105	116.7 Å²	116.7	73%	0.734	69%	0.689	S	S	*	*	S	Bend	trans	-90.3	8.7	-175.5	-152.6	0	0	0	0	114.9
20	N	38.4	Very low	45.5	Very low	137 Å²	137	120.2 Å²	120.2	73%	0.733	71%	0.707	S	S	*	*			trans	-128.9	53.4	-177.2	-127.3	17.3	0	0	0	111.9	H18	H18-N20 VanDerWaalsContact C-N 3.34Å; H18-N20 PolarHBondContact O-N 3.28Å
21	N	38.3	Very low	46.2	Very low	161 Å²	161	119.9 Å²	119.9	86%	0.861	71%	0.713	S	S	*	*			trans	-120.7	87.6	159.9	-127.6	4.2	0	0	0	108.3	N23	N21-N23 PolarHBondContact O-N 2.96Å
22	N	38.1	Very low	46.5	Very low	142 Å²	142	121.1 Å²	121.1	76%	0.759	72%	0.719	S	S	*	*			trans	-61.3	121.3	169	-81.3	-41.5	0	0	0	109.4
23	N	35.6	Very low	46.9	Very low	146 Å²	146	120.7 Å²	120.7	78%	0.781	72%	0.718	S	S	*	*			trans	62	83.5	134.8	-161	27	0	0	0	117.8	N21	N21-N23 PolarHBondContact O-N 2.96Å
24	I	37.8	Very low	47.3	Very low	153 Å²	153	123.5 Å²	123.5	79%	0.785	72%	0.724	S	S	*	*			trans	-135.5	100.2	142.6	-58.8	173.5	0	0	0	107.6	T26	I24-T26 HydrophobicContact CG2-CG2 4.18Å; I24-T26 PolarHBondContact O-N 2.83Å
25	G	35.9	Very low	47.8	Very low	68 Å²	68	124.3 Å²	124.3	70%	0.701	73%	0.729	S	S	*	*			trans	-64.3	125.2	163	0	0	0	0	0	109.4
26	T	38.8	Very low	48.4	Very low	121 Å²	121	123.9 Å²	123.9	74%	0.742	73%	0.729	S	S	*	*			trans	-142.4	120.5	155.3	49.9	0	0	0	0	107.9	I24 G28	I24-T26 HydrophobicContact CG2-CG2 4.18Å; I24-T26 PolarHBondContact O-N 2.83Å; T26-G28 VanDerWaalsContact C-N 3.29Å; T26-G28 PolarHBondContact O-N 3.21Å
27	T	48.8	Very low	48.8	Very low	158 Å²	158	126.5 Å²	126.5	97%	0.969	73%	0.732	S	S	*	*			trans	-68.5	86.9	167.3	48.8	0	0	0	0	107.8
28	G	43.4	Very low	49	Very low	48 Å²	48	126 Å²	126	50%	0.495	73%	0.729	S	S	.	*			trans	-113.9	153.9	169.8	0	0	0	0	0	109.6	T26 L30	T26-G28 VanDerWaalsContact C-N 3.29Å; T26-G28 PolarHBondContact O-N 3.21Å; G28-L30 PolarHBondContact O-N 3.06Å
29	P	46.9	Very low	48.9	Very low	136 Å²	136	121.3 Å²	121.3	88%	0.883	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-54.7	126.4	180	22.1	-30.9	0	0	0	109.6	A31	P29-A31 PolarHBondContact O-N 3.06Å
30	L	60.8	Low	49	Very low	169 Å²	169	123 Å²	123	89%	0.885	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-52.8	135	175.5	-74.4	160	0	0	0	108.8	G28	G28-L30 PolarHBondContact O-N 3.06Å
31	A	67.2	Low	49.9	Very low	89 Å²	89	121.4 Å²	121.4	74%	0.736	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-53.4	138.8	173	0	0	0	0	0	109.3	P29 D33	P29-A31 PolarHBondContact O-N 3.06Å; A31-D33 PolarHBondContact O-N 3.35Å
32	P	53.2	Low	50.2	Low	87 Å²	87	120.1 Å²	120.1	57%	0.565	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-51.6	139.2	179.1	-25.3	33.5	0	0	0	111.2
33	D	61.7	Low	50.8	Low	113 Å²	113	122 Å²	122	60%	0.604	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-58.4	142.7	178.4	-161.4	-8.9	0	0	0	109.9	A31 D35 E36	A31-D33 PolarHBondContact O-N 3.35Å; D33-D35 PolarHBondContact O-N 3.35Å; D33-D35 VanDerWaalsContact O-N 3.1Å; D33-E36 WeakPolarHBondContact O-CB 3.49Å; D33-E36 PolarHBondContact O-N 2.88Å
34	L	59.6	Low	51.1	Low	123 Å²	123	123.1 Å²	123.1	64%	0.644	72%	0.721	S	S	*	*	H	α-helix	trans	-58.9	-27.4	-175.3	-87.9	160.2	0	0	0	112.2	E36 I37 I38	L34-E36 PolarHBondContact O-N 3.24Å; L34-I37 PolarHBondContact O-N 3.47Å; L34-I38 PolarHBondContact O-N 3.44Å
35	D	58	Low	51.1	Low	126 Å²	126	122.6 Å²	122.6	67%	0.674	72%	0.72	S	S	*	*	H	α-helix	trans	-67.5	-22	177	-65.6	-19.3	0	0	0	112.7	D33	D33-D35 PolarHBondContact O-N 3.35Å; D33-D35 VanDerWaalsContact O-N 3.1Å
36	E	62.7	Low	51.3	Low	148 Å²	148	126.9 Å²	126.9	69%	0.692	72%	0.721	S	S	*	*	H	α-helix	trans	-81.4	-25.4	176.2	-162.2	176	-167.4	0	0	112.3	D33 L34	D33-E36 WeakPolarHBondContact O-CB 3.49Å; D33-E36 PolarHBondContact O-N 2.88Å; L34-E36 PolarHBondContact O-N 3.24Å
37	I	59.5	Low	51.4	Low	127 Å²	127	127 Å²	127	65%	0.651	73%	0.728	S	S	*	*	H	α-helix	trans	-79.6	-30.8	176.2	-63.1	176.6	0	0	0	111.1	L34 G39	L34-I37 PolarHBondContact O-N 3.47Å; I37-G39 PolarHBondContact O-N 3.01Å
38	I	51.1	Low	51.2	Low	132 Å²	132	124.8 Å²	124.8	68%	0.677	71%	0.709	S	S	*	*	S	Bend	trans	-80.5	65.4	173.3	-52.8	173.7	0	0	0	107	L34 D40	L34-I38 PolarHBondContact O-N 3.44Å; I38-D40 PolarHBondContact O-N 3.19Å
39	G	43.5	Very low	51.6	Low	58 Å²	58	130.8 Å²	130.8	60%	0.598	73%	0.725	S	S	*	*			trans	-55.1	121.4	174.7	0	0	0	0	0	109.9	I37 S41	I37-G39 PolarHBondContact O-N 3.01Å; G39-S41 VanDerWaalsContact C-N 3.3Å; G39-S41 PolarHBondContact O-N 3.48Å
40	D	49.9	Very low	52	Low	140 Å²	140	130.3 Å²	130.3	75%	0.749	71%	0.711	S	S	*	*			trans	-56.7	87.4	167.2	-166.7	22.1	0	0	0	109.6	I38 D42	I38-D40 PolarHBondContact O-N 3.19Å; D40-D42 PolarHBondContact O-N 3.29Å
41	S	56	Low	52.4	Low	105 Å²	105	129.6 Å²	129.6	73%	0.734	71%	0.707	S	S	*	*			trans	-95.3	81.4	167.6	-172.4	0	0	0	0	108	G39 E43	G39-S41 VanDerWaalsContact C-N 3.3Å; G39-S41 PolarHBondContact O-N 3.48Å; S41-E43 VanDerWaalsContact C-N 3.35Å; S41-E43 PolarHBondContact O-N 3.06Å
42	D	46.2	Very low	53.1	Low	134 Å²	134	127.9 Å²	127.9	72%	0.717	69%	0.685	S	S	*	*			trans	-55.6	94.1	157.1	-86.4	-26.2	0	0	0	109.4	D40	D40-D42 PolarHBondContact O-N 3.29Å
43	E	49.8	Very low	55	Low	181 Å²	181	126.8 Å²	126.8	85%	0.846	68%	0.677	S	S	*	*			trans	-111.6	113.4	149	-75.6	-147.7	-177.1	0	0	109.3	S41	S41-E43 VanDerWaalsContact C-N 3.35Å; S41-E43 PolarHBondContact O-N 3.06Å
44	E	42.3	Very low	56.4	Low	169 Å²	169	124 Å²	124	79%	0.79	67%	0.666	S	S	*	*			trans	-62	144.5	179.3	-58.9	178.7	159.7	0	0	112.7
45	N	38.3	Very low	58	Low	143 Å²	143	121.5 Å²	121.5	77%	0.765	66%	0.663	S	S	*	*			trans	56.6	90.6	144.7	-69.5	-37.9	0	0	0	118
46	Q	38.9	Very low	59.8	Low	157 Å²	157	118.8 Å²	118.8	73%	0.734	65%	0.647	S	S	*	*			trans	-140.3	120.1	132.4	-116.5	144.9	90.6	0	0	108.1	D48	Q46-D48 PolarHBondContact O-N 3.49Å
47	S	41.1	Very low	61.4	Low	125 Å²	125	112.3 Å²	112.3	87%	0.874	62%	0.617	S	S	*	*			trans	-67	49.8	163.8	59.8	0	0	0	0	109.9	E49	S47-E49 PolarHBondContact O-N 3.38Å
48	D	45.9	Very low	63.2	Low	110 Å²	110	108.7 Å²	108.7	59%	0.588	60%	0.598	S	S	*	*			trans	-68.2	97.6	167.9	-72.2	-10.3	0	0	0	103.6	Q46 E50	Q46-D48 PolarHBondContact O-N 3.49Å; D48-E50 PolarHBondContact O-N 2.77Å
49	E	51.7	Low	65.4	Low	174 Å²	174	110.3 Å²	110.3	81%	0.813	60%	0.6	S	S	*	*			trans	-43.2	87.7	153.7	-168.7	172.3	-138.3	0	0	105.7	S47 L51	S47-E49 PolarHBondContact O-N 3.38Å; E49-L51 VanDerWaalsContact C-N 3.29Å; E49-L51 PolarHBondContact O-N 2.91Å
50	E	54.4	Low	67.9	Low	126 Å²	126	113 Å²	113	59%	0.589	59%	0.592	S	S	*	*			trans	-54.9	100.2	-170.7	-176.7	-171.1	-151.9	0	0	105.1	D48 L52 R60	D48-E50 PolarHBondContact O-N 2.77Å; E50-L52 PolarHBondContact O-N 3.48Å; E50-R60 IonicContact OE2-NH2 3.48Å; E50-R60 PolarHBondContact OE2-NH2 3.25Å
51	L	68.6	Low	70.2	Confident	154 Å²	154	106.5 Å²	106.5	81%	0.806	56%	0.558	S	S	*	*			trans	-61.3	97	-176.6	-81.6	167.8	0	0	0	105.2	E49 T53	E49-L51 VanDerWaalsContact C-N 3.29Å; E49-L51 PolarHBondContact O-N 2.91Å; L51-T53 PolarHBondContact O-N 2.95Å
52	L	82.6	Confident	72.2	Confident	54 Å²	54	106.7 Å²	106.7	28%	0.283	54%	0.543	S	S	.	.			trans	-58.1	108.2	-173	179.6	68.7	0	0	0	107.9	E50 E56 L57 R60 L84	E50-L52 PolarHBondContact O-N 3.48Å; L52-E56 HydrophobicContact CD1-CB 3.5Å; L52-E56 VanDerWaalsContact CD1-CB 3.5Å; L52-E56 HydrophobicContact CG-CB 4.48Å; L52-L57 HydrophobicContact CD2-CB 3.93Å; L52-L57 HydrophobicContact CD2-CD1 3.74Å; L52-L57 HydrophobicContact CD2-CG 4.39Å; L52-L57 HydrophobicContact CG-CB 4.03Å; L52-R60 VanDerWaalsContact CD1-CZ 3.5Å; L52-L84 HydrophobicContact CD2-CD1 4.49Å
53	T	92.7	Very high	74.6	Confident	64 Å²	64	106.8 Å²	106.8	39%	0.393	54%	0.537	S	S	.	.			trans	-68.6	156.9	-179.2	68.7	0	0	0	0	109.5	L51 A55 E56 L57	L51-T53 PolarHBondContact O-N 2.95Å; T53-A55 PolarHBondContact O-N 2.9Å; T53-A55 VanDerWaalsContact O-N 3.11Å; T53-E56 VanDerWaalsContact CB-OE2 3.27Å; T53-E56 WeakPolarHBondContact CB-OE2 3.38Å; T53-E56 VanDerWaalsContact CG2-OE2 3.27Å; T53-E56 WeakPolarHBondContact CG2-OE2 3.49Å; T53-E56 PolarHBondContact N-OE2 3.1Å; T53-E56 PolarHBondContact O-N 3.45Å; T53-E56 VanDerWaalsContact O-N 3.13Å; T53-E56 PolarHBondContact OG1-N 3.17Å; T53-E56 PolarHBondContact OG1-OE1 3.46Å; T53-E56 PolarHBondContact OG1-OE2 3.39Å; T53-L57 WeakPolarHBondContact O-CB 3.36Å; T53-L57 PolarHBondContact O-N 3.2Å
54	S	91.6	Very high	76.9	Confident	53 Å²	53	99.5 Å²	99.5	37%	0.371	50%	0.504	S	S	.	.	H	α-helix	trans	-53.7	-33.6	173.8	-58.4	0	0	0	0	112.3	L58 E88	S54-L58 VanDerWaalsContact O-CG 3.27Å; S54-L58 WeakPolarHBondContact O-CG 3.3Å; S54-L58 PolarHBondContact O-N 3.38Å; S54-L58 VanDerWaalsContact O-N 3.08Å; S54-E88 WeakPolarHBondContact CB-OE1 3.48Å; S54-E88 VanDerWaalsContact CB-OE2 3.31Å; S54-E88 WeakPolarHBondContact CB-OE2 3.24Å; S54-E88 PolarHBondContact OG-OE1 3.39Å; S54-E88 PolarHBondContact OG-OE2 2.95Å
55	A	93.8	Very high	79.6	Confident	71 Å²	71	92.8 Å²	92.8	59%	0.587	47%	0.471	S	S	*	.	H	α-helix	trans	-69.9	-45.9	178.1	0	0	0	0	0	112.5	T53 K59	T53-A55 PolarHBondContact O-N 2.9Å; T53-A55 VanDerWaalsContact O-N 3.11Å; A55-K59 WeakPolarHBondContact O-CB 3.32Å; A55-K59 PolarHBondContact O-N 3.44Å
56	E	95.9	Very high	82.4	Confident	70 Å²	70	89.4 Å²	89.4	33%	0.327	45%	0.451	S	S	.	.	H	α-helix	trans	-65.5	-39.9	174.3	-78.4	118.9	-152.2	0	0	111.8	L52 T53 L58 K59 R60	L52-E56 HydrophobicContact CD1-CB 3.5Å; L52-E56 VanDerWaalsContact CD1-CB 3.5Å; L52-E56 HydrophobicContact CG-CB 4.48Å; T53-E56 VanDerWaalsContact CB-OE2 3.27Å; T53-E56 WeakPolarHBondContact CB-OE2 3.38Å; T53-E56 VanDerWaalsContact CG2-OE2 3.27Å; T53-E56 WeakPolarHBondContact CG2-OE2 3.49Å; T53-E56 PolarHBondContact N-OE2 3.1Å; T53-E56 PolarHBondContact O-N 3.45Å; T53-E56 VanDerWaalsContact O-N 3.13Å; T53-E56 PolarHBondContact OG1-N 3.17Å; T53-E56 PolarHBondContact OG1-OE1 3.46Å; T53-E56 PolarHBondContact OG1-OE2 3.39Å; E56-L58 PolarHBondContact O-N 2.96Å; E56-K59 WeakPolarHBondContact O-CB 3.11Å; E56-K59 PolarHBondContact O-N 2.88Å; E56-R60 WeakPolarHBondContact O-CB 3.37Å; E56-R60 WeakPolarHBondContact O-CG 3.09Å; E56-R60 PolarHBondContact O-N 2.87Å
