A0A3Q0KL40_SCHMA Loading...

Putative orthopedia homeobox protein

AlphaFold DB , UniProt , Accession A0A3Q0KL40, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,097 aa.

						>A0A3Q0KL40_SCHMA|A0A3Q0KL40
MLNLKTDNISLLTIMNTGNTNNTTITTTTNNDTTNNSNIGDVKFTDNVNIYSSTNSRNYHELCSISELDEHLTHSVICSKDDNINKNEEGVTNLTYPFNVSISYSYPHYYSHPYQRFYVQSSNQQSSNDHLTQNEIITTLNKLNSTTTGKTSVSTLTTTTTTTTTTISTATTISTAQLTRNNIYSSLLVPQFQTTKLNMNYPELSLHNLSSNNLNETYLNDLKLIKTTISDYLPERTVGIQSNHWCLTSNEPRNMVHKRQINNGGNIIIENGYNHVDGVHRHRDNNEDVDNEEEIYDESEIDDESDLAHLSRAQNNKSLSYEDKQHSMYESEYSNDSENSMCSEINIRLNPVNRINHETVGRVKPDSSTSPLSSASSHWSNKYEHKSLNYHTPVSRNSQSSSILIHKSSSINNNNSVNENINGISNNGIDDSTNINNLHLCEETNMLNSTIQTRIHYINYSDNLTLDKNNNQISTYTNGVLLQQSNPQQHRQHLSTIANIAKFPQDQTLNNLNKFFGYLDSKSPVETKQFHSTSLENYNIDDGNSENGHHKSDQLMRLFNPPKLNNSSPFEIKCQNICSTQPHLFQSQQTQQQISHSTPIYHTQQENYTDYENNINSMDKLQACIQSTYIGTTHTTDSSTYSQLEDLNLTYDSTGPSSNLSSNETSSECLNYEKCNDICNKSGNVTSNTNLTNTINNYNVISSHNNNCNNNTGICSVSDMKLSSSNTCVKQKRHRTRFTPNQLNELERAFSKTHYPDIFMREELALRIGLTESRVQVWFQNRRAKWKKRKKSGTPFRMTINSNSLTKNVSLTTNNSMKNITNGDNNYNNIASSNNFNPYIQQLVPTAQTRSLDGLNCSRLDINPTNSFLLQSPTTYFGDSSSNTNCPLFEHSRSSTRKPQANSYPFFSQLEHITDNMKVNPYFVESNSIGPFDQILQQRLGLPQMHNIPEVSTLNQIANQMDSQNDRQDLDTAQGWHRKIDSLITKQLNSMHQHEQNEKSSTCDFNLFSTTNPCDLLRNRVKNLNEIVTIPPNLINQNSSNMDSMDFPCTTGTTTTITNSTDDIITTTAEQCNALSNLMLTKISKEELNNFINSPSY
					

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Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.3	Very low	32.2	Very low	243 Å²	243	158.9 Å²	158.9	100%	1.197	84%	0.842	S	S	*	*				0	132.4	0	-66.8	173.3	71.3	0	0	108.1
2	L	32.7	Very low	31.9	Very low	168 Å²	168	157.7 Å²	157.7	88%	0.88	84%	0.835	S	S	*	*			trans	-107.4	137.6	172.4	-78.3	160	0	0	0	108.1	L4	L2-L4 PolarHBondContact O-N 3.28Å
3	N	31.3	Very low	31.5	Very low	163 Å²	163	154.4 Å²	154.4	87%	0.872	83%	0.825	S	S	*	*			trans	-78.5	99	173.2	-83.5	-14.9	0	0	0	109.6	K5	N3-K5 PolarHBondContact O-N 3.12Å
4	L	35.3	Very low	31.5	Very low	160 Å²	160	155.7 Å²	155.7	84%	0.838	83%	0.83	S	S	*	*			trans	-78.5	101.2	157.7	-79.4	166.3	0	0	0	108.2	L2 T6	L2-L4 PolarHBondContact O-N 3.28Å; L4-T6 PolarHBondContact O-N 2.75Å
5	K	34.2	Very low	31.1	Very low	174 Å²	174	155.9 Å²	155.9	76%	0.757	83%	0.826	S	S	*	*			trans	-77.2	112.5	158.4	-89.8	-165.4	165.6	-154.6	0	108.3	N3	N3-K5 PolarHBondContact O-N 3.12Å
6	T	35.4	Very low	31.3	Very low	127 Å²	127	156.7 Å²	156.7	78%	0.779	83%	0.831	S	S	*	*			trans	-102.2	87.2	161.7	51.9	0	0	0	0	108.3	L4	L4-T6 PolarHBondContact O-N 2.75Å
7	D	29	Very low	31.1	Very low	115 Å²	115	155.9 Å²	155.9	62%	0.615	83%	0.834	S	S	*	*			trans	-68.9	164.6	158.9	-62.1	-56.9	0	0	0	108.7
8	N	32.8	Very low	31.3	Very low	155 Å²	155	151.3 Å²	151.3	83%	0.829	83%	0.83	S	S	*	*			trans	81.3	68.8	-175.1	-51.8	-34.9	0	0	0	118
9	I	32.9	Very low	31.3	Very low	171 Å²	171	151.3 Å²	151.3	88%	0.877	83%	0.828	S	S	*	*			trans	-127.6	97.4	132.5	-58.1	-177.4	0	0	0	108.4
10	S	27.8	Very low	31.5	Very low	114 Å²	114	148.7 Å²	148.7	80%	0.797	82%	0.817	S	S	*	*			trans	-110.5	106.8	163.5	-73.2	0	0	0	0	108.3
11	L	30.7	Very low	31.6	Very low	158 Å²	158	148 Å²	148	83%	0.827	81%	0.813	S	S	*	*			trans	-162.6	131.9	154.7	-112.4	168.2	0	0	0	112.7
12	L	28.7	Very low	31.5	Very low	144 Å²	144	143.4 Å²	143.4	75%	0.754	79%	0.793	S	S	*	*			trans	65.2	83	149.7	-134.6	65.7	0	0	0	119.8
13	T	26.3	Very low	31.5	Very low	115 Å²	115	141.3 Å²	141.3	71%	0.706	79%	0.787	S	S	*	*				39	113.5	111.3	-48.1	0	0	0	0	118.8
14	I	31.3	Very low	31.4	Very low	173 Å²	173	139.1 Å²	139.1	89%	0.887	78%	0.78	S	S	*	*				-147	150	124.1	-103.3	153.6	0	0	0	108.6
15	M	26.6	Very low	31	Very low	158 Å²	158	138.5 Å²	138.5	78%	0.778	78%	0.776	S	S	*	*			trans	-83.8	147.5	-167.2	-56.6	172.7	-70.4	0	0	112.7
16	N	33	Very low	30.6	Very low	169 Å²	169	135.7 Å²	135.7	90%	0.904	77%	0.774	S	S	*	*				-159.6	126.5	129.7	-99.5	-28.8	0	0	0	110.8
17	T	28.5	Very low	30.2	Very low	144 Å²	144	135.2 Å²	135.2	88%	0.883	77%	0.77	S	S	*	*			trans	-107.8	143	-177.3	46	0	0	0	0	111
18	G	34.5	Very low	30.2	Very low	73 Å²	73	136 Å²	136	75%	0.753	78%	0.779	S	S	*	*			trans	149.3	76.3	-177	0	0	0	0	0	111.2
19	N	31.4	Very low	30.1	Very low	150 Å²	150	133.7 Å²	133.7	80%	0.802	77%	0.771	S	S	*	*				82.8	148.6	57.1	-162.5	20.1	0	0	0	113.3
20	T	34.9	Very low	30.2	Very low	99 Å²	99	131.6 Å²	131.6	61%	0.607	76%	0.762	S	S	*	*			trans	77	105.2	174	62.2	0	0	0	0	119.8
21	N	35	Very low	30.4	Very low	136 Å²	136	132.3 Å²	132.3	73%	0.727	76%	0.757	S	S	*	*				69.3	129.1	124.2	-51.8	-15.5	0	0	0	118.9
22	N	29	Very low	30.5	Very low	145 Å²	145	131.1 Å²	131.1	78%	0.775	75%	0.751	S	S	*	*				50.7	119.6	69.1	-60.4	-15.8	0	0	0	110.9
23	T	33.1	Very low	30.6	Very low	125 Å²	125	129.3 Å²	129.3	77%	0.767	75%	0.746	S	S	*	*			cis	-150	150	44.9	33.5	0	0	0	0	111.2
24	T	29.6	Very low	30.8	Very low	116 Å²	116	129.1 Å²	129.1	71%	0.712	75%	0.745	S	S	*	*				52	119.6	78.9	-33.4	0	0	0	0	111.3
25	I	26.2	Very low	30.7	Very low	148 Å²	148	126.7 Å²	126.7	76%	0.759	73%	0.734	S	S	*	*			cis	-169.9	-178.8	-6.9	-127.8	169.9	0	0	0	105.1
26	T	26.3	Very low	30.8	Very low	115 Å²	115	125.9 Å²	125.9	71%	0.706	73%	0.733	S	S	*	*			trans	-42.9	161.1	176.2	61	0	0	0	0	117.7
27	T	27.5	Very low	30.7	Very low	116 Å²	116	122.7 Å²	122.7	71%	0.712	72%	0.724	S	S	*	*				-173.9	126.9	111.6	31	0	0	0	0	114.1
28	T	28.1	Very low	30.7	Very low	131 Å²	131	122.6 Å²	122.6	80%	0.804	72%	0.718	S	S	*	*			trans	60.8	170	146.9	69.4	0	0	0	0	118
29	T	30.4	Very low	30.4	Very low	108 Å²	108	127.2 Å²	127.2	66%	0.663	72%	0.724	S	S	*	*			cis	-134.7	145.8	-2.7	43.2	0	0	0	0	106.4
30	N	34.4	Very low	30.5	Very low	127 Å²	127	122.7 Å²	122.7	68%	0.679	71%	0.712	S	S	*	*				165.9	134	87.6	-94.8	-44.7	0	0	0	105.2
31	N	31.9	Very low	30.5	Very low	128 Å²	128	124.2 Å²	124.2	68%	0.684	72%	0.717	S	S	*	*				67.2	144.1	84.6	-75	18.8	0	0	0	115.1
32	D	33.9	Very low	30.4	Very low	134 Å²	134	123.2 Å²	123.2	72%	0.717	72%	0.715	S	S	*	*			trans	61	127.7	156.4	-52.6	-23.7	0	0	0	118.3
33	T	31.1	Very low	30.6	Very low	106 Å²	106	123.6 Å²	123.6	65%	0.65	71%	0.71	S	S	*	*			cis	168.7	156.9	-12.4	27.1	0	0	0	0	104.7
34	T	30.6	Very low	30.8	Very low	110 Å²	110	125.3 Å²	125.3	68%	0.675	71%	0.707	S	S	*	*			trans	61.6	131	147.7	52.6	0	0	0	0	122.2
35	N	29.3	Very low	31.1	Very low	122 Å²	122	124.7 Å²	124.7	65%	0.652	70%	0.703	S	S	*	*			trans	73.1	110.1	130.8	-62.6	-9.1	0	0	0	121.7
36	N	27.2	Very low	31.5	Very low	141 Å²	141	123.7 Å²	123.7	75%	0.754	70%	0.699	S	S	*	*				72.1	172.3	123.3	-58	-20.4	0	0	0	119.4
37	S	31.8	Very low	31.9	Very low	103 Å²	103	124.9 Å²	124.9	72%	0.72	70%	0.701	S	S	*	*			trans	63.7	108.6	-175.2	24.9	0	0	0	0	114.6
38	N	28.4	Very low	32.1	Very low	142 Å²	142	124.1 Å²	124.1	76%	0.759	70%	0.696	S	S	*	*				84	135	56.2	-71.1	-15.4	0	0	0	112.9
39	I	28.8	Very low	32.3	Very low	170 Å²	170	124.2 Å²	124.2	87%	0.872	69%	0.692	S	S	*	*			trans	71.2	135.5	163.6	-56.9	146	0	0	0	113.9
40	G	33.7	Very low	32.3	Very low	54 Å²	54	124.5 Å²	124.5	56%	0.557	69%	0.688	S	S	*	*			cis	-146.2	169	-0.7	0	0	0	0	0	111.1
41	D	33.6	Very low	32.1	Very low	132 Å²	132	127.8 Å²	127.8	71%	0.706	69%	0.692	S	S	*	*				63	122.4	94.5	-70.6	-62.9	0	0	0	112.8
42	V	34.1	Very low	32	Very low	114 Å²	114	126.2 Å²	126.2	69%	0.691	69%	0.692	S	S	*	*			cis	-147.5	126.3	28.4	169.6	0	0	0	0	108.2
43	K	33.7	Very low	31.7	Very low	154 Å²	154	124 Å²	124	67%	0.67	69%	0.687	S	S	*	*				49.9	154.4	102.6	-47.1	147.9	152.5	160.8	0	115.7
44	F	35.3	Very low	31.8	Very low	161 Å²	161	125.2 Å²	125.2	71%	0.706	69%	0.694	S	S	*	*			cis	-158.7	132.4	30.6	-120.8	-81.6	0	0	0	110.7
45	T	36.2	Very low	31.6	Very low	103 Å²	103	127.2 Å²	127.2	63%	0.632	70%	0.7	S	S	*	*			trans	58.9	155.5	140.5	53.3	0	0	0	0	123
46	D	35.8	Very low	31.8	Very low	126 Å²	126	126.5 Å²	126.5	67%	0.674	71%	0.705	S	S	*	*			cis	-158.2	173	-2.9	-122.9	-28.2	0	0	0	115.7
47	N	33.8	Very low	31.8	Very low	140 Å²	140	130.2 Å²	130.2	75%	0.749	71%	0.709	S	S	*	*			trans	75.4	116.6	164.6	-58.3	-47.7	0	0	0	118
48	V	32.9	Very low	31.6	Very low	100 Å²	100	131.3 Å²	131.3	61%	0.606	71%	0.706	S	S	*	*			cis	84.8	128.9	37.1	180	0	0	0	0	111.8	I50	V48-I50 HydrophobicContact CG1-CD1 3.95Å
49	N	32.5	Very low	31.6	Very low	134 Å²	134	134.6 Å²	134.6	72%	0.717	71%	0.71	S	S	*	*			cis	-112.8	157.9	17.2	-67.8	-83.6	0	0	0	112.6
50	I	29.9	Very low	31.7	Very low	113 Å²	113	133.4 Å²	133.4	58%	0.579	70%	0.7	S	S	*	*			cis	68.6	131.9	42.7	-39.8	164	0	0	0	111.1	V48	V48-I50 HydrophobicContact CG1-CD1 3.95Å
51	Y	30.6	Very low	31.4	Very low	196 Å²	196	137.6 Å²	137.6	77%	0.769	71%	0.705	S	S	*	*			cis	-120.2	151.3	17.3	-73.4	-97.8	0	0	0	111.6
52	S	29.3	Very low	31.1	Very low	96 Å²	96	138 Å²	138	67%	0.671	71%	0.706	S	S	*	*				70.6	149.8	57.5	128.6	0	0	0	0	114.2
53	S	27.3	Very low	30.7	Very low	88 Å²	88	138.1 Å²	138.1	62%	0.615	71%	0.711	S	S	*	*			cis	177.5	-177.2	-19.9	51.5	0	0	0	0	108.7
54	T	32.3	Very low	30.2	Very low	131 Å²	131	136.6 Å²	136.6	80%	0.804	72%	0.72	S	S	*	*			trans	70.1	126	175.2	69	0	0	0	0	115.5
55	N	27.7	Very low	30	Very low	151 Å²	151	136.8 Å²	136.8	81%	0.807	73%	0.727	S	S	*	*			cis	94.4	142.3	13.9	-158.6	15.1	0	0	0	115.8
56	S	32.3	Very low	29.5	Very low	108 Å²	108	136.3 Å²	136.3	76%	0.755	73%	0.727	S	S	*	*			trans	70.7	156.1	178.4	79.8	0	0	0	0	117.3
57	R	27.1	Very low	29.2	Very low	219 Å²	219	138.8 Å²	138.8	83%	0.826	74%	0.735	S	S	*	*			cis	-169.6	146.1	-45.7	-131	-174.5	-178.4	159.1	-0.3	109.9
58	N	27.4	Very low	29.1	Very low	125 Å²	125	140.5 Å²	140.5	67%	0.668	74%	0.743	S	S	*	*			trans	65.9	168.2	161	-59.1	1.4	0	0	0	118.2
59	Y	29.7	Very low	28.9	Very low	211 Å²	211	142.8 Å²	142.8	83%	0.827	75%	0.752	S	S	*	*			trans	68.3	145.9	179.9	-56.2	-76.9	0	0	0	116.1
60	H	30	Very low	29	Very low	145 Å²	145	144 Å²	144	67%	0.671	75%	0.754	S	S	*	*			cis	-154.7	170.3	-35.8	-143.4	-121.3	0	0	0	107.8
61	E	28.3	Very low	29	Very low	142 Å²	142	145.8 Å²	145.8	66%	0.664	76%	0.759	S	S	*	*			trans	17.1	126.8	153.3	-78.3	174.2	138.2	0	0	123
62	L	26.1	Very low	29.1	Very low	140 Å²	140	145 Å²	145	73%	0.733	77%	0.767	S	S	*	*				80.6	164.2	129.9	-64.6	171.4	0	0	0	121.4
63	C	27	Very low	29	Very low	117 Å²	117	145.8 Å²	145.8	79%	0.791	77%	0.768	S	S	*	*			trans	69.2	97.9	166.5	-71.7	0	0	0	0	118.8
64	S	23.7	Very low	29.1	Very low	123 Å²	123	150 Å²	150	86%	0.86	78%	0.778	S	S	*	*			trans	-54.6	139.3	150.9	-29.6	0	0	0	0	111.4
65	I	29.3	Very low	28.8	Very low	165 Å²	165	148.1 Å²	148.1	85%	0.846	77%	0.77	S	S	*	*			trans	-144.2	141.8	153.8	-96.6	152.2	0	0	0	106.7
66	S	25.8	Very low	29	Very low	92 Å²	92	146.9 Å²	146.9	64%	0.643	77%	0.768	S	S	*	*			trans	-96.6	-173.3	176.5	45.4	0	0	0	0	111.1
67	E	29.3	Very low	28.9	Very low	178 Å²	178	149.2 Å²	149.2	83%	0.832	77%	0.77	S	S	*	*			trans	74.5	110.2	168.1	-56.5	169.1	-178.2	0	0	116.3
68	L	32.9	Very low	28.8	Very low	176 Å²	176	144.6 Å²	144.6	92%	0.921	77%	0.77	S	S	*	*				-165.1	126.7	115.8	-100.9	164.5	0	0	0	108.6
69	D	28.5	Very low	29.1	Very low	149 Å²	149	144.3 Å²	144.3	80%	0.797	78%	0.778	S	S	*	*			trans	-108.7	-156.4	176.4	-158	-22.7	0	0	0	108.5
70	E	33.8	Very low	29	Very low	160 Å²	160	142.5 Å²	142.5	75%	0.748	77%	0.774	S	S	*	*			trans	103.6	96.5	167.7	-56	-154.1	130	0	0	117.8
71	H	30.3	Very low	29.3	Very low	150 Å²	150	143 Å²	143	69%	0.694	78%	0.782	S	S	*	*				47.2	114.7	122.2	-62.8	-65.4	0	0	0	120.7
72	L	33.1	Very low	29.5	Very low	179 Å²	179	142.5 Å²	142.5	94%	0.937	78%	0.784	S	S	*	*			trans	-148	93.1	137.6	-131	143.3	0	0	0	112.6
73	T	26.1	Very low	29.9	Very low	112 Å²	112	142.4 Å²	142.4	69%	0.687	78%	0.784	S	S	*	*			trans	-128.1	116.9	171.8	49.8	0	0	0	0	109.8
74	H	30.7	Very low	30.1	Very low	176 Å²	176	143.3 Å²	143.3	82%	0.815	78%	0.78	S	S	*	*			trans	179.4	109.6	156.8	-99.8	-67.5	0	0	0	106.9
75	S	26.3	Very low	30.7	Very low	92 Å²	92	145.1 Å²	145.1	64%	0.643	78%	0.78	S	S	*	*				66.3	131.9	88	77.5	0	0	0	0	115
76	V	30.7	Very low	30.8	Very low	126 Å²	126	146.3 Å²	146.3	76%	0.764	78%	0.779	S	S	*	*			trans	176.7	118.2	138.1	143.2	0	0	0	0	113
77	I	31.3	Very low	31.2	Very low	157 Å²	157	147.9 Å²	147.9	81%	0.805	78%	0.78	S	S	*	*			trans	62.1	132.1	140.6	-59.3	178.2	0	0	0	121.8
78	C	24.7	Very low	31.5	Very low	122 Å²	122	146.8 Å²	146.8	82%	0.824	78%	0.775	S	S	*	*			trans	-86.4	155.5	163.5	-54.3	0	0	0	0	112.2
79	S	32.6	Very low	31.4	Very low	119 Å²	119	147.9 Å²	147.9	83%	0.832	78%	0.775	S	S	*	*			trans	-148	155.7	143.9	-158	0	0	0	0	111.6
80	K	29.1	Very low	31.7	Very low	172 Å²	172	144.2 Å²	144.2	75%	0.748	77%	0.773	S	S	*	*			trans	-86.2	166.6	166.4	-64.8	178.3	172.8	-176.1	0	109.8
81	D	35.1	Very low	31.6	Very low	157 Å²	157	143.1 Å²	143.1	84%	0.84	78%	0.777	S	S	*	*				-166.7	164.9	109.6	-90.8	-16.6	0	0	0	111.7
82	D	33	Very low	31.7	Very low	130 Å²	130	141.3 Å²	141.3	70%	0.695	78%	0.776	S	S	*	*			trans	-94.8	-176.2	-164.7	-70.5	-67.9	0	0	0	114.8
83	N	35.4	Very low	31.5	Very low	139 Å²	139	139.3 Å²	139.3	74%	0.743	77%	0.767	S	S	*	*			trans	109	99.6	165.8	-58.6	-73.4	0	0	0	114.9
84	I	31.1	Very low	31.8	Very low	136 Å²	136	142.6 Å²	142.6	70%	0.697	78%	0.779	S	S	*	*				74.2	105.3	73.5	-65.5	168.6	0	0	0	113
85	N	35	Very low	31.6	Very low	161 Å²	161	139.7 Å²	139.7	86%	0.861	77%	0.774	S	S	*	*				-158.4	162.1	114	-106.8	-44.5	0	0	0	111.8
86	K	32.5	Very low	31.8	Very low	189 Å²	189	146 Å²	146	82%	0.822	79%	0.785	S	S	*	*			trans	-114.1	165.4	-177.5	-60.6	178.1	-179.2	178.2	0	110.5
87	N	34.6	Very low	32	Very low	125 Å²	125	145.3 Å²	145.3	67%	0.668	78%	0.783	S	S	*	*				-174	137.2	119	-97.5	18.7	0	0	0	112.6
88	E	34.7	Very low	31.9	Very low	156 Å²	156	147.2 Å²	147.2	73%	0.729	79%	0.786	S	S	*	*			trans	60.1	99.2	138.3	-64.4	154.5	-179.6	0	0	118.4
89	E	31.6	Very low	32	Very low	198 Å²	198	149 Å²	149	93%	0.925	79%	0.787	S	S	*	*				82	121.1	72.3	-76	-166.4	-174.8	0	0	115
90	G	33.5	Very low	31.8	Very low	73 Å²	73	148.6 Å²	148.6	75%	0.753	78%	0.78	S	S	*	*			trans	170	75.3	179.8	0	0	0	0	0	118.4
91	V	32.4	Very low	31.6	Very low	136 Å²	136	144.6 Å²	144.6	82%	0.824	77%	0.773	S	S	*	*			trans	59.2	79.7	148.2	-165	0	0	0	0	119.7
92	T	32.9	Very low	31.3	Very low	112 Å²	112	143.1 Å²	143.1	69%	0.687	76%	0.764	S	S	*	*				44.4	139	126	63.2	0	0	0	0	124.7
93	N	29.4	Very low	31	Very low	138 Å²	138	141.4 Å²	141.4	74%	0.738	76%	0.762	S	S	*	*			trans	80.6	94.1	142.9	-63.8	-11.3	0	0	0	121.2
94	L	30.6	Very low	30.6	Very low	180 Å²	180	143.5 Å²	143.5	94%	0.942	76%	0.761	S	S	*	*				-161.3	135.6	111.1	-107.1	164.2	0	0	0	110.5
95	T	27.8	Very low	30.5	Very low	115 Å²	115	142.4 Å²	142.4	71%	0.706	77%	0.765	S	S	*	*			trans	-118	124.1	-166.7	-52.3	0	0	0	0	111.9