57	L	96.2	Very high	85.3	Confident	11 Å²	11	85.7 Å²	85.7	6%	0.058	44%	0.436	C	S	.	.	H	α-helix	trans	-55.1	-51.8	176.4	174.8	60.3	0	0	0	110.8	L52 T53 K59 R60 F61 L81 L84 I85 E88	L52-L57 HydrophobicContact CD2-CB 3.93Å; L52-L57 HydrophobicContact CD2-CD1 3.74Å; L52-L57 HydrophobicContact CD2-CG 4.39Å; L52-L57 HydrophobicContact CG-CB 4.03Å; T53-L57 WeakPolarHBondContact O-CB 3.36Å; T53-L57 PolarHBondContact O-N 3.2Å; L57-K59 PolarHBondContact O-N 2.95Å; L57-R60 PolarHBondContact O-N 3.38Å; L57-F61 WeakPolarHBondContact O-CB 3.33Å; L57-F61 PolarHBondContact O-N 3.01Å; L57-L81 HydrophobicContact CD1-CD1 3.42Å; L57-L81 VanDerWaalsContact CD1-CD1 3.42Å; L57-L81 HydrophobicContact CD1-CG 4.26Å; L57-L84 HydrophobicContact CD1-CB 3.81Å; L57-L84 HydrophobicContact CD1-CD1 4.27Å; L57-L84 HydrophobicContact CD2-CB 3.96Å; L57-I85 HydrophobicContact CD1-CD1 3.91Å; L57-I85 HydrophobicContact CD1-CG1 4.06Å; L57-I85 HydrophobicContact CD2-CD1 4.23Å; L57-I85 HydrophobicContact CG-CD1 3.6Å; L57-I85 HydrophobicContact CG-CG1 4.23Å; L57-E88 HydrophobicContact CD2-CB 4.18Å
58	L	96.7	Very high	88	Confident	51 Å²	51	79.8 Å²	79.8	27%	0.267	39%	0.394	S	S	.	.	H	α-helix	trans	-63.9	-38.3	177.5	-69.7	173.5	0	0	0	112.5	S54 E56 F61 Y62 I85 I116	S54-L58 VanDerWaalsContact O-CG 3.27Å; S54-L58 WeakPolarHBondContact O-CG 3.3Å; S54-L58 PolarHBondContact O-N 3.38Å; S54-L58 VanDerWaalsContact O-N 3.08Å; E56-L58 PolarHBondContact O-N 2.96Å; L58-F61 PolarHBondContact O-N 3.41Å; L58-Y62 WeakPolarHBondContact O-CB 3.17Å; L58-Y62 PolarHBondContact O-N 3.4Å; L58-I85 HydrophobicContact CD2-CD1 3.87Å; L58-I116 HydrophobicContact CD1-CD1 4.15Å; L58-I116 HydrophobicContact CD2-CD1 3.62Å; L58-I116 HydrophobicContact CD2-CG1 3.84Å; L58-I116 HydrophobicContact CD2-CG2 4.1Å
59	K	96.8	Very high	90.5	Very high	166 Å²	166	79.8 Å²	79.8	72%	0.722	39%	0.389	S	S	*	.	H	α-helix	trans	-63.7	-44.2	176.2	-174.3	-178.5	179	-176	0	111.6	A55 E56 L57 Y62 K63	A55-K59 WeakPolarHBondContact O-CB 3.32Å; A55-K59 PolarHBondContact O-N 3.44Å; E56-K59 WeakPolarHBondContact O-CB 3.11Å; E56-K59 PolarHBondContact O-N 2.88Å; L57-K59 PolarHBondContact O-N 2.95Å; K59-Y62 PolarHBondContact O-N 3.02Å; K59-K63 PolarHBondContact O-N 3.29Å; K59-K63 VanDerWaalsContact O-N 3.15Å
60	R	96.6	Very high	92.7	Very high	114 Å²	114	78.4 Å²	78.4	43%	0.43	39%	0.387	S	S	.	.	H	α-helix	trans	-63.2	-45.2	176.2	-70.9	-178.8	-171.1	-165	5.4	110.6	E50 L52 E56 L57 Y62 K63 I64	E50-R60 IonicContact OE2-NH2 3.48Å; E50-R60 PolarHBondContact OE2-NH2 3.25Å; L52-R60 VanDerWaalsContact CD1-CZ 3.5Å; E56-R60 WeakPolarHBondContact O-CB 3.37Å; E56-R60 WeakPolarHBondContact O-CG 3.09Å; E56-R60 PolarHBondContact O-N 2.87Å; L57-R60 PolarHBondContact O-N 3.38Å; R60-Y62 PolarHBondContact O-N 2.92Å; R60-K63 PolarHBondContact O-N 3.44Å; R60-I64 PolarHBondContact O-N 3.16Å
61	F	97.9	Very high	94.7	Very high	5 Å²	5	73.4 Å²	73.4	2%	0.022	37%	0.367	C	S	.	.	H	α-helix	trans	-63.6	-42.2	178.6	-177.7	-121.2	0	0	0	113	L57 L58 K63 I64 W65 L81 L82 I85 I119 M120 Y123	L57-F61 WeakPolarHBondContact O-CB 3.33Å; L57-F61 PolarHBondContact O-N 3.01Å; L58-F61 PolarHBondContact O-N 3.41Å; F61-K63 VanDerWaalsContact C-N 3.32Å; F61-K63 PolarHBondContact O-N 3.05Å; F61-I64 PolarHBondContact O-N 3.17Å; F61-W65 PolarHBondContact O-N 3.39Å; F61-L81 HydrophobicContact CB-CD2 4.25Å; F61-L81 HydrophobicContact CD2-CD2 4.21Å; F61-L82 HydrophobicContact CE2-CD1 4.04Å; F61-L82 HydrophobicContact CZ-CD1 4.23Å; F61-I85 HydrophobicContact CB-CD1 3.39Å; F61-I85 HydrophobicContact CB-CG1 3.75Å; F61-I85 HydrophobicContact CD1-CD1 3.86Å; F61-I85 HydrophobicContact CD1-CG1 4.02Å; F61-I85 HydrophobicContact CD1-CG2 3.94Å; F61-I85 HydrophobicContact CD2-CG1 4.03Å; F61-I85 HydrophobicContact CE1-CG2 4.03Å; F61-I85 HydrophobicContact CG-CD1 3.68Å; F61-I85 HydrophobicContact CG-CG1 3.65Å; F61-I85 HydrophobicContact CG-CG2 4.4Å; F61-I119 HydrophobicContact CD1-CG2 4.14Å; F61-I119 HydrophobicContact CE1-CB 4.1Å; F61-I119 HydrophobicContact CE1-CG2 3.48Å; F61-I119 VanDerWaalsContact CE1-CG2 3.48Å; F61-I119 HydrophobicContact CZ-CG2 4Å; F61-M120 HydrophobicContact CE1-CG 3.67Å; F61-M120 HydrophobicContact CZ-CB 4.28Å; F61-M120 HydrophobicContact CZ-CG 3.72Å; F61-Y123 HydrophobicContact CE2-CD1 4.33Å; F61-Y123 HydrophobicContact CE2-CG 4.44Å
62	Y	97.8	Very high	96	Very high	109 Å²	109	71.4 Å²	71.4	43%	0.427	36%	0.363	S	S	.	.	H	α-helix	trans	-59.2	-43.7	175.1	-173.9	-103.1	0	0	0	112	L58 K59 R60 W65 Q66 I119	L58-Y62 WeakPolarHBondContact O-CB 3.17Å; L58-Y62 PolarHBondContact O-N 3.4Å; K59-Y62 PolarHBondContact O-N 3.02Å; R60-Y62 PolarHBondContact O-N 2.92Å; Y62-W65 AromaticContact CD2-CE3 3.81Å; Y62-W65 HydrophobicContact CD2-CE3 3.81Å; Y62-W65 AromaticContact CD2-CZ3 3.95Å; Y62-W65 HydrophobicContact CD2-CZ3 3.95Å; Y62-W65 AromaticContact CE2-CE3 3.73Å; Y62-W65 HydrophobicContact CE2-CE3 3.73Å; Y62-W65 AromaticContact CE2-CZ3 3.37Å; Y62-W65 HydrophobicContact CE2-CZ3 3.37Å; Y62-W65 AromaticContact CZ-CZ3 3.98Å; Y62-W65 PolarHBondContact O-N 3.02Å; Y62-Q66 HydrophobicContact CD1-CG 4.27Å; Y62-Q66 HydrophobicContact CE1-CG 3.96Å; Y62-Q66 WeakPolarHBondContact O-CG 3.46Å; Y62-Q66 PolarHBondContact O-N 3.13Å; Y62-Q66 PolarHBondContact OH-NE2 2.7Å; Y62-I119 HydrophobicContact CD2-CD1 4.21Å
63	K	97.9	Very high	96.6	Very high	136 Å²	136	72.9 Å²	72.9	59%	0.591	37%	0.374	S	S	*	.	H	α-helix	trans	-61.7	-44.7	176.7	-174.1	178	-179.4	-179.1	0	111.8	K59 R60 F61 Q66 N67	K59-K63 PolarHBondContact O-N 3.29Å; K59-K63 VanDerWaalsContact O-N 3.15Å; R60-K63 PolarHBondContact O-N 3.44Å; F61-K63 VanDerWaalsContact C-N 3.32Å; F61-K63 PolarHBondContact O-N 3.05Å; K63-Q66 PolarHBondContact O-N 3.28Å; K63-N67 WeakPolarHBondContact O-CB 3.31Å; K63-N67 PolarHBondContact O-N 2.66Å; K63-N67 PolarHBondContact O-OD1 3.17Å
64	I	97.3	Very high	96.9	Very high	28 Å²	28	70.2 Å²	70.2	14%	0.144	36%	0.357	C	S	.	.	H	α-helix	trans	-62.7	-44.4	177.7	-77.4	160.2	0	0	0	111.3	R60 F61 Q66 N67 E68 H78 L81 Y123	R60-I64 PolarHBondContact O-N 3.16Å; F61-I64 PolarHBondContact O-N 3.17Å; I64-Q66 PolarHBondContact O-N 3.1Å; I64-N67 PolarHBondContact O-N 3.06Å; I64-E68 WeakPolarHBondContact O-CB 3.4Å; I64-E68 PolarHBondContact O-N 2.71Å; I64-H78 HydrophobicContact CD1-CB 4.35Å; I64-H78 HydrophobicContact CG2-CB 4.48Å; I64-H78 VanDerWaalsContact CG2-CD2 3.46Å; I64-H78 WeakPolarHBondContact CG2-CD2 3.33Å; I64-L81 HydrophobicContact CD1-CD2 3.2Å; I64-L81 HydrophobicContact CG1-CD2 4.49Å; I64-Y123 HydrophobicContact CG2-CD2 4.4Å; I64-Y123 HydrophobicContact CG2-CE2 3.6Å
65	W	98.4	Very high	97.1	Very high	27 Å²	27	70 Å²	70	10%	0.102	35%	0.352	C	S	.	.	H	α-helix	trans	-60.3	-45.8	175.5	167.3	68.1	0	0	0	112.4	F61 Y62 E68 K69 I119 D122 Y123	F61-W65 PolarHBondContact O-N 3.39Å; Y62-W65 AromaticContact CD2-CE3 3.81Å; Y62-W65 HydrophobicContact CD2-CE3 3.81Å; Y62-W65 AromaticContact CD2-CZ3 3.95Å; Y62-W65 HydrophobicContact CD2-CZ3 3.95Å; Y62-W65 AromaticContact CE2-CE3 3.73Å; Y62-W65 HydrophobicContact CE2-CE3 3.73Å; Y62-W65 AromaticContact CE2-CZ3 3.37Å; Y62-W65 HydrophobicContact CE2-CZ3 3.37Å; Y62-W65 AromaticContact CZ-CZ3 3.98Å; Y62-W65 PolarHBondContact O-N 3.02Å; W65-E68 PolarHBondContact O-N 2.72Å; W65-K69 HydrophobicContact CZ2-CD 4.12Å; W65-K69 VanDerWaalsContact O-CB 3.27Å; W65-K69 WeakPolarHBondContact O-CB 3.37Å; W65-K69 PolarHBondContact O-N 3.49Å; W65-I119 HydrophobicContact CB-CG2 3.79Å; W65-I119 HydrophobicContact CD2-CG2 3.71Å; W65-I119 HydrophobicContact CE3-CG2 4.13Å; W65-I119 HydrophobicContact CG-CG2 3.56Å; W65-D122 PolarHBondContact NE1-OD2 3.49Å; W65-Y123 HydrophobicContact CB-CD2 4.49Å
66	Q	98.4	Very high	97.3	Very high	73 Å²	73	68.8 Å²	68.8	34%	0.341	34%	0.337	S	S	.	.	H	α-helix	trans	-62	-45.3	177.1	-72.8	-177.7	-52.8	0	0	112	Y62 K63 I64 K69 L70	Y62-Q66 HydrophobicContact CD1-CG 4.27Å; Y62-Q66 HydrophobicContact CE1-CG 3.96Å; Y62-Q66 WeakPolarHBondContact O-CG 3.46Å; Y62-Q66 PolarHBondContact O-N 3.13Å; Y62-Q66 PolarHBondContact OH-NE2 2.7Å; K63-Q66 PolarHBondContact O-N 3.28Å; I64-Q66 PolarHBondContact O-N 3.1Å; Q66-K69 PolarHBondContact O-N 3.48Å; Q66-L70 WeakPolarHBondContact O-CB 3.44Å; Q66-L70 VanDerWaalsContact O-CG 3.32Å; Q66-L70 WeakPolarHBondContact O-CG 3.38Å; Q66-L70 PolarHBondContact O-N 2.89Å
67	N	98.5	Very high	97.2	Very high	78 Å²	78	66.1 Å²	66.1	42%	0.417	33%	0.327	S	S	.	.	H	α-helix	trans	-60.3	-48.3	178	-72.7	-6.8	0	0	0	110.9	K63 I64 K69 L70 A71 L75	K63-N67 WeakPolarHBondContact O-CB 3.31Å; K63-N67 PolarHBondContact O-N 2.66Å; K63-N67 PolarHBondContact O-OD1 3.17Å; I64-N67 PolarHBondContact O-N 3.06Å; N67-K69 VanDerWaalsContact C-N 3.31Å; N67-K69 PolarHBondContact O-N 3.01Å; N67-L70 PolarHBondContact O-N 2.71Å; N67-A71 WeakPolarHBondContact O-CB 3.2Å; N67-A71 PolarHBondContact O-N 3.28Å; N67-L75 HydrophobicContact CB-CD1 3.81Å
68	E	98.1	Very high	97.1	Very high	1 Å²	1	68.9 Å²	68.9	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-61.2	-41.5	177.8	-170.9	68.1	-114.5	0	0	111.3	I64 W65 L70 Y123 I126 R127 K130	I64-E68 WeakPolarHBondContact O-CB 3.4Å; I64-E68 PolarHBondContact O-N 2.71Å; W65-E68 PolarHBondContact O-N 2.72Å; E68-L70 VanDerWaalsContact C-N 3.32Å; E68-L70 PolarHBondContact O-N 3.29Å; E68-Y123 HydrophobicContact CB-CD2 3.89Å; E68-Y123 HydrophobicContact CB-CE2 3.71Å; E68-Y123 HydrophobicContact CG-CD2 3.95Å; E68-Y123 HydrophobicContact CG-CE2 3.75Å; E68-I126 HydrophobicContact CG-CG2 3.94Å; E68-R127 HydrophobicContact CG-CG 3.67Å; E68-R127 IonicContact OE2-CZ 3.93Å; E68-R127 IonicContact OE2-NH1 3.55Å; E68-R127 PolarHBondContact OE2-NH1 2.71Å; E68-K130 VanDerWaalsContact O-CE 3.32Å; E68-K130 WeakPolarHBondContact O-CE 3.46Å; E68-K130 PolarHBondContact O-NZ 2.8Å; E68-K130 WeakPolarHBondContact OE1-CD 3.48Å; E68-K130 WeakPolarHBondContact OE1-CE 3.36Å; E68-K130 IonicContact OE1-NZ 2.78Å; E68-K130 PolarHBondContact OE1-NZ 2.87Å
69	K	97.8	Very high	96.9	Very high	110 Å²	110	69.2 Å²	69.2	48%	0.478	35%	0.346	S	S	.	.	H	α-helix	trans	-63.9	-34.7	178.4	-172.4	167.1	-177.1	159.8	0	113.6	W65 Q66 N67 D122 I126	W65-K69 HydrophobicContact CZ2-CD 4.12Å; W65-K69 VanDerWaalsContact O-CB 3.27Å; W65-K69 WeakPolarHBondContact O-CB 3.37Å; W65-K69 PolarHBondContact O-N 3.49Å; Q66-K69 PolarHBondContact O-N 3.48Å; N67-K69 VanDerWaalsContact C-N 3.31Å; N67-K69 PolarHBondContact O-N 3.01Å; K69-D122 IonicContact NZ-OD2 4Å; K69-I126 HydrophobicContact CB-CD1 3.81Å; K69-I126 HydrophobicContact CD-CD1 4.14Å; K69-I126 HydrophobicContact CG-CD1 3.86Å