96	Y	29.6	Very low	30.2	Very low	226 Å²	226	144.9 Å²	144.9	89%	0.886	76%	0.764	S	S	*	*			trans	-169.1	168	145.8	-96.2	-50.9	0	0	0	109.3
97	P	34.9	Very low	30.3	Very low	110 Å²	110	141.3 Å²	141.3	71%	0.714	76%	0.76	S	S	*	*			trans	-103.8	159.8	-131.8	38.3	-31.7	0	0	0	115.5	N99	P97-N99 PolarHBondContact O-N 2.78Å
98	F	29.5	Very low	30	Very low	197 Å²	197	142.8 Å²	142.8	86%	0.864	76%	0.763	S	S	*	*			trans	-62.2	120.9	172.1	-88	-109.9	0	0	0	112.2	V100	F98-V100 HydrophobicContact CB-CG2 4.28Å; F98-V100 PolarHBondContact O-N 3.06Å
99	N	26.7	Very low	29.8	Very low	161 Å²	161	145.1 Å²	145.1	86%	0.861	77%	0.766	S	S	*	*			trans	-77.6	105.2	157.5	-84.4	-30.3	0	0	0	109.1	P97	P97-N99 PolarHBondContact O-N 2.78Å
100	V	29.2	Very low	29.9	Very low	110 Å²	110	145.7 Å²	145.7	67%	0.667	76%	0.761	S	S	*	*			trans	-97.7	97.6	169.2	-177.4	0	0	0	0	108.8	F98 I102	F98-V100 HydrophobicContact CB-CG2 4.28Å; F98-V100 PolarHBondContact O-N 3.06Å; V100-I102 HydrophobicContact CG1-CG1 4.09Å; V100-I102 PolarHBondContact O-N 3.01Å
101	S	25.1	Very low	29.7	Very low	88 Å²	88	146.5 Å²	146.5	62%	0.615	76%	0.756	S	S	*	*			trans	-76.2	106.6	175.1	34.8	0	0	0	0	111
102	I	29	Very low	29.5	Very low	126 Å²	126	148.8 Å²	148.8	65%	0.646	76%	0.757	S	S	*	*			trans	-98.3	96.9	172.7	-54.7	-177.2	0	0	0	109.4	V100 Y104	V100-I102 HydrophobicContact CG1-CG1 4.09Å; V100-I102 PolarHBondContact O-N 3.01Å; I102-Y104 HydrophobicContact CG2-CD2 3.83Å; I102-Y104 HydrophobicContact CG2-CE2 3.58Å; I102-Y104 PolarHBondContact O-N 3Å; I102-Y104 VanDerWaalsContact O-N 3.15Å
103	S	25.1	Very low	29.5	Very low	94 Å²	94	148.2 Å²	148.2	66%	0.657	76%	0.756	S	S	*	*			trans	-76.7	92.5	-178.8	-55.4	0	0	0	0	112.2	S105	S103-S105 PolarHBondContact O-N 2.71Å; S103-S105 VanDerWaalsContact O-N 3.13Å
104	Y	28.1	Very low	29.3	Very low	183 Å²	183	152 Å²	152	72%	0.718	76%	0.761	S	S	*	*			trans	-78.7	90.1	171	-88.4	-80.9	0	0	0	111.9	I102 Y106	I102-Y104 HydrophobicContact CG2-CD2 3.83Å; I102-Y104 HydrophobicContact CG2-CE2 3.58Å; I102-Y104 PolarHBondContact O-N 3Å; I102-Y104 VanDerWaalsContact O-N 3.15Å; Y104-Y106 PolarHBondContact O-N 2.93Å
105	S	28.4	Very low	29.3	Very low	113 Å²	113	151.5 Å²	151.5	79%	0.79	75%	0.754	S	S	*	*			trans	-75.8	106.3	170.9	-62.5	0	0	0	0	111.3	S103	S103-S105 PolarHBondContact O-N 2.71Å; S103-S105 VanDerWaalsContact O-N 3.13Å
106	Y	29.1	Very low	29.2	Very low	212 Å²	212	156.2 Å²	156.2	83%	0.831	76%	0.758	S	S	*	*			trans	-81.5	132.5	168.5	-104	-93	0	0	0	111	Y104	Y104-Y106 PolarHBondContact O-N 2.93Å
107	P	34.6	Very low	29.2	Very low	114 Å²	114	153.9 Å²	153.9	74%	0.74	75%	0.753	S	S	*	*			trans	-76.5	132.1	-176.9	29.3	-34.1	0	0	0	113
108	H	27.7	Very low	28.7	Very low	156 Å²	156	158.4 Å²	158.4	72%	0.722	76%	0.758	S	S	*	*			trans	-88	113	171.7	-99.7	-73.6	0	0	0	111.6
109	Y	31.6	Very low	28.7	Very low	205 Å²	205	154.8 Å²	154.8	80%	0.804	75%	0.752	S	S	*	*			trans	-140.2	111.5	154	-81.3	-84.9	0	0	0	107.6
110	Y	32.6	Very low	28.7	Very low	210 Å²	210	155.5 Å²	155.5	82%	0.824	75%	0.75	S	S	*	*				103.3	155.8	69.4	-108.5	-76	0	0	0	110.3
111	S	30.1	Very low	28.6	Very low	91 Å²	91	156 Å²	156	64%	0.636	76%	0.758	S	S	*	*			trans	-132.7	134.1	-158.3	57.6	0	0	0	0	114.6
112	H	27.1	Very low	28.9	Very low	183 Å²	183	156.9 Å²	156.9	85%	0.847	76%	0.764	S	S	*	*			trans	65.3	166.2	164.5	-66.4	-24.6	0	0	0	116.6
113	P	34.3	Very low	28.8	Very low	101 Å²	101	158.9 Å²	158.9	66%	0.656	78%	0.776	S	S	*	*			cis	-119.7	-160.1	-6.6	37.6	-20.6	0	0	0	113.2
114	Y	25.3	Very low	29.1	Very low	217 Å²	217	163.5 Å²	163.5	85%	0.851	79%	0.787	S	S	*	*			trans	-59.6	128.4	173.9	-83	-115.6	0	0	0	113.1
115	Q	29.9	Very low	29	Very low	169 Å²	169	163.6 Å²	163.6	79%	0.79	79%	0.794	S	S	*	*			trans	-149.5	134.2	148	-122.7	166.7	-11.4	0	0	109.7	F117	Q115-F117 HydrophobicContact CB-CE2 4.41Å; Q115-F117 HydrophobicContact CG-CE2 4.49Å
116	R	26.3	Very low	29	Very low	214 Å²	214	163.9 Å²	163.9	81%	0.808	80%	0.796	S	S	*	*			trans	-86.3	129.9	173.5	-80.7	-178.9	168.9	-177	-5.4	108.6
117	F	29.3	Very low	29.1	Very low	177 Å²	177	158.4 Å²	158.4	78%	0.776	79%	0.789	S	S	*	*			trans	-126.3	130.9	159.9	-81.8	-85.2	0	0	0	109.2	Q115	Q115-F117 HydrophobicContact CB-CE2 4.41Å; Q115-F117 HydrophobicContact CG-CE2 4.49Å
118	Y	24.5	Very low	28.8	Very low	205 Å²	205	159.8 Å²	159.8	80%	0.804	79%	0.79	S	S	*	*			trans	-108.2	121.1	172.9	-103.5	-99.3	0	0	0	107.4
119	V	28.4	Very low	29	Very low	122 Å²	122	158.8 Å²	158.8	74%	0.739	79%	0.79	S	S	*	*			trans	-145.7	100.9	161.4	-174.9	0	0	0	0	104.1
120	Q	27.9	Very low	29	Very low	176 Å²	176	156.9 Å²	156.9	82%	0.822	79%	0.789	S	S	*	*				57.9	75.3	87.3	-74.1	-174.7	-84.8	0	0	114.1
121	S	27.2	Very low	29	Very low	121 Å²	121	153.8 Å²	153.8	85%	0.846	79%	0.785	S	S	*	*			trans	-82.9	103.5	154.6	-55.1	0	0	0	0	108.9	N123	S121-N123 PolarHBondContact O-N 3.18Å
122	S	30.9	Very low	29.4	Very low	106 Å²	106	155.5 Å²	155.5	74%	0.741	79%	0.792	S	S	*	*			trans	-84.9	97.7	-179.3	52.1	0	0	0	0	112.1	Q124	S122-Q124 PolarHBondContact O-N 3.1Å
123	N	27.3	Very low	29.4	Very low	167 Å²	167	155.6 Å²	155.6	89%	0.893	79%	0.793	S	S	*	*			trans	-75	100.8	158.7	-82.4	-11	0	0	0	108.9	S121	S121-N123 PolarHBondContact O-N 3.18Å
124	Q	30	Very low	29.3	Very low	192 Å²	192	158.4 Å²	158.4	90%	0.897	80%	0.802	S	S	*	*			trans	-98.3	159	154.4	-79	-164.9	-7.8	0	0	109.9	S122	S122-Q124 PolarHBondContact O-N 3.1Å
125	Q	27	Very low	29.8	Very low	184 Å²	184	156.3 Å²	156.3	86%	0.86	80%	0.8	S	S	*	*			trans	-135.5	155.2	-158	-164.1	169.9	-4.4	0	0	110.5
126	S	27.9	Very low	30.1	Very low	119 Å²	119	154.9 Å²	154.9	83%	0.832	80%	0.797	S	S	*	*			trans	71.8	151.9	-166.2	81.9	0	0	0	0	114
127	S	31.3	Very low	30.4	Very low	98 Å²	98	152 Å²	152	69%	0.685	80%	0.796	S	S	*	*			cis	-141.3	147.6	11.1	57.4	0	0	0	0	113.7
128	N	27.8	Very low	30.6	Very low	142 Å²	142	149.8 Å²	149.8	76%	0.759	80%	0.797	S	S	*	*			trans	17.9	133.6	149.2	-44.8	-10.9	0	0	0	118.7
129	D	32.9	Very low	31.1	Very low	136 Å²	136	145.9 Å²	145.9	73%	0.727	80%	0.795	S	S	*	*				-164.8	128.3	80.1	-97.7	-23.8	0	0	0	116.2
130	H	30.8	Very low	31.3	Very low	165 Å²	165	147.1 Å²	147.1	76%	0.764	80%	0.796	S	S	*	*				54.6	139.6	126.9	-89.9	-74.5	0	0	0	126
131	L	32	Very low	31.5	Very low	145 Å²	145	146 Å²	146	76%	0.759	80%	0.796	S	S	*	*			trans	68.4	137.9	165.9	-80.3	82.5	0	0	0	117.3
132	T	38.8	Very low	31.7	Very low	127 Å²	127	150 Å²	150	78%	0.779	80%	0.798	S	S	*	*			cis	-155.4	138.7	-12.2	-1.4	0	0	0	0	109.2
133	Q	27.7	Very low	31.7	Very low	184 Å²	184	152.7 Å²	152.7	86%	0.86	80%	0.803	S	S	*	*			trans	-92.9	138.1	163	-79.3	-173.2	-16.9	0	0	110.6
134	N	31.8	Very low	31.9	Very low	160 Å²	160	153.2 Å²	153.2	86%	0.856	81%	0.806	S	S	*	*			trans	-168.2	155.3	140.8	-109.4	-31.3	0	0	0	112.8
135	E	36.1	Very low	31.9	Very low	173 Å²	173	149 Å²	149	81%	0.808	80%	0.798	S	S	*	*			trans	75.2	140.7	164.6	-65.5	-172.9	170.9	0	0	121.3
136	I	35.3	Very low	32.1	Very low	140 Å²	140	146.1 Å²	146.1	72%	0.718	79%	0.793	S	S	*	*			trans	68.8	75.2	165.3	-47.9	146.4	0	0	0	117.6
137	I	34.5	Very low	32.5	Very low	154 Å²	154	147.8 Å²	147.8	79%	0.79	80%	0.799	S	S	*	*				-138.5	98.4	110.8	-58.9	-171.1	0	0	0	107.8
138	T	32.5	Very low	32.5	Very low	129 Å²	129	149.2 Å²	149.2	79%	0.791	80%	0.803	S	S	*	*			trans	-127.9	34	-174.5	-34.1	0	0	0	0	112.2
139	T	34.5	Very low	32.8	Very low	124 Å²	124	145.9 Å²	145.9	76%	0.761	80%	0.803	S	S	*	*			trans	-138	40.5	-167.1	39.1	0	0	0	0	114.4
140	L	32.2	Very low	32.8	Very low	148 Å²	148	148.4 Å²	148.4	78%	0.775	81%	0.807	S	S	*	*	S	Bend	trans	-129.2	137.4	161.6	-88.5	170.4	0	0	0	111.5
141	N	33.2	Very low	32.8	Very low	153 Å²	153	146.9 Å²	146.9	82%	0.818	81%	0.81	S	S	*	*	S	Bend	trans	61.1	55.8	161.6	-55.1	-21	0	0	0	117.8
142	K	32.1	Very low	32.9	Very low	204 Å²	204	144.4 Å²	144.4	89%	0.887	80%	0.804	S	S	*	*			trans	-117.9	148.1	151.2	-97.4	-178.2	177.1	175	0	110.3
143	L	29.9	Very low	32.4	Very low	163 Å²	163	144.4 Å²	144.4	85%	0.853	80%	0.804	S	S	*	*	S	Bend	trans	66.8	80.6	175.7	-54.3	175.2	0	0	0	116.5
144	N	31.7	Very low	32.5	Very low	177 Å²	177	140 Å²	140	95%	0.947	79%	0.793	S	S	*	*			trans	-163.7	66.1	135.2	-103.6	-25	0	0	0	111.6
145	S	30.3	Very low	32.3	Very low	104 Å²	104	138.5 Å²	138.5	73%	0.727	79%	0.79	S	S	*	*			trans	-143.5	160.6	164.5	60.8	0	0	0	0	109.3
146	T	31.4	Very low	32	Very low	124 Å²	124	137.3 Å²	137.3	76%	0.761	79%	0.789	S	S	*	*			trans	62.5	86	178.8	62.4	0	0	0	0	117.8
147	T	34.7	Very low	31.6	Very low	154 Å²	154	136 Å²	136	95%	0.945	79%	0.787	S	S	*	*			trans	-128.4	120.4	135.3	-38.3	0	0	0	0	107.8
148	T	32.6	Very low	31.4	Very low	128 Å²	128	134.2 Å²	134.2	79%	0.785	78%	0.784	S	S	*	*			trans	-110.7	145.8	-166.5	49.9	0	0	0	0	113.9
149	G	33.2	Very low	31.1	Very low	72 Å²	72	133.4 Å²	133.4	74%	0.742	78%	0.779	S	S	*	*			trans	98.6	162	161.7	0	0	0	0	0	115.8
150	K	33.2	Very low	30.7	Very low	188 Å²	188	133.5 Å²	133.5	82%	0.817	78%	0.779	S	S	*	*			cis	-151	155.3	-2	-67.2	-179.5	178.1	171.2	0	109.4
151	T	31.5	Very low	30.5	Very low	134 Å²	134	131.8 Å²	131.8	82%	0.822	78%	0.775	S	S	*	*			trans	56.7	145.1	151.4	46.4	0	0	0	0	119.1
152	S	33.3	Very low	30.2	Very low	93 Å²	93	129.9 Å²	129.9	65%	0.65	77%	0.769	S	S	*	*			cis	-158.9	153	-3.9	42.2	0	0	0	0	108.3
153	V	28.2	Very low	30.3	Very low	127 Å²	127	126.5 Å²	126.5	77%	0.77	77%	0.766	S	S	*	*				28.4	123.3	102.6	-135.2	0	0	0	0	112.4
154	S	29.9	Very low	30.2	Very low	90 Å²	90	124.4 Å²	124.4	63%	0.629	76%	0.76	S	S	*	*			cis	-169.9	155.5	49.6	-50.8	0	0	0	0	113.6
155	T	28.5	Very low	30.3	Very low	129 Å²	129	122.1 Å²	122.1	79%	0.791	75%	0.752	S	S	*	*			trans	61.5	166.9	144.8	52.7	0	0	0	0	119.1
156	L	29.5	Very low	30.4	Very low	149 Å²	149	123 Å²	123	78%	0.78	75%	0.753	S	S	*	*			cis	-141.4	175.8	4.6	-155.8	69.7	0	0	0	111.2
157	T	26.5	Very low	30.5	Very low	112 Å²	112	124.3 Å²	124.3	69%	0.687	75%	0.754	S	S	*	*			trans	-73.6	-166.8	179.4	54.2	0	0	0	0	115.3
158	T	30.8	Very low	30.2	Very low	117 Å²	117	122 Å²	122	72%	0.718	74%	0.744	S	S	*	*			trans	88.4	113.7	171.9	67.6	0	0	0	0	115.2
159	T	26.3	Very low	30.4	Very low	112 Å²	112	122.3 Å²	122.3	69%	0.687	75%	0.746	S	S	*	*			cis	99.5	138.2	34.8	59.7	0	0	0	0	113.4
160	T	26.5	Very low	30.3	Very low	125 Å²	125	123 Å²	123	77%	0.767	75%	0.745	S	S	*	*			trans	64.5	150.9	156.7	53	0	0	0	0	117.5
161	T	27.4	Very low	30.4	Very low	113 Å²	113	120.3 Å²	120.3	69%	0.693	74%	0.744	S	S	*	*			cis	-166.7	156.6	-11.7	21.2	0	0	0	0	110.3
162	T	26.9	Very low	30.3	Very low	112 Å²	112	119.5 Å²	119.5	69%	0.687	74%	0.74	S	S	*	*			trans	39.8	124	147.7	60.2	0	0	0	0	122.2
163	T	34	Very low	30.3	Very low	134 Å²	134	122.3 Å²	122.3	82%	0.822	75%	0.746	S	S	*	*				178.3	132.1	118.2	26.7	0	0	0	0	108.3
164	T	28.2	Very low	30.4	Very low	118 Å²	118	120.9 Å²	120.9	72%	0.724	74%	0.742	S	S	*	*			cis	86.2	82.1	21.1	75.4	0	0	0	0	118.1
165	T	34.1	Very low	30.2	Very low	129 Å²	129	122.9 Å²	122.9	79%	0.791	75%	0.75	S	S	*	*			trans	-159.8	111.7	145.7	25.6	0	0	0	0	106.9
166	T	31	Very low	30.2	Very low	122 Å²	122	121 Å²	121	75%	0.748	75%	0.748	S	S	*	*				53.4	130.2	82.2	67.6	0	0	0	0	113
167	I	33.6	Very low	30.1	Very low	152 Å²	152	122.8 Å²	122.8	78%	0.779	75%	0.752	S	S	*	*			cis	-150.8	149.5	49.8	-76.6	174.6	0	0	0	112.2
168	S	28.9	Very low	30.2	Very low	105 Å²	105	124.3 Å²	124.3	73%	0.734	76%	0.755	S	S	*	*			trans	12.4	155.5	152	-45.7	0	0	0	0	122.5
169	T	36.6	Very low	30.1	Very low	136 Å²	136	124.1 Å²	124.1	83%	0.834	75%	0.754	S	S	*	*			cis	-144.4	156.1	29.7	49.3	0	0	0	0	116.2
170	A	31.1	Very low	30.2	Very low	87 Å²	87	129 Å²	129	72%	0.719	76%	0.76	S	S	*	*			trans	-18	157.1	155.3	0	0	0	0	0	118.7
171	T	35.7	Very low	30.2	Very low	130 Å²	130	129.7 Å²	129.7	80%	0.798	76%	0.759	S	S	*	*				-156	155	51.7	-50.7	0	0	0	0	115.6
172	T	30.3	Very low	30.3	Very low	118 Å²	118	130.8 Å²	130.8	72%	0.724	76%	0.761	S	S	*	*			trans	-60.2	169.3	178	45	0	0	0	0	114.3
173	I	32.2	Very low	30.3	Very low	151 Å²	151	128.3 Å²	128.3	77%	0.774	74%	0.742	S	S	*	*				-158.7	147.7	58.7	-75.6	176.7	0	0	0	113.8
174	S	29.5	Very low	29.9	Very low	98 Å²	98	129.4 Å²	129.4	69%	0.685	73%	0.732	S	S	*	*			trans	4.3	139.6	156.6	-69.2	0	0	0	0	122.2
175	T	26.2	Very low	29.8	Very low	132 Å²	132	127.9 Å²	127.9	81%	0.81	73%	0.727	S	S	*	*			cis	79.4	95.4	44.1	72	0	0	0	0	117.6
176	A	29.7	Very low	29.4	Very low	90 Å²	90	126 Å²	126	74%	0.744	72%	0.719	S	S	*	*			trans	-176	122.7	146.4	0	0	0	0	0	107.2
177	Q	27.7	Very low	29.2	Very low	185 Å²	185	127.3 Å²	127.3	86%	0.864	72%	0.721	S	S	*	*				73.8	130.4	60	-75.1	-171.3	-54.7	0	0	116.4
178	L	27	Very low	28.9	Very low	145 Å²	145	127.4 Å²	127.4	76%	0.759	72%	0.722	S	S	*	*			trans	83.1	89.4	157.9	-67.5	159	0	0	0	121
179	T	29.6	Very low	29	Very low	112 Å²	112	127.8 Å²	127.8	69%	0.687	72%	0.719	S	S	*	*				45.5	122.8	123.1	61.1	0	0	0	0	121.1
180	R	27.5	Very low	28.7	Very low	216 Å²	216	127.2 Å²	127.2	82%	0.815	72%	0.718	S	S	*	*				-177.1	136.8	107	-106.1	-179	177.3	133	0.8	116.3
181	N	27.8	Very low	28.5	Very low	138 Å²	138	129.9 Å²	129.9	74%	0.738	72%	0.716	S	S	*	*			trans	-22	151.1	163	-54.7	-3.9	0	0	0	120.6
182	N	28.5	Very low	28.3	Very low	137 Å²	137	133.7 Å²	133.7	73%	0.733	72%	0.721	S	S	*	*			trans	76.2	164.6	151.5	-71.5	-24.2	0	0	0	118.3
183	I	26.6	Very low	28	Very low	59 Å²	59	135.1 Å²	135.1	30%	0.303	72%	0.72	S	S	.	*			trans	80.6	118.8	168.5	-47.8	-169	0	0	0	112.4	P599 I600 Y601 H602	I183-P599 HydrophobicContact CD1-CB 3.59Å; I183-P599 HydrophobicContact CG2-CB 4.07Å; I183-I600 VanDerWaalsContact CG2-O 3.25Å; I183-I600 WeakPolarHBondContact CG2-O 3.14Å; I183-Y601 HydrophobicContact CG2-CD2 3.49Å; I183-Y601 VanDerWaalsContact CG2-CD2 3.49Å; I183-Y601 HydrophobicContact CG2-CE2 4.16Å; I183-Y601 HydrophobicContact CG2-CG 4.24Å; I183-Y601 CarbonylContact O-C 3.29Å; I183-Y601 WeakPolarHBondContact O-CA 3.31Å; I183-H602 PolarHBondContact O-N 3.08Å
184	Y	26.3	Very low	27.7	Very low	157 Å²	157	134.3 Å²	134.3	62%	0.616	72%	0.722	S	S	*	*			cis	-170.8	-158.6	-4.1	-126.9	-113.8	0	0	0	105.7	Y601	Y184-Y601 VanDerWaalsContact CB-CG 3.41Å; Y184-Y601 VanDerWaalsContact CB-CZ 3.48Å; Y184-Y601 HydrophobicContact CD1-CD2 4.46Å; Y184-Y601 HydrophobicContact CD1-CE1 4.1Å; Y184-Y601 AromaticContact CD1-CE2 3.59Å; Y184-Y601 HydrophobicContact CD1-CE2 3.59Å; Y184-Y601 AromaticContact CD1-CZ 3.35Å; Y184-Y601 WeakPolarHBondContact CD1-OH 3.06Å; Y184-Y601 HydrophobicContact CD2-CE2 4.14Å; Y184-Y601 HydrophobicContact CE1-CE2 4.01Å; Y184-Y601 AromaticContact CE1-CZ 3.9Å; Y184-Y601 WeakPolarHBondContact CE1-OH 3.28Å; Y184-Y601 HydrophobicContact CG-CD2 4.03Å; Y184-Y601 HydrophobicContact CG-CE1 4.35Å; Y184-Y601 AromaticContact CG-CE2 3.58Å; Y184-Y601 HydrophobicContact CG-CE2 3.58Å; Y184-Y601 AromaticContact CG-CZ 3.75Å