70	L	98.2	Very high	96.7	Very high	146 Å²	146	67.5 Å²	67.5	76%	0.764	35%	0.345	S	S	*	.	H	α-helix	trans	-96.7	-23	-174.5	-64.3	175.1	0	0	0	113.4	Q66 N67 E68	Q66-L70 WeakPolarHBondContact O-CB 3.44Å; Q66-L70 VanDerWaalsContact O-CG 3.32Å; Q66-L70 WeakPolarHBondContact O-CG 3.38Å; Q66-L70 PolarHBondContact O-N 2.89Å; N67-L70 PolarHBondContact O-N 2.71Å; E68-L70 VanDerWaalsContact C-N 3.32Å; E68-L70 PolarHBondContact O-N 3.29Å
71	A	97.6	Very high	96.6	Very high	20 Å²	20	63.2 Å²	63.2	17%	0.165	33%	0.33	C	S	.	.			trans	-70.1	132.8	179.1	0	0	0	0	0	111	N67 V73 L75 K130	N67-A71 WeakPolarHBondContact O-CB 3.2Å; N67-A71 PolarHBondContact O-N 3.28Å; A71-V73 PolarHBondContact O-N 3.33Å; A71-L75 HydrophobicContact CB-CD1 3.96Å; A71-L75 HydrophobicContact CB-CD2 3.91Å; A71-L75 HydrophobicContact CB-CG 3.94Å; A71-K130 VanDerWaalsContact O-CE 3.24Å; A71-K130 WeakPolarHBondContact O-CE 3.5Å; A71-K130 PolarHBondContact O-NZ 2.91Å
72	P	95.7	Very high	96.4	Very high	113 Å²	113	64.4 Å²	64.4	73%	0.734	34%	0.337	S	S	*	.	S	Bend	trans	-72.5	-19.3	175.6	29.9	-34.8	0	0	0	112.8
73	V	95.5	Very high	96.4	Very high	84 Å²	84	61.3 Å²	61.3	51%	0.509	34%	0.338	S	S	.	.	S	Bend	trans	-108.8	158.1	179.6	-63.4	0	0	0	0	110.6	A71 L75 K130	A71-V73 PolarHBondContact O-N 3.33Å; V73-L75 HydrophobicContact CG2-CD2 4.37Å; V73-K130 PolarHBondContact O-NZ 3.31Å
74	L	97.7	Very high	96.3	Very high	8 Å²	8	59.2 Å²	59.2	4%	0.042	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-69.7	132.6	172.8	-173.6	71.7	0	0	0	109	R127 K130 I131 I138 H152 L153	L74-R127 HydrophobicContact CD1-CB 4.12Å; L74-R127 HydrophobicContact CD1-CG 4.1Å; L74-K130 HydrophobicContact CB-CD 4.45Å; L74-K130 HydrophobicContact CD1-CB 4.11Å; L74-K130 HydrophobicContact CD1-CD 4.17Å; L74-I131 HydrophobicContact CD1-CG1 4.22Å; L74-I131 HydrophobicContact CD2-CD1 4.33Å; L74-I131 HydrophobicContact CD2-CG1 3.76Å; L74-I138 HydrophobicContact CB-CD1 4.15Å; L74-I138 HydrophobicContact CD2-CD1 4.08Å; L74-I138 HydrophobicContact CD2-CG2 3.92Å; L74-H152 HydrophobicContact CD2-CB 4.39Å; L74-H152 PolarHBondContact O-ND1 2.92Å; L74-L153 HydrophobicContact CD2-CD2 3.59Å; L74-L153 HydrophobicContact CD2-CG 4.31Å
75	L	97.2	Very high	96.3	Very high	50 Å²	50	57.9 Å²	57.9	26%	0.262	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-95.4	170.9	177.2	-56.3	-179.3	0	0	0	111.2	N67 A71 V73 A77 R127	N67-L75 HydrophobicContact CB-CD1 3.81Å; A71-L75 HydrophobicContact CB-CD1 3.96Å; A71-L75 HydrophobicContact CB-CD2 3.91Å; A71-L75 HydrophobicContact CB-CG 3.94Å; V73-L75 HydrophobicContact CG2-CD2 4.37Å; L75-A77 PolarHBondContact O-N 2.92Å; L75-R127 PolarHBondContact O-NH1 3.41Å
76	T	96.3	Very high	96.3	Very high	44 Å²	44	60.4 Å²	60.4	27%	0.27	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-46.3	136.4	173.1	-50.4	0	0	0	0	112.2	H78 S150 P151	T76-H78 PolarHBondContact O-CD2 2.8Å; T76-S150 VanDerWaalsContact CG2-CB 3.4Å; T76-P151 WeakPolarHBondContact CG2-O 3.35Å
77	A	94.1	Very high	96.3	Very high	15 Å²	15	59.5 Å²	59.5	12%	0.124	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-70.8	135.6	175.1	0	0	0	0	0	110.1	L75 P151 T154	L75-A77 PolarHBondContact O-N 2.92Å; A77-P151 PolarHBondContact N-O 2.97Å; A77-T154 HydrophobicContact CB-CG2 3.82Å
78	H	93.9	Very high	96.2	Very high	69 Å²	69	56.8 Å²	56.8	32%	0.319	33%	0.329	S	S	.	.			trans	-114.6	54.7	178	-65.3	-77.8	0	0	0	111	I64 T76 D80 L81 L82	I64-H78 HydrophobicContact CD1-CB 4.35Å; I64-H78 HydrophobicContact CG2-CB 4.48Å; I64-H78 VanDerWaalsContact CG2-CD2 3.46Å; I64-H78 WeakPolarHBondContact CG2-CD2 3.33Å; T76-H78 PolarHBondContact O-CD2 2.8Å; H78-D80 VanDerWaalsContact C-N 3.34Å; H78-D80 PolarHBondContact O-N 2.89Å; H78-L81 HydrophobicContact CB-CB 4.15Å; H78-L81 HydrophobicContact CB-CD2 4.49Å; H78-L81 PolarHBondContact O-N 2.91Å; H78-L82 WeakPolarHBondContact O-CB 3.39Å; H78-L82 PolarHBondContact O-N 2.72Å
79	S	92.4	Very high	96.1	Very high	58 Å²	58	56.8 Å²	56.8	41%	0.406	33%	0.329	S	S	.	.	H	α-helix	trans	-55.9	-45.5	-177.1	49.9	0	0	0	0	112.9	L81 L82 G83	S79-L81 PolarHBondContact O-N 3.02Å; S79-L82 WeakPolarHBondContact O-CB 3.47Å; S79-L82 PolarHBondContact O-N 3.37Å; S79-L82 VanDerWaalsContact O-N 3.17Å; S79-G83 PolarHBondContact O-N 3.26Å
80	D	93	Very high	96.2	Very high	130 Å²	130	55.7 Å²	55.7	70%	0.695	33%	0.328	S	S	*	.	H	α-helix	trans	-66.5	-44.2	-174.9	-56.1	-16.5	0	0	0	110.4	H78 L82 G83 L84	H78-D80 VanDerWaalsContact C-N 3.34Å; H78-D80 PolarHBondContact O-N 2.89Å; D80-L82 VanDerWaalsContact C-N 3.29Å; D80-L82 PolarHBondContact O-N 3.43Å; D80-G83 PolarHBondContact O-N 3.43Å; D80-L84 WeakPolarHBondContact O-CG 3.43Å; D80-L84 PolarHBondContact O-N 3.36Å
81	L	94.2	Very high	96.1	Very high	23 Å²	23	53.6 Å²	53.6	12%	0.12	32%	0.315	C	S	.	.	H	α-helix	trans	-60.7	-40.3	174.5	-170	77.7	0	0	0	111.5	L57 F61 I64 H78 S79 G83 L84 I85	L57-L81 HydrophobicContact CD1-CD1 3.42Å; L57-L81 VanDerWaalsContact CD1-CD1 3.42Å; L57-L81 HydrophobicContact CD1-CG 4.26Å; F61-L81 HydrophobicContact CB-CD2 4.25Å; F61-L81 HydrophobicContact CD2-CD2 4.21Å; I64-L81 HydrophobicContact CD1-CD2 3.2Å; I64-L81 HydrophobicContact CG1-CD2 4.49Å; H78-L81 HydrophobicContact CB-CB 4.15Å; H78-L81 HydrophobicContact CB-CD2 4.49Å; H78-L81 PolarHBondContact O-N 2.91Å; S79-L81 PolarHBondContact O-N 3.02Å; L81-G83 VanDerWaalsContact C-N 3.31Å; L81-G83 PolarHBondContact O-N 3.35Å; L81-L84 PolarHBondContact O-N 3.4Å; L81-I85 HydrophobicContact CG-CG1 4.48Å; L81-I85 WeakPolarHBondContact O-CG1 3.47Å; L81-I85 PolarHBondContact O-N 2.91Å
82	L	95	Very high	96	Very high	30 Å²	30	53.2 Å²	53.2	16%	0.157	31%	0.31	C	S	.	.	H	α-helix	trans	-65.5	-36.9	178.5	-168.8	60.8	0	0	0	111.7	F61 H78 S79 D80 I85 Q86 M120 M124	F61-L82 HydrophobicContact CE2-CD1 4.04Å; F61-L82 HydrophobicContact CZ-CD1 4.23Å; H78-L82 WeakPolarHBondContact O-CB 3.39Å; H78-L82 PolarHBondContact O-N 2.72Å; S79-L82 WeakPolarHBondContact O-CB 3.47Å; S79-L82 PolarHBondContact O-N 3.37Å; S79-L82 VanDerWaalsContact O-N 3.17Å; D80-L82 VanDerWaalsContact C-N 3.29Å; D80-L82 PolarHBondContact O-N 3.43Å; L82-I85 PolarHBondContact O-N 2.96Å; L82-Q86 WeakPolarHBondContact O-CB 3.45Å; L82-Q86 PolarHBondContact O-N 3.48Å; L82-M120 HydrophobicContact CD1-CB 4.45Å; L82-M120 HydrophobicContact CD1-CE 3.97Å; L82-M120 HydrophobicContact CD1-CG 4.24Å; L82-M124 HydrophobicContact CD1-CE 4.24Å; L82-M124 HydrophobicContact CD2-CE 3.35Å; L82-M124 HydrophobicContact CD2-CG 4.38Å; L82-M124 HydrophobicContact CG-CE 4.02Å
83	G	96.2	Very high	96.1	Very high	44 Å²	44	50.5 Å²	50.5	45%	0.454	29%	0.288	S	S	.	.	H	α-helix	trans	-61.7	-46.5	170.8	0	0	0	0	0	112.6	S79 D80 L81 I85 Q86 A87	S79-G83 PolarHBondContact O-N 3.26Å; D80-G83 PolarHBondContact O-N 3.43Å; L81-G83 VanDerWaalsContact C-N 3.31Å; L81-G83 PolarHBondContact O-N 3.35Å; G83-I85 PolarHBondContact O-N 2.82Å; G83-Q86 PolarHBondContact O-N 3.39Å; G83-A87 PolarHBondContact O-N 2.67Å
84	L	96.8	Very high	96.1	Very high	93 Å²	93	49.1 Å²	49.1	49%	0.487	29%	0.285	S	S	.	.	H	α-helix	trans	-61.1	-43.2	175.4	-66.8	175.4	0	0	0	111.9	L52 L57 D80 L81 Q86 A87 E88	L52-L84 HydrophobicContact CD2-CD1 4.49Å; L57-L84 HydrophobicContact CD1-CB 3.81Å; L57-L84 HydrophobicContact CD1-CD1 4.27Å; L57-L84 HydrophobicContact CD2-CB 3.96Å; D80-L84 WeakPolarHBondContact O-CG 3.43Å; D80-L84 PolarHBondContact O-N 3.36Å; L81-L84 PolarHBondContact O-N 3.4Å; L84-Q86 VanDerWaalsContact C-N 3.34Å; L84-Q86 PolarHBondContact O-N 3.25Å; L84-A87 WeakPolarHBondContact O-CB 3.2Å; L84-A87 PolarHBondContact O-N 2.86Å; L84-E88 PolarHBondContact O-N 3.02Å
85	I	97.8	Very high	96	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-40.1	176.8	-67	-76.2	0	0	0	111	L57 L58 F61 L81 L82 G83 A87 E88 V89 I116 M120	L57-I85 HydrophobicContact CD1-CD1 3.91Å; L57-I85 HydrophobicContact CD1-CG1 4.06Å; L57-I85 HydrophobicContact CD2-CD1 4.23Å; L57-I85 HydrophobicContact CG-CD1 3.6Å; L57-I85 HydrophobicContact CG-CG1 4.23Å; L58-I85 HydrophobicContact CD2-CD1 3.87Å; F61-I85 HydrophobicContact CB-CD1 3.39Å; F61-I85 HydrophobicContact CB-CG1 3.75Å; F61-I85 HydrophobicContact CD1-CD1 3.86Å; F61-I85 HydrophobicContact CD1-CG1 4.02Å; F61-I85 HydrophobicContact CD1-CG2 3.94Å; F61-I85 HydrophobicContact CD2-CG1 4.03Å; F61-I85 HydrophobicContact CE1-CG2 4.03Å; F61-I85 HydrophobicContact CG-CD1 3.68Å; F61-I85 HydrophobicContact CG-CG1 3.65Å; F61-I85 HydrophobicContact CG-CG2 4.4Å; L81-I85 HydrophobicContact CG-CG1 4.48Å; L81-I85 WeakPolarHBondContact O-CG1 3.47Å; L81-I85 PolarHBondContact O-N 2.91Å; L82-I85 PolarHBondContact O-N 2.96Å; G83-I85 PolarHBondContact O-N 2.82Å; I85-A87 VanDerWaalsContact C-N 3.31Å; I85-A87 PolarHBondContact O-N 3.29Å; I85-E88 PolarHBondContact O-N 3.4Å; I85-V89 HydrophobicContact CG2-CG2 4.47Å; I85-V89 VanDerWaalsContact O-CG2 3.32Å; I85-V89 WeakPolarHBondContact O-CG2 3.41Å; I85-V89 PolarHBondContact O-N 3.17Å; I85-I116 HydrophobicContact CG2-CG2 3.68Å; I85-M120 HydrophobicContact CG2-CE 4.13Å; I85-M120 HydrophobicContact CG2-CG 3.78Å; I85-M120 HydrophobicContact CG2-SD 3.59Å; I85-M120 VanDerWaalsContact CG2-SD 3.59Å
86	Q	97.8	Very high	95.9	Very high	79 Å²	79	49.6 Å²	49.6	37%	0.369	29%	0.285	S	S	.	.	H	α-helix	trans	-62.6	-39.5	176	-175.1	59.4	73.8	0	0	111.8	L82 G83 L84 V89 N90 M120	L82-Q86 WeakPolarHBondContact O-CB 3.45Å; L82-Q86 PolarHBondContact O-N 3.48Å; G83-Q86 PolarHBondContact O-N 3.39Å; L84-Q86 VanDerWaalsContact C-N 3.34Å; L84-Q86 PolarHBondContact O-N 3.25Å; Q86-V89 PolarHBondContact O-N 3.49Å; Q86-N90 PolarHBondContact NE2-OD1 2.89Å; Q86-N90 PolarHBondContact O-N 2.96Å; Q86-N90 PolarHBondContact O-ND2 3.47Å; Q86-N90 PolarHBondContact O-OD1 3.01Å; Q86-M120 HydrophobicContact CB-CE 3.85Å; Q86-M120 HydrophobicContact CG-CE 4.44Å; Q86-M120 VanDerWaalsContact OE1-CE 3.28Å