185	S	25.3	Very low	27.5	Very low	87 Å²	87	135.3 Å²	135.3	61%	0.608	72%	0.724	S	S	*	*			trans	-83.2	-176.1	-173.1	-37.4	0	0	0	0	117.8	Y601	S185-Y601 WeakPolarHBondContact O-CD1 3.15Å; S185-Y601 WeakPolarHBondContact O-CE1 3.48Å
186	S	26.2	Very low	27.6	Very low	88 Å²	88	139 Å²	139	62%	0.615	73%	0.729	S	S	*	*			trans	73.3	161.2	155.9	75.9	0	0	0	0	120.4
187	L	27	Very low	27.5	Very low	151 Å²	151	142 Å²	142	79%	0.791	73%	0.731	S	S	*	*			trans	66.4	136.8	-168.7	-70.4	95.4	0	0	0	115.3
188	L	27.9	Very low	27.3	Very low	153 Å²	153	139.1 Å²	139.1	80%	0.801	72%	0.722	S	S	*	*			cis	-150.6	161	-18.2	-156.6	72.1	0	0	0	110.6
189	V	30.7	Very low	27.4	Very low	114 Å²	114	140 Å²	140	69%	0.691	72%	0.724	S	S	*	*			trans	-82.2	147.3	-178.2	169.1	0	0	0	0	112.5	Q191	V189-Q191 HydrophobicContact CG1-CG 4.09Å
190	P	30	Very low	27.2	Very low	123 Å²	123	140.6 Å²	140.6	80%	0.799	72%	0.723	S	S	*	*			trans	-105.7	133.1	138.5	-10.2	28.7	0	0	0	111.2
191	Q	27.9	Very low	27.1	Very low	144 Å²	144	140.8 Å²	140.8	67%	0.673	73%	0.726	S	S	*	*			trans	-80.5	142.2	179.7	-63.4	176.5	-9.6	0	0	111.1	V189	V189-Q191 HydrophobicContact CG1-CG 4.09Å
192	F	30.3	Very low	27.1	Very low	210 Å²	210	138.5 Å²	138.5	92%	0.921	72%	0.719	S	S	*	*			trans	-128.2	114.3	145.3	-91.6	-81.5	0	0	0	109.3
193	Q	24.9	Very low	26.9	Very low	148 Å²	148	141 Å²	141	69%	0.692	73%	0.726	S	S	*	*			trans	-85.4	175.1	172.6	-64.7	175.3	-66.7	0	0	110.4
194	T	24.3	Very low	26.9	Very low	133 Å²	133	144.4 Å²	144.4	82%	0.816	74%	0.744	S	S	*	*			trans	79.5	132.1	167.1	77.7	0	0	0	0	115.6
195	T	27.1	Very low	26.9	Very low	119 Å²	119	141.1 Å²	141.1	73%	0.73	74%	0.744	S	S	*	*			cis	-130.7	128.8	-11.7	39.1	0	0	0	0	110.3	L197	T195-L197 PolarHBondContact O-N 3.23Å
196	K	26.8	Very low	27	Very low	210 Å²	210	145.1 Å²	145.1	91%	0.913	76%	0.758	S	S	*	*			trans	-75.7	106.6	158.4	-97.2	-170.9	172.1	-174.4	0	107.5	N198	K196-N198 PolarHBondContact O-N 2.96Å
197	L	27.5	Very low	27.1	Very low	152 Å²	152	148.3 Å²	148.3	80%	0.796	76%	0.763	S	S	*	*			trans	-64.4	117.4	167.3	-81.4	173.3	0	0	0	108.7	T195 M199	T195-L197 PolarHBondContact O-N 3.23Å; L197-M199 VanDerWaalsContact C-N 3.29Å; L197-M199 PolarHBondContact O-N 3.35Å
198	N	24.9	Very low	27	Very low	125 Å²	125	148.6 Å²	148.6	67%	0.668	77%	0.765	S	S	*	*			trans	-78	74.9	-173.7	-174	42.3	0	0	0	111.6	K196 N200	K196-N198 PolarHBondContact O-N 2.96Å; N198-N200 PolarHBondContact ND2-ND2 3.18Å; N198-N200 PolarHBondContact O-N 2.92Å; N198-N200 PolarHBondContact OD1-OD1 3.11Å
199	M	27.4	Very low	27	Very low	163 Å²	163	149 Å²	149	80%	0.803	77%	0.767	S	S	*	*			trans	-79.4	79.5	164.7	-72.3	-62.9	-177.9	0	0	109.4	L197 Y201	L197-M199 VanDerWaalsContact C-N 3.29Å; L197-M199 PolarHBondContact O-N 3.35Å; M199-Y201 PolarHBondContact O-N 3.02Å
200	N	25.3	Very low	26.9	Very low	125 Å²	125	148.4 Å²	148.4	67%	0.668	77%	0.768	S	S	*	*			trans	-56	102.9	158.8	-82.1	-17.8	0	0	0	108	N198 P202	N198-N200 PolarHBondContact ND2-ND2 3.18Å; N198-N200 PolarHBondContact O-N 2.92Å; N198-N200 PolarHBondContact OD1-OD1 3.11Å; N200-P202 VanDerWaalsContact O-CD 3.31Å; N200-P202 WeakPolarHBondContact O-CD 3.3Å
201	Y	25.8	Very low	26.8	Very low	220 Å²	220	147 Å²	147	86%	0.863	76%	0.761	S	S	*	*			trans	-69.9	116.1	152.4	-91.3	-87.9	0	0	0	106.4	M199	M199-Y201 PolarHBondContact O-N 3.02Å
202	P	27.3	Very low	26.9	Very low	91 Å²	91	147 Å²	147	59%	0.591	77%	0.765	S	S	*	*			trans	-64.7	145.2	172.5	28.6	-33.4	0	0	0	108.8	N200 L204	N200-P202 VanDerWaalsContact O-CD 3.31Å; N200-P202 WeakPolarHBondContact O-CD 3.3Å; P202-L204 VanDerWaalsContact C-N 3.29Å; P202-L204 HydrophobicContact CG-CG 4.39Å; P202-L204 PolarHBondContact O-N 3.05Å
203	E	26.1	Very low	26.9	Very low	188 Å²	188	144.6 Å²	144.6	88%	0.879	76%	0.762	S	S	*	*			trans	-60.3	100.8	154.3	-71.4	-176	118.1	0	0	107.2	S205	E203-S205 PolarHBondContact O-N 3.4Å; E203-S205 PolarHBondContact O-OG 2.86Å
204	L	26.6	Very low	27.4	Very low	132 Å²	132	145.8 Å²	145.8	69%	0.691	77%	0.773	S	S	*	*			trans	-71	68	168.3	-89	164.7	0	0	0	109.1	P202 L206	P202-L204 VanDerWaalsContact C-N 3.29Å; P202-L204 HydrophobicContact CG-CG 4.39Å; P202-L204 PolarHBondContact O-N 3.05Å; L204-L206 PolarHBondContact O-N 3.23Å
205	S	26	Very low	28.1	Very low	88 Å²	88	145.5 Å²	145.5	62%	0.615	77%	0.766	S	S	*	*			trans	-50.2	120.2	154.4	43.2	0	0	0	0	107.7	E203 H207	E203-S205 PolarHBondContact O-N 3.4Å; E203-S205 PolarHBondContact O-OG 2.86Å; S205-H207 PolarHBondContact O-N 3.31Å
206	L	27.3	Very low	28.7	Very low	171 Å²	171	146.9 Å²	146.9	90%	0.895	76%	0.764	S	S	*	*	S	Bend	trans	-75.9	60.7	175.9	-83	91.2	0	0	0	110.6	L204	L204-L206 PolarHBondContact O-N 3.23Å
207	H	27.3	Very low	29.4	Very low	155 Å²	155	141.3 Å²	141.3	72%	0.718	75%	0.748	S	S	*	*	S	Bend	trans	-142	130.9	168.6	-99.7	-96.1	0	0	0	107.6	S205	S205-H207 PolarHBondContact O-N 3.31Å
208	N	25.5	Very low	30	Very low	157 Å²	157	142 Å²	142	84%	0.84	74%	0.741	S	S	*	*			trans	74	65.1	-177.4	-45.9	-40.3	0	0	0	116.4
209	L	27.6	Very low	31	Very low	161 Å²	161	141 Å²	141	84%	0.843	74%	0.735	S	S	*	*			trans	-139.1	117.9	145.2	-107.8	156.4	0	0	0	108.7
210	S	28.9	Very low	32	Very low	101 Å²	101	136.6 Å²	136.6	71%	0.706	72%	0.715	S	S	*	*			trans	-65.4	152.3	-177.3	179.6	0	0	0	0	111.4
211	S	27.6	Very low	33	Very low	94 Å²	94	134.2 Å²	134.2	66%	0.657	70%	0.702	S	S	*	*	S	Bend	trans	-51.1	156	159.7	41.1	0	0	0	0	112.4
212	N	29.8	Very low	34.2	Very low	143 Å²	143	128.3 Å²	128.3	77%	0.765	69%	0.685	S	S	*	*	S	Bend	trans	93.6	136.3	-179.3	-47.8	-27.9	0	0	0	114.8
213	N	31.1	Very low	35.7	Very low	161 Å²	161	129.2 Å²	129.2	86%	0.861	68%	0.679	S	S	*	*			trans	75.8	56.6	175.3	-54	-11.7	0	0	0	118.4
214	L	35	Very low	36.9	Very low	173 Å²	173	125.2 Å²	125.2	91%	0.906	66%	0.664	S	S	*	*			trans	-125.9	133.7	154	-76.7	174.1	0	0	0	110.2
215	N	38.3	Very low	38.1	Very low	126 Å²	126	123.2 Å²	123.2	67%	0.674	65%	0.653	S	S	*	*			trans	-65.8	135.9	-169	-86.2	-19	0	0	0	113.2	T217 Y218 L219	N215-T217 PolarHBondContact O-N 3.39Å; N215-Y218 PolarHBondContact O-N 3.41Å; N215-L219 PolarHBondContact O-N 3.35Å
216	E	41.1	Very low	39	Very low	149 Å²	149	126.5 Å²	126.5	70%	0.696	66%	0.656	S	S	*	*	H	α-helix	trans	-56.8	-32.7	177.6	-170.8	166.7	-145.6	0	0	112.7	Y218 L219 N220	E216-Y218 PolarHBondContact O-N 3.03Å; E216-L219 PolarHBondContact O-N 3.39Å; E216-N220 WeakPolarHBondContact O-CB 3.47Å; E216-N220 VanDerWaalsContact O-CG 3.28Å; E216-N220 PolarHBondContact O-N 3.42Å; E216-N220 PolarHBondContact O-ND2 2.89Å
217	T	41.8	Very low	39.9	Very low	93 Å²	93	121.7 Å²	121.7	57%	0.571	63%	0.633	S	S	*	*	H	α-helix	trans	-54.4	-50.8	172.1	-23.8	0	0	0	0	111.9	N215 L219 N220 D221	N215-T217 PolarHBondContact O-N 3.39Å; T217-L219 VanDerWaalsContact C-N 3.3Å; T217-L219 PolarHBondContact O-N 3.21Å; T217-N220 CarbonylContact O-C 3.54Å; T217-N220 WeakPolarHBondContact O-CA 3.44Å; T217-N220 PolarHBondContact O-N 3.23Å; T217-D221 VanDerWaalsContact O-CG 3.28Å; T217-D221 PolarHBondContact O-N 2.74Å
218	Y	38.3	Very low	40.5	Very low	167 Å²	167	117.2 Å²	117.2	66%	0.655	62%	0.617	S	S	*	*	H	α-helix	trans	-69.2	-30.8	-176.1	-148.2	-95.3	0	0	0	111.9	N215 E216 L222	N215-Y218 PolarHBondContact O-N 3.41Å; E216-Y218 PolarHBondContact O-N 3.03Å; Y218-L222 HydrophobicContact CD1-CD1 3.99Å; Y218-L222 HydrophobicContact CD1-CG 4.45Å; Y218-L222 HydrophobicContact CE1-CD1 4.24Å; Y218-L222 WeakPolarHBondContact O-CB 3.26Å; Y218-L222 WeakPolarHBondContact O-CG 3.25Å; Y218-L222 PolarHBondContact O-N 3.37Å
219	L	45.9	Very low	41.4	Very low	103 Å²	103	114.6 Å²	114.6	54%	0.539	60%	0.602	S	S	.	*	H	α-helix	trans	-71.1	-33.6	172.3	-165.5	72.2	0	0	0	111.6	N215 E216 T217 K223	N215-L219 PolarHBondContact O-N 3.35Å; E216-L219 PolarHBondContact O-N 3.39Å; T217-L219 VanDerWaalsContact C-N 3.3Å; T217-L219 PolarHBondContact O-N 3.21Å; L219-K223 VanDerWaalsContact O-CG 3.24Å; L219-K223 WeakPolarHBondContact O-CG 3.44Å; L219-K223 PolarHBondContact O-N 3.27Å
220	N	49.9	Very low	41.9	Very low	70 Å²	70	110.8 Å²	110.8	37%	0.374	59%	0.589	S	S	.	*	H	α-helix	trans	-76.4	-35.8	175.3	-69.7	-21.7	0	0	0	112.2	E216 T217 K223 L224	E216-N220 WeakPolarHBondContact O-CB 3.47Å; E216-N220 VanDerWaalsContact O-CG 3.28Å; E216-N220 PolarHBondContact O-N 3.42Å; E216-N220 PolarHBondContact O-ND2 2.89Å; T217-N220 CarbonylContact O-C 3.54Å; T217-N220 WeakPolarHBondContact O-CA 3.44Å; T217-N220 PolarHBondContact O-N 3.23Å; N220-K223 PolarHBondContact O-N 3.5Å; N220-K223 PolarHBondContact OD1-NZ 2.92Å; N220-L224 VanDerWaalsContact O-CB 3.3Å; N220-L224 WeakPolarHBondContact O-CB 3.49Å; N220-L224 PolarHBondContact O-N 2.98Å
221	D	45.3	Very low	42.3	Very low	75 Å²	75	111.7 Å²	111.7	40%	0.401	59%	0.586	S	S	.	*	H	α-helix	trans	-62.5	-44.2	170.6	-65	-34.1	0	0	0	110.8	T217 K223 L224 I225	T217-D221 VanDerWaalsContact O-CG 3.28Å; T217-D221 PolarHBondContact O-N 2.74Å; D221-K223 PolarHBondContact O-N 3.37Å; D221-L224 PolarHBondContact O-N 3.17Å; D221-I225 WeakPolarHBondContact O-CB 3.49Å; D221-I225 VanDerWaalsContact O-CG1 3.26Å; D221-I225 WeakPolarHBondContact O-CG1 3.46Å; D221-I225 PolarHBondContact O-N 3.23Å
222	L	52.4	Low	42.6	Very low	96 Å²	96	115.2 Å²	115.2	50%	0.503	59%	0.586	S	S	.	*	H	α-helix	trans	-65.7	-33.8	174	-76.1	169.8	0	0	0	113.1	Y218 K226	Y218-L222 HydrophobicContact CD1-CD1 3.99Å; Y218-L222 HydrophobicContact CD1-CG 4.45Å; Y218-L222 HydrophobicContact CE1-CD1 4.24Å; Y218-L222 WeakPolarHBondContact O-CB 3.26Å; Y218-L222 WeakPolarHBondContact O-CG 3.25Å; Y218-L222 PolarHBondContact O-N 3.37Å; L222-K226 VanDerWaalsContact O-CB 3.27Å; L222-K226 WeakPolarHBondContact O-CB 3.49Å; L222-K226 PolarHBondContact O-N 2.84Å
223	K	57.4	Low	42.9	Very low	110 Å²	110	114.2 Å²	114.2	48%	0.478	58%	0.58	S	S	.	*	H	α-helix	trans	-66.4	-43.6	169.9	-73.8	167.3	-163.8	160.9	0	111.4	L219 N220 D221 K226 T227	L219-K223 VanDerWaalsContact O-CG 3.24Å; L219-K223 WeakPolarHBondContact O-CG 3.44Å; L219-K223 PolarHBondContact O-N 3.27Å; N220-K223 PolarHBondContact O-N 3.5Å; N220-K223 PolarHBondContact OD1-NZ 2.92Å; D221-K223 PolarHBondContact O-N 3.37Å; K223-K226 CarbonylContact O-C 3.55Å; K223-K226 WeakPolarHBondContact O-CA 3.35Å; K223-K226 WeakPolarHBondContact O-CB 3.35Å; K223-K226 PolarHBondContact O-N 3.34Å; K223-K226 VanDerWaalsContact O-N 3.12Å; K223-T227 PolarHBondContact O-N 3.14Å; K223-T227 PolarHBondContact O-OG1 2.9Å
224	L	52.7	Low	43	Very low	105 Å²	105	112 Å²	112	55%	0.55	58%	0.575	S	S	.	*	H	α-helix	trans	-66.9	-38.5	-178.9	-175.5	65.2	0	0	0	111.9	N220 D221 T227 T228	N220-L224 VanDerWaalsContact O-CB 3.3Å; N220-L224 WeakPolarHBondContact O-CB 3.49Å; N220-L224 PolarHBondContact O-N 2.98Å; D221-L224 PolarHBondContact O-N 3.17Å; L224-T227 WeakPolarHBondContact CA-OG1 3.33Å; L224-T227 PolarHBondContact O-OG1 2.82Å; L224-T227 VanDerWaalsContact O-OG1 3.09Å; L224-T228 WeakPolarHBondContact O-CB 3.27Å; L224-T228 WeakPolarHBondContact O-CG2 3.36Å; L224-T228 PolarHBondContact O-N 3.09Å; L224-T228 PolarHBondContact O-OG1 2.98Å
225	I	50.4	Low	42.7	Very low	90 Å²	90	111.6 Å²	111.6	46%	0.462	57%	0.568	S	S	.	*	H	α-helix	trans	-64.3	-41.8	169.7	-70.3	165	0	0	0	109.9	D221 T228 I229	D221-I225 WeakPolarHBondContact O-CB 3.49Å; D221-I225 VanDerWaalsContact O-CG1 3.26Å; D221-I225 WeakPolarHBondContact O-CG1 3.46Å; D221-I225 PolarHBondContact O-N 3.23Å; I225-T228 WeakPolarHBondContact CA-OG1 3.39Å; I225-T228 PolarHBondContact O-OG1 2.79Å; I225-I229 HydrophobicContact CG2-CD1 3.67Å; I225-I229 HydrophobicContact CG2-CG1 4.46Å; I225-I229 WeakPolarHBondContact O-CB 3.3Å; I225-I229 WeakPolarHBondContact O-CG1 3.48Å; I225-I229 PolarHBondContact O-N 3.06Å
226	K	46.4	Very low	42.3	Very low	157 Å²	157	115.6 Å²	115.6	68%	0.683	57%	0.574	S	S	*	*	H	α-helix	trans	-66.5	-39.7	177.8	-168.6	175.2	-177.2	-180	0	112.8	L222 K223 S230	L222-K226 VanDerWaalsContact O-CB 3.27Å; L222-K226 WeakPolarHBondContact O-CB 3.49Å; L222-K226 PolarHBondContact O-N 2.84Å; K223-K226 CarbonylContact O-C 3.55Å; K223-K226 WeakPolarHBondContact O-CA 3.35Å; K223-K226 WeakPolarHBondContact O-CB 3.35Å; K223-K226 PolarHBondContact O-N 3.34Å; K223-K226 VanDerWaalsContact O-N 3.12Å; K226-S230 PolarHBondContact O-N 3.08Å; K226-S230 VanDerWaalsContact O-N 3.16Å; K226-S230 PolarHBondContact O-OG 3.29Å
227	T	45.5	Very low	41.6	Very low	69 Å²	69	113.8 Å²	113.8	42%	0.423	57%	0.573	S	S	.	*	H	α-helix	trans	-69.5	-50.2	174.3	54.1	0	0	0	0	110.9	K223 L224 I229 S230 D231	K223-T227 PolarHBondContact O-N 3.14Å; K223-T227 PolarHBondContact O-OG1 2.9Å; L224-T227 WeakPolarHBondContact CA-OG1 3.33Å; L224-T227 PolarHBondContact O-OG1 2.82Å; L224-T227 VanDerWaalsContact O-OG1 3.09Å; T227-I229 VanDerWaalsContact C-N 3.26Å; T227-I229 PolarHBondContact O-N 3.47Å; T227-S230 CarbonylContact O-C 3.58Å; T227-S230 WeakPolarHBondContact O-CA 3.35Å; T227-S230 WeakPolarHBondContact O-CB 3.4Å; T227-S230 PolarHBondContact O-N 3.33Å; T227-D231 VanDerWaalsContact C-OD2 3.3Å; T227-D231 PolarHBondContact O-N 3.03Å
228	T	39.6	Very low	41.2	Very low	62 Å²	62	115.7 Å²	115.7	38%	0.38	58%	0.584	S	S	.	*	H	α-helix	trans	-61.8	-29.7	179.7	49.9	0	0	0	0	113.7	L224 I225 Y232	L224-T228 WeakPolarHBondContact O-CB 3.27Å; L224-T228 WeakPolarHBondContact O-CG2 3.36Å; L224-T228 PolarHBondContact O-N 3.09Å; L224-T228 PolarHBondContact O-OG1 2.98Å; I225-T228 WeakPolarHBondContact CA-OG1 3.39Å; I225-T228 PolarHBondContact O-OG1 2.79Å; T228-Y232 WeakPolarHBondContact O-CD2 3.28Å; T228-Y232 PolarHBondContact O-N 2.96Å
229	I	43.8	Very low	40.8	Very low	102 Å²	102	110.9 Å²	110.9	52%	0.523	59%	0.585	S	S	.	*	H	α-helix	trans	-72.2	-33.8	170.2	-69.9	171	0	0	0	112	I225 T227 L233	I225-I229 HydrophobicContact CG2-CD1 3.67Å; I225-I229 HydrophobicContact CG2-CG1 4.46Å; I225-I229 WeakPolarHBondContact O-CB 3.3Å; I225-I229 WeakPolarHBondContact O-CG1 3.48Å; I225-I229 PolarHBondContact O-N 3.06Å; T227-I229 VanDerWaalsContact C-N 3.26Å; T227-I229 PolarHBondContact O-N 3.47Å; I229-L233 HydrophobicContact CG2-CD1 4.43Å
230	S	39.7	Very low	39.9	Very low	81 Å²	81	114.5 Å²	114.5	57%	0.566	60%	0.603	S	S	*	*	H	α-helix	trans	-69.2	-38.4	170.6	-71.6	0	0	0	0	112.8	K226 T227 Y232	K226-S230 PolarHBondContact O-N 3.08Å; K226-S230 VanDerWaalsContact O-N 3.16Å; K226-S230 PolarHBondContact O-OG 3.29Å; T227-S230 CarbonylContact O-C 3.58Å; T227-S230 WeakPolarHBondContact O-CA 3.35Å; T227-S230 WeakPolarHBondContact O-CB 3.4Å; T227-S230 PolarHBondContact O-N 3.33Å; S230-Y232 VanDerWaalsContact C-N 3.32Å; S230-Y232 PolarHBondContact O-N 3.2Å
231	D	37	Very low	38.9	Very low	119 Å²	119	117.3 Å²	117.3	64%	0.636	61%	0.614	S	S	*	*	H	α-helix	trans	-74.9	-19.7	-175.8	-58	-35.4	0	0	0	113.1	T227	T227-D231 VanDerWaalsContact C-OD2 3.3Å; T227-D231 PolarHBondContact O-N 3.03Å
232	Y	33.5	Very low	38.1	Very low	169 Å²	169	118.4 Å²	118.4	66%	0.663	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	4.3	179.6	-87.4	-96.7	0	0	0	114.9	T228 S230 P234	T228-Y232 WeakPolarHBondContact O-CD2 3.28Å; T228-Y232 PolarHBondContact O-N 2.96Å; S230-Y232 VanDerWaalsContact C-N 3.32Å; S230-Y232 PolarHBondContact O-N 3.2Å; Y232-P234 WeakPolarHBondContact O-CD 3.21Å
233	L	35.7	Very low	36.9	Very low	121 Å²	121	120.5 Å²	120.5	63%	0.634	64%	0.639	S	S	*	*	S	Bend	trans	-98	108.7	173.7	-85.9	168	0	0	0	110.8	I229 E235	I229-L233 HydrophobicContact CG2-CD1 4.43Å; L233-E235 PolarHBondContact O-N 3.49Å; L233-E235 VanDerWaalsContact O-N 3.15Å
234	P	32.4	Very low	35.6	Very low	116 Å²	116	122.6 Å²	122.6	75%	0.753	65%	0.651	S	S	*	*			trans	-67.4	115.4	175.5	26.9	-33.2	0	0	0	110.4	Y232 R236	Y232-P234 WeakPolarHBondContact O-CD 3.21Å; P234-R236 PolarHBondContact O-N 2.91Å
235	E	30.3	Very low	34.4	Very low	164 Å²	164	129 Å²	129	77%	0.766	67%	0.668	S	S	*	*			trans	-61.7	99.7	-179.9	-67.3	-161.1	138	0	0	112.1	L233 T237	L233-E235 PolarHBondContact O-N 3.49Å; L233-E235 VanDerWaalsContact O-N 3.15Å; E235-T237 PolarHBondContact O-N 3.47Å
236	R	28.6	Very low	33.3	Very low	210 Å²	210	128.1 Å²	128.1	79%	0.792	67%	0.669	S	S	*	*			trans	-86	57	160.8	-80.2	-160.7	175.5	-141	3.8	111.7	P234 V238	P234-R236 PolarHBondContact O-N 2.91Å; R236-V238 PolarHBondContact O-N 3.16Å
237	T	28	Very low	32.2	Very low	111 Å²	111	129 Å²	129	68%	0.681	68%	0.68	S	S	*	*			trans	-83.8	58.8	167.9	42.7	0	0	0	0	110.8	E235	E235-T237 PolarHBondContact O-N 3.47Å
238	V	32.2	Very low	31.3	Very low	133 Å²	133	130.9 Å²	130.9	81%	0.806	69%	0.691	S	S	*	*			trans	-99.5	124.6	175.9	-175.7	0	0	0	0	109.9	R236	R236-V238 PolarHBondContact O-N 3.16Å
239	G	29.7	Very low	30.7	Very low	66 Å²	66	132.1 Å²	132.1	68%	0.68	70%	0.703	S	S	*	*			trans	-76.2	167.5	-175.2	0	0	0	0	0	114.5	Q241	G239-Q241 PolarHBondContact O-N 2.8Å
240	I	27.6	Very low	30	Very low	178 Å²	178	134 Å²	134	91%	0.913	71%	0.713	S	S	*	*			trans	-71.7	112.2	171.4	-59	170	0	0	0	108.6
241	Q	29.5	Very low	29.6	Very low	130 Å²	130	138.2 Å²	138.2	61%	0.607	72%	0.724	S	S	*	*			trans	-124.5	135.7	149	-71.2	-164.6	-72.4	0	0	108.1	G239	G239-Q241 PolarHBondContact O-N 2.8Å
242	S	28.6	Very low	29.2	Very low	97 Å²	97	137.1 Å²	137.1	68%	0.678	72%	0.724	S	S	*	*			trans	-68.9	150.7	163.5	53.4	0	0	0	0	109.5
243	N	26.6	Very low	29	Very low	140 Å²	140	139.8 Å²	139.8	75%	0.749	73%	0.733	S	S	*	*				-175.1	165.2	111.8	-89.4	-0.8	0	0	0	112.1
244	H	30	Very low	28.7	Very low	155 Å²	155	139.9 Å²	139.9	72%	0.718	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-51.7	145.2	-177.2	-72.9	-121.4	0	0	0	114
245	W	27.1	Very low	28.5	Very low	240 Å²	240	141.4 Å²	141.4	91%	0.909	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-80.1	126.4	139.5	-100.3	52.6	0	0	0	107.9
246	C	27.6	Very low	28.5	Very low	71 Å²	71	139.4 Å²	139.4	48%	0.48	73%	0.731	S	S	.	*	P	Polyproline II helix	trans	-98.2	132	-160	-60.6	0	0	0	0	113.7
247	L	24	Very low	28.6	Very low	176 Å²	176	137.1 Å²	137.1	92%	0.921	73%	0.729	S	S	*	*	S	Bend		-112	109.5	117.3	-62.9	173.2	0	0	0	104.4
248	T	25	Very low	28.9	Very low	107 Å²	107	140.1 Å²	140.1	66%	0.656	73%	0.733	S	S	*	*	S	Bend	cis	-142.3	-175.7	7.7	51.6	0	0	0	0	111.6
249	S	28.3	Very low	28.9	Very low	89 Å²	89	144.9 Å²	144.9	62%	0.622	74%	0.736	S	S	*	*			trans	61.1	101.8	168.7	67.4	0	0	0	0	121.1
250	N	29	Very low	29.2	Very low	140 Å²	140	149.3 Å²	149.3	75%	0.749	74%	0.739	S	S	*	*				64.2	111.2	118.8	-57.4	8.6	0	0	0	122.9
251	E	31.3	Very low	29.5	Very low	171 Å²	171	148 Å²	148	80%	0.799	73%	0.733	S	S	*	*			trans	72.1	176.4	137.8	-53.3	-162.2	101	0	0	118.8
252	P	28.9	Very low	30	Very low	96 Å²	96	147.5 Å²	147.5	62%	0.623	73%	0.734	S	S	*	*				-137.3	162.6	-81.3	42.3	-26.2	0	0	0	117.3
253	R	28.4	Very low	30.6	Very low	225 Å²	225	151.6 Å²	151.6	85%	0.849	75%	0.749	S	S	*	*			trans	62	124	149.5	-68	165.9	-166.3	-138.9	3	121.3
254	N	29.3	Very low	31.5	Very low	122 Å²	122	148 Å²	148	65%	0.652	74%	0.744	S	S	*	*				29.7	123.5	130	-60.4	-14.6	0	0	0	120.5
255	M	28.9	Very low	32.1	Very low	149 Å²	149	143.7 Å²	143.7	73%	0.734	74%	0.742	S	S	*	*			trans	-142.5	117.4	131	-92.3	-158.1	74.1	0	0	112.4
256	V	29.3	Very low	32.8	Very low	122 Å²	122	139.4 Å²	139.4	74%	0.739	74%	0.737	S	S	*	*			trans	-72.4	123.7	174.8	173.7	0	0	0	0	110.1	K258	V256-K258 HydrophobicContact CG1-CG 4.43Å
257	H	32.4	Very low	33.3	Very low	162 Å²	162	142.8 Å²	142.8	75%	0.75	75%	0.749	S	S	*	*			trans	-97.4	97.7	165.1	-84.2	71.6	0	0	0	110.5	R259	H257-R259 PolarHBondContact O-N 3.12Å
258	K	34.4	Very low	33.8	Very low	174 Å²	174	141.2 Å²	141.2	76%	0.757	74%	0.74	S	S	*	*			trans	-60	117.9	166.1	-74.2	178.9	174.9	177.6	0	108.4	V256 Q260	V256-K258 HydrophobicContact CG1-CG 4.43Å; K258-Q260 PolarHBondContact O-N 3.05Å
259	R	31	Very low	34.4	Very low	232 Å²	232	142.8 Å²	142.8	88%	0.875	74%	0.743	S	S	*	*			trans	-74	82.4	162.9	-71.7	-173	178.9	-173.9	-0.6	108.8	H257 I261	H257-R259 PolarHBondContact O-N 3.12Å; R259-I261 PolarHBondContact O-N 2.96Å
260	Q	36.4	Very low	34.7	Very low	159 Å²	159	147 Å²	147	74%	0.743	75%	0.752	S	S	*	*			trans	-65.9	121.4	163.6	-73.9	-176.1	-81.7	0	0	108.2	K258 N262	K258-Q260 PolarHBondContact O-N 3.05Å; Q260-N262 PolarHBondContact O-N 3.18Å
261	I	33.8	Very low	34.9	Very low	151 Å²	151	147.8 Å²	147.8	77%	0.774	76%	0.756	S	S	*	*			trans	-82.7	106.6	167.4	-62	173.2	0	0	0	105.8	R259	R259-I261 PolarHBondContact O-N 2.96Å
262	N	41	Very low	34.9	Very low	119 Å²	119	143.4 Å²	143.4	64%	0.636	76%	0.757	S	S	*	*			trans	-69.2	148.6	170.8	-61.9	-5.3	0	0	0	108.6	Q260 G264 G265	Q260-N262 PolarHBondContact O-N 3.18Å; N262-G264 PolarHBondContact O-N 2.99Å; N262-G265 PolarHBondContact O-N 2.94Å
263	N	39.9	Very low	35	Very low	184 Å²	184	149.4 Å²	149.4	98%	0.984	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	18.7	-174.8	-68.2	-8.3	0	0	0	115.6
264	G	45.5	Very low	35.2	Very low	63 Å²	63	146.7 Å²	146.7	65%	0.649	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	8.5	177.8	0	0	0	0	0	115.1	N262 N266	N262-G264 PolarHBondContact O-N 2.99Å; G264-N266 VanDerWaalsContact C-N 3.25Å; G264-N266 PolarHBondContact O-N 3.1Å
265	G	42.2	Very low	35.3	Very low	65 Å²	65	149.4 Å²	149.4	67%	0.67	78%	0.78	S	S	*	*			trans	72.4	-15.1	163.4	0	0	0	0	0	119.1	N262	N262-G265 PolarHBondContact O-N 2.94Å
266	N	41.9	Very low	35.6	Very low	150 Å²	150	147.8 Å²	147.8	80%	0.802	78%	0.778	S	S	*	*			trans	-85.6	140.5	-177.4	-73.4	-23.1	0	0	0	113.5	G264	G264-N266 VanDerWaalsContact C-N 3.25Å; G264-N266 PolarHBondContact O-N 3.1Å
267	I	37.6	Very low	35.7	Very low	143 Å²	143	149.4 Å²	149.4	73%	0.733	78%	0.782	S	S	*	*			trans	-107.2	125.1	169.2	-60.6	176.1	0	0	0	108.3	I269	I267-I269 HydrophobicContact CG2-CG1 4.21Å
268	I	35.6	Very low	35.6	Very low	143 Å²	143	144.5 Å²	144.5	73%	0.733	78%	0.776	S	S	*	*			trans	-112	139.2	171.9	-57.8	175.9	0	0	0	107.6	E270	I268-E270 HydrophobicContact CG2-CG 4.13Å
269	I	38.2	Very low	35.5	Very low	140 Å²	140	142.9 Å²	142.9	72%	0.718	78%	0.781	S	S	*	*			trans	-130.5	108.1	171.9	-57	177.9	0	0	0	107.3	I267	I267-I269 HydrophobicContact CG2-CG1 4.21Å
270	E	34	Very low	35.4	Very low	177 Å²	177	139.5 Å²	139.5	83%	0.827	77%	0.774	S	S	*	*			trans	-97.9	134.3	170.3	-65.6	-174.5	138.7	0	0	109.5	I268	I268-E270 HydrophobicContact CG2-CG 4.13Å
271	N	32.2	Very low	35.1	Very low	156 Å²	156	141.7 Å²	141.7	83%	0.834	78%	0.776	S	S	*	*			trans	-100.2	111.8	172.7	-75.7	-23.6	0	0	0	109.1
272	G	32.8	Very low	35.1	Very low	79 Å²	79	142 Å²	142	81%	0.814	77%	0.774	S	S	*	*			trans	-117.7	104.8	173.7	0	0	0	0	0	111.5
273	Y	30	Very low	34.5	Very low	222 Å²	222	146.2 Å²	146.2	87%	0.871	78%	0.781	S	S	*	*			trans	-74.7	149.5	163	-84.8	-94.2	0	0	0	109.9
274	N	32.6	Very low	34.2	Very low	169 Å²	169	141.8 Å²	141.8	90%	0.904	76%	0.757	S	S	*	*			trans	-140.9	147.5	150.9	-96.1	-47.4	0	0	0	110.1
275	H	31	Very low	33.5	Very low	178 Å²	178	145 Å²	145	82%	0.824	76%	0.759	S	S	*	*			trans	-106.3	-143.2	-174.3	-174.4	26.2	0	0	0	109.1
276	V	35	Very low	33.1	Very low	116 Å²	116	148.8 Å²	148.8	70%	0.703	76%	0.764	S	S	*	*			trans	76.2	126.6	174.8	-170.8	0	0	0	0	112.4
277	D	32.8	Very low	32.6	Very low	155 Å²	155	150.1 Å²	150.1	83%	0.829	77%	0.766	S	S	*	*			cis	-146.2	172.4	2.3	-130.8	-20.3	0	0	0	112.5
278	G	29.3	Very low	32.5	Very low	60 Å²	60	151.5 Å²	151.5	62%	0.619	77%	0.774	S	S	*	*			trans	-131.2	130.3	-179.8	0	0	0	0	0	115.7
279	V	33.1	Very low	32.4	Very low	140 Å²	140	150 Å²	150	85%	0.848	77%	0.771	S	S	*	*			trans	-141	106.4	168.8	-176	0	0	0	0	107.2
280	H	29	Very low	32.2	Very low	161 Å²	161	151.2 Å²	151.2	75%	0.745	78%	0.779	S	S	*	*			cis	78.7	101.2	43.9	-159	86.1	0	0	0	113.5
281	R	29.4	Very low	32.2	Very low	204 Å²	204	146.1 Å²	146.1	77%	0.77	76%	0.758	S	S	*	*			trans	159.4	155.9	137	-87.9	163.2	-159.1	-156.7	6.3	114.9
282	H	33.9	Very low	32.3	Very low	159 Å²	159	148 Å²	148	74%	0.736	76%	0.762	S	S	*	*			trans	53.6	111.9	165.8	-57.7	-59.9	0	0	0	117.7
283	R	28.5	Very low	32.4	Very low	207 Å²	207	149.6 Å²	149.6	78%	0.781	75%	0.748	S	S	*	*			cis	77.4	138.4	19.5	-151.9	-159.1	144.4	134.7	7.9	115.3
284	D	34.3	Very low	32.5	Very low	91 Å²	91	143.7 Å²	143.7	49%	0.487	73%	0.728	S	S	.	*			trans	75.6	141.8	169	-49.4	-67	0	0	0	116
285	N	30.1	Very low	32.6	Very low	129 Å²	129	141.6 Å²	141.6	69%	0.69	72%	0.716	S	S	*	*			cis	-163.7	-166.4	-19.7	-97.7	-22.9	0	0	0	108.9
286	N	33.3	Very low	32.6	Very low	146 Å²	146	140.6 Å²	140.6	78%	0.781	71%	0.706	S	S	*	*			trans	83.4	107.9	-176.4	-46.8	-2.9	0	0	0	110.9
287	E	31.8	Very low	32.5	Very low	178 Å²	178	142.7 Å²	142.7	83%	0.832	71%	0.713	S	S	*	*				62.1	96.9	52.2	-52.5	-168.1	146.2	0	0	112.4
288	D	35.5	Very low	32.5	Very low	171 Å²	171	143.3 Å²	143.3	91%	0.914	71%	0.711	S	S	*	*				-148.8	159.8	114.4	-94.4	-38.5	0	0	0	108.7
289	V	34	Very low	32.8	Very low	111 Å²	111	145.1 Å²	145.1	67%	0.673	71%	0.714	S	S	*	*			trans	-137.2	128.1	-171.6	173.6	0	0	0	0	109.9	N291	V289-N291 WeakPolarHBondContact CG1-ND2 3.31Å
290	D	34.8	Very low	32.9	Very low	166 Å²	166	146 Å²	146	89%	0.888	71%	0.709	S	S	*	*			trans	-139.2	146.5	156.7	-88.4	-48	0	0	0	110.2
291	N	32.6	Very low	33.2	Very low	71 Å²	71	144.4 Å²	144.4	38%	0.38	71%	0.705	S	S	.	*			trans	-141.7	126.3	176.3	-60.8	-95.8	0	0	0	107.8	V289 L388	V289-N291 WeakPolarHBondContact CG1-ND2 3.31Å; N291-L388 HydrophobicContact CB-CB 3.84Å; N291-L388 HydrophobicContact CB-CD1 3.97Å; N291-L388 HydrophobicContact CB-CG 4.5Å
292	E	34.1	Very low	33.4	Very low	194 Å²	194	141.4 Å²	141.4	91%	0.907	70%	0.704	S	S	*	*			trans	-133	147.2	161.5	-65.6	-164.8	144.5	0	0	108.5
293	E	35.7	Very low	33.6	Very low	113 Å²	113	141.5 Å²	141.5	53%	0.528	71%	0.71	S	S	.	*			trans	-106.5	-141.8	-169.2	-155.9	175.9	-115	0	0	110.6	N389 Y390	E293-N389 VanDerWaalsContact CB-O 3.25Å; E293-N389 WeakPolarHBondContact CB-O 3.07Å; E293-N389 PolarHBondContact OE1-N 3.42Å; E293-N389 WeakPolarHBondContact OE2-CA 3.45Å; E293-N389 PolarHBondContact OE2-N 3.1Å; E293-Y390 CarbonylContact C-O 3.27Å; E293-Y390 VanDerWaalsContact C-O 3.27Å; E293-Y390 VanDerWaalsContact CB-O 3.3Å; E293-Y390 WeakPolarHBondContact CB-O 3.13Å; E293-Y390 PolarHBondContact OE2-N 3.29Å
294	E	31.8	Very low	34	Very low	98 Å²	98	141.1 Å²	141.1	46%	0.458	72%	0.717	S	S	.	*			trans	-57.3	153	-177.8	-10	167.4	70.6	0	0	116	Y390 H391 T392	E294-Y390 CarbonylContact C-O 3.37Å; E294-Y390 VanDerWaalsContact CA-O 3.26Å; E294-Y390 WeakPolarHBondContact CA-O 3.41Å; E294-Y390 WeakPolarHBondContact CB-O 3.37Å; E294-Y390 WeakPolarHBondContact CG-O 3.42Å; E294-Y390 PolarHBondContact N-O 3.38Å; E294-Y390 CarbonylContact O-C 3.37Å; E294-H391 PolarHBondContact O-N 2.97Å; E294-H391 WeakPolarHBondContact OE2-CA 3.4Å; E294-H391 PolarHBondContact OE2-N 3.32Å; E294-H391 VanDerWaalsContact OE2-N 3.12Å; E294-T392 PolarHBondContact OE2-N 3.37Å
295	I	34.1	Very low	34.4	Very low	126 Å²	126	141.8 Å²	141.8	65%	0.646	73%	0.729	S	S	*	*				-174.5	148.7	126.9	-92.5	149.7	0	0	0	108.6	H391	I295-H391 HydrophobicContact CD1-CB 3.9Å; I295-H391 HydrophobicContact CG1-CB 3.77Å
296	Y	32.1	Very low	34.7	Very low	157 Å²	157	143.7 Å²	143.7	62%	0.616	74%	0.739	S	S	*	*			trans	-76.5	156.8	177.9	-86.1	-111.4	0	0	0	113.5	E298	Y296-E298 HydrophobicContact CD1-CG 4.22Å
297	D	33.3	Very low	34.9	Very low	160 Å²	160	144.9 Å²	144.9	86%	0.856	75%	0.745	S	S	*	*			trans	-138.2	118.5	140.1	-128.8	-19.1	0	0	0	109.3
298	E	32.3	Very low	35.1	Very low	167 Å²	167	139.9 Å²	139.9	78%	0.78	73%	0.734	S	S	*	*			trans	-115.1	113.7	173	-91.4	-174.1	179.5	0	0	108.6	Y296	Y296-E298 HydrophobicContact CD1-CG 4.22Å
299	S	36	Very low	35	Very low	98 Å²	98	140.4 Å²	140.4	69%	0.685	73%	0.731	S	S	*	*			trans	-179	145.9	163.2	34.1	0	0	0	0	109.8
300	E	34.9	Very low	35	Very low	160 Å²	160	141.4 Å²	141.4	75%	0.748	73%	0.731	S	S	*	*			cis	-166	166.9	-15.9	-125.9	-176.9	152.5	0	0	107.7
301	I	34.8	Very low	34.9	Very low	127 Å²	127	137.6 Å²	137.6	65%	0.651	72%	0.718	S	S	*	*			trans	65.2	132.3	145.1	-73.4	167.4	0	0	0	118
302	D	34.1	Very low	34.9	Very low	141 Å²	141	143.1 Å²	143.1	75%	0.754	73%	0.733	S	S	*	*			cis	-157.3	-168.7	-2.5	-116.6	-14.6	0	0	0	110.9
303	D	37.8	Very low	35	Very low	161 Å²	161	135.9 Å²	135.9	86%	0.861	71%	0.707	S	S	*	*			trans	97.8	69.9	170.6	-63.9	-18.6	0	0	0	118
304	E	37.1	Very low	35.1	Very low	198 Å²	198	137.2 Å²	137.2	93%	0.925	71%	0.713	S	S	*	*			trans	-123.1	82.9	154.6	-169	172	-139.5	0	0	111.4
305	S	41.5	Very low	35.2	Very low	106 Å²	106	137.8 Å²	137.8	74%	0.741	72%	0.719	S	S	*	*			trans	-100.6	94.3	175.5	63.6	0	0	0	0	112.3
306	D	37.6	Very low	35.2	Very low	168 Å²	168	137.8 Å²	137.8	90%	0.898	72%	0.721	S	S	*	*			trans	-178.2	100.1	137.6	-98.9	-14.6	0	0	0	110.9
307	L	37.5	Very low	35.3	Very low	171 Å²	171	139.9 Å²	139.9	90%	0.895	73%	0.733	S	S	*	*			trans	-122.3	143.6	-173.1	-122.3	178.3	0	0	0	113.1