87	A	97.5	Very high	95.9	Very high	55 Å²	55	54 Å²	54	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-64.2	-46.4	174.7	0	0	0	0	0	111.8	G83 L84 I85 V89 N90 Q91	G83-A87 PolarHBondContact O-N 2.67Å; L84-A87 WeakPolarHBondContact O-CB 3.2Å; L84-A87 PolarHBondContact O-N 2.86Å; I85-A87 VanDerWaalsContact C-N 3.31Å; I85-A87 PolarHBondContact O-N 3.29Å; A87-V89 VanDerWaalsContact C-N 3.33Å; A87-V89 PolarHBondContact O-N 2.78Å; A87-N90 WeakPolarHBondContact O-CB 3.38Å; A87-N90 PolarHBondContact O-N 3.34Å; A87-N90 VanDerWaalsContact O-N 3.15Å; A87-Q91 PolarHBondContact O-N 3.41Å
88	E	96.6	Very high	96	Very high	21 Å²	21	59 Å²	59	10%	0.098	33%	0.33	C	S	.	.	H	α-helix	trans	-58	-44.2	175.7	177.6	63.9	-157.5	0	0	111.5	S54 L57 L84 I85 N90 Q91 L92	S54-E88 WeakPolarHBondContact CB-OE1 3.48Å; S54-E88 VanDerWaalsContact CB-OE2 3.31Å; S54-E88 WeakPolarHBondContact CB-OE2 3.24Å; S54-E88 PolarHBondContact OG-OE1 3.39Å; S54-E88 PolarHBondContact OG-OE2 2.95Å; L57-E88 HydrophobicContact CD2-CB 4.18Å; L84-E88 PolarHBondContact O-N 3.02Å; I85-E88 PolarHBondContact O-N 3.4Å; E88-N90 PolarHBondContact O-N 2.98Å; E88-Q91 PolarHBondContact O-N 3.19Å; E88-L92 HydrophobicContact CG-CD1 4.21Å; E88-L92 WeakPolarHBondContact O-CB 3.36Å; E88-L92 WeakPolarHBondContact O-CG 3.32Å; E88-L92 PolarHBondContact O-N 3.39Å
89	V	97.8	Very high	96	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-60.9	-44.1	175.7	169.1	0	0	0	0	111.6	I85 Q86 A87 L92 E93 V113 I116 M120	I85-V89 HydrophobicContact CG2-CG2 4.47Å; I85-V89 VanDerWaalsContact O-CG2 3.32Å; I85-V89 WeakPolarHBondContact O-CG2 3.41Å; I85-V89 PolarHBondContact O-N 3.17Å; Q86-V89 PolarHBondContact O-N 3.49Å; A87-V89 VanDerWaalsContact C-N 3.33Å; A87-V89 PolarHBondContact O-N 2.78Å; V89-L92 PolarHBondContact O-N 2.92Å; V89-E93 WeakPolarHBondContact O-CB 3.32Å; V89-E93 PolarHBondContact O-N 3.2Å; V89-V113 HydrophobicContact CG1-CG1 4.09Å; V89-I116 HydrophobicContact CG2-CB 3.77Å; V89-I116 HydrophobicContact CG2-CD1 4.39Å; V89-I116 HydrophobicContact CG2-CG2 3.31Å; V89-M120 HydrophobicContact CG2-SD 3.99Å
90	N	97.9	Very high	96.1	Very high	87 Å²	87	59 Å²	59	47%	0.465	33%	0.332	S	S	.	.	H	α-helix	trans	-64.7	-40.9	179.1	-68.7	-15.4	0	0	0	111.5	Q86 A87 E88 E93 A94	Q86-N90 PolarHBondContact NE2-OD1 2.89Å; Q86-N90 PolarHBondContact O-N 2.96Å; Q86-N90 PolarHBondContact O-ND2 3.47Å; Q86-N90 PolarHBondContact O-OD1 3.01Å; A87-N90 WeakPolarHBondContact O-CB 3.38Å; A87-N90 PolarHBondContact O-N 3.34Å; A87-N90 VanDerWaalsContact O-N 3.15Å; E88-N90 PolarHBondContact O-N 2.98Å; N90-E93 PolarHBondContact O-N 3.22Å; N90-A94 PolarHBondContact O-N 2.89Å
91	Q	97	Very high	95.8	Very high	102 Å²	102	57.6 Å²	57.6	48%	0.477	34%	0.339	S	S	.	.	H	α-helix	trans	-62.9	-50.5	175.6	178.9	177.7	-10	0	0	111.2	A87 E88 E93 A94 E95	A87-Q91 PolarHBondContact O-N 3.41Å; E88-Q91 PolarHBondContact O-N 3.19Å; Q91-E93 PolarHBondContact O-N 2.89Å; Q91-A94 PolarHBondContact O-N 3.38Å; Q91-A94 VanDerWaalsContact O-N 3.11Å; Q91-E95 HydrophobicContact CG-CG 4.48Å; Q91-E95 WeakPolarHBondContact CG-OE1 3.42Å; Q91-E95 PolarHBondContact NE2-OE1 2.98Å; Q91-E95 WeakPolarHBondContact O-CG 3.45Å; Q91-E95 PolarHBondContact O-N 3.26Å
92	L	96	Very high	95.6	Very high	12 Å²	12	59.3 Å²	59.3	6%	0.063	36%	0.362	C	S	.	.	H	α-helix	trans	-59.2	-37.4	177.8	-74.1	174.2	0	0	0	112.1	E88 V89 A96 V113 I116	E88-L92 HydrophobicContact CG-CD1 4.21Å; E88-L92 WeakPolarHBondContact O-CB 3.36Å; E88-L92 WeakPolarHBondContact O-CG 3.32Å; E88-L92 PolarHBondContact O-N 3.39Å; V89-L92 PolarHBondContact O-N 2.92Å; L92-A96 WeakPolarHBondContact O-CB 3.47Å; L92-A96 PolarHBondContact O-N 3.4Å; L92-V113 HydrophobicContact CB-CG2 3.63Å; L92-I116 HydrophobicContact CD1-CD1 3.88Å
93	E	96.7	Very high	95.5	Very high	57 Å²	57	60.4 Å²	60.4	27%	0.266	37%	0.368	S	S	.	.	H	α-helix	trans	-66.9	-41.7	175.7	-170.2	179.1	153.3	0	0	111.9	V89 N90 Q91 A96 K97 V113 R117	V89-E93 WeakPolarHBondContact O-CB 3.32Å; V89-E93 PolarHBondContact O-N 3.2Å; N90-E93 PolarHBondContact O-N 3.22Å; Q91-E93 PolarHBondContact O-N 2.89Å; E93-A96 PolarHBondContact O-N 3.03Å; E93-K97 WeakPolarHBondContact O-CG 3.44Å; E93-K97 PolarHBondContact O-N 3.23Å; E93-K97 WeakPolarHBondContact OE1-CE 3.31Å; E93-K97 IonicContact OE1-NZ 2.73Å; E93-K97 PolarHBondContact OE1-NZ 3.36Å; E93-V113 HydrophobicContact CB-CG1 4.37Å; E93-V113 HydrophobicContact CB-CG2 4.11Å; E93-R117 IonicContact OE2-CZ 3.29Å; E93-R117 IonicContact OE2-NH2 2.72Å; E93-R117 PolarHBondContact OE2-NH2 3.25Å
94	A	97.3	Very high	95.5	Very high	54 Å²	54	63.9 Å²	63.9	45%	0.446	38%	0.376	S	S	.	.	H	α-helix	trans	-63.9	-46.9	176	0	0	0	0	0	111.6	N90 Q91 A96 K97 T98	N90-A94 PolarHBondContact O-N 2.89Å; Q91-A94 PolarHBondContact O-N 3.38Å; Q91-A94 VanDerWaalsContact O-N 3.11Å; A94-A96 VanDerWaalsContact C-N 3.26Å; A94-A96 PolarHBondContact O-N 3.43Å; A94-K97 WeakPolarHBondContact O-CB 3.46Å; A94-K97 PolarHBondContact O-N 2.85Å; A94-T98 PolarHBondContact O-N 3.34Å
95	E	95.1	Very high	95.4	Very high	67 Å²	67	65.4 Å²	65.4	31%	0.313	38%	0.378	S	S	.	.	H	α-helix	trans	-61.7	-33.6	176.2	-69.8	177.1	-165.2	0	0	112.5	Q91 K97 T98 K109	Q91-E95 HydrophobicContact CG-CG 4.48Å; Q91-E95 WeakPolarHBondContact CG-OE1 3.42Å; Q91-E95 PolarHBondContact NE2-OE1 2.98Å; Q91-E95 WeakPolarHBondContact O-CG 3.45Å; Q91-E95 PolarHBondContact O-N 3.26Å; E95-K97 VanDerWaalsContact C-N 3.27Å; E95-K97 PolarHBondContact O-N 3.41Å; E95-T98 PolarHBondContact O-N 2.9Å; E95-T98 PolarHBondContact O-OG1 2.86Å; E95-K109 HydrophobicContact CB-CD 4.19Å; E95-K109 IonicContact OE2-NZ 3.01Å; E95-K109 PolarHBondContact OE2-NZ 3.1Å
96	A	95.1	Very high	95.3	Very high	1 Å²	1	65.4 Å²	65.4	1%	0.008	38%	0.378	C	S	.	.	H	α-helix	trans	-70.9	-22.6	175.4	0	0	0	0	0	113.2	L92 E93 A94 K109 R110	L92-A96 WeakPolarHBondContact O-CB 3.47Å; L92-A96 PolarHBondContact O-N 3.4Å; E93-A96 PolarHBondContact O-N 3.03Å; A94-A96 VanDerWaalsContact C-N 3.26Å; A94-A96 PolarHBondContact O-N 3.43Å; A96-K109 HydrophobicContact CB-CB 3.76Å; A96-K109 HydrophobicContact CB-CD 4.48Å; A96-R110 HydrophobicContact CB-CG 3.93Å; A96-R110 PolarHBondContact O-NH2 2.78Å
97	K	94.9	Very high	95.2	Very high	138 Å²	138	66 Å²	66	60%	0.6	38%	0.381	S	S	*	.	H	α-helix	trans	-83.4	-25.5	177.3	-72.1	169.3	-176.2	167.1	0	112.5	E93 A94 E95 L99	E93-K97 WeakPolarHBondContact O-CG 3.44Å; E93-K97 PolarHBondContact O-N 3.23Å; E93-K97 WeakPolarHBondContact OE1-CE 3.31Å; E93-K97 IonicContact OE1-NZ 2.73Å; E93-K97 PolarHBondContact OE1-NZ 3.36Å; A94-K97 WeakPolarHBondContact O-CB 3.46Å; A94-K97 PolarHBondContact O-N 2.85Å; E95-K97 VanDerWaalsContact C-N 3.27Å; E95-K97 PolarHBondContact O-N 3.41Å; K97-L99 VanDerWaalsContact C-N 3.27Å; K97-L99 PolarHBondContact O-N 3.42Å
98	T	96.3	Very high	95.1	Very high	118 Å²	118	67.4 Å²	67.4	72%	0.724	38%	0.38	S	S	*	.	S	Bend	trans	-77.2	-14.1	176.9	61.3	0	0	0	0	113.2	A94 E95	A94-T98 PolarHBondContact O-N 3.34Å; E95-T98 PolarHBondContact O-N 2.9Å; E95-T98 PolarHBondContact O-OG1 2.86Å
99	L	95.2	Very high	95.1	Very high	39 Å²	39	67.9 Å²	67.9	20%	0.204	38%	0.382	C	S	.	.	S	Bend	trans	-89	149.7	178.9	-66.1	170.9	0	0	0	111.6	K97 K105 A106 K109	K97-L99 VanDerWaalsContact C-N 3.27Å; K97-L99 PolarHBondContact O-N 3.42Å; L99-K105 HydrophobicContact CD1-CB 4.11Å; L99-K105 HydrophobicContact CD1-CD 4.04Å; L99-K105 HydrophobicContact CD1-CG 3.84Å; L99-A106 HydrophobicContact CB-CB 3.62Å; L99-A106 HydrophobicContact CD1-CB 4.01Å; L99-A106 HydrophobicContact CG-CB 4.48Å; L99-K109 HydrophobicContact CD1-CD 4.11Å
100	P	93.3	Very high	95	Very high	89 Å²	89	72.4 Å²	72.4	58%	0.578	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-56.5	148.6	-179.6	-24.7	34.1	0	0	0	113.8	G102 D103	P100-G102 PolarHBondContact O-N 2.62Å; P100-D103 HydrophobicContact CB-CB 4.41Å; P100-D103 VanDerWaalsContact O-CB 3.26Å; P100-D103 WeakPolarHBondContact O-CB 3.32Å; P100-D103 PolarHBondContact O-N 3.2Å; P100-D103 VanDerWaalsContact O-N 3.15Å
101	A	87.1	Confident	94.9	Very high	101 Å²	101	72.6 Å²	72.6	84%	0.835	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	133.9	169.9	0	0	0	0	0	110.2	D103	A101-D103 VanDerWaalsContact C-N 3.3Å; A101-D103 PolarHBondContact O-N 3.13Å
102	G	89.6	Confident	94.9	Very high	58 Å²	58	71.5 Å²	71.5	60%	0.598	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	-13	-175.9	0	0	0	0	0	115.3	P100 L104 Q107	P100-G102 PolarHBondContact O-N 2.62Å; G102-L104 PolarHBondContact O-N 2.83Å; G102-Q107 PolarHBondContact O-NE2 3.33Å
103	D	93.5	Very high	95	Very high	53 Å²	53	71.2 Å²	71.2	28%	0.283	39%	0.393	S	S	.	.			trans	-58.8	126	175.1	-177	-13	0	0	0	110.7	P100 A101 K105 A106 Q107	P100-D103 HydrophobicContact CB-CB 4.41Å; P100-D103 VanDerWaalsContact O-CB 3.26Å; P100-D103 WeakPolarHBondContact O-CB 3.32Å; P100-D103 PolarHBondContact O-N 3.2Å; P100-D103 VanDerWaalsContact O-N 3.15Å; A101-D103 VanDerWaalsContact C-N 3.3Å; A101-D103 PolarHBondContact O-N 3.13Å; D103-K105 VanDerWaalsContact C-N 3.25Å; D103-K105 PolarHBondContact O-N 2.87Å; D103-K105 WeakPolarHBondContact OD1-CB 3.49Å; D103-K105 PolarHBondContact OD1-N 3.46Å; D103-A106 HydrophobicContact CB-CB 4Å; D103-A106 WeakPolarHBondContact O-CB 3.31Å; D103-A106 PolarHBondContact O-N 3.26Å; D103-A106 VanDerWaalsContact O-N 3.09Å; D103-Q107 WeakPolarHBondContact O-CG 3.49Å; D103-Q107 PolarHBondContact O-N 3.03Å
104	L	96.1	Very high	95.1	Very high	118 Å²	118	74.5 Å²	74.5	62%	0.618	41%	0.408	S	S	*	.	H	α-helix	trans	-58	-37.5	177.9	-179.9	61.6	0	0	0	111.8	G102 A106 Q107 I108	G102-L104 PolarHBondContact O-N 2.83Å; L104-A106 VanDerWaalsContact C-N 3.32Å; L104-A106 PolarHBondContact O-N 3.49Å; L104-Q107 PolarHBondContact O-N 3.45Å; L104-I108 HydrophobicContact CD1-CD1 4.29Å; L104-I108 HydrophobicContact CD1-CG1 4.37Å; L104-I108 HydrophobicContact CG-CD1 3.99Å; L104-I108 HydrophobicContact CG-CG1 4.5Å; L104-I108 VanDerWaalsContact O-CG1 3.31Å; L104-I108 WeakPolarHBondContact O-CG1 3.27Å; L104-I108 PolarHBondContact O-N 2.94Å
105	K	94.7	Very high	95.1	Very high	125 Å²	125	79.7 Å²	79.7	54%	0.543	42%	0.416	S	S	.	.	H	α-helix	trans	-63.9	-39.8	176.2	-173.6	-179.8	179.6	-179.5	0	111.1	L99 D103 I108 K109	L99-K105 HydrophobicContact CD1-CB 4.11Å; L99-K105 HydrophobicContact CD1-CD 4.04Å; L99-K105 HydrophobicContact CD1-CG 3.84Å; D103-K105 VanDerWaalsContact C-N 3.25Å; D103-K105 PolarHBondContact O-N 2.87Å; D103-K105 WeakPolarHBondContact OD1-CB 3.49Å; D103-K105 PolarHBondContact OD1-N 3.46Å; K105-I108 PolarHBondContact O-N 3.19Å; K105-K109 WeakPolarHBondContact O-CG 3.27Å; K105-K109 PolarHBondContact O-N 3.43Å; K105-K109 VanDerWaalsContact O-N 3.08Å