308	A	34.7	Very low	35.2	Very low	74 Å²	74	137 Å²	137	61%	0.612	73%	0.725	S	S	*	*			trans	70	105.6	154.1	0	0	0	0	0	121
309	H	33.8	Very low	35.2	Very low	182 Å²	182	136.9 Å²	136.9	84%	0.843	73%	0.729	S	S	*	*				-150.2	140.7	128.6	-78.8	-41.3	0	0	0	109.2
310	L	35.2	Very low	34.9	Very low	131 Å²	131	136.5 Å²	136.5	69%	0.686	73%	0.726	S	S	*	*			cis	-160.6	159.4	-16.1	-124.2	175	0	0	0	109.2	Y876	L310-Y876 PolarHBondContact O-OH 2.86Å
311	S	32.7	Very low	34.7	Very low	86 Å²	86	138.9 Å²	138.9	60%	0.601	73%	0.73	S	S	*	*			trans	-139.3	132.8	177.7	171	0	0	0	0	112.2	Y876	S311-Y876 VanDerWaalsContact CA-OH 3.28Å; S311-Y876 WeakPolarHBondContact CA-OH 3.37Å
312	R	32.9	Very low	34.4	Very low	187 Å²	187	140.6 Å²	140.6	71%	0.706	74%	0.735	S	S	*	*			trans	168.4	136.2	145.7	-100.1	171.4	-178	86.3	-3.6	115.3
313	A	35.3	Very low	34.3	Very low	43 Å²	43	139.5 Å²	139.5	36%	0.355	73%	0.73	S	S	.	*				-173.6	119.3	122.8	0	0	0	0	0	108.6	F877	A313-F877 HydrophobicContact CB-CE1 4.24Å
314	Q	37.8	Very low	34.3	Very low	141 Å²	141	139.7 Å²	139.7	66%	0.659	72%	0.723	S	S	*	*				64.6	133.9	63.1	-65.3	-166.2	-28.8	0	0	113.5
315	N	34.3	Very low	34	Very low	110 Å²	110	138.1 Å²	138.1	59%	0.588	72%	0.715	S	S	*	*			cis	-167.5	156.9	5.7	-115.9	-6.3	0	0	0	114.4
316	N	33.4	Very low	33.4	Very low	126 Å²	126	141.1 Å²	141.1	67%	0.674	72%	0.717	S	S	*	*			trans	61.1	115.7	143.8	-56.8	-19.9	0	0	0	123.7
317	K	34.9	Very low	33	Very low	200 Å²	200	137.3 Å²	137.3	87%	0.87	70%	0.704	S	S	*	*				161.8	156.9	111.3	-88.1	171.3	-177.1	178.1	0	111.7
318	S	29.8	Very low	32.7	Very low	100 Å²	100	137.1 Å²	137.1	70%	0.699	70%	0.7	S	S	*	*			cis	167	151.4	-38.1	-88.6	0	0	0	0	108.7
319	L	32.7	Very low	32.6	Very low	165 Å²	165	142.3 Å²	142.3	86%	0.864	71%	0.705	S	S	*	*			trans	78.3	128.5	177.4	-50.8	159.8	0	0	0	113.7
320	S	29.4	Very low	32.5	Very low	89 Å²	89	141.3 Å²	141.3	62%	0.622	70%	0.701	S	S	*	*			cis	77.3	138.6	40.1	82.4	0	0	0	0	113.6
321	Y	31.8	Very low	32.2	Very low	210 Å²	210	139.7 Å²	139.7	82%	0.824	70%	0.7	S	S	*	*			cis	-144.6	-164.1	27.1	-123.6	-80.9	0	0	0	112.6
322	E	29.2	Very low	32.3	Very low	164 Å²	164	142.7 Å²	142.7	77%	0.766	71%	0.705	S	S	*	*			trans	-96.7	170.8	-170.2	-56.4	162.7	115	0	0	115.7
323	D	32	Very low	32.3	Very low	118 Å²	118	142.8 Å²	142.8	63%	0.631	71%	0.707	S	S	*	*			trans	99.9	145.9	133.2	-148.1	8.7	0	0	0	122.1
324	K	36.9	Very low	32.2	Very low	165 Å²	165	144.8 Å²	144.8	72%	0.717	72%	0.718	S	S	*	*			trans	57.6	130.7	176.4	-67.4	116.5	-176.3	161.2	0	118.6
325	Q	30.3	Very low	31.8	Very low	164 Å²	164	144.5 Å²	144.5	77%	0.766	72%	0.721	S	S	*	*			cis	94.7	130.9	37.3	-81.8	-144.2	-10.3	0	0	115.6
326	H	28.6	Very low	31.8	Very low	170 Å²	170	146 Å²	146	79%	0.787	73%	0.729	S	S	*	*			trans	60.1	162.3	169.9	-78.4	-80.5	0	0	0	116.3
327	S	28.9	Very low	31.6	Very low	88 Å²	88	144.3 Å²	144.3	62%	0.615	73%	0.727	S	S	*	*			cis	170.4	126	-28.5	166.1	0	0	0	0	107.4
328	M	33.2	Very low	31.5	Very low	167 Å²	167	142.3 Å²	142.3	82%	0.823	72%	0.721	S	S	*	*			trans	173.8	136.7	152.3	-95.3	167.8	78.9	0	0	107.2
329	Y	30.7	Very low	31.6	Very low	183 Å²	183	143.7 Å²	143.7	72%	0.718	72%	0.72	S	S	*	*				62	132.1	72.4	-82.9	-110.8	0	0	0	112.5
330	E	31.7	Very low	31.4	Very low	161 Å²	161	140.8 Å²	140.8	75%	0.752	71%	0.714	S	S	*	*			cis	-146.4	-171.9	7.7	-159.4	150.1	-151.5	0	0	112.1
331	S	30.2	Very low	31.3	Very low	96 Å²	96	144.3 Å²	144.3	67%	0.671	72%	0.723	S	S	*	*			trans	-70.1	174.9	178.1	55	0	0	0	0	114.3
332	E	33.9	Very low	31.1	Very low	149 Å²	149	139 Å²	139	70%	0.696	72%	0.715	S	S	*	*				-175.6	147.2	115.4	-103.4	177.5	-163.4	0	0	114.7
333	Y	34.1	Very low	31	Very low	190 Å²	190	135.6 Å²	135.6	75%	0.745	71%	0.709	S	S	*	*			trans	46.5	153	153	-61.4	-55.5	0	0	0	121.6
334	S	32.9	Very low	30.9	Very low	85 Å²	85	137.6 Å²	137.6	59%	0.594	72%	0.715	S	S	*	*			cis	-154.3	133.1	-5.6	-118.8	0	0	0	0	107.4
335	N	29.6	Very low	30.6	Very low	134 Å²	134	136.1 Å²	136.1	72%	0.717	71%	0.714	S	S	*	*				75.2	157.9	97.5	-79.3	-0.9	0	0	0	116.3
336	D	33.6	Very low	30.6	Very low	143 Å²	143	134.3 Å²	134.3	77%	0.765	71%	0.709	S	S	*	*			trans	71	136.3	166.1	-55.5	-42.2	0	0	0	119.2
337	S	29.5	Very low	30.8	Very low	89 Å²	89	132.6 Å²	132.6	62%	0.622	70%	0.704	S	S	*	*			cis	168.3	175.3	-37.2	48.7	0	0	0	0	107.3
338	E	33.5	Very low	31	Very low	158 Å²	158	138.7 Å²	138.7	74%	0.738	71%	0.714	S	S	*	*			trans	74.6	139.6	157.5	-75	-163.9	-154.3	0	0	122.5
339	N	31.6	Very low	31.1	Very low	130 Å²	130	138.3 Å²	138.3	70%	0.695	71%	0.714	S	S	*	*			trans	59	129.6	152.8	-52.8	-32.7	0	0	0	120.1
340	S	27.6	Very low	31.1	Very low	104 Å²	104	136.3 Å²	136.3	73%	0.727	72%	0.716	S	S	*	*			cis	85.7	139	28.8	-162.3	0	0	0	0	115.4
341	M	27.6	Very low	31.5	Very low	163 Å²	163	133.8 Å²	133.8	80%	0.803	71%	0.713	S	S	*	*			trans	73.9	145.8	171.8	-67.5	-174	61.2	0	0	120.3
342	C	27.3	Very low	31.8	Very low	98 Å²	98	134.7 Å²	134.7	66%	0.662	72%	0.715	S	S	*	*			trans	63.3	106.6	150.6	-73.5	0	0	0	0	118.1
343	S	27.4	Very low	31.9	Very low	93 Å²	93	133 Å²	133	65%	0.65	71%	0.71	S	S	*	*				73.8	132.5	87.2	70.1	0	0	0	0	112.4
344	E	30.4	Very low	31.9	Very low	159 Å²	159	133.6 Å²	133.6	74%	0.743	71%	0.711	S	S	*	*				-160.5	148.2	54.7	-129.7	146.3	-154.3	0	0	112.8
345	I	30.4	Very low	32.1	Very low	135 Å²	135	136.3 Å²	136.3	69%	0.692	72%	0.718	S	S	*	*				45.1	122.4	125.6	-65.5	-171.3	0	0	0	117.4
346	N	30.4	Very low	32.5	Very low	126 Å²	126	136.3 Å²	136.3	67%	0.674	72%	0.718	S	S	*	*			cis	-163	143.8	43.2	-130.4	-15	0	0	0	115
347	I	32.5	Very low	32.6	Very low	134 Å²	134	136.8 Å²	136.8	69%	0.687	72%	0.715	S	S	*	*			trans	45.1	127.1	133.7	-72.9	174.5	0	0	0	119
348	R	32.1	Very low	33	Very low	215 Å²	215	139.7 Å²	139.7	81%	0.811	72%	0.719	S	S	*	*			cis	-161.2	134.3	48.2	-150.8	148.4	-156	177.8	5.3	115.9
349	L	35.3	Very low	33.2	Very low	159 Å²	159	137.5 Å²	137.5	83%	0.832	72%	0.716	S	S	*	*			trans	61.7	96.9	150.7	-66.5	174.4	0	0	0	122.6
350	N	31	Very low	33.5	Very low	142 Å²	142	137.7 Å²	137.7	76%	0.759	72%	0.722	S	S	*	*			trans	-57.3	173.4	142	-145.6	-10.4	0	0	0	111.4
351	P	39.4	Very low	33.9	Very low	107 Å²	107	135.8 Å²	135.8	70%	0.695	72%	0.719	S	S	*	*				-156.7	158.2	68.6	42.4	-21.7	0	0	0	119.9
352	V	37.2	Very low	34.2	Very low	115 Å²	115	139.4 Å²	139.4	70%	0.697	72%	0.723	S	S	*	*			trans	70.5	139.6	136.9	153.6	0	0	0	0	118.4
353	N	36.6	Very low	34.8	Very low	113 Å²	113	141 Å²	141	60%	0.604	73%	0.729	S	S	*	*			cis	-165.2	174.1	-6	-101.9	-16.9	0	0	0	106
354	R	34.3	Very low	35.4	Very low	204 Å²	204	145.7 Å²	145.7	77%	0.77	74%	0.738	S	S	*	*			cis	-159	148.3	-10.5	-103.5	165.5	-179.6	-168.2	-1.7	104.5
355	I	37.7	Very low	36.1	Very low	141 Å²	141	143.1 Å²	143.1	72%	0.723	74%	0.736	S	S	*	*			cis	96.2	135.7	42.4	-69.9	169.9	0	0	0	113.7
356	N	36.4	Very low	36.4	Very low	134 Å²	134	144.5 Å²	144.5	72%	0.717	74%	0.744	S	S	*	*			trans	81.3	123.3	-179.1	-62.4	-7.7	0	0	0	116.5
357	H	37.3	Very low	36.7	Very low	154 Å²	154	143.2 Å²	143.2	71%	0.713	75%	0.745	S	S	*	*			cis	85.2	142.2	48.1	-72.4	-132.8	0	0	0	111.9
358	E	36.6	Very low	36.8	Very low	150 Å²	150	141.4 Å²	141.4	70%	0.701	75%	0.745	S	S	*	*			cis	-161.8	156.4	16.9	-137.4	155.5	-143.3	0	0	116.5
359	T	38.4	Very low	37	Very low	112 Å²	112	138.2 Å²	138.2	69%	0.687	75%	0.749	S	S	*	*			trans	45.8	133.6	146.2	48.5	0	0	0	0	127
360	V	38.4	Very low	37.1	Very low	134 Å²	134	135.5 Å²	135.5	81%	0.812	74%	0.743	S	S	*	*				60.8	140.6	127.1	-179.8	0	0	0	0	120.1
361	G	35	Very low	37.6	Very low	64 Å²	64	133.9 Å²	133.9	66%	0.66	74%	0.74	S	S	*	*			cis	127.8	117.5	-2.7	0	0	0	0	0	114.8
362	R	35	Very low	37.3	Very low	239 Å²	239	136.5 Å²	136.5	90%	0.902	75%	0.748	S	S	*	*			trans	-163.7	130.2	169.9	-107.9	175.8	-177	179.5	1.2	110.3
363	V	39.4	Very low	37	Very low	130 Å²	130	135.5 Å²	135.5	79%	0.788	75%	0.746	S	S	*	*				69.8	132.3	93.1	164.7	0	0	0	0	113.8
364	K	40.1	Very low	36.9	Very low	192 Å²	192	136 Å²	136	84%	0.835	76%	0.758	S	S	*	*			cis	-167.6	167.9	-23.7	-124.5	-156.7	174.5	-171.1	0	107.2
365	P	45.2	Very low	36.7	Very low	106 Å²	106	130.4 Å²	130.4	69%	0.688	76%	0.756	S	S	*	*			trans	-95.4	166.3	-179.5	39.2	-34.8	0	0	0	113.8
366	D	36.1	Very low	36.5	Very low	164 Å²	164	128.6 Å²	128.6	88%	0.877	76%	0.756	S	S	*	*			trans	-179.4	157.1	155.4	-94.2	-28.8	0	0	0	107.7
367	S	36.6	Very low	36.1	Very low	99 Å²	99	126.4 Å²	126.4	69%	0.692	75%	0.751	S	S	*	*			cis	-156.8	164.7	-1.9	50.1	0	0	0	0	112.8
368	S	34.4	Very low	35.6	Very low	96 Å²	96	126.8 Å²	126.8	67%	0.671	75%	0.753	S	S	*	*			trans	9.9	132.5	157.3	58.8	0	0	0	0	123
369	T	36.1	Very low	35.1	Very low	147 Å²	147	130.2 Å²	130.2	90%	0.902	76%	0.759	S	S	*	*				-144.7	147.4	115.7	-58.8	0	0	0	0	108.5
370	S	37.7	Very low	34.5	Very low	102 Å²	102	129.8 Å²	129.8	71%	0.713	76%	0.761	S	S	*	*			trans	-145.1	-155.3	-166.9	55.1	0	0	0	0	112.4
371	P	41.5	Very low	34	Very low	108 Å²	108	130 Å²	130	70%	0.701	76%	0.758	S	S	*	*				-131	161.3	-103.4	40	-22.5	0	0	0	116.8
372	L	32.4	Very low	33.7	Very low	162 Å²	162	134 Å²	134	85%	0.848	76%	0.757	S	S	*	*			trans	-138.9	139	152.2	-71.8	96.4	0	0	0	108.1
373	S	31.9	Very low	33.5	Very low	94 Å²	94	131.1 Å²	131.1	66%	0.657	75%	0.747	S	S	*	*			cis	85.9	139.3	19.1	96	0	0	0	0	115.8
374	S	34.7	Very low	33.2	Very low	123 Å²	123	130.9 Å²	130.9	86%	0.86	74%	0.737	S	S	*	*			trans	62.7	148.7	-161.4	77.3	0	0	0	0	114.4
375	A	30.6	Very low	32.8	Very low	88 Å²	88	129.9 Å²	129.9	73%	0.727	74%	0.736	S	S	*	*			cis	-130.2	145.2	-12.7	0	0	0	0	0	107.2
376	S	32	Very low	32.1	Very low	102 Å²	102	133.4 Å²	133.4	71%	0.713	74%	0.74	S	S	*	*				64.6	99.1	52.8	-154.9	0	0	0	0	114.4
377	S	28.3	Very low	31.9	Very low	89 Å²	89	129 Å²	129	62%	0.622	72%	0.722	S	S	*	*			trans	57.1	132.7	134.1	65.8	0	0	0	0	122.3
378	H	27.7	Very low	31.6	Very low	161 Å²	161	127.9 Å²	127.9	75%	0.745	71%	0.708	S	S	*	*			trans	81.1	141.8	139.2	-86.6	-56.5	0	0	0	121.6
379	W	26	Very low	31.4	Very low	222 Å²	222	127 Å²	127	84%	0.841	70%	0.696	S	S	*	*			trans	73.2	121.2	160.1	-57.1	-10.4	0	0	0	114.8
380	S	25.6	Very low	31.1	Very low	104 Å²	104	126.7 Å²	126.7	73%	0.727	68%	0.679	S	S	*	*				66	82.8	60.3	-54.4	0	0	0	0	112
381	N	27.4	Very low	30.7	Very low	139 Å²	139	126.6 Å²	126.6	74%	0.743	67%	0.667	S	S	*	*			trans	-165.1	142.9	137.6	-101.3	-58.1	0	0	0	110.8
382	K	29.2	Very low	30.3	Very low	146 Å²	146	126 Å²	126	64%	0.635	66%	0.661	S	S	*	*			trans	32.4	141	133.1	-56.1	177.3	-178.3	-166.7	0	118.7
383	Y	31.6	Very low	30.2	Very low	180 Å²	180	122.7 Å²	122.7	71%	0.706	65%	0.65	S	S	*	*			cis	-139.6	132.2	45.3	-91.4	-97.8	0	0	0	110.9
384	E	31.1	Very low	30	Very low	124 Å²	124	123.5 Å²	123.5	58%	0.579	65%	0.651	S	S	*	*				63.1	133.9	104	-71.9	179	-165.7	0	0	114.2
385	H	32	Very low	29.7	Very low	172 Å²	172	122 Å²	122	80%	0.796	64%	0.64	S	S	*	*			cis	-156	138.6	8	-99.4	-53.9	0	0	0	106.3
386	K	31.8	Very low	29.6	Very low	179 Å²	179	128.4 Å²	128.4	78%	0.778	65%	0.645	S	S	*	*				-178.7	126.5	66	-108.5	159.5	-179.2	-172.8	0	106.4
387	S	31	Very low	29.2	Very low	72 Å²	72	131.2 Å²	131.2	50%	0.503	65%	0.652	S	S	.	*				68.3	134.6	92.3	75.4	0	0	0	0	115
388	L	31.3	Very low	29.2	Very low	76 Å²	76	131.7 Å²	131.7	40%	0.398	66%	0.656	S	S	.	*			cis	-143.5	139.5	11.3	-88.3	101.1	0	0	0	109	N291	N291-L388 HydrophobicContact CB-CB 3.84Å; N291-L388 HydrophobicContact CB-CD1 3.97Å; N291-L388 HydrophobicContact CB-CG 4.5Å
389	N	29	Very low	29.2	Very low	78 Å²	78	132.6 Å²	132.6	42%	0.417	66%	0.66	S	S	.	*				93.2	114.1	68.7	-73.1	-6.6	0	0	0	119.8	E293	E293-N389 VanDerWaalsContact CB-O 3.25Å; E293-N389 WeakPolarHBondContact CB-O 3.07Å; E293-N389 PolarHBondContact OE1-N 3.42Å; E293-N389 WeakPolarHBondContact OE2-CA 3.45Å; E293-N389 PolarHBondContact OE2-N 3.1Å
390	Y	29.8	Very low	29.4	Very low	139 Å²	139	127.4 Å²	127.4	55%	0.545	66%	0.658	S	S	.	*			trans	84.4	140.6	158.8	-50.3	-59.4	0	0	0	116.8	E293 E294	E293-Y390 CarbonylContact C-O 3.27Å; E293-Y390 VanDerWaalsContact C-O 3.27Å; E293-Y390 VanDerWaalsContact CB-O 3.3Å; E293-Y390 WeakPolarHBondContact CB-O 3.13Å; E293-Y390 PolarHBondContact OE2-N 3.29Å; E294-Y390 CarbonylContact C-O 3.37Å; E294-Y390 VanDerWaalsContact CA-O 3.26Å; E294-Y390 WeakPolarHBondContact CA-O 3.41Å; E294-Y390 WeakPolarHBondContact CB-O 3.37Å; E294-Y390 WeakPolarHBondContact CG-O 3.42Å; E294-Y390 PolarHBondContact N-O 3.38Å; E294-Y390 CarbonylContact O-C 3.37Å
391	H	30.4	Very low	29.5	Very low	100 Å²	100	127.8 Å²	127.8	46%	0.463	66%	0.66	S	S	.	*			cis	-149.5	141.2	-12.7	-103.4	-60.7	0	0	0	114.7	E294 I295	E294-H391 PolarHBondContact O-N 2.97Å; E294-H391 WeakPolarHBondContact OE2-CA 3.4Å; E294-H391 PolarHBondContact OE2-N 3.32Å; E294-H391 VanDerWaalsContact OE2-N 3.12Å; I295-H391 HydrophobicContact CD1-CB 3.9Å; I295-H391 HydrophobicContact CG1-CB 3.77Å
392	T	31.4	Very low	29.4	Very low	95 Å²	95	125 Å²	125	58%	0.583	65%	0.652	S	S	*	*			trans	-53.3	151.9	161.5	62.5	0	0	0	0	115	E294	E294-T392 PolarHBondContact OE2-N 3.37Å
393	P	31.6	Very low	29.3	Very low	94 Å²	94	124.9 Å²	124.9	61%	0.61	66%	0.657	S	S	*	*				-141.5	162.6	94.4	32.8	-16.2	0	0	0	113.9
394	V	28.2	Very low	29	Very low	111 Å²	111	123.1 Å²	123.1	67%	0.673	66%	0.659	S	S	*	*			cis	95.4	101.4	15.8	-177.2	0	0	0	0	116.5
395	S	27.1	Very low	28.8	Very low	90 Å²	90	122.9 Å²	122.9	63%	0.629	66%	0.66	S	S	*	*			trans	73.4	140.8	146.9	-70	0	0	0	0	122.7
396	R	28.1	Very low	28.8	Very low	224 Å²	224	121.2 Å²	121.2	85%	0.845	65%	0.652	S	S	*	*			trans	73.8	134.3	157.5	-61.4	145.9	-170.9	178.4	2.6	115.2
397	N	24.9	Very low	28.7	Very low	160 Å²	160	120 Å²	120	86%	0.856	65%	0.647	S	S	*	*			cis	74.7	54.9	35.4	-161.3	90.6	0	0	0	114.5
398	S	28.6	Very low	28.7	Very low	99 Å²	99	121.2 Å²	121.2	69%	0.692	66%	0.655	S	S	*	*			trans	-160.6	128.3	155.3	37.5	0	0	0	0	106.1
399	Q	27.8	Very low	28.7	Very low	181 Å²	181	121.4 Å²	121.4	85%	0.846	66%	0.663	S	S	*	*				61.5	134.5	54.9	-69.4	-162.5	-27.3	0	0	114.1
400	S	29.2	Very low	28.5	Very low	113 Å²	113	124 Å²	124	79%	0.79	69%	0.688	S	S	*	*			trans	69.5	104.3	179.5	-39.4	0	0	0	0	112
401	S	27.3	Very low	28.6	Very low	111 Å²	111	123.6 Å²	123.6	78%	0.776	69%	0.693	S	S	*	*				-154.7	152.1	73.9	-87.3	0	0	0	0	112.9
402	S	26.4	Very low	28.7	Very low	82 Å²	82	125.5 Å²	125.5	57%	0.573	71%	0.707	S	S	*	*			cis	-162.5	160.1	-1.8	-119.2	0	0	0	0	113.8
403	I	26.1	Very low	28.4	Very low	142 Å²	142	128 Å²	128	73%	0.728	72%	0.717	S	S	*	*			trans	37.8	122.7	132.9	-63	168.7	0	0	0	116.7
404	L	26.1	Very low	28.3	Very low	143 Å²	143	129.7 Å²	129.7	75%	0.749	72%	0.721	S	S	*	*			cis	-161.5	-179.3	2.3	-88.7	167.1	0	0	0	104.2
405	I	27.3	Very low	28.5	Very low	119 Å²	119	131.6 Å²	131.6	61%	0.61	73%	0.727	S	S	*	*			cis	-163.1	145.7	18.7	-143	153.9	0	0	0	107.7
406	H	30.5	Very low	28.6	Very low	137 Å²	137	131.9 Å²	131.9	63%	0.634	73%	0.729	S	S	*	*			trans	65.8	154.1	156.5	-70.9	11.6	0	0	0	119.1
407	K	30.4	Very low	28.9	Very low	155 Å²	155	126.6 Å²	126.6	67%	0.674	72%	0.722	S	S	*	*			cis	-164.6	157.9	-26.5	-120.5	171.5	-170.7	157.7	0	108.8
408	S	30.6	Very low	29.1	Very low	96 Å²	96	124.5 Å²	124.5	67%	0.671	71%	0.711	S	S	*	*			trans	61.4	131.5	145.5	-54.4	0	0	0	0	120.8
409	S	31.6	Very low	29.3	Very low	80 Å²	80	127 Å²	127	56%	0.559	71%	0.711	S	S	*	*			trans	40.9	124.1	137.8	60.9	0	0	0	0	119.6
410	S	26.1	Very low	29.5	Very low	134 Å²	134	123.9 Å²	123.9	94%	0.937	70%	0.7	S	S	*	*			cis	47.5	56.6	27.1	-154.9	0	0	0	0	113.7
411	I	31.3	Very low	29.6	Very low	129 Å²	129	124.4 Å²	124.4	66%	0.662	69%	0.693	S	S	*	*			trans	-134.3	137.1	158.7	-81.2	172.5	0	0	0	106.7
412	N	31.3	Very low	29.8	Very low	141 Å²	141	126 Å²	126	75%	0.754	69%	0.693	S	S	*	*			trans	20.1	119.9	159.6	-55.2	-12.6	0	0	0	117.7
413	N	26.9	Very low	30.2	Very low	148 Å²	148	125.4 Å²	125.4	79%	0.791	70%	0.699	S	S	*	*			cis	49.8	67.7	46.7	-146.8	49.3	0	0	0	113.1
414	N	29.5	Very low	30.4	Very low	129 Å²	129	125.1 Å²	125.1	69%	0.69	70%	0.698	S	S	*	*			trans	173.5	135.3	138.3	-87.6	-20	0	0	0	111
415	N	31.3	Very low	30.8	Very low	151 Å²	151	123 Å²	123	81%	0.807	70%	0.695	S	S	*	*			trans	65.7	151.8	156.1	-60.7	-12.4	0	0	0	117
416	S	30.2	Very low	31	Very low	95 Å²	95	123.7 Å²	123.7	66%	0.664	70%	0.7	S	S	*	*			cis	-173.8	168.6	-17.6	51	0	0	0	0	109.1
417	V	33	Very low	31.1	Very low	114 Å²	114	124.4 Å²	124.4	69%	0.691	71%	0.708	S	S	*	*			trans	69.2	101.9	146	162.8	0	0	0	0	116.4
418	N	29	Very low	31.1	Very low	116 Å²	116	120.2 Å²	120.2	62%	0.62	71%	0.71	S	S	*	*				75.3	131.4	124.4	-65.8	28.5	0	0	0	121
419	E	33.2	Very low	31.1	Very low	150 Å²	150	122.7 Å²	122.7	70%	0.701	71%	0.714	S	S	*	*				74.7	147.4	125.6	-70.2	-176.3	-118.7	0	0	119.5
420	N	31.5	Very low	31	Very low	117 Å²	117	126 Å²	126	63%	0.626	73%	0.725	S	S	*	*			cis	-164.8	170.6	-9	-126.8	-24.7	0	0	0	111.8
421	I	32.9	Very low	31.2	Very low	124 Å²	124	126.6 Å²	126.6	64%	0.636	72%	0.718	S	S	*	*			trans	69.8	109.7	138.9	-73.9	166.5	0	0	0	120.8
422	N	31.3	Very low	31	Very low	144 Å²	144	124.5 Å²	124.5	77%	0.77	71%	0.714	S	S	*	*			trans	77.8	146.8	133.4	-61.8	5.7	0	0	0	123.6
423	G	34	Very low	31.1	Very low	69 Å²	69	124 Å²	124	71%	0.711	72%	0.717	S	S	*	*			trans	132.3	52.1	165.1	0	0	0	0	0	115
424	I	30.7	Very low	31.3	Very low	137 Å²	137	123.3 Å²	123.3	70%	0.703	71%	0.713	S	S	*	*				65.7	112.7	84.2	-63.3	172.9	0	0	0	114.8
425	S	33.5	Very low	31.3	Very low	97 Å²	97	123 Å²	123	68%	0.678	71%	0.71	S	S	*	*			trans	74.7	154.4	150.9	81.9	0	0	0	0	119.3
426	N	32	Very low	31.3	Very low	135 Å²	135	122.1 Å²	122.1	72%	0.722	71%	0.706	S	S	*	*			cis	-169.5	158	-16.4	-110.5	3.1	0	0	0	111.9
427	N	32.2	Very low	31.2	Very low	151 Å²	151	125 Å²	125	81%	0.807	71%	0.714	S	S	*	*			trans	65.2	156.5	150.4	-57.4	-7.3	0	0	0	120.9
428	G	30.5	Very low	31.1	Very low	68 Å²	68	127.1 Å²	127.1	70%	0.701	72%	0.72	S	S	*	*			trans	101.7	89.7	167.4	0	0	0	0	0	113.5
429	I	32.1	Very low	31.1	Very low	148 Å²	148	129.4 Å²	129.4	76%	0.759	73%	0.727	S	S	*	*			cis	85.3	116.2	48.7	-60.6	178	0	0	0	113.2
430	D	27.8	Very low	30.8	Very low	148 Å²	148	129.7 Å²	129.7	79%	0.791	73%	0.732	S	S	*	*			trans	69.7	160.6	158	-59.8	-13.5	0	0	0	122.7
431	D	32.2	Very low	30.6	Very low	147 Å²	147	127.3 Å²	127.3	79%	0.786	72%	0.724	S	S	*	*			trans	58.5	106.2	178.9	-70.7	-46.9	0	0	0	118.7
432	S	26.5	Very low	30.6	Very low	85 Å²	85	127.9 Å²	127.9	59%	0.594	72%	0.724	S	S	*	*				92.2	150.6	50.1	83	0	0	0	0	113.3
433	T	33.7	Very low	30.6	Very low	130 Å²	130	130.7 Å²	130.7	80%	0.798	73%	0.732	S	S	*	*			trans	66.7	152.2	-164	85.2	0	0	0	0	113.6
434	N	29.7	Very low	30.3	Very low	134 Å²	134	131.6 Å²	131.6	72%	0.717	72%	0.724	S	S	*	*			cis	-151.6	155.5	-14.3	-133.4	-11.4	0	0	0	111.5
435	I	30.8	Very low	30.3	Very low	123 Å²	123	131.8 Å²	131.8	63%	0.631	73%	0.726	S	S	*	*			trans	45.6	105.5	151.4	-62.4	158.6	0	0	0	118.1
436	N	30	Very low	30.3	Very low	133 Å²	133	135.9 Å²	135.9	71%	0.711	74%	0.737	S	S	*	*				27.8	121.3	128.1	-41.9	-26.5	0	0	0	118.8
437	N	29.6	Very low	30.2	Very low	156 Å²	156	136 Å²	136	83%	0.834	74%	0.737	S	S	*	*				174.3	77.8	111.8	-85.7	-28.5	0	0	0	113.1
438	L	29.2	Very low	30	Very low	157 Å²	157	134.7 Å²	134.7	82%	0.822	73%	0.73	S	S	*	*			trans	-152.4	99.7	153.4	-142.8	79.7	0	0	0	109.7	L440	L438-L440 VanDerWaalsContact C-N 3.34Å; L438-L440 HydrophobicContact CD2-CD1 4.33Å; L438-L440 PolarHBondContact O-N 2.97Å
439	H	29.6	Very low	30	Very low	164 Å²	164	136 Å²	136	76%	0.759	73%	0.729	S	S	*	*			trans	-82.7	69.3	-166.2	-169.8	-76.2	0	0	0	113.1	C441	H439-C441 VanDerWaalsContact CE1-CB 3.49Å; H439-C441 WeakPolarHBondContact CE1-CB 3.47Å; H439-C441 PolarHBondContact CE1-O 3.24Å; H439-C441 PolarHBondContact ND1-O 3.01Å; H439-C441 PolarHBondContact O-N 3.22Å; H439-C441 VanDerWaalsContact O-N 3.1Å
440	L	26.5	Very low	30	Very low	157 Å²	157	133.5 Å²	133.5	82%	0.822	72%	0.72	S	S	*	*			trans	-77.8	72	157.4	-86.8	84.7	0	0	0	110	L438	L438-L440 VanDerWaalsContact C-N 3.34Å; L438-L440 HydrophobicContact CD2-CD1 4.33Å; L438-L440 PolarHBondContact O-N 2.97Å
441	C	28	Very low	30.2	Very low	66 Å²	66	132.8 Å²	132.8	45%	0.446	72%	0.715	S	S	.	*			trans	-142.2	139.3	172.3	-78.9	0	0	0	0	107.9	H439	H439-C441 VanDerWaalsContact CE1-CB 3.49Å; H439-C441 WeakPolarHBondContact CE1-CB 3.47Å; H439-C441 PolarHBondContact CE1-O 3.24Å; H439-C441 PolarHBondContact ND1-O 3.01Å; H439-C441 PolarHBondContact O-N 3.22Å; H439-C441 VanDerWaalsContact O-N 3.1Å
442	E	33.8	Very low	30.1	Very low	137 Å²	137	134.1 Å²	134.1	64%	0.64	72%	0.717	S	S	*	*			cis	-164.5	144.2	-7.1	-137	167.2	-116.9	0	0	109.8	T444	E442-T444 WeakPolarHBondContact CB-OG1 3.32Å; E442-T444 HydrophobicContact CG-CG2 4.38Å; E442-T444 PolarHBondContact O-N 3.3Å; E442-T444 PolarHBondContact OE2-OG1 3.36Å; E442-T444 VanDerWaalsContact OE2-OG1 3.11Å
443	E	29.7	Very low	30.3	Very low	203 Å²	203	135.5 Å²	135.5	95%	0.949	72%	0.721	S	S	*	*	S	Bend	trans	-80.7	39.5	-178	-66.5	-169.1	106.1	0	0	113.6
444	T	29.2	Very low	29.9	Very low	87 Å²	87	140.6 Å²	140.6	53%	0.534	73%	0.726	S	S	.	*			trans	-122.2	13.6	-166.5	51.7	0	0	0	0	115.2	E442	E442-T444 WeakPolarHBondContact CB-OG1 3.32Å; E442-T444 HydrophobicContact CG-CG2 4.38Å; E442-T444 PolarHBondContact O-N 3.3Å; E442-T444 PolarHBondContact OE2-OG1 3.36Å; E442-T444 VanDerWaalsContact OE2-OG1 3.11Å
445	N	30.4	Very low	29.9	Very low	141 Å²	141	142.3 Å²	142.3	75%	0.754	73%	0.733	S	S	*	*			trans	-113	11.4	177.6	-90.6	-67	0	0	0	116	L447	N445-L447 VanDerWaalsContact C-N 3.28Å; N445-L447 PolarHBondContact O-N 2.86Å
446	M	32.5	Very low	29.9	Very low	184 Å²	184	144 Å²	144	91%	0.906	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	3.9	174.1	-91.3	-85.2	-75.3	0	0	114.7
447	L	29.5	Very low	29.7	Very low	136 Å²	136	149.2 Å²	149.2	71%	0.712	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.4	18.9	-169.2	-152.7	69.3	0	0	0	115.7	N445	N445-L447 VanDerWaalsContact C-N 3.28Å; N445-L447 PolarHBondContact O-N 2.86Å
448	N	29.2	Very low	29.8	Very low	124 Å²	124	147.8 Å²	147.8	66%	0.663	74%	0.741	S	S	*	*	S	Bend	trans	-130	29.4	-175.7	-144.9	2.8	0	0	0	117.1
449	S	29.7	Very low	29.7	Very low	97 Å²	97	145.9 Å²	145.9	68%	0.678	73%	0.732	S	S	*	*	S	Bend	trans	-113.6	-8.2	153	69.3	0	0	0	0	113.2	I451 Q452	S449-I451 PolarHBondContact O-N 2.93Å; S449-Q452 PolarHBondContact O-N 2.68Å
450	T	33.1	Very low	29.7	Very low	94 Å²	94	145 Å²	145	58%	0.577	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-7.1	-178	-36.6	0	0	0	0	113.9	T453	T450-T453 PolarHBondContact O-OG1 3.16Å
451	I	30.6	Very low	29.6	Very low	133 Å²	133	141.8 Å²	141.8	68%	0.682	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-10.1	-177.5	-63	177.6	0	0	0	112.1	S449 T453	S449-I451 PolarHBondContact O-N 2.93Å; I451-T453 PolarHBondContact O-N 3.11Å
452	Q	31.7	Very low	29.7	Very low	176 Å²	176	145.1 Å²	145.1	82%	0.822	73%	0.727	S	S	*	*	S	Bend	trans	-79.3	11.4	173.9	-86.1	-74	-13.4	0	0	114.3	S449	S449-Q452 PolarHBondContact O-N 2.68Å
453	T	29.2	Very low	29.3	Very low	113 Å²	113	145.8 Å²	145.8	69%	0.693	74%	0.735	S	S	*	*	S	Bend	trans	-130.5	52.1	-175.3	48.6	0	0	0	0	113.2	T450 I451	T450-T453 PolarHBondContact O-OG1 3.16Å; I451-T453 PolarHBondContact O-N 3.11Å
454	R	26.1	Very low	29.1	Very low	238 Å²	238	143.9 Å²	143.9	90%	0.898	73%	0.73	S	S	*	*	S	Bend	trans	-149.2	21.9	173.6	-134.6	169.4	-174.6	156.4	1.3	118.9
455	I	29.5	Very low	29.1	Very low	169 Å²	169	145.9 Å²	145.9	87%	0.867	74%	0.742	S	S	*	*	S	Bend	trans	-129.8	148.2	164.6	-62.1	-177.1	0	0	0	109.6
456	H	30.4	Very low	29.1	Very low	159 Å²	159	146.7 Å²	146.7	74%	0.736	75%	0.746	S	S	*	*			trans	78.2	37	173.7	-128.8	-70.9	0	0	0	119.4	I458	H456-I458 PolarHBondContact O-N 2.91Å
457	Y	25.9	Very low	29	Very low	243 Å²	243	144.8 Å²	144.8	95%	0.953	74%	0.74	S	S	*	*			trans	-83.5	76.5	163.5	-133.8	-78	0	0	0	111.3
458	I	32.6	Very low	29.2	Very low	126 Å²	126	147 Å²	147	65%	0.646	74%	0.743	S	S	*	*			trans	-139	124.1	164.9	-58	-177.8	0	0	0	109.1	H456	H456-I458 PolarHBondContact O-N 2.91Å
459	N	27.2	Very low	29.2	Very low	117 Å²	117	147.7 Å²	147.7	63%	0.626	75%	0.747	S	S	*	*			trans	9.9	145	156.2	-40.4	-24.9	0	0	0	119.2
460	Y	28.8	Very low	29.3	Very low	144 Å²	144	151 Å²	151	57%	0.565	76%	0.757	S	S	*	*			cis	-152.3	158.4	33.7	-128.2	-77.6	0	0	0	112.3	N478 V480	Y460-N478 PolarHBondContact OH-O 2.88Å; Y460-V480 HydrophobicContact CE2-CB 4.25Å; Y460-V480 HydrophobicContact CE2-CG2 3.79Å; Y460-V480 WeakPolarHBondContact OH-CG2 3.34Å
461	S	25.5	Very low	29.1	Very low	90 Å²	90	154.2 Å²	154.2	63%	0.629	77%	0.771	S	S	*	*			trans	-72.4	145.2	166.4	-49.6	0	0	0	0	111.8
462	D	28.3	Very low	29.1	Very low	136 Å²	136	156.8 Å²	156.8	73%	0.727	78%	0.78	S	S	*	*				-176.1	167.1	98.7	-97.2	-30.3	0	0	0	113.9
463	N	26.2	Very low	28.8	Very low	151 Å²	151	156.1 Å²	156.1	81%	0.807	78%	0.78	S	S	*	*			trans	-84	121.4	-174.9	-64.3	-91.1	0	0	0	111.6
464	L	26.3	Very low	28.6	Very low	163 Å²	163	155.7 Å²	155.7	85%	0.853	78%	0.782	S	S	*	*			trans	-119.2	81.2	169.9	-88.2	166.7	0	0	0	111.6	L466	L464-L466 PolarHBondContact O-N 2.87Å
465	T	28.5	Very low	28.7	Very low	129 Å²	129	150.1 Å²	150.1	79%	0.791	78%	0.775	S	S	*	*			trans	-74.8	112	160.2	46.3	0	0	0	0	109	D467	T465-D467 PolarHBondContact O-N 3.23Å
466	L	29.6	Very low	28.5	Very low	159 Å²	159	152 Å²	152	83%	0.832	77%	0.772	S	S	*	*			trans	-66.8	101.8	170.7	-91.4	78.3	0	0	0	109.9	L464	L464-L466 PolarHBondContact O-N 2.87Å
467	D	30.5	Very low	28.5	Very low	144 Å²	144	151 Å²	151	77%	0.77	78%	0.777	S	S	*	*			trans	-76.9	126.3	162.3	-167.7	-0.1	0	0	0	109.5	T465 N469	T465-D467 PolarHBondContact O-N 3.23Å; D467-N469 VanDerWaalsContact C-N 3.34Å; D467-N469 PolarHBondContact O-N 2.77Å
468	K	34.3	Very low	28.6	Very low	183 Å²	183	145.1 Å²	145.1	80%	0.796	76%	0.762	S	S	*	*	S	Bend	trans	-90.6	70.1	176.8	-71.5	-175.2	178.7	179.7	0	109.5
469	N	29.5	Very low	28.4	Very low	138 Å²	138	142.6 Å²	142.6	74%	0.738	77%	0.768	S	S	*	*	S	Bend	trans	176.6	91.6	151.8	-89.1	-28.3	0	0	0	111.9	D467	D467-N469 VanDerWaalsContact C-N 3.34Å; D467-N469 PolarHBondContact O-N 2.77Å
470	N	32.4	Very low	28.4	Very low	165 Å²	165	141.6 Å²	141.6	88%	0.882	77%	0.766	S	S	*	*			trans	172.6	141.6	135	-93.2	-47.7	0	0	0	112.4	Q472	N470-Q472 PolarHBondContact O-N 2.77Å
471	N	27.3	Very low	28.3	Very low	163 Å²	163	141.9 Å²	141.9	87%	0.872	78%	0.776	S	S	*	*			trans	-88.9	94.6	176.8	-79.6	-32.2	0	0	0	111.7
472	Q	31.8	Very low	28.4	Very low	186 Å²	186	145.2 Å²	145.2	87%	0.869	79%	0.786	S	S	*	*			trans	-159.8	128.4	154.5	-117.4	157.3	89	0	0	110.7	N470	N470-Q472 PolarHBondContact O-N 2.77Å
473	I	24.6	Very low	28.4	Very low	163 Å²	163	146 Å²	146	84%	0.836	79%	0.785	S	S	*	*			trans	-98.6	114.3	-178.9	-61.8	172.4	0	0	0	108.4	T475	I473-T475 HydrophobicContact CG2-CG2 4.28Å
474	S	26	Very low	28.5	Very low	103 Å²	103	147.8 Å²	147.8	72%	0.72	79%	0.789	S	S	*	*			trans	-126.1	106.1	169.6	47.9	0	0	0	0	109.9
475	T	26.6	Very low	28.7	Very low	122 Å²	122	144.9 Å²	144.9	75%	0.748	78%	0.782	S	S	*	*			trans	-85.5	114	-179.4	48.4	0	0	0	0	111	I473	I473-T475 HydrophobicContact CG2-CG2 4.28Å
476	Y	25.6	Very low	29.1	Very low	209 Å²	209	142 Å²	142	82%	0.82	76%	0.762	S	S	*	*			trans	-125.8	100.2	167.6	-93	-84.1	0	0	0	110.6
477	T	30	Very low	29.5	Very low	136 Å²	136	139.1 Å²	139.1	83%	0.834	75%	0.753	S	S	*	*			trans	-109.8	115.9	162.1	48.8	0	0	0	0	107.8	G479	T477-G479 PolarHBondContact O-N 3.4Å
478	N	29.5	Very low	30.2	Very low	120 Å²	120	138.3 Å²	138.3	64%	0.642	74%	0.744	S	S	*	*			trans	-65.8	131.4	177.2	-79.6	-56.2	0	0	0	110.4	Y460	Y460-N478 PolarHBondContact OH-O 2.88Å
479	G	26.8	Very low	30.8	Very low	74 Å²	74	134.7 Å²	134.7	76%	0.763	73%	0.73	S	S	*	*			trans	-81.5	138.4	-172.3	0	0	0	0	0	114	T477	T477-G479 PolarHBondContact O-N 3.4Å
480	V	28.2	Very low	31.5	Very low	96 Å²	96	134.3 Å²	134.3	58%	0.582	72%	0.724	S	S	*	*			trans	-106.9	141.9	151.9	162.1	0	0	0	0	108.5	Y460 L482	Y460-V480 HydrophobicContact CE2-CB 4.25Å; Y460-V480 HydrophobicContact CE2-CG2 3.79Å; Y460-V480 WeakPolarHBondContact OH-CG2 3.34Å; V480-L482 PolarHBondContact O-N 2.92Å
481	L	26	Very low	32.3	Very low	149 Å²	149	135.5 Å²	135.5	78%	0.78	72%	0.716	S	S	*	*			trans	-76.1	101.3	-165.1	-168.4	78.4	0	0	0	112.6
482	L	28.4	Very low	33.4	Very low	160 Å²	160	134.1 Å²	134.1	84%	0.838	70%	0.704	S	S	*	*			trans	-128.1	89	162.5	-79.4	176.1	0	0	0	110.5	V480	V480-L482 PolarHBondContact O-N 2.92Å
483	Q	27.4	Very low	34	Very low	154 Å²	154	131.6 Å²	131.6	72%	0.72	69%	0.692	S	S	*	*			trans	-71.8	155.3	160.5	-66.6	-178.5	-20.8	0	0	109.6
484	Q	29.9	Very low	34.9	Very low	187 Å²	187	127.6 Å²	127.6	87%	0.874	67%	0.672	S	S	*	*			trans	69.5	78	170	-49.5	179.2	12.8	0	0	116.8
485	S	30.4	Very low	35.9	Very low	103 Å²	103	125.7 Å²	125.7	72%	0.72	66%	0.659	S	S	*	*			trans	-146.3	149.5	150	58.7	0	0	0	0	111