106	A	95.5	Very high	95.3	Very high	0 Å²	0	77.2 Å²	77.2	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-64.5	-42.5	174.8	0	0	0	0	0	111.3	L99 D103 L104 K109 R110	L99-A106 HydrophobicContact CB-CB 3.62Å; L99-A106 HydrophobicContact CD1-CB 4.01Å; L99-A106 HydrophobicContact CG-CB 4.48Å; D103-A106 HydrophobicContact CB-CB 4Å; D103-A106 WeakPolarHBondContact O-CB 3.31Å; D103-A106 PolarHBondContact O-N 3.26Å; D103-A106 VanDerWaalsContact O-N 3.09Å; L104-A106 VanDerWaalsContact C-N 3.32Å; L104-A106 PolarHBondContact O-N 3.49Å; A106-K109 PolarHBondContact O-N 3.25Å; A106-R110 WeakPolarHBondContact O-CG 3.47Å; A106-R110 PolarHBondContact O-N 2.91Å
107	Q	96.2	Very high	95.4	Very high	91 Å²	91	82.3 Å²	82.3	43%	0.425	42%	0.424	S	S	.	.	H	α-helix	trans	-62.5	-46.2	176.8	-67.7	-178.8	64.2	0	0	111.9	G102 D103 L104 K109 R110 I111	G102-Q107 PolarHBondContact O-NE2 3.33Å; D103-Q107 WeakPolarHBondContact O-CG 3.49Å; D103-Q107 PolarHBondContact O-N 3.03Å; L104-Q107 PolarHBondContact O-N 3.45Å; Q107-K109 VanDerWaalsContact C-N 3.34Å; Q107-K109 PolarHBondContact O-N 3.41Å; Q107-R110 PolarHBondContact O-N 2.89Å; Q107-I111 WeakPolarHBondContact O-CG1 3.47Å; Q107-I111 PolarHBondContact O-N 3.28Å
108	I	96	Very high	95.6	Very high	84 Å²	84	81.8 Å²	81.8	43%	0.431	42%	0.422	S	S	.	.	H	α-helix	trans	-59.2	-45.4	177.3	-69.9	166.6	0	0	0	110.9	L104 K105 R110 I111 Q112	L104-I108 HydrophobicContact CD1-CD1 4.29Å; L104-I108 HydrophobicContact CD1-CG1 4.37Å; L104-I108 HydrophobicContact CG-CD1 3.99Å; L104-I108 HydrophobicContact CG-CG1 4.5Å; L104-I108 VanDerWaalsContact O-CG1 3.31Å; L104-I108 WeakPolarHBondContact O-CG1 3.27Å; L104-I108 PolarHBondContact O-N 2.94Å; K105-I108 PolarHBondContact O-N 3.19Å; I108-R110 PolarHBondContact O-N 3.01Å; I108-I111 PolarHBondContact O-N 3.25Å; I108-Q112 WeakPolarHBondContact O-CG 3.45Å; I108-Q112 PolarHBondContact O-N 3.06Å
109	K	95.5	Very high	95.7	Very high	31 Å²	31	77.4 Å²	77.4	14%	0.135	39%	0.394	C	S	.	.	H	α-helix	trans	-61.9	-42.3	177.3	-74.7	-179.9	169.4	-70	0	112.4	E95 A96 L99 K105 A106 Q107 Q112 V113	E95-K109 HydrophobicContact CB-CD 4.19Å; E95-K109 IonicContact OE2-NZ 3.01Å; E95-K109 PolarHBondContact OE2-NZ 3.1Å; A96-K109 HydrophobicContact CB-CB 3.76Å; A96-K109 HydrophobicContact CB-CD 4.48Å; L99-K109 HydrophobicContact CD1-CD 4.11Å; K105-K109 WeakPolarHBondContact O-CG 3.27Å; K105-K109 PolarHBondContact O-N 3.43Å; K105-K109 VanDerWaalsContact O-N 3.08Å; A106-K109 PolarHBondContact O-N 3.25Å; Q107-K109 VanDerWaalsContact C-N 3.34Å; Q107-K109 PolarHBondContact O-N 3.41Å; K109-Q112 WeakPolarHBondContact O-CB 3.31Å; K109-Q112 PolarHBondContact O-N 3.35Å; K109-V113 WeakPolarHBondContact O-CG2 3.39Å; K109-V113 PolarHBondContact O-N 3.31Å
110	R	95.8	Very high	95.8	Very high	96 Å²	96	75.9 Å²	75.9	36%	0.362	39%	0.385	S	S	.	.	H	α-helix	trans	-61.9	-44.5	175.9	-70.3	172.6	-166.9	139.6	9.4	112.1	A96 A106 Q107 I108 Q112 V113 E114	A96-R110 HydrophobicContact CB-CG 3.93Å; A96-R110 PolarHBondContact O-NH2 2.78Å; A106-R110 WeakPolarHBondContact O-CG 3.47Å; A106-R110 PolarHBondContact O-N 2.91Å; Q107-R110 PolarHBondContact O-N 2.89Å; I108-R110 PolarHBondContact O-N 3.01Å; R110-Q112 VanDerWaalsContact C-N 3.29Å; R110-Q112 PolarHBondContact O-N 3.12Å; R110-V113 WeakPolarHBondContact O-CB 3.41Å; R110-V113 PolarHBondContact O-N 3.44Å; R110-E114 WeakPolarHBondContact O-CG 3.48Å; R110-E114 PolarHBondContact O-N 3.04Å
111	I	97.1	Very high	96	Very high	91 Å²	91	74.3 Å²	74.3	47%	0.467	37%	0.374	S	S	.	.	H	α-helix	trans	-61	-40.3	175.5	-68.3	166.1	0	0	0	110.7	Q107 I108 E114 R115	Q107-I111 WeakPolarHBondContact O-CG1 3.47Å; Q107-I111 PolarHBondContact O-N 3.28Å; I108-I111 PolarHBondContact O-N 3.25Å; I111-E114 PolarHBondContact O-N 3.04Å; I111-R115 HydrophobicContact CG2-CG 4.46Å; I111-R115 WeakPolarHBondContact O-CB 3.5Å; I111-R115 VanDerWaalsContact O-CG 3.24Å; I111-R115 WeakPolarHBondContact O-CG 3.42Å; I111-R115 PolarHBondContact O-N 3.5Å
112	Q	96.4	Very high	96.6	Very high	78 Å²	78	71.1 Å²	71.1	36%	0.364	34%	0.343	S	S	.	.	H	α-helix	trans	-63.1	-46.5	175.3	-75.3	-179.8	-18.9	0	0	111.9	I108 K109 R110 E114 R115 I116	I108-Q112 WeakPolarHBondContact O-CG 3.45Å; I108-Q112 PolarHBondContact O-N 3.06Å; K109-Q112 WeakPolarHBondContact O-CB 3.31Å; K109-Q112 PolarHBondContact O-N 3.35Å; R110-Q112 VanDerWaalsContact C-N 3.29Å; R110-Q112 PolarHBondContact O-N 3.12Å; Q112-E114 VanDerWaalsContact C-N 3.33Å; Q112-E114 PolarHBondContact O-N 3.15Å; Q112-R115 PolarHBondContact O-N 2.92Å; Q112-I116 WeakPolarHBondContact O-CD1 3.27Å; Q112-I116 VanDerWaalsContact O-CG1 3.27Å; Q112-I116 WeakPolarHBondContact O-CG1 3.36Å; Q112-I116 PolarHBondContact O-N 2.92Å
113	V	97.8	Very high	97	Very high	7 Å²	7	68.6 Å²	68.6	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-54.2	-48.6	174.7	163.2	0	0	0	0	111.2	V89 L92 E93 K109 R110 R115 I116 R117	V89-V113 HydrophobicContact CG1-CG1 4.09Å; L92-V113 HydrophobicContact CB-CG2 3.63Å; E93-V113 HydrophobicContact CB-CG1 4.37Å; E93-V113 HydrophobicContact CB-CG2 4.11Å; K109-V113 WeakPolarHBondContact O-CG2 3.39Å; K109-V113 PolarHBondContact O-N 3.31Å; R110-V113 WeakPolarHBondContact O-CB 3.41Å; R110-V113 PolarHBondContact O-N 3.44Å; V113-R115 PolarHBondContact O-N 3.41Å; V113-I116 PolarHBondContact O-N 2.91Å; V113-R117 VanDerWaalsContact O-CB 3.29Å; V113-R117 WeakPolarHBondContact O-CB 3.4Å; V113-R117 PolarHBondContact O-N 3.26Å
114	E	98.2	Very high	97.2	Very high	126 Å²	126	70.2 Å²	70.2	59%	0.589	32%	0.323	S	S	*	.	H	α-helix	trans	-62.5	-43.6	179.4	-72	174.7	173.1	0	0	112.3	R110 I111 Q112 R117 F118	R110-E114 WeakPolarHBondContact O-CG 3.48Å; R110-E114 PolarHBondContact O-N 3.04Å; I111-E114 PolarHBondContact O-N 3.04Å; Q112-E114 VanDerWaalsContact C-N 3.33Å; Q112-E114 PolarHBondContact O-N 3.15Å; E114-R117 PolarHBondContact O-N 3.38Å; E114-F118 WeakPolarHBondContact O-CB 3.42Å; E114-F118 PolarHBondContact O-N 3.48Å
115	R	98.3	Very high	97.3	Very high	162 Å²	162	71.8 Å²	71.8	61%	0.611	32%	0.32	S	S	*	.	H	α-helix	trans	-61.6	-45.8	177.5	-74.5	172.3	63.8	-162	-2.1	111.9	I111 Q112 V113 F118 I119	I111-R115 HydrophobicContact CG2-CG 4.46Å; I111-R115 WeakPolarHBondContact O-CB 3.5Å; I111-R115 VanDerWaalsContact O-CG 3.24Å; I111-R115 WeakPolarHBondContact O-CG 3.42Å; I111-R115 PolarHBondContact O-N 3.5Å; Q112-R115 PolarHBondContact O-N 2.92Å; V113-R115 PolarHBondContact O-N 3.41Å; R115-F118 PolarHBondContact O-N 2.97Å; R115-I119 WeakPolarHBondContact O-CG1 3.21Å; R115-I119 PolarHBondContact O-N 3.37Å; R115-I119 VanDerWaalsContact O-N 3.17Å
116	I	98.2	Very high	97.5	Very high	16 Å²	16	67.1 Å²	67.1	8%	0.082	30%	0.301	C	S	.	.	H	α-helix	trans	-67	-45.2	-179.7	-60	160	0	0	0	109.8	L58 I85 V89 L92 Q112 V113 F118 I119 M120	L58-I116 HydrophobicContact CD1-CD1 4.15Å; L58-I116 HydrophobicContact CD2-CD1 3.62Å; L58-I116 HydrophobicContact CD2-CG1 3.84Å; L58-I116 HydrophobicContact CD2-CG2 4.1Å; I85-I116 HydrophobicContact CG2-CG2 3.68Å; V89-I116 HydrophobicContact CG2-CB 3.77Å; V89-I116 HydrophobicContact CG2-CD1 4.39Å; V89-I116 HydrophobicContact CG2-CG2 3.31Å; L92-I116 HydrophobicContact CD1-CD1 3.88Å; Q112-I116 WeakPolarHBondContact O-CD1 3.27Å; Q112-I116 VanDerWaalsContact O-CG1 3.27Å; Q112-I116 WeakPolarHBondContact O-CG1 3.36Å; Q112-I116 PolarHBondContact O-N 2.92Å; V113-I116 PolarHBondContact O-N 2.91Å; I116-F118 VanDerWaalsContact C-N 3.31Å; I116-F118 PolarHBondContact O-N 3.29Å; I116-I119 PolarHBondContact O-N 3.28Å; I116-I119 VanDerWaalsContact O-N 3.09Å; I116-M120 HydrophobicContact CG2-CG 4.4Å; I116-M120 HydrophobicContact CG2-SD 4.21Å; I116-M120 WeakPolarHBondContact O-CG 3.44Å; I116-M120 PolarHBondContact O-N 3.26Å
117	R	98.1	Very high	97.6	Very high	108 Å²	108	67.2 Å²	67.2	41%	0.408	30%	0.301	S	S	.	.	H	α-helix	trans	-58.6	-41.5	176.6	-173.4	-179.6	-64.2	163.5	0.1	112.2	E93 V113 E114 I119 M120 V121	E93-R117 IonicContact OE2-CZ 3.29Å; E93-R117 IonicContact OE2-NH2 2.72Å; E93-R117 PolarHBondContact OE2-NH2 3.25Å; V113-R117 VanDerWaalsContact O-CB 3.29Å; V113-R117 WeakPolarHBondContact O-CB 3.4Å; V113-R117 PolarHBondContact O-N 3.26Å; E114-R117 PolarHBondContact O-N 3.38Å; R117-I119 PolarHBondContact O-N 3.27Å; R117-M120 PolarHBondContact O-N 3.48Å; R117-V121 WeakPolarHBondContact O-CG2 3.23Å; R117-V121 PolarHBondContact O-N 3.01Å
118	F	98.5	Very high	97.7	Very high	126 Å²	126	66 Å²	66	55%	0.553	30%	0.296	S	S	*	.	H	α-helix	trans	-58.4	-47.6	174.1	172.5	-93	0	0	0	111.5	E114 R115 I116 M120 V121 D122	E114-F118 WeakPolarHBondContact O-CB 3.42Å; E114-F118 PolarHBondContact O-N 3.48Å; R115-F118 PolarHBondContact O-N 2.97Å; I116-F118 VanDerWaalsContact C-N 3.31Å; I116-F118 PolarHBondContact O-N 3.29Å; F118-M120 PolarHBondContact O-N 3.45Å; F118-V121 PolarHBondContact O-N 2.91Å; F118-D122 WeakPolarHBondContact O-CB 3.42Å; F118-D122 PolarHBondContact O-N 3.08Å
119	I	98.3	Very high	97.8	Very high	27 Å²	27	68.7 Å²	68.7	14%	0.138	31%	0.305	C	S	.	.	H	α-helix	trans	-62.9	-42.4	179.5	-65.4	166.8	0	0	0	110.9	F61 Y62 W65 R115 I116 R117 D122 Y123	F61-I119 HydrophobicContact CD1-CG2 4.14Å; F61-I119 HydrophobicContact CE1-CB 4.1Å; F61-I119 HydrophobicContact CE1-CG2 3.48Å; F61-I119 VanDerWaalsContact CE1-CG2 3.48Å; F61-I119 HydrophobicContact CZ-CG2 4Å; Y62-I119 HydrophobicContact CD2-CD1 4.21Å; W65-I119 HydrophobicContact CB-CG2 3.79Å; W65-I119 HydrophobicContact CD2-CG2 3.71Å; W65-I119 HydrophobicContact CE3-CG2 4.13Å; W65-I119 HydrophobicContact CG-CG2 3.56Å; R115-I119 WeakPolarHBondContact O-CG1 3.21Å; R115-I119 PolarHBondContact O-N 3.37Å; R115-I119 VanDerWaalsContact O-N 3.17Å; I116-I119 PolarHBondContact O-N 3.28Å; I116-I119 VanDerWaalsContact O-N 3.09Å; R117-I119 PolarHBondContact O-N 3.27Å; I119-D122 PolarHBondContact O-N 3.48Å; I119-Y123 WeakPolarHBondContact O-CB 3.36Å; I119-Y123 PolarHBondContact O-N 2.97Å
120	M	98.2	Very high	98	Very high	6 Å²	6	68.3 Å²	68.3	3%	0.03	30%	0.303	C	S	.	.	H	α-helix	trans	-57.2	-50.6	175	-66.3	170.6	75.9	0	0	112.5	F61 L82 I85 Q86 V89 I116 R117 F118 Y123 M124	F61-M120 HydrophobicContact CE1-CG 3.67Å; F61-M120 HydrophobicContact CZ-CB 4.28Å; F61-M120 HydrophobicContact CZ-CG 3.72Å; L82-M120 HydrophobicContact CD1-CB 4.45Å; L82-M120 HydrophobicContact CD1-CE 3.97Å; L82-M120 HydrophobicContact CD1-CG 4.24Å; I85-M120 HydrophobicContact CG2-CE 4.13Å; I85-M120 HydrophobicContact CG2-CG 3.78Å; I85-M120 HydrophobicContact CG2-SD 3.59Å; I85-M120 VanDerWaalsContact CG2-SD 3.59Å; Q86-M120 HydrophobicContact CB-CE 3.85Å; Q86-M120 HydrophobicContact CG-CE 4.44Å; Q86-M120 VanDerWaalsContact OE1-CE 3.28Å; V89-M120 HydrophobicContact CG2-SD 3.99Å; I116-M120 HydrophobicContact CG2-CG 4.4Å; I116-M120 HydrophobicContact CG2-SD 4.21Å; I116-M120 WeakPolarHBondContact O-CG 3.44Å; I116-M120 PolarHBondContact O-N 3.26Å; R117-M120 PolarHBondContact O-N 3.48Å; F118-M120 PolarHBondContact O-N 3.45Å; M120-Y123 PolarHBondContact O-N 2.89Å; M120-M124 WeakPolarHBondContact O-CG 3.22Å; M120-M124 PolarHBondContact O-N 3.5Å
121	V	98.1	Very high	98.1	Very high	57 Å²	57	63.7 Å²	63.7	35%	0.345	29%	0.286	S	S	.	.	H	α-helix	trans	-65.6	-41	179.9	172.3	0	0	0	0	111	R117 F118 M124 R125	R117-V121 WeakPolarHBondContact O-CG2 3.23Å; R117-V121 PolarHBondContact O-N 3.01Å; F118-V121 PolarHBondContact O-N 2.91Å; V121-M124 PolarHBondContact O-N 3.06Å; V121-R125 HydrophobicContact CG1-CG 4.38Å; V121-R125 WeakPolarHBondContact O-CB 3.27Å; V121-R125 WeakPolarHBondContact O-CG 3.27Å; V121-R125 PolarHBondContact O-N 3.11Å
122	D	98.6	Very high	98.1	Very high	33 Å²	33	66.1 Å²	66.1	18%	0.176	30%	0.295	C	S	.	.	H	α-helix	trans	-64.8	-42.9	177.6	-165.4	49.4	0	0	0	111.5	W65 K69 F118 I119 R125 I126	W65-D122 PolarHBondContact NE1-OD2 3.49Å; K69-D122 IonicContact NZ-OD2 4Å; F118-D122 WeakPolarHBondContact O-CB 3.42Å; F118-D122 PolarHBondContact O-N 3.08Å; I119-D122 PolarHBondContact O-N 3.48Å; D122-R125 PolarHBondContact O-N 2.95Å; D122-I126 WeakPolarHBondContact O-CD1 3.34Å; D122-I126 VanDerWaalsContact O-CG1 3.23Å; D122-I126 WeakPolarHBondContact O-CG1 3.26Å; D122-I126 PolarHBondContact O-N 3.4Å
123	Y	98.3	Very high	98.2	Very high	5 Å²	5	71.7 Å²	71.7	2%	0.02	31%	0.313	C	S	.	.	H	α-helix	trans	-55.7	-53.4	174	174.3	-108.5	0	0	0	111.8	F61 I64 W65 E68 I119 M120 R125 I126 R127	F61-Y123 HydrophobicContact CE2-CD1 4.33Å; F61-Y123 HydrophobicContact CE2-CG 4.44Å; I64-Y123 HydrophobicContact CG2-CD2 4.4Å; I64-Y123 HydrophobicContact CG2-CE2 3.6Å; W65-Y123 HydrophobicContact CB-CD2 4.49Å; E68-Y123 HydrophobicContact CB-CD2 3.89Å; E68-Y123 HydrophobicContact CB-CE2 3.71Å; E68-Y123 HydrophobicContact CG-CD2 3.95Å; E68-Y123 HydrophobicContact CG-CE2 3.75Å; I119-Y123 WeakPolarHBondContact O-CB 3.36Å; I119-Y123 PolarHBondContact O-N 2.97Å; M120-Y123 PolarHBondContact O-N 2.89Å; Y123-R125 VanDerWaalsContact C-N 3.34Å; Y123-R125 PolarHBondContact O-N 3.38Å; Y123-I126 PolarHBondContact O-N 2.93Å; Y123-R127 HydrophobicContact CE2-CG 4.31Å; Y123-R127 WeakPolarHBondContact O-CG 3.38Å; Y123-R127 PolarHBondContact O-N 3.49Å; Y123-R127 VanDerWaalsContact O-N 3.1Å; Y123-R127 WeakPolarHBondContact OH-CD 3.32Å
124	M	98	Very high	98.1	Very high	88 Å²	88	75.4 Å²	75.4	43%	0.433	33%	0.328	S	S	.	.	H	α-helix	trans	-58.8	-45.1	177.5	-69.3	177.7	176.5	0	0	111.3	L82 M120 V121 I126 R127 M128	L82-M124 HydrophobicContact CD1-CE 4.24Å; L82-M124 HydrophobicContact CD2-CE 3.35Å; L82-M124 HydrophobicContact CD2-CG 4.38Å; L82-M124 HydrophobicContact CG-CE 4.02Å; M120-M124 WeakPolarHBondContact O-CG 3.22Å; M120-M124 PolarHBondContact O-N 3.5Å; V121-M124 PolarHBondContact O-N 3.06Å; M124-I126 VanDerWaalsContact C-N 3.35Å; M124-I126 PolarHBondContact O-N 3.4Å; M124-R127 PolarHBondContact O-N 2.85Å; M124-M128 VanDerWaalsContact O-CG 3.27Å; M124-M128 WeakPolarHBondContact O-CG 3.49Å; M124-M128 PolarHBondContact O-N 3.33Å
125	R	98.4	Very high	98.1	Very high	151 Å²	151	70.6 Å²	70.6	57%	0.57	31%	0.311	S	S	*	.	H	α-helix	trans	-61	-40.9	178.5	-76.3	172.5	-179.9	178.8	2.8	112.8	V121 D122 Y123 K129	V121-R125 HydrophobicContact CG1-CG 4.38Å; V121-R125 WeakPolarHBondContact O-CB 3.27Å; V121-R125 WeakPolarHBondContact O-CG 3.27Å; V121-R125 PolarHBondContact O-N 3.11Å; D122-R125 PolarHBondContact O-N 2.95Å; Y123-R125 VanDerWaalsContact C-N 3.34Å; Y123-R125 PolarHBondContact O-N 3.38Å; R125-K129 WeakPolarHBondContact O-CB 3.31Å; R125-K129 VanDerWaalsContact O-CG 3.26Å; R125-K129 WeakPolarHBondContact O-CG 3.39Å; R125-K129 PolarHBondContact O-N 3.46Å
126	I	98.4	Very high	98.1	Very high	26 Å²	26	71.1 Å²	71.1	13%	0.133	32%	0.32	C	S	.	.	H	α-helix	trans	-62.5	-46.7	177.7	-70.4	159.4	0	0	0	109.7	E68 K69 D122 Y123 M124 K129 K130	E68-I126 HydrophobicContact CG-CG2 3.94Å; K69-I126 HydrophobicContact CB-CD1 3.81Å; K69-I126 HydrophobicContact CD-CD1 4.14Å; K69-I126 HydrophobicContact CG-CD1 3.86Å; D122-I126 WeakPolarHBondContact O-CD1 3.34Å; D122-I126 VanDerWaalsContact O-CG1 3.23Å; D122-I126 WeakPolarHBondContact O-CG1 3.26Å; D122-I126 PolarHBondContact O-N 3.4Å; Y123-I126 PolarHBondContact O-N 2.93Å; M124-I126 VanDerWaalsContact C-N 3.35Å; M124-I126 PolarHBondContact O-N 3.4Å; I126-K129 PolarHBondContact O-N 2.9Å; I126-K130 WeakPolarHBondContact O-CG 3.47Å; I126-K130 PolarHBondContact O-N 3.28Å
127	R	98.2	Very high	98	Very high	3 Å²	3	76 Å²	76	1%	0.011	34%	0.342	C	S	.	.	H	α-helix	trans	-61.3	-50.3	178.4	-69.4	-178.6	59.6	78.9	1.7	112	E68 L74 L75 Y123 M124 K129 K130 I131 H152 E157	E68-R127 HydrophobicContact CG-CG 3.67Å; E68-R127 IonicContact OE2-CZ 3.93Å; E68-R127 IonicContact OE2-NH1 3.55Å; E68-R127 PolarHBondContact OE2-NH1 2.71Å; L74-R127 HydrophobicContact CD1-CB 4.12Å; L74-R127 HydrophobicContact CD1-CG 4.1Å; L75-R127 PolarHBondContact O-NH1 3.41Å; Y123-R127 HydrophobicContact CE2-CG 4.31Å; Y123-R127 WeakPolarHBondContact O-CG 3.38Å; Y123-R127 PolarHBondContact O-N 3.49Å; Y123-R127 VanDerWaalsContact O-N 3.1Å; Y123-R127 WeakPolarHBondContact OH-CD 3.32Å; M124-R127 PolarHBondContact O-N 2.85Å; R127-K129 VanDerWaalsContact C-N 3.29Å; R127-K129 PolarHBondContact O-N 3.36Å; R127-K130 WeakPolarHBondContact O-CB 3.38Å; R127-K130 PolarHBondContact O-N 2.93Å; R127-I131 VanDerWaalsContact O-CG1 3.31Å; R127-I131 WeakPolarHBondContact O-CG1 3.36Å; R127-I131 PolarHBondContact O-N 2.88Å; R127-H152 PolarHBondContact NH2-O 3.02Å; R127-E157 IonicContact CZ-OE1 2.61Å; R127-E157 IonicContact CZ-OE2 3.96Å; R127-E157 IonicContact NE-OE1 2.77Å; R127-E157 PolarHBondContact NE-OE1 3.43Å; R127-E157 IonicContact NE-OE2 3.62Å; R127-E157 IonicContact NH2-OE1 2.87Å; R127-E157 PolarHBondContact NH2-OE1 3.49Å; R127-E157 IonicContact NH2-OE2 3.02Å; R127-E157 PolarHBondContact NH2-OE2 2.92Å
128	M	98.1	Very high	98	Very high	64 Å²	64	71.2 Å²	71.2	32%	0.315	33%	0.325	S	S	.	.	H	α-helix	trans	-56.4	-42.6	177.6	-67.6	-58.1	-68.4	0	0	112.2	M124 K130 I131 E132 F160	M124-M128 VanDerWaalsContact O-CG 3.27Å; M124-M128 WeakPolarHBondContact O-CG 3.49Å; M124-M128 PolarHBondContact O-N 3.33Å; M128-K130 VanDerWaalsContact C-N 3.34Å; M128-K130 PolarHBondContact O-N 2.91Å; M128-I131 PolarHBondContact O-N 3.15Å; M128-I131 HydrophobicContact SD-CD1 4.42Å; M128-E132 VanDerWaalsContact O-CB 3.31Å; M128-E132 WeakPolarHBondContact O-CB 3.37Å; M128-E132 PolarHBondContact O-N 3.48Å; M128-F160 HydrophobicContact CE-CB 4.25Å; M128-F160 HydrophobicContact CE-CD1 3.31Å; M128-F160 HydrophobicContact CE-CD2 3.61Å; M128-F160 HydrophobicContact CE-CE1 3.38Å; M128-F160 HydrophobicContact CE-CE2 3.67Å; M128-F160 HydrophobicContact CE-CG 3.43Å; M128-F160 VanDerWaalsContact CE-CG 3.43Å; M128-F160 HydrophobicContact CE-CZ 3.56Å; M128-F160 HydrophobicContact SD-CD1 4.22Å; M128-F160 HydrophobicContact SD-CE1 4.49Å
129	K	98.2	Very high	98	Very high	141 Å²	141	66 Å²	66	61%	0.613	30%	0.302	S	S	*	.	H	α-helix	trans	-63.2	-37.5	175.7	-75.6	173.8	179.2	-179.4	0	113.1	R125 I126 R127 R133	R125-K129 WeakPolarHBondContact O-CB 3.31Å; R125-K129 VanDerWaalsContact O-CG 3.26Å; R125-K129 WeakPolarHBondContact O-CG 3.39Å; R125-K129 PolarHBondContact O-N 3.46Å; I126-K129 PolarHBondContact O-N 2.9Å; R127-K129 VanDerWaalsContact C-N 3.29Å; R127-K129 PolarHBondContact O-N 3.36Å; K129-R133 WeakPolarHBondContact O-CB 3.48Å; K129-R133 PolarHBondContact O-N 2.93Å; K129-R133 VanDerWaalsContact O-N 3.12Å
130	K	98.5	Very high	97.9	Very high	23 Å²	23	66.9 Å²	66.9	10%	0.1	31%	0.314	C	S	.	.	H	α-helix	trans	-68.7	-43.5	175.8	-71.9	-179	-179.2	-177.2	0	111	E68 A71 V73 L74 I126 R127 M128 R133 F134 I138	E68-K130 VanDerWaalsContact O-CE 3.32Å; E68-K130 WeakPolarHBondContact O-CE 3.46Å; E68-K130 PolarHBondContact O-NZ 2.8Å; E68-K130 WeakPolarHBondContact OE1-CD 3.48Å; E68-K130 WeakPolarHBondContact OE1-CE 3.36Å; E68-K130 IonicContact OE1-NZ 2.78Å; E68-K130 PolarHBondContact OE1-NZ 2.87Å; A71-K130 VanDerWaalsContact O-CE 3.24Å; A71-K130 WeakPolarHBondContact O-CE 3.5Å; A71-K130 PolarHBondContact O-NZ 2.91Å; V73-K130 PolarHBondContact O-NZ 3.31Å; L74-K130 HydrophobicContact CB-CD 4.45Å; L74-K130 HydrophobicContact CD1-CB 4.11Å; L74-K130 HydrophobicContact CD1-CD 4.17Å; I126-K130 WeakPolarHBondContact O-CG 3.47Å; I126-K130 PolarHBondContact O-N 3.28Å; R127-K130 WeakPolarHBondContact O-CB 3.38Å; R127-K130 PolarHBondContact O-N 2.93Å; M128-K130 VanDerWaalsContact C-N 3.34Å; M128-K130 PolarHBondContact O-N 2.91Å; K130-R133 PolarHBondContact O-N 3.33Å; K130-F134 WeakPolarHBondContact O-CD2 3.27Å; K130-F134 PolarHBondContact O-N 3.45Å; K130-I138 WeakPolarHBondContact O-CD1 3.42Å
131	I	98.3	Very high	97.8	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61	-51.7	177.9	-64.7	161.8	0	0	0	110.4	L74 R127 M128 R133 F134 A135 I138 L153 E157 F160 A161	L74-I131 HydrophobicContact CD1-CG1 4.22Å; L74-I131 HydrophobicContact CD2-CD1 4.33Å; L74-I131 HydrophobicContact CD2-CG1 3.76Å; R127-I131 VanDerWaalsContact O-CG1 3.31Å; R127-I131 WeakPolarHBondContact O-CG1 3.36Å; R127-I131 PolarHBondContact O-N 2.88Å; M128-I131 PolarHBondContact O-N 3.15Å; M128-I131 HydrophobicContact SD-CD1 4.42Å; I131-R133 VanDerWaalsContact C-N 3.29Å; I131-R133 PolarHBondContact O-N 3.45Å; I131-F134 CarbonylContact O-C 3.58Å; I131-F134 PolarHBondContact O-N 3.4Å; I131-A135 WeakPolarHBondContact O-CA 3.41Å; I131-A135 WeakPolarHBondContact O-CB 3.32Å; I131-A135 PolarHBondContact O-N 3.04Å; I131-I138 HydrophobicContact CG1-CD1 4.42Å; I131-L153 HydrophobicContact CD1-CD2 3.64Å; I131-L153 HydrophobicContact CG1-CD2 3.75Å; I131-E157 HydrophobicContact CD1-CB 3.75Å; I131-E157 HydrophobicContact CD1-CG 3.75Å; I131-F160 HydrophobicContact CB-CD1 4.46Å; I131-F160 HydrophobicContact CG2-CD1 3.76Å; I131-F160 HydrophobicContact CG2-CE1 4.12Å; I131-A161 HydrophobicContact CG2-CB 3.62Å