486	N	35.7	Very low	37	Very low	68 Å²	68	123.6 Å²	123.6	36%	0.364	65%	0.646	S	S	.	*			trans	-87.3	131.3	-168.3	175.1	-10.5	0	0	0	111.3	Q488 Q489	N486-Q488 PolarHBondContact ND2-OE1 3.04Å; N486-Q488 PolarHBondContact O-N 3.47Å; N486-Q488 WeakPolarHBondContact OD1-CB 3.35Å; N486-Q488 WeakPolarHBondContact OD1-CG 3.46Å; N486-Q488 PolarHBondContact OD1-N 3.02Å; N486-Q488 PolarHBondContact OD1-OE1 3.07Å; N486-Q489 HydrophobicContact CB-CG 4.46Å; N486-Q489 WeakPolarHBondContact O-CB 3.43Å; N486-Q489 PolarHBondContact O-N 3.18Å
487	P	39	Very low	37.8	Very low	98 Å²	98	118.3 Å²	118.3	64%	0.636	63%	0.631	S	S	*	*	H	α-helix	trans	-57.6	-18.3	177.8	23	-34.7	0	0	0	115.1	R491	P487-R491 PolarHBondContact O-N 2.85Å
488	Q	45.3	Very low	38.2	Very low	128 Å²	128	114.6 Å²	114.6	60%	0.598	61%	0.614	S	S	*	*	H	α-helix	trans	-67.1	-38.6	170.6	-66.3	170.8	-44.1	0	0	112.5	N486 H490 R491 Q492	N486-Q488 PolarHBondContact ND2-OE1 3.04Å; N486-Q488 PolarHBondContact O-N 3.47Å; N486-Q488 WeakPolarHBondContact OD1-CB 3.35Å; N486-Q488 WeakPolarHBondContact OD1-CG 3.46Å; N486-Q488 PolarHBondContact OD1-N 3.02Å; N486-Q488 PolarHBondContact OD1-OE1 3.07Å; Q488-H490 VanDerWaalsContact C-N 3.35Å; Q488-R491 PolarHBondContact O-N 3.41Å; Q488-Q492 PolarHBondContact O-N 3.32Å; Q488-Q492 VanDerWaalsContact O-N 3.12Å
489	Q	46.4	Very low	38.7	Very low	107 Å²	107	113.9 Å²	113.9	50%	0.5	61%	0.61	S	S	.	*	H	α-helix	trans	-68.3	-35.4	177.9	-66.9	174.9	-60.1	0	0	111.5	N486 R491 Q492 H493	N486-Q489 HydrophobicContact CB-CG 4.46Å; N486-Q489 WeakPolarHBondContact O-CB 3.43Å; N486-Q489 PolarHBondContact O-N 3.18Å; Q489-R491 VanDerWaalsContact C-N 3.33Å; Q489-R491 PolarHBondContact O-N 2.81Å; Q489-Q492 PolarHBondContact O-N 3.2Å; Q489-Q492 VanDerWaalsContact O-N 3.15Å; Q489-H493 PolarHBondContact O-N 3.46Å
490	H	43	Very low	39.3	Very low	130 Å²	130	116.9 Å²	116.9	60%	0.602	61%	0.607	S	S	*	*	H	α-helix	trans	-65.1	-36.5	177	-148.7	-92.2	0	0	0	112	Q488 L494	Q488-H490 VanDerWaalsContact C-N 3.35Å; H490-L494 WeakPolarHBondContact O-CG 3.36Å; H490-L494 PolarHBondContact O-N 3.18Å; H490-L494 VanDerWaalsContact O-N 3.11Å
491	R	50	Low	39.4	Very low	190 Å²	190	114.1 Å²	114.1	72%	0.717	60%	0.595	S	S	*	*	H	α-helix	trans	-68.4	-35.7	170.7	-82.7	-164.7	-80.2	-157.4	-4.8	113.1	P487 Q488 Q489 S495	P487-R491 PolarHBondContact O-N 2.85Å; Q488-R491 PolarHBondContact O-N 3.41Å; Q489-R491 VanDerWaalsContact C-N 3.33Å; Q489-R491 PolarHBondContact O-N 2.81Å; R491-S495 WeakPolarHBondContact O-CB 3.43Å; R491-S495 PolarHBondContact O-N 2.78Å
492	Q	50.1	Low	40	Very low	133 Å²	133	117.3 Å²	117.3	62%	0.621	60%	0.602	S	S	*	*	H	α-helix	trans	-65.7	-44.1	173.2	-74.2	-179.2	-26.5	0	0	111.9	Q488 Q489 L494 S495 T496	Q488-Q492 PolarHBondContact O-N 3.32Å; Q488-Q492 VanDerWaalsContact O-N 3.12Å; Q489-Q492 PolarHBondContact O-N 3.2Å; Q489-Q492 VanDerWaalsContact O-N 3.15Å; Q492-L494 PolarHBondContact O-N 3.37Å; Q492-S495 WeakPolarHBondContact O-CB 3.46Å; Q492-S495 PolarHBondContact O-N 2.82Å; Q492-T496 PolarHBondContact O-N 3.01Å; Q492-T496 PolarHBondContact O-OG1 3.24Å; Q492-T496 VanDerWaalsContact O-OG1 3.07Å
493	H	43.9	Very low	40.3	Very low	133 Å²	133	116.8 Å²	116.8	62%	0.616	59%	0.593	S	S	*	*	H	α-helix	trans	-58.7	-46.3	174.9	-104.6	-97.8	0	0	0	112.6	Q489 S495 T496 I497	Q489-H493 PolarHBondContact O-N 3.46Å; H493-S495 VanDerWaalsContact C-N 3.34Å; H493-S495 PolarHBondContact O-N 3.32Å; H493-T496 PolarHBondContact O-N 3.33Å; H493-I497 WeakPolarHBondContact O-CD1 3.38Å; H493-I497 VanDerWaalsContact O-CG1 3.27Å; H493-I497 WeakPolarHBondContact O-CG1 3.34Å; H493-I497 PolarHBondContact O-N 3.34Å
494	L	43.9	Very low	40.6	Very low	79 Å²	79	114.1 Å²	114.1	41%	0.414	59%	0.589	S	S	.	*	H	α-helix	trans	-65.3	-36.2	177.8	-70.4	169.1	0	0	0	112.5	H490 Q492 A498	H490-L494 WeakPolarHBondContact O-CG 3.36Å; H490-L494 PolarHBondContact O-N 3.18Å; H490-L494 VanDerWaalsContact O-N 3.11Å; Q492-L494 PolarHBondContact O-N 3.37Å; L494-A498 VanDerWaalsContact O-CB 3.31Å; L494-A498 WeakPolarHBondContact O-CB 3.19Å; L494-A498 PolarHBondContact O-N 3.25Å
495	S	46.7	Very low	41	Very low	64 Å²	64	111.1 Å²	111.1	45%	0.448	58%	0.575	S	S	.	*	H	α-helix	trans	-62.6	-48.4	171.5	-177.9	0	0	0	0	111.8	R491 Q492 H493 I497 A498 N499	R491-S495 WeakPolarHBondContact O-CB 3.43Å; R491-S495 PolarHBondContact O-N 2.78Å; Q492-S495 WeakPolarHBondContact O-CB 3.46Å; Q492-S495 PolarHBondContact O-N 2.82Å; H493-S495 VanDerWaalsContact C-N 3.34Å; H493-S495 PolarHBondContact O-N 3.32Å; S495-I497 VanDerWaalsContact C-N 3.35Å; S495-I497 PolarHBondContact O-N 2.88Å; S495-A498 PolarHBondContact O-N 2.99Å; S495-N499 VanDerWaalsContact O-CG 3.27Å; S495-N499 PolarHBondContact O-N 3.1Å; S495-N499 PolarHBondContact O-ND2 2.77Å; S495-N499 VanDerWaalsContact O-ND2 3.14Å
496	T	50.4	Low	41.7	Very low	77 Å²	77	112.3 Å²	112.3	47%	0.472	57%	0.573	S	S	.	*	H	α-helix	trans	-60.1	-42.9	177.3	-58.4	0	0	0	0	111.9	Q492 H493 N499 I500	Q492-T496 PolarHBondContact O-N 3.01Å; Q492-T496 PolarHBondContact O-OG1 3.24Å; Q492-T496 VanDerWaalsContact O-OG1 3.07Å; H493-T496 PolarHBondContact O-N 3.33Å; T496-N499 PolarHBondContact O-N 2.72Å; T496-I500 HydrophobicContact CG2-CD1 3.91Å; T496-I500 VanDerWaalsContact O-CG1 3.3Å; T496-I500 WeakPolarHBondContact O-CG1 3.48Å; T496-I500 PolarHBondContact O-N 3.03Å; T496-I500 VanDerWaalsContact O-N 3.08Å
497	I	42.1	Very low	42.1	Very low	99 Å²	99	115.3 Å²	115.3	51%	0.508	59%	0.585	S	S	.	*	H	α-helix	trans	-64.3	-41.3	176.1	-67.9	163.3	0	0	0	111.1	H493 S495 N499 I500 A501	H493-I497 WeakPolarHBondContact O-CD1 3.38Å; H493-I497 VanDerWaalsContact O-CG1 3.27Å; H493-I497 WeakPolarHBondContact O-CG1 3.34Å; H493-I497 PolarHBondContact O-N 3.34Å; S495-I497 VanDerWaalsContact C-N 3.35Å; S495-I497 PolarHBondContact O-N 2.88Å; I497-N499 VanDerWaalsContact C-N 3.26Å; I497-N499 PolarHBondContact O-N 2.69Å; I497-I500 PolarHBondContact O-N 3.3Å; I497-A501 PolarHBondContact O-N 3.33Å
498	A	38.9	Very low	42.2	Very low	57 Å²	57	114.4 Å²	114.4	47%	0.471	58%	0.578	S	S	.	*	H	α-helix	trans	-67.6	-22.6	175.9	0	0	0	0	0	113.9	L494 S495	L494-A498 VanDerWaalsContact O-CB 3.31Å; L494-A498 WeakPolarHBondContact O-CB 3.19Å; L494-A498 PolarHBondContact O-N 3.25Å; S495-A498 PolarHBondContact O-N 2.99Å
499	N	39.9	Very low	42.1	Very low	106 Å²	106	113.4 Å²	113.4	57%	0.567	58%	0.576	S	S	*	*	H	α-helix	trans	-87.4	-21.5	174.6	-67.6	-32.7	0	0	0	113.3	S495 T496 I497	S495-N499 VanDerWaalsContact O-CG 3.27Å; S495-N499 PolarHBondContact O-N 3.1Å; S495-N499 PolarHBondContact O-ND2 2.77Å; S495-N499 VanDerWaalsContact O-ND2 3.14Å; T496-N499 PolarHBondContact O-N 2.72Å; I497-N499 VanDerWaalsContact C-N 3.26Å; I497-N499 PolarHBondContact O-N 2.69Å
500	I	38.9	Very low	42.3	Very low	136 Å²	136	112.6 Å²	112.6	70%	0.697	58%	0.576	S	S	*	*	H	α-helix	trans	-80.2	-31.8	177.5	-72.9	165.3	0	0	0	111.7	T496 I497	T496-I500 HydrophobicContact CG2-CD1 3.91Å; T496-I500 VanDerWaalsContact O-CG1 3.3Å; T496-I500 WeakPolarHBondContact O-CG1 3.48Å; T496-I500 PolarHBondContact O-N 3.03Å; T496-I500 VanDerWaalsContact O-N 3.08Å; I497-I500 PolarHBondContact O-N 3.3Å
501	A	31.3	Very low	42.5	Very low	39 Å²	39	111.4 Å²	111.4	32%	0.322	57%	0.573	S	S	.	*	S	Bend	trans	-100.9	128.5	179.5	0	0	0	0	0	111.7	I497 F503	I497-A501 PolarHBondContact O-N 3.33Å; A501-F503 HydrophobicContact CB-CD2 3.65Å; A501-F503 HydrophobicContact CB-CE2 3.95Å; A501-F503 PolarHBondContact O-N 3.28Å
502	K	38	Very low	42.2	Very low	216 Å²	216	106 Å²	106	94%	0.939	56%	0.558	S	S	*	*			trans	-71.1	59	179.7	-66.7	-176.1	176.1	-179.4	0	113.4
503	F	35	Very low	42.2	Very low	148 Å²	148	104.3 Å²	104.3	65%	0.649	55%	0.554	S	S	*	*			trans	-95.3	148.7	174.4	-79.9	-79	0	0	0	112.2	A501 Q505	A501-F503 HydrophobicContact CB-CD2 3.65Å; A501-F503 HydrophobicContact CB-CE2 3.95Å; A501-F503 PolarHBondContact O-N 3.28Å; F503-Q505 PolarHBondContact O-N 3.38Å
504	P	33.3	Very low	43	Very low	98 Å²	98	105 Å²	105	64%	0.636	56%	0.555	S	S	*	*			trans	-60.3	117.1	170.6	-21.6	33.5	0	0	0	110.9	D506	P504-D506 PolarHBondContact O-N 3.08Å
505	Q	39.4	Very low	43	Very low	124 Å²	124	107 Å²	107	58%	0.579	56%	0.561	S	S	*	*	H	α-helix	trans	-68.4	-32.2	-166.3	-68.6	-178.1	-34.7	0	0	113.5	F503 L509	F503-Q505 PolarHBondContact O-N 3.38Å; Q505-L509 WeakPolarHBondContact O-CB 3.49Å; Q505-L509 PolarHBondContact O-N 3.14Å
506	D	43.6	Very low	42.9	Very low	128 Å²	128	108.8 Å²	108.8	68%	0.684	56%	0.56	S	S	*	*	H	α-helix	trans	-75.7	-29.4	-165.8	-62.5	-52	0	0	0	115.7	P504 N510	P504-D506 PolarHBondContact O-N 3.08Å; D506-N510 VanDerWaalsContact O-CB 3.31Å; D506-N510 WeakPolarHBondContact O-CB 3.34Å; D506-N510 PolarHBondContact O-N 3.23Å; D506-N510 PolarHBondContact O-ND2 2.96Å
507	Q	44.7	Very low	42.9	Very low	132 Å²	132	107.1 Å²	107.1	62%	0.617	56%	0.558	S	S	*	*	H	α-helix	trans	-85.6	-46.5	-177.5	-74.8	-172.1	-10.8	0	0	112.5	L509 N510 N511	Q507-L509 VanDerWaalsContact C-N 3.35Å; Q507-L509 PolarHBondContact O-N 2.97Å; Q507-N510 PolarHBondContact O-N 3.18Å; Q507-N511 WeakPolarHBondContact O-CB 3.38Å; Q507-N511 VanDerWaalsContact O-CG 3.29Å; Q507-N511 PolarHBondContact O-N 3.14Å; Q507-N511 PolarHBondContact O-ND2 3.31Å
508	T	42	Very low	42.8	Very low	79 Å²	79	109.1 Å²	109.1	49%	0.485	56%	0.56	S	S	.	*	H	α-helix	trans	-63.6	-42.2	-178.1	-44.8	0	0	0	0	111.2	N511 L512	T508-N511 PolarHBondContact O-N 2.89Å; T508-L512 HydrophobicContact CG2-CD1 4.45Å; T508-L512 PolarHBondContact O-N 3.41Å
509	L	43.6	Very low	42.7	Very low	106 Å²	106	110.6 Å²	110.6	56%	0.555	56%	0.56	S	S	*	*	H	α-helix	trans	-69.9	-39.8	179.2	-169.8	62.6	0	0	0	112.3	Q505 Q507 L512 N513	Q505-L509 WeakPolarHBondContact O-CB 3.49Å; Q505-L509 PolarHBondContact O-N 3.14Å; Q507-L509 VanDerWaalsContact C-N 3.35Å; Q507-L509 PolarHBondContact O-N 2.97Å; L509-L512 PolarHBondContact O-N 3.39Å; L509-N513 WeakPolarHBondContact O-CB 3.1Å; L509-N513 VanDerWaalsContact O-CG 3.23Å; L509-N513 PolarHBondContact O-N 2.87Å; L509-N513 PolarHBondContact O-ND2 3.42Å
510	N	49.7	Very low	42.9	Very low	91 Å²	91	112.4 Å²	112.4	49%	0.487	57%	0.57	S	S	.	*	H	α-helix	trans	-63.4	-41.5	173.7	-96.1	-65.9	0	0	0	112.6	D506 Q507 N513 K514	D506-N510 VanDerWaalsContact O-CB 3.31Å; D506-N510 WeakPolarHBondContact O-CB 3.34Å; D506-N510 PolarHBondContact O-N 3.23Å; D506-N510 PolarHBondContact O-ND2 2.96Å; Q507-N510 PolarHBondContact O-N 3.18Å; N510-N513 PolarHBondContact O-N 2.94Å; N510-K514 WeakPolarHBondContact O-CB 3.47Å; N510-K514 WeakPolarHBondContact O-CG 3.4Å; N510-K514 PolarHBondContact O-N 3.45Å
511	N	46.2	Very low	42.9	Very low	104 Å²	104	109.9 Å²	109.9	56%	0.556	56%	0.564	S	S	*	*	H	α-helix	trans	-68.3	-38.7	179.8	-71.5	-22.5	0	0	0	111.7	Q507 T508 F515	Q507-N511 WeakPolarHBondContact O-CB 3.38Å; Q507-N511 VanDerWaalsContact O-CG 3.29Å; Q507-N511 PolarHBondContact O-N 3.14Å; Q507-N511 PolarHBondContact O-ND2 3.31Å; T508-N511 PolarHBondContact O-N 2.89Å; N511-F515 WeakPolarHBondContact O-CB 3.41Å; N511-F515 PolarHBondContact O-N 3.21Å
512	L	43.9	Very low	43.2	Very low	76 Å²	76	114.5 Å²	114.5	40%	0.398	58%	0.577	S	S	.	*	H	α-helix	trans	-65.1	-44.5	171.2	-81.1	164.4	0	0	0	112.4	T508 L509 K514 F515 F516	T508-L512 HydrophobicContact CG2-CD1 4.45Å; T508-L512 PolarHBondContact O-N 3.41Å; L509-L512 PolarHBondContact O-N 3.39Å; L512-K514 VanDerWaalsContact C-N 3.34Å; L512-K514 PolarHBondContact O-N 2.86Å; L512-F515 WeakPolarHBondContact O-CB 3.27Å; L512-F515 PolarHBondContact O-N 2.94Å; L512-F515 VanDerWaalsContact O-N 3.13Å; L512-F516 HydrophobicContact CB-CE2 4.47Å; L512-F516 HydrophobicContact CD2-CE2 4.07Å; L512-F516 WeakPolarHBondContact O-CD2 3.41Å; L512-F516 PolarHBondContact O-N 3.49Å
513	N	50.5	Low	42.8	Very low	98 Å²	98	108.9 Å²	108.9	52%	0.524	57%	0.565	S	S	.	*	H	α-helix	trans	-64.4	-37.6	178	-72.9	-21	0	0	0	112.2	L509 N510 G517	L509-N513 WeakPolarHBondContact O-CB 3.1Å; L509-N513 VanDerWaalsContact O-CG 3.23Å; L509-N513 PolarHBondContact O-N 2.87Å; L509-N513 PolarHBondContact O-ND2 3.42Å; N510-N513 PolarHBondContact O-N 2.94Å; N513-G517 PolarHBondContact O-N 3.31Å
514	K	60.3	Low	42.6	Very low	149 Å²	149	107.7 Å²	107.7	65%	0.648	57%	0.572	S	S	*	*	H	α-helix	trans	-64.5	-39.8	170.6	-78.2	179.6	177.1	177.6	0	112.3	N510 L512 Y518	N510-K514 WeakPolarHBondContact O-CB 3.47Å; N510-K514 WeakPolarHBondContact O-CG 3.4Å; N510-K514 PolarHBondContact O-N 3.45Å; L512-K514 VanDerWaalsContact C-N 3.34Å; L512-K514 PolarHBondContact O-N 2.86Å; K514-Y518 VanDerWaalsContact O-CB 3.31Å; K514-Y518 WeakPolarHBondContact O-CB 3.4Å; K514-Y518 PolarHBondContact O-N 3.39Å
515	F	44.7	Very low	42.5	Very low	121 Å²	121	108.3 Å²	108.3	53%	0.531	57%	0.574	S	S	.	*	H	α-helix	trans	-64	-48.2	177.3	-178.6	-105.8	0	0	0	111.8	N511 L512 Y518 L519	N511-F515 WeakPolarHBondContact O-CB 3.41Å; N511-F515 PolarHBondContact O-N 3.21Å; L512-F515 WeakPolarHBondContact O-CB 3.27Å; L512-F515 PolarHBondContact O-N 2.94Å; L512-F515 VanDerWaalsContact O-N 3.13Å; F515-Y518 PolarHBondContact O-N 3.39Å; F515-L519 HydrophobicContact CD1-CD1 3.94Å; F515-L519 HydrophobicContact CE1-CD1 3.55Å; F515-L519 HydrophobicContact CZ-CD1 3.89Å; F515-L519 WeakPolarHBondContact O-CG 3.49Å; F515-L519 PolarHBondContact O-N 2.9Å; F515-L519 VanDerWaalsContact O-N 3.08Å
516	F	45.1	Very low	41.9	Very low	100 Å²	100	109.7 Å²	109.7	44%	0.439	58%	0.58	S	S	.	*	H	α-helix	trans	-65.2	-43.9	176.2	-71.2	-62.2	0	0	0	112.6	L512 Y518 L519 D520	L512-F516 HydrophobicContact CB-CE2 4.47Å; L512-F516 HydrophobicContact CD2-CE2 4.07Å; L512-F516 WeakPolarHBondContact O-CD2 3.41Å; L512-F516 PolarHBondContact O-N 3.49Å; F516-Y518 PolarHBondContact O-N 2.94Å; F516-L519 HydrophobicContact CD1-CD1 4.39Å; F516-L519 PolarHBondContact O-N 3.15Å; F516-D520 PolarHBondContact O-N 3.4Å
517	G	50.1	Low	41.3	Very low	42 Å²	42	109.7 Å²	109.7	43%	0.433	59%	0.585	S	S	.	*	H	α-helix	trans	-60.8	-31.4	175	0	0	0	0	0	113.7	N513 S521	N513-G517 PolarHBondContact O-N 3.31Å; G517-S521 WeakPolarHBondContact O-CB 3.42Å; G517-S521 PolarHBondContact O-N 3.07Å
518	Y	40.4	Very low	40.5	Very low	141 Å²	141	111.2 Å²	111.2	55%	0.553	59%	0.59	S	S	*	*	H	α-helix	trans	-73.5	-33.1	174.2	-165.8	-94.9	0	0	0	112.5	K514 F515 F516 S521 K522	K514-Y518 VanDerWaalsContact O-CB 3.31Å; K514-Y518 WeakPolarHBondContact O-CB 3.4Å; K514-Y518 PolarHBondContact O-N 3.39Å; F515-Y518 PolarHBondContact O-N 3.39Å; F516-Y518 PolarHBondContact O-N 2.94Å; Y518-S521 PolarHBondContact O-OG 3.4Å; Y518-K522 HydrophobicContact CE1-CD 3.89Å; Y518-K522 PolarHBondContact OH-NZ 3.3Å