132	E	97.6	Very high	97.6	Very high	141 Å²	141	68.2 Å²	68.2	66%	0.659	32%	0.316	S	S	*	.	H	α-helix	trans	-58.2	-41.2	178.2	-175.7	179.4	-165.1	0	0	111.9	M128 F160	M128-E132 VanDerWaalsContact O-CB 3.31Å; M128-E132 WeakPolarHBondContact O-CB 3.37Å; M128-E132 PolarHBondContact O-N 3.48Å; E132-F160 HydrophobicContact CB-CE1 4.21Å; E132-F160 HydrophobicContact CB-CZ 4.41Å
133	R	97.5	Very high	97.5	Very high	195 Å²	195	74.3 Å²	74.3	74%	0.736	34%	0.336	S	S	*	.	H	α-helix	trans	-74	-30.7	-177.6	-174.9	172.6	179.9	-178.4	0.4	114	K129 K130 I131	K129-R133 WeakPolarHBondContact O-CB 3.48Å; K129-R133 PolarHBondContact O-N 2.93Å; K129-R133 VanDerWaalsContact O-N 3.12Å; K130-R133 PolarHBondContact O-N 3.33Å; I131-R133 VanDerWaalsContact C-N 3.29Å; I131-R133 PolarHBondContact O-N 3.45Å
134	F	97	Very high	97.3	Very high	85 Å²	85	78.4 Å²	78.4	37%	0.373	37%	0.366	S	S	.	.	S	Bend	trans	-128.8	29.6	-170.7	-56	-69.5	0	0	0	112.8	K130 I131 E136 H137 I138	K130-F134 WeakPolarHBondContact O-CD2 3.27Å; K130-F134 PolarHBondContact O-N 3.45Å; I131-F134 CarbonylContact O-C 3.58Å; I131-F134 PolarHBondContact O-N 3.4Å; F134-E136 PolarHBondContact O-N 3.5Å; F134-H137 PolarHBondContact O-N 3.02Å; F134-H137 VanDerWaalsContact O-N 3.16Å; F134-I138 HydrophobicContact CB-CD1 3.84Å; F134-I138 HydrophobicContact CB-CG1 4.15Å; F134-I138 WeakPolarHBondContact O-CG1 3.39Å; F134-I138 PolarHBondContact O-N 3.36Å
135	A	97.4	Very high	97.1	Very high	26 Å²	26	76.3 Å²	76.3	22%	0.215	35%	0.353	C	S	.	.	H	α-helix	trans	-51.4	-50.4	-170.9	0	0	0	0	0	113.4	I131 H137 I138 L139	I131-A135 WeakPolarHBondContact O-CA 3.41Å; I131-A135 WeakPolarHBondContact O-CB 3.32Å; I131-A135 PolarHBondContact O-N 3.04Å; A135-H137 PolarHBondContact O-N 3.09Å; A135-I138 PolarHBondContact O-N 3.36Å; A135-L139 WeakPolarHBondContact O-CB 3.4Å; A135-L139 VanDerWaalsContact O-CG 3.31Å; A135-L139 WeakPolarHBondContact O-CG 3.38Å; A135-L139 PolarHBondContact O-N 3.4Å
136	E	97.1	Very high	96.8	Very high	172 Å²	172	73.6 Å²	73.6	80%	0.804	35%	0.35	S	S	*	.	H	α-helix	trans	-60.6	-45.5	-179.3	-65	-174.9	166.5	0	0	112.6	F134 A140	F134-E136 PolarHBondContact O-N 3.5Å; E136-A140 WeakPolarHBondContact O-CB 3.29Å; E136-A140 PolarHBondContact O-N 3.17Å
137	H	97.4	Very high	96.4	Very high	120 Å²	120	78.8 Å²	78.8	56%	0.556	39%	0.388	S	S	*	.	H	α-helix	trans	-63.8	-49	178.3	174.4	-77.5	0	0	0	110.9	F134 A135 L139 A140 E141	F134-H137 PolarHBondContact O-N 3.02Å; F134-H137 VanDerWaalsContact O-N 3.16Å; A135-H137 PolarHBondContact O-N 3.09Å; H137-L139 VanDerWaalsContact C-N 3.35Å; H137-L139 PolarHBondContact O-N 2.96Å; H137-A140 WeakPolarHBondContact O-CB 3.44Å; H137-A140 PolarHBondContact O-N 3.44Å; H137-A140 VanDerWaalsContact O-N 3.17Å; H137-E141 IonicContact CE1-OE2 3.65Å; H137-E141 IonicContact ND1-OE2 3.71Å; H137-E141 WeakPolarHBondContact O-CB 3.4Å; H137-E141 PolarHBondContact O-N 2.91Å
138	I	97.6	Very high	96.1	Very high	7 Å²	7	85.1 Å²	85.1	4%	0.036	42%	0.422	C	S	.	.	H	α-helix	trans	-62.6	-43.3	-178.9	-68.3	164.9	0	0	0	110.5	L74 K130 I131 F134 A135 A140 E141 E142 L153	L74-I138 HydrophobicContact CB-CD1 4.15Å; L74-I138 HydrophobicContact CD2-CD1 4.08Å; L74-I138 HydrophobicContact CD2-CG2 3.92Å; K130-I138 WeakPolarHBondContact O-CD1 3.42Å; I131-I138 HydrophobicContact CG1-CD1 4.42Å; F134-I138 HydrophobicContact CB-CD1 3.84Å; F134-I138 HydrophobicContact CB-CG1 4.15Å; F134-I138 WeakPolarHBondContact O-CG1 3.39Å; F134-I138 PolarHBondContact O-N 3.36Å; A135-I138 PolarHBondContact O-N 3.36Å; I138-A140 VanDerWaalsContact C-N 3.32Å; I138-A140 PolarHBondContact O-N 2.9Å; I138-E141 PolarHBondContact O-N 3.11Å; I138-E142 WeakPolarHBondContact O-CB 3.47Å; I138-E142 PolarHBondContact O-N 2.97Å; I138-L153 HydrophobicContact CG2-CD1 3.71Å; I138-L153 HydrophobicContact CG2-CD2 3.99Å; I138-L153 HydrophobicContact CG2-CG 4Å
139	L	97.8	Very high	95.7	Very high	17 Å²	17	86.2 Å²	86.2	9%	0.089	43%	0.427	C	S	.	.	H	α-helix	trans	-65.8	-34.4	176.1	-74.8	178.1	0	0	0	112.6	A135 H137 R143 Y158 A161 K162	A135-L139 WeakPolarHBondContact O-CB 3.4Å; A135-L139 VanDerWaalsContact O-CG 3.31Å; A135-L139 WeakPolarHBondContact O-CG 3.38Å; A135-L139 PolarHBondContact O-N 3.4Å; H137-L139 VanDerWaalsContact C-N 3.35Å; H137-L139 PolarHBondContact O-N 2.96Å; L139-R143 VanDerWaalsContact O-CG 3.3Å; L139-R143 WeakPolarHBondContact O-CG 3.47Å; L139-R143 VanDerWaalsContact O-CZ 3.32Å; L139-R143 PolarHBondContact O-N 3.01Å; L139-R143 VanDerWaalsContact O-N 3.1Å; L139-R143 PolarHBondContact O-NE 2.61Å; L139-R143 PolarHBondContact O-NH1 2.95Å; L139-Y158 HydrophobicContact CD2-CD2 3.8Å; L139-Y158 HydrophobicContact CD2-CE2 3.64Å; L139-A161 HydrophobicContact CD1-CB 4.3Å; L139-A161 WeakPolarHBondContact CD1-O 3.44Å; L139-A161 HydrophobicContact CD2-CB 3.85Å; L139-A161 HydrophobicContact CG-CB 3.95Å; L139-K162 HydrophobicContact CD1-CG 4.04Å; L139-K162 HydrophobicContact CD2-CG 4.12Å
140	A	97	Very high	95.4	Very high	45 Å²	45	83.2 Å²	83.2	37%	0.372	42%	0.424	S	S	.	.	H	α-helix	trans	-67	-45.8	174.5	0	0	0	0	0	111.3	E136 H137 I138 E142 R143 S144	E136-A140 WeakPolarHBondContact O-CB 3.29Å; E136-A140 PolarHBondContact O-N 3.17Å; H137-A140 WeakPolarHBondContact O-CB 3.44Å; H137-A140 PolarHBondContact O-N 3.44Å; H137-A140 VanDerWaalsContact O-N 3.17Å; I138-A140 VanDerWaalsContact C-N 3.32Å; I138-A140 PolarHBondContact O-N 2.9Å; A140-E142 VanDerWaalsContact C-N 3.34Å; A140-E142 PolarHBondContact O-N 3.31Å; A140-R143 VanDerWaalsContact CA-NH2 3.33Å; A140-R143 PolarHBondContact O-N 2.96Å; A140-S144 PolarHBondContact O-N 3.45Å; A140-S144 PolarHBondContact O-OG 2.92Å
141	E	95.6	Very high	95.2	Very high	55 Å²	55	85.2 Å²	85.2	26%	0.257	44%	0.439	S	S	.	.	H	α-helix	trans	-57.6	-48	175.5	-167.3	-171.9	145.2	0	0	110.9	H137 I138 R143 S144 R145 H152	H137-E141 IonicContact CE1-OE2 3.65Å; H137-E141 IonicContact ND1-OE2 3.71Å; H137-E141 WeakPolarHBondContact O-CB 3.4Å; H137-E141 PolarHBondContact O-N 2.91Å; I138-E141 PolarHBondContact O-N 3.11Å; E141-R143 VanDerWaalsContact C-N 3.3Å; E141-R143 PolarHBondContact O-N 3.29Å; E141-S144 WeakPolarHBondContact CA-OG 3.43Å; E141-S144 CarbonylContact O-C 3.52Å; E141-S144 PolarHBondContact O-N 2.77Å; E141-S144 PolarHBondContact O-OG 3.23Å; E141-R145 PolarHBondContact O-N 3.22Å; E141-R145 IonicContact OE1-CZ 3.28Å; E141-R145 IonicContact OE1-NH2 2.95Å; E141-R145 PolarHBondContact OE1-NH2 3.49Å; E141-H152 IonicContact OE1-CE1 2.95Å; E141-H152 PolarHBondContact OE1-CE1 3.5Å; E141-H152 IonicContact OE1-ND1 3.38Å; E141-H152 PolarHBondContact OE1-ND1 3.37Å
142	E	95.5	Very high	95	Very high	36 Å²	36	86.5 Å²	86.5	17%	0.168	45%	0.445	C	S	.	.	H	α-helix	trans	-64.7	-32.7	-179.7	-160.2	64.4	-169.1	0	0	112.6	I138 A140 R145 P151 H152 L153 Y158	I138-E142 WeakPolarHBondContact O-CB 3.47Å; I138-E142 PolarHBondContact O-N 2.97Å; A140-E142 VanDerWaalsContact C-N 3.34Å; A140-E142 PolarHBondContact O-N 3.31Å; E142-R145 IonicContact OE1-NE 3.64Å; E142-R145 IonicContact OE2-CZ 3.91Å; E142-R145 IonicContact OE2-NE 3.88Å; E142-R145 PolarHBondContact OE2-NE 2.94Å; E142-R145 IonicContact OE2-NH2 2.72Å; E142-R145 PolarHBondContact OE2-NH2 3.42Å; E142-P151 VanDerWaalsContact OE1-CA 3.32Å; E142-P151 WeakPolarHBondContact OE1-CA 3.34Å; E142-P151 WeakPolarHBondContact OE1-CB 3.24Å; E142-H152 PolarHBondContact OE1-N 3.25Å; E142-H152 PolarHBondContact OE2-N 3.33Å; E142-L153 HydrophobicContact CB-CD1 4.48Å; E142-L153 HydrophobicContact CG-CD1 4.33Å; E142-Y158 HydrophobicContact CG-CD2 4.33Å; E142-Y158 HydrophobicContact CG-CE2 4.37Å
143	R	94.6	Very high	95	Very high	160 Å²	160	80.1 Å²	80.1	60%	0.604	42%	0.415	S	S	*	.	H	α-helix	trans	-70.2	-33.2	172.7	-77.4	-175.5	-63.2	-95.3	2.4	113	L139 A140 E141 R145	L139-R143 VanDerWaalsContact O-CG 3.3Å; L139-R143 WeakPolarHBondContact O-CG 3.47Å; L139-R143 VanDerWaalsContact O-CZ 3.32Å; L139-R143 PolarHBondContact O-N 3.01Å; L139-R143 VanDerWaalsContact O-N 3.1Å; L139-R143 PolarHBondContact O-NE 2.61Å; L139-R143 PolarHBondContact O-NH1 2.95Å; A140-R143 VanDerWaalsContact CA-NH2 3.33Å; A140-R143 PolarHBondContact O-N 2.96Å; E141-R143 VanDerWaalsContact C-N 3.3Å; E141-R143 PolarHBondContact O-N 3.29Å; R143-R145 VanDerWaalsContact C-N 3.35Å
144	S	95.1	Very high	94.9	Very high	91 Å²	91	72.2 Å²	72.2	64%	0.636	39%	0.389	S	S	*	.	H	α-helix	trans	-86.4	-7	179.1	60.6	0	0	0	0	113.7	A140 E141	A140-S144 PolarHBondContact O-N 3.45Å; A140-S144 PolarHBondContact O-OG 2.92Å; E141-S144 WeakPolarHBondContact CA-OG 3.43Å; E141-S144 CarbonylContact O-C 3.52Å; E141-S144 PolarHBondContact O-N 2.77Å; E141-S144 PolarHBondContact O-OG 3.23Å
145	R	93	Very high	94.8	Very high	44 Å²	44	73.2 Å²	73.2	17%	0.166	40%	0.402	C	S	.	.	S	Bend	trans	-65.8	140.3	-176.6	-171.4	174.3	-57.7	-65.1	-8.6	111.1	E141 E142 R143 E149 H152	E141-R145 PolarHBondContact O-N 3.22Å; E141-R145 IonicContact OE1-CZ 3.28Å; E141-R145 IonicContact OE1-NH2 2.95Å; E141-R145 PolarHBondContact OE1-NH2 3.49Å; E142-R145 IonicContact OE1-NE 3.64Å; E142-R145 IonicContact OE2-CZ 3.91Å; E142-R145 IonicContact OE2-NE 3.88Å; E142-R145 PolarHBondContact OE2-NE 2.94Å; E142-R145 IonicContact OE2-NH2 2.72Å; E142-R145 PolarHBondContact OE2-NH2 3.42Å; R143-R145 VanDerWaalsContact C-N 3.35Å; R145-E149 HydrophobicContact CG-CB 3.92Å; R145-E149 IonicContact NH1-OE2 2.87Å; R145-E149 PolarHBondContact NH1-OE2 3.45Å; R145-H152 VanDerWaalsContact CZ-CD2 3.48Å; R145-H152 PolarHBondContact NH1-NE2 3.4Å; R145-H152 PolarHBondContact NH2-CD2 2.73Å; R145-H152 VanDerWaalsContact NH2-CD2 3.29Å; R145-H152 PolarHBondContact NH2-CE1 3.45Å; R145-H152 PolarHBondContact NH2-ND1 3Å; R145-H152 PolarHBondContact NH2-NE2 3.24Å
146	N	92.8	Very high	94.7	Very high	95 Å²	95	78.4 Å²	78.4	51%	0.508	42%	0.421	S	S	.	.			trans	-70.7	142.2	174	-60	-52.3	0	0	0	110.4	N148 E149	N146-N148 WeakPolarHBondContact CB-OD1 3.43Å; N146-N148 PolarHBondContact O-N 3Å; N146-N148 VanDerWaalsContact O-N 3.08Å; N146-E149 HydrophobicContact CB-CG 4.29Å; N146-E149 PolarHBondContact ND2-OE1 3.4Å; N146-E149 PolarHBondContact O-N 3.24Å
147	S	89.1	Confident	94.7	Very high	134 Å²	134	71.1 Å²	71.1	94%	0.937	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-11.9	-177.3	55.7	0	0	0	0	114.9
148	N	91.9	Very high	94.7	Very high	136 Å²	136	68.7 Å²	68.7	73%	0.727	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-7.4	175.1	66.5	-33.1	0	0	0	113.5	N146	N146-N148 WeakPolarHBondContact CB-OD1 3.43Å; N146-N148 PolarHBondContact O-N 3Å; N146-N148 VanDerWaalsContact O-N 3.08Å
149	E	90.9	Very high	94.7	Very high	88 Å²	88	73.6 Å²	73.6	41%	0.411	40%	0.399	S	S	.	.	S	Bend	trans	-93.6	146.9	177.5	-68.4	172.1	-158	0	0	111	R145 N146	R145-E149 HydrophobicContact CG-CB 3.92Å; R145-E149 IonicContact NH1-OE2 2.87Å; R145-E149 PolarHBondContact NH1-OE2 3.45Å; N146-E149 HydrophobicContact CB-CG 4.29Å; N146-E149 PolarHBondContact ND2-OE1 3.4Å; N146-E149 PolarHBondContact O-N 3.24Å
150	S	92	Very high	94.7	Very high	78 Å²	78	76.4 Å²	76.4	55%	0.545	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-68.2	138	175.4	-59.6	0	0	0	0	111.3	T76	T76-S150 VanDerWaalsContact CG2-CB 3.4Å
151	P	93.4	Very high	94.7	Very high	65 Å²	65	74.7 Å²	74.7	42%	0.422	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-67	146.8	-176.9	28.3	-35.6	0	0	0	112.1	T76 A77 E142 L153	T76-P151 WeakPolarHBondContact CG2-O 3.35Å; A77-P151 PolarHBondContact N-O 2.97Å; E142-P151 VanDerWaalsContact OE1-CA 3.32Å; E142-P151 WeakPolarHBondContact OE1-CA 3.34Å; E142-P151 WeakPolarHBondContact OE1-CB 3.24Å; P151-L153 VanDerWaalsContact C-N 3.29Å
152	H	94.8	Very high	94.7	Very high	27 Å²	27	77.9 Å²	77.9	13%	0.125	41%	0.41	C	S	.	.	S	Bend	trans	-79.5	-17	173	-78.4	-169.7	0	0	0	112.9	L74 R127 E141 E142 R145	L74-H152 HydrophobicContact CD2-CB 4.39Å; L74-H152 PolarHBondContact O-ND1 2.92Å; R127-H152 PolarHBondContact NH2-O 3.02Å; E141-H152 IonicContact OE1-CE1 2.95Å; E141-H152 PolarHBondContact OE1-CE1 3.5Å; E141-H152 IonicContact OE1-ND1 3.38Å; E141-H152 PolarHBondContact OE1-ND1 3.37Å; E142-H152 PolarHBondContact OE1-N 3.25Å; E142-H152 PolarHBondContact OE2-N 3.33Å; R145-H152 VanDerWaalsContact CZ-CD2 3.48Å; R145-H152 PolarHBondContact NH1-NE2 3.4Å; R145-H152 PolarHBondContact NH2-CD2 2.73Å; R145-H152 VanDerWaalsContact NH2-CD2 3.29Å; R145-H152 PolarHBondContact NH2-CE1 3.45Å; R145-H152 PolarHBondContact NH2-ND1 3Å; R145-H152 PolarHBondContact NH2-NE2 3.24Å
153	L	97.1	Very high	94.4	Very high	7 Å²	7	83 Å²	83	4%	0.037	45%	0.45	C	S	.	.	S	Bend	trans	-121	138.6	-176.5	-64.8	167.5	0	0	0	110	L74 I131 I138 E142 P151 E157 Y158	L74-L153 HydrophobicContact CD2-CD2 3.59Å; L74-L153 HydrophobicContact CD2-CG 4.31Å; I131-L153 HydrophobicContact CD1-CD2 3.64Å; I131-L153 HydrophobicContact CG1-CD2 3.75Å; I138-L153 HydrophobicContact CG2-CD1 3.71Å; I138-L153 HydrophobicContact CG2-CD2 3.99Å; I138-L153 HydrophobicContact CG2-CG 4Å; E142-L153 HydrophobicContact CB-CD1 4.48Å; E142-L153 HydrophobicContact CG-CD1 4.33Å; P151-L153 VanDerWaalsContact C-N 3.29Å; L153-E157 WeakPolarHBondContact CA-OE2 3.37Å; L153-E157 HydrophobicContact CB-CB 4.14Å; L153-E157 HydrophobicContact CD2-CB 3.75Å; L153-Y158 HydrophobicContact CD1-CD2 3.84Å
154	T	95.8	Very high	94.4	Very high	29 Å²	29	79.2 Å²	79.2	18%	0.178	44%	0.442	C	S	.	.			trans	-67.3	168	158.1	79.6	0	0	0	0	110.1	A77 E156 E157 Y158	A77-T154 HydrophobicContact CB-CG2 3.82Å; T154-E156 VanDerWaalsContact C-N 3.25Å; T154-E156 WeakPolarHBondContact CB-OE2 3.37Å; T154-E156 PolarHBondContact O-N 2.97Å; T154-E156 PolarHBondContact OG1-N 3.35Å; T154-E156 PolarHBondContact OG1-OE2 3.47Å; T154-E157 PolarHBondContact N-OE2 3.09Å; T154-E157 PolarHBondContact O-N 3.24Å; T154-E157 WeakPolarHBondContact OG1-CG 3.33Å; T154-E157 PolarHBondContact OG1-N 3.49Å; T154-Y158 WeakPolarHBondContact O-CB 3.35Å; T154-Y158 PolarHBondContact O-N 3.34Å
155	V	94.6	Very high	94.4	Very high	106 Å²	106	78.5 Å²	78.5	64%	0.642	43%	0.432	S	S	*	.	H	α-helix	trans	-57.3	-43	176.3	178.6	0	0	0	0	110.7	Y158 L159	V155-Y158 PolarHBondContact O-N 3.08Å; V155-L159 HydrophobicContact CG1-CD1 4.38Å; V155-L159 VanDerWaalsContact O-CG 3.31Å; V155-L159 WeakPolarHBondContact O-CG 3.33Å; V155-L159 PolarHBondContact O-N 2.89Å
156	E	96	Very high	94.4	Very high	134 Å²	134	80.4 Å²	80.4	63%	0.626	45%	0.446	S	S	*	.	H	α-helix	trans	-66.8	-43.1	179.3	-56.5	75.7	-165.7	0	0	111.8	T154 Y158 L159 F160	T154-E156 VanDerWaalsContact C-N 3.25Å; T154-E156 WeakPolarHBondContact CB-OE2 3.37Å; T154-E156 PolarHBondContact O-N 2.97Å; T154-E156 PolarHBondContact OG1-N 3.35Å; T154-E156 PolarHBondContact OG1-OE2 3.47Å; E156-Y158 VanDerWaalsContact C-N 3.31Å; E156-Y158 PolarHBondContact O-N 2.81Å; E156-L159 PolarHBondContact O-N 3.24Å; E156-F160 WeakPolarHBondContact O-CB 3.31Å; E156-F160 PolarHBondContact O-N 3.03Å
157	E	97.7	Very high	94.5	Very high	20 Å²	20	79.6 Å²	79.6	9%	0.093	44%	0.443	C	S	.	.	H	α-helix	trans	-63.9	-38.1	176.7	-73.2	177.5	151.1	0	0	111.6	R127 I131 L153 T154 F160 A161	R127-E157 IonicContact CZ-OE1 2.61Å; R127-E157 IonicContact CZ-OE2 3.96Å; R127-E157 IonicContact NE-OE1 2.77Å; R127-E157 PolarHBondContact NE-OE1 3.43Å; R127-E157 IonicContact NE-OE2 3.62Å; R127-E157 IonicContact NH2-OE1 2.87Å; R127-E157 PolarHBondContact NH2-OE1 3.49Å; R127-E157 IonicContact NH2-OE2 3.02Å; R127-E157 PolarHBondContact NH2-OE2 2.92Å; I131-E157 HydrophobicContact CD1-CB 3.75Å; I131-E157 HydrophobicContact CD1-CG 3.75Å; L153-E157 WeakPolarHBondContact CA-OE2 3.37Å; L153-E157 HydrophobicContact CB-CB 4.14Å; L153-E157 HydrophobicContact CD2-CB 3.75Å; T154-E157 PolarHBondContact N-OE2 3.09Å; T154-E157 PolarHBondContact O-N 3.24Å; T154-E157 WeakPolarHBondContact OG1-CG 3.33Å; T154-E157 PolarHBondContact OG1-N 3.49Å; E157-F160 PolarHBondContact O-N 3.49Å; E157-A161 WeakPolarHBondContact O-CB 3.26Å; E157-A161 PolarHBondContact O-N 3.42Å
158	Y	97	Very high	94.9	Very high	68 Å²	68	76.2 Å²	76.2	27%	0.267	41%	0.412	S	S	.	.	H	α-helix	trans	-66.5	-39.7	175.3	-178.3	-95.2	0	0	0	112.5	L139 E142 L153 T154 V155 E156 A161 K162	L139-Y158 HydrophobicContact CD2-CD2 3.8Å; L139-Y158 HydrophobicContact CD2-CE2 3.64Å; E142-Y158 HydrophobicContact CG-CD2 4.33Å; E142-Y158 HydrophobicContact CG-CE2 4.37Å; L153-Y158 HydrophobicContact CD1-CD2 3.84Å; T154-Y158 WeakPolarHBondContact O-CB 3.35Å; T154-Y158 PolarHBondContact O-N 3.34Å; V155-Y158 PolarHBondContact O-N 3.08Å; E156-Y158 VanDerWaalsContact C-N 3.31Å; E156-Y158 PolarHBondContact O-N 2.81Å; Y158-A161 PolarHBondContact O-N 3.4Å; Y158-K162 HydrophobicContact CD1-CD 4.34Å; Y158-K162 HydrophobicContact CE1-CD 3.82Å; Y158-K162 VanDerWaalsContact CZ-NZ 3.33Å; Y158-K162 PolarHBondContact O-N 3.15Å; Y158-K162 WeakPolarHBondContact OH-CE 3.44Å; Y158-K162 PolarHBondContact OH-NZ 3.47Å
159	L	96.9	Very high	95.1	Very high	110 Å²	110	72.2 Å²	72.2	58%	0.576	39%	0.391	S	S	*	.	H	α-helix	trans	-65.2	-41.9	173.7	-69.7	173.8	0	0	0	111.4	V155 E156 K162 S163	V155-L159 HydrophobicContact CG1-CD1 4.38Å; V155-L159 VanDerWaalsContact O-CG 3.31Å; V155-L159 WeakPolarHBondContact O-CG 3.33Å; V155-L159 PolarHBondContact O-N 2.89Å; E156-L159 PolarHBondContact O-N 3.24Å; L159-K162 PolarHBondContact O-N 3.27Å; L159-S163 PolarHBondContact O-N 2.98Å
160	F	97.2	Very high	95.4	Very high	77 Å²	77	71.1 Å²	71.1	34%	0.338	39%	0.389	S	S	.	.	H	α-helix	trans	-63.2	-39.8	174.9	175.2	-99.1	0	0	0	112.5	M128 I131 E132 E156 E157 K162 S163	M128-F160 HydrophobicContact CE-CB 4.25Å; M128-F160 HydrophobicContact CE-CD1 3.31Å; M128-F160 HydrophobicContact CE-CD2 3.61Å; M128-F160 HydrophobicContact CE-CE1 3.38Å; M128-F160 HydrophobicContact CE-CE2 3.67Å; M128-F160 HydrophobicContact CE-CG 3.43Å; M128-F160 VanDerWaalsContact CE-CG 3.43Å; M128-F160 HydrophobicContact CE-CZ 3.56Å; M128-F160 HydrophobicContact SD-CD1 4.22Å; M128-F160 HydrophobicContact SD-CE1 4.49Å; I131-F160 HydrophobicContact CB-CD1 4.46Å; I131-F160 HydrophobicContact CG2-CD1 3.76Å; I131-F160 HydrophobicContact CG2-CE1 4.12Å; E132-F160 HydrophobicContact CB-CE1 4.21Å; E132-F160 HydrophobicContact CB-CZ 4.41Å; E156-F160 WeakPolarHBondContact O-CB 3.31Å; E156-F160 PolarHBondContact O-N 3.03Å; E157-F160 PolarHBondContact O-N 3.49Å; F160-K162 PolarHBondContact O-N 3.01Å; F160-S163 PolarHBondContact O-N 3.49Å; F160-S163 PolarHBondContact O-OG 2.96Å
161	A	97.1	Very high	95.6	Very high	8 Å²	8	70.5 Å²	70.5	7%	0.066	38%	0.378	C	S	.	.	H	α-helix	trans	-64.7	-21.9	177.7	0	0	0	0	0	113.3	I131 L139 E157 Y158	I131-A161 HydrophobicContact CG2-CB 3.62Å; L139-A161 HydrophobicContact CD1-CB 4.3Å; L139-A161 WeakPolarHBondContact CD1-O 3.44Å; L139-A161 HydrophobicContact CD2-CB 3.85Å; L139-A161 HydrophobicContact CG-CB 3.95Å; E157-A161 WeakPolarHBondContact O-CB 3.26Å; E157-A161 PolarHBondContact O-N 3.42Å; Y158-A161 PolarHBondContact O-N 3.4Å
162	K	95.8	Very high	95.8	Very high	122 Å²	122	71 Å²	71	53%	0.53	37%	0.374	S	S	.	.	H	α-helix	trans	-90.5	-15.7	-179.4	-79.6	-173	170.9	179.4	0	114.8	L139 Y158 L159 F160	L139-K162 HydrophobicContact CD1-CG 4.04Å; L139-K162 HydrophobicContact CD2-CG 4.12Å; Y158-K162 HydrophobicContact CD1-CD 4.34Å; Y158-K162 HydrophobicContact CE1-CD 3.82Å; Y158-K162 VanDerWaalsContact CZ-NZ 3.33Å; Y158-K162 PolarHBondContact O-N 3.15Å; Y158-K162 WeakPolarHBondContact OH-CE 3.44Å; Y158-K162 PolarHBondContact OH-NZ 3.47Å; L159-K162 PolarHBondContact O-N 3.27Å; F160-K162 PolarHBondContact O-N 3.01Å
163	S	89.9	Confident	95.9	Very high	144 Å²	144	75 Å²	75	100%	1.007	40%	0.396	S	S	*	.			trans	-79	0	-177.9	63.6	0	0	0	0	111.6	L159 F160	L159-S163 PolarHBondContact O-N 2.98Å; F160-S163 PolarHBondContact O-N 3.49Å; F160-S163 PolarHBondContact O-OG 2.96Å

Retrieved 163 of 163 residues in 127.7 ms (Link to these results)

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