519	L	37.2	Very low	40.1	Very low	89 Å²	89	115.8 Å²	115.8	47%	0.466	61%	0.606	S	S	.	*	H	α-helix	trans	-71.5	-46.7	175.2	-71.1	171.7	0	0	0	111.7	F515 F516 S521 K522	F515-L519 HydrophobicContact CD1-CD1 3.94Å; F515-L519 HydrophobicContact CE1-CD1 3.55Å; F515-L519 HydrophobicContact CZ-CD1 3.89Å; F515-L519 WeakPolarHBondContact O-CG 3.49Å; F515-L519 PolarHBondContact O-N 2.9Å; F515-L519 VanDerWaalsContact O-N 3.08Å; F516-L519 HydrophobicContact CD1-CD1 4.39Å; F516-L519 PolarHBondContact O-N 3.15Å; L519-S521 PolarHBondContact O-N 3.29Å; L519-K522 PolarHBondContact O-N 3.02Å; L519-K522 VanDerWaalsContact O-N 3.12Å
520	D	42.5	Very low	39.2	Very low	143 Å²	143	120.3 Å²	120.3	77%	0.765	62%	0.621	S	S	*	*	H	α-helix	trans	-58.9	-31.8	176.2	-73.4	-23.3	0	0	0	111.7	F516 K522	F516-D520 PolarHBondContact O-N 3.4Å; D520-K522 VanDerWaalsContact C-N 3.25Å; D520-K522 PolarHBondContact O-N 2.93Å
521	S	39.2	Very low	38.4	Very low	84 Å²	84	124.3 Å²	124.3	59%	0.587	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-2.6	178.8	75.5	0	0	0	0	116	G517 Y518 L519	G517-S521 WeakPolarHBondContact O-CB 3.42Å; G517-S521 PolarHBondContact O-N 3.07Å; Y518-S521 PolarHBondContact O-OG 3.4Å; L519-S521 PolarHBondContact O-N 3.29Å
522	K	37.3	Very low	37.5	Very low	136 Å²	136	123.7 Å²	123.7	59%	0.591	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.9	9.5	-160.9	-113.7	-178.9	176.4	-174.8	0	117.7	Y518 L519 D520 P524	Y518-K522 HydrophobicContact CE1-CD 3.89Å; Y518-K522 PolarHBondContact OH-NZ 3.3Å; L519-K522 PolarHBondContact O-N 3.02Å; L519-K522 VanDerWaalsContact O-N 3.12Å; D520-K522 VanDerWaalsContact C-N 3.25Å; D520-K522 PolarHBondContact O-N 2.93Å; K522-P524 WeakPolarHBondContact O-CD 3.43Å
523	S	30.7	Very low	36.7	Very low	97 Å²	97	126.2 Å²	126.2	68%	0.678	66%	0.659	S	S	*	*			trans	-114.9	104.5	-178.1	-169.5	0	0	0	0	113.6
524	P	29.9	Very low	35.8	Very low	123 Å²	123	127 Å²	127	80%	0.799	67%	0.672	S	S	*	*			trans	-98	109.8	170.9	34.1	-27.7	0	0	0	111.4	K522	K522-P524 WeakPolarHBondContact O-CD 3.43Å
525	V	31.6	Very low	34.2	Very low	111 Å²	111	126.9 Å²	126.9	67%	0.673	68%	0.678	S	S	*	*			trans	-138.1	112.9	173.2	-176.3	0	0	0	0	111.5	T527	V525-T527 HydrophobicContact CG1-CG2 4.2Å; V525-T527 PolarHBondContact O-N 3.39Å
526	E	27.2	Very low	33.6	Very low	154 Å²	154	128.2 Å²	128.2	72%	0.72	69%	0.686	S	S	*	*			trans	-74.9	113.3	163.3	-65.8	-173.3	157.5	0	0	110.3	K528	E526-K528 PolarHBondContact O-N 3.04Å; E526-K528 WeakPolarHBondContact OE2-CE 3.39Å; E526-K528 IonicContact OE2-NZ 3.34Å; E526-K528 PolarHBondContact OE2-NZ 3.48Å
527	T	30.1	Very low	32.9	Very low	127 Å²	127	128.8 Å²	128.8	78%	0.779	69%	0.693	S	S	*	*			trans	-93.2	91	167.5	53.9	0	0	0	0	110.7	V525 Q529	V525-T527 HydrophobicContact CG1-CG2 4.2Å; V525-T527 PolarHBondContact O-N 3.39Å; T527-Q529 PolarHBondContact O-N 2.94Å
528	K	28.6	Very low	31.9	Very low	165 Å²	165	136.2 Å²	136.2	72%	0.717	71%	0.71	S	S	*	*			trans	-67.5	116	173.9	-69.5	177.7	-178.5	167.3	0	110.5	E526	E526-K528 PolarHBondContact O-N 3.04Å; E526-K528 WeakPolarHBondContact OE2-CE 3.39Å; E526-K528 IonicContact OE2-NZ 3.34Å; E526-K528 PolarHBondContact OE2-NZ 3.48Å
529	Q	33.4	Very low	31.6	Very low	175 Å²	175	135.7 Å²	135.7	82%	0.818	72%	0.717	S	S	*	*			trans	-74.3	129.7	168.6	-73.7	-176	-20.6	0	0	110.2	T527	T527-Q529 PolarHBondContact O-N 2.94Å
530	F	25.7	Very low	31.5	Very low	200 Å²	200	137.6 Å²	137.6	88%	0.877	73%	0.726	S	S	*	*			trans	-83.5	112.2	164.1	-89.9	-96.5	0	0	0	109.3
531	H	33.3	Very low	31.2	Very low	175 Å²	175	137.5 Å²	137.5	81%	0.81	73%	0.725	S	S	*	*			trans	-132	166.4	156.3	-93.8	-61	0	0	0	110.1
532	S	26.1	Very low	31.2	Very low	91 Å²	91	140.6 Å²	140.6	64%	0.636	74%	0.735	S	S	*	*			trans	-124.1	153.1	-140.8	52.4	0	0	0	0	115.3
533	T	26.8	Very low	31.2	Very low	130 Å²	130	136.6 Å²	136.6	80%	0.798	73%	0.733	S	S	*	*			trans	69.9	146.7	155.4	46.3	0	0	0	0	119.7
534	S	31.9	Very low	31.4	Very low	115 Å²	115	139.6 Å²	139.6	80%	0.804	74%	0.741	S	S	*	*			trans	67.3	148.1	173.2	-54.3	0	0	0	0	116.9
535	L	27.6	Very low	31.7	Very low	146 Å²	146	137.5 Å²	137.5	76%	0.764	73%	0.73	S	S	*	*			cis	-179.3	157.5	-36	-148.4	70.9	0	0	0	103.6
536	E	32	Very low	31.9	Very low	149 Å²	149	140 Å²	140	70%	0.696	73%	0.734	S	S	*	*			trans	71.2	110.4	157.2	-70.1	-166.6	-166.3	0	0	121.8
537	N	30.2	Very low	32.4	Very low	111 Å²	111	139.3 Å²	139.3	59%	0.594	74%	0.735	S	S	*	*				94.3	95.7	114.9	-64.6	-14.9	0	0	0	122
538	Y	29.2	Very low	32.8	Very low	198 Å²	198	136 Å²	136	78%	0.776	73%	0.726	S	S	*	*				83.9	143.1	121.1	-85.7	-76.3	0	0	0	122.6
539	N	33.6	Very low	33.2	Very low	131 Å²	131	135.7 Å²	135.7	70%	0.701	73%	0.727	S	S	*	*			trans	80.9	149.3	153.9	-62.1	-14.8	0	0	0	120.4
540	I	34.3	Very low	33.4	Very low	129 Å²	129	135 Å²	135	66%	0.662	72%	0.723	S	S	*	*			cis	-176.2	160.4	-40.2	-115.8	173.6	0	0	0	107.8
541	D	37.4	Very low	33.9	Very low	141 Å²	141	134.1 Å²	134.1	75%	0.754	72%	0.719	S	S	*	*			trans	66.5	147.8	164.4	-72.3	-5.5	0	0	0	119.1
542	D	37.8	Very low	34	Very low	148 Å²	148	130.2 Å²	130.2	79%	0.791	71%	0.711	S	S	*	*			cis	-162.7	171	-16	-152.4	-8.5	0	0	0	112.2
543	G	37.3	Very low	34.5	Very low	52 Å²	52	132.5 Å²	132.5	54%	0.536	72%	0.716	S	S	.	*			trans	109.5	96.8	137.7	0	0	0	0	0	122.5
544	N	36	Very low	35.1	Very low	160 Å²	160	134.5 Å²	134.5	86%	0.856	72%	0.717	S	S	*	*				63.8	146.9	119.5	-71.1	-14.2	0	0	0	122.5
545	S	34.8	Very low	35.2	Very low	80 Å²	80	136.2 Å²	136.2	56%	0.559	72%	0.716	S	S	*	*			cis	-164.3	167.6	-5.2	-163.1	0	0	0	0	113.8
546	E	37.7	Very low	35.4	Very low	164 Å²	164	137.4 Å²	137.4	77%	0.766	72%	0.72	S	S	*	*			trans	65.6	147.9	149.6	-81.9	152.4	-89.5	0	0	122.2
547	N	37	Very low	35.3	Very low	139 Å²	139	140.7 Å²	140.7	74%	0.743	73%	0.726	S	S	*	*			cis	-166.1	158.2	-27.7	-142	-28	0	0	0	114.2
548	G	37.4	Very low	35.3	Very low	57 Å²	57	142.2 Å²	142.2	59%	0.588	73%	0.733	S	S	*	*			trans	70	164.2	153.9	0	0	0	0	0	119.9
549	H	38.3	Very low	35.3	Very low	159 Å²	159	142 Å²	142	74%	0.736	74%	0.737	S	S	*	*			cis	177.5	151.9	-17	-103.6	-27	0	0	0	107.2
550	H	36.9	Very low	35.2	Very low	159 Å²	159	143 Å²	143	74%	0.736	74%	0.742	S	S	*	*			cis	-168.4	-176.5	-12.9	-143.3	1.6	0	0	0	110.7
551	K	36.7	Very low	35.1	Very low	183 Å²	183	141.3 Å²	141.3	80%	0.796	74%	0.739	S	S	*	*			trans	75.3	119.5	175.5	-54.1	-179.7	-178.1	179.2	0	115.8
552	S	34.3	Very low	35.3	Very low	92 Å²	92	141.3 Å²	141.3	64%	0.643	75%	0.747	S	S	*	*			cis	84.4	143.6	31	94.9	0	0	0	0	113.8
553	D	37.2	Very low	34.8	Very low	139 Å²	139	142.3 Å²	142.3	74%	0.743	74%	0.744	S	S	*	*			cis	-143.9	150.8	11.8	-84.4	-74.5	0	0	0	112.8
554	Q	39.4	Very low	34.4	Very low	173 Å²	173	146.7 Å²	146.7	81%	0.808	76%	0.755	S	S	*	*				173.5	120.9	111	-91	-179.5	24.5	0	0	113.5
555	L	34.1	Very low	33.9	Very low	150 Å²	150	144.9 Å²	144.9	79%	0.785	75%	0.745	S	S	*	*			trans	43.7	93	142.7	-47.6	179.8	0	0	0	116.8
556	M	30.9	Very low	33.5	Very low	171 Å²	171	147.7 Å²	147.7	84%	0.842	75%	0.754	S	S	*	*			cis	61.1	137.5	38	-90.7	-65.1	-82.1	0	0	116.4
557	R	29.9	Very low	33.3	Very low	219 Å²	219	145.9 Å²	145.9	83%	0.826	76%	0.759	S	S	*	*			trans	88.8	137.7	178.9	-54.3	-179.3	-175.7	-158.8	0	115.9
558	L	30.3	Very low	33.1	Very low	143 Å²	143	143.6 Å²	143.6	75%	0.749	75%	0.754	S	S	*	*			cis	-157.5	155	-8.6	-117.6	170.8	0	0	0	110.8
559	F	29.7	Very low	33	Very low	194 Å²	194	146.7 Å²	146.7	85%	0.851	76%	0.764	S	S	*	*			trans	-65.3	132.8	162.9	-81.5	-109.1	0	0	0	110.1
560	N	31.4	Very low	32.3	Very low	152 Å²	152	147.1 Å²	147.1	81%	0.813	76%	0.764	S	S	*	*			trans	-167.6	130.4	156.1	-107.4	-25.6	0	0	0	111.9
561	P	31.9	Very low	32.1	Very low	92 Å²	92	147 Å²	147	60%	0.597	76%	0.764	S	S	*	*			trans	-90	144.8	169.2	34.7	-31.7	0	0	0	111.7	K563	P561-K563 VanDerWaalsContact C-N 3.33Å; P561-K563 PolarHBondContact O-N 3.32Å
562	P	41.9	Very low	31.8	Very low	142 Å²	142	144.6 Å²	144.6	92%	0.922	76%	0.758	S	S	*	*			trans	-71.8	89.5	167.4	30.1	-32.7	0	0	0	109.9
563	K	28	Very low	31.7	Very low	169 Å²	169	148.1 Å²	148.1	74%	0.735	76%	0.762	S	S	*	*			trans	-91.3	154.5	173.6	-128.9	-178.2	-172	-179.8	0	109.3	P561	P561-K563 VanDerWaalsContact C-N 3.33Å; P561-K563 PolarHBondContact O-N 3.32Å
564	L	28	Very low	31.4	Very low	144 Å²	144	146.5 Å²	146.5	75%	0.754	76%	0.76	S	S	*	*			trans	67.6	162.6	161.6	-58.6	163.6	0	0	0	115.4
565	N	26.7	Very low	30.9	Very low	121 Å²	121	145.8 Å²	145.8	65%	0.647	76%	0.757	S	S	*	*			cis	-169.1	162.3	-43.2	-112.1	16.1	0	0	0	107.1
566	N	26.3	Very low	30.6	Very low	139 Å²	139	144.8 Å²	144.8	74%	0.743	75%	0.753	S	S	*	*			trans	47.7	108	149.2	-56	-4.8	0	0	0	120.1
567	S	32.4	Very low	30.4	Very low	127 Å²	127	143.6 Å²	143.6	89%	0.888	75%	0.748	S	S	*	*				-162.2	137.2	126	9.1	0	0	0	0	111.4
568	S	34.2	Very low	30.2	Very low	91 Å²	91	138.2 Å²	138.2	64%	0.636	74%	0.743	S	S	*	*			trans	-96.2	163.7	166.2	58.5	0	0	0	0	110.1
569	P	33.8	Very low	30	Very low	122 Å²	122	136.1 Å²	136.1	79%	0.792	74%	0.74	S	S	*	*				-117	150.1	89.2	-3.7	25	0	0	0	111.8
570	F	25.2	Very low	29.9	Very low	168 Å²	168	133 Å²	133	74%	0.737	74%	0.737	S	S	*	*				77	154.4	60.4	-94.8	-89.3	0	0	0	115.2
571	E	32.6	Very low	30.2	Very low	156 Å²	156	134 Å²	134	73%	0.729	74%	0.737	S	S	*	*			trans	62	105.9	-163.9	-56.5	-154.6	131.9	0	0	112.8
572	I	29.5	Very low	30.3	Very low	132 Å²	132	134.5 Å²	134.5	68%	0.677	74%	0.74	S	S	*	*			cis	53.7	90.9	29.9	-46.5	179	0	0	0	112.3
573	K	32.1	Very low	29.6	Very low	167 Å²	167	135.1 Å²	135.1	73%	0.726	73%	0.731	S	S	*	*			trans	-136.7	87.3	148.5	-126.6	163.2	-164.7	142.8	0	110.8	Q575	K573-Q575 PolarHBondContact O-N 2.8Å
574	C	30.8	Very low	29.5	Very low	105 Å²	105	133 Å²	133	71%	0.709	73%	0.727	S	S	*	*			trans	-66	123.9	165	-55.7	0	0	0	0	108.9
575	Q	30	Very low	29.4	Very low	157 Å²	157	134 Å²	134	73%	0.734	73%	0.725	S	S	*	*			trans	-145.9	114.8	153.6	-102.9	148	6	0	0	105.8	K573	K573-Q575 PolarHBondContact O-N 2.8Å
576	N	27.1	Very low	29.5	Very low	130 Å²	130	136.1 Å²	136.1	70%	0.695	73%	0.731	S	S	*	*				76.8	135.1	74.6	-69.2	-4	0	0	0	110.8
577	I	26.4	Very low	29.6	Very low	145 Å²	145	133.4 Å²	133.4	74%	0.744	72%	0.723	S	S	*	*			cis	-151.4	147.6	2.6	-125.4	161	0	0	0	111
578	C	25.7	Very low	29.6	Very low	106 Å²	106	135.1 Å²	135.1	72%	0.716	72%	0.717	S	S	*	*			trans	20.2	147	147.1	-145.7	0	0	0	0	122.3
579	S	25.9	Very low	29.6	Very low	100 Å²	100	137.7 Å²	137.7	70%	0.699	72%	0.719	S	S	*	*			trans	73.8	155.9	154.8	91.3	0	0	0	0	117.3
580	T	29	Very low	29.3	Very low	128 Å²	128	137.3 Å²	137.3	79%	0.785	72%	0.715	S	S	*	*			cis	-145.4	148.7	8.7	-25.8	0	0	0	0	111.6
581	Q	36	Very low	29.6	Very low	172 Å²	172	136.6 Å²	136.6	80%	0.804	71%	0.714	S	S	*	*			trans	-62.1	169.9	151.7	-99.9	-168	5.2	0	0	110.3
582	P	34.3	Very low	29.6	Very low	103 Å²	103	136.7 Å²	136.7	67%	0.669	71%	0.714	S	S	*	*			cis	-151.8	-173.7	35.9	41.7	-18.8	0	0	0	117.9
583	H	26.9	Very low	29.6	Very low	156 Å²	156	137.4 Å²	137.4	72%	0.722	72%	0.715	S	S	*	*			trans	61.3	114.9	138.1	-97.2	-132	0	0	0	123.1
584	L	25.8	Very low	29.5	Very low	125 Å²	125	136.7 Å²	136.7	65%	0.654	72%	0.717	S	S	*	*				78.7	122.1	113.9	-118.5	74.2	0	0	0	122.5
585	F	26.5	Very low	29.5	Very low	163 Å²	163	136.5 Å²	136.5	72%	0.715	72%	0.717	S	S	*	*				82.3	137.3	129.4	-111.5	-129	0	0	0	121.8
586	Q	29.5	Very low	29.5	Very low	166 Å²	166	137.9 Å²	137.9	78%	0.776	72%	0.723	S	S	*	*			trans	61.7	141.1	162.4	-77.4	160.4	-35.2	0	0	117.8
587	S	29	Very low	29.6	Very low	83 Å²	83	137.4 Å²	137.4	58%	0.58	73%	0.73	S	S	*	*			cis	-174.3	143.4	-13.9	42.8	0	0	0	0	112
588	Q	32	Very low	29.8	Very low	163 Å²	163	136.7 Å²	136.7	76%	0.762	73%	0.732	S	S	*	*			trans	65.1	157.2	150.2	-65.2	171.3	31.6	0	0	115.9
589	Q	32.5	Very low	30	Very low	145 Å²	145	135.5 Å²	135.5	68%	0.678	72%	0.723	S	S	*	*			cis	-161.3	148.2	-9.3	-119.7	165.9	11.7	0	0	108.6
590	T	28.7	Very low	30.2	Very low	114 Å²	114	137.8 Å²	137.8	70%	0.699	73%	0.726	S	S	*	*			trans	55.5	148.3	154.8	51.9	0	0	0	0	119.8
591	Q	30.9	Very low	30	Very low	152 Å²	152	136.7 Å²	136.7	71%	0.71	71%	0.708	S	S	*	*			cis	-152.5	139.2	-2.1	-112.6	157.2	-0.5	0	0	106.5
592	Q	32.2	Very low	29.7	Very low	158 Å²	158	135.2 Å²	135.2	74%	0.738	70%	0.701	S	S	*	*				52.9	129.4	97.5	-62.5	-177.5	-7.7	0	0	114.9
593	Q	30.7	Very low	29.3	Very low	148 Å²	148	136.2 Å²	136.2	69%	0.692	71%	0.705	S	S	*	*			cis	-152	132.3	4.5	-104.5	158.2	8.1	0	0	110
594	I	30.5	Very low	29.4	Very low	151 Å²	151	135.5 Å²	135.5	77%	0.774	70%	0.703	S	S	*	*				60.5	127.6	101.4	-57.7	-176.9	0	0	0	115.6
595	S	28.9	Very low	29.3	Very low	101 Å²	101	138.8 Å²	138.8	71%	0.706	71%	0.714	S	S	*	*			cis	-168.6	158.6	-26.3	56.1	0	0	0	0	110.3
596	H	30.9	Very low	29.4	Very low	187 Å²	187	139 Å²	139	87%	0.866	72%	0.718	S	S	*	*			trans	-58.4	158.2	-175.9	-45.3	-87.3	0	0	0	117.1
597	S	29.2	Very low	29.4	Very low	119 Å²	119	136.8 Å²	136.8	83%	0.832	71%	0.711	S	S	*	*			trans	-155.6	131.4	148.7	50.2	0	0	0	0	113.1
598	T	30.9	Very low	29.3	Very low	130 Å²	130	144.6 Å²	144.6	80%	0.798	73%	0.73	S	S	*	*			trans	-133.9	153.8	163.4	26.1	0	0	0	0	108	I600	T598-I600 PolarHBondContact O-N 2.87Å
599	P	29.3	Very low	29.1	Very low	82 Å²	82	140.8 Å²	140.8	53%	0.532	72%	0.718	S	S	.	*			trans	-79.3	121.8	-157.4	30.1	-36.2	0	0	0	113.6	I183	I183-P599 HydrophobicContact CD1-CB 3.59Å; I183-P599 HydrophobicContact CG2-CB 4.07Å
600	I	31.2	Very low	28.8	Very low	147 Å²	147	139.8 Å²	139.8	75%	0.754	72%	0.717	S	S	*	*			trans	-112.6	136.4	166.6	-67.2	177.7	0	0	0	108.5	I183 T598	I183-I600 VanDerWaalsContact CG2-O 3.25Å; I183-I600 WeakPolarHBondContact CG2-O 3.14Å; T598-I600 PolarHBondContact O-N 2.87Å
601	Y	25.1	Very low	28.9	Very low	106 Å²	106	145.1 Å²	145.1	42%	0.416	73%	0.726	S	S	.	*			trans	-78.4	123.4	-179.5	-60.4	-169.1	0	0	0	110.3	I183 Y184 S185	I183-Y601 HydrophobicContact CG2-CD2 3.49Å; I183-Y601 VanDerWaalsContact CG2-CD2 3.49Å; I183-Y601 HydrophobicContact CG2-CE2 4.16Å; I183-Y601 HydrophobicContact CG2-CG 4.24Å; I183-Y601 CarbonylContact O-C 3.29Å; I183-Y601 WeakPolarHBondContact O-CA 3.31Å; Y184-Y601 VanDerWaalsContact CB-CG 3.41Å; Y184-Y601 VanDerWaalsContact CB-CZ 3.48Å; Y184-Y601 HydrophobicContact CD1-CD2 4.46Å; Y184-Y601 HydrophobicContact CD1-CE1 4.1Å; Y184-Y601 AromaticContact CD1-CE2 3.59Å; Y184-Y601 HydrophobicContact CD1-CE2 3.59Å; Y184-Y601 AromaticContact CD1-CZ 3.35Å; Y184-Y601 WeakPolarHBondContact CD1-OH 3.06Å; Y184-Y601 HydrophobicContact CD2-CE2 4.14Å; Y184-Y601 HydrophobicContact CE1-CE2 4.01Å; Y184-Y601 AromaticContact CE1-CZ 3.9Å; Y184-Y601 WeakPolarHBondContact CE1-OH 3.28Å; Y184-Y601 HydrophobicContact CG-CD2 4.03Å; Y184-Y601 HydrophobicContact CG-CE1 4.35Å; Y184-Y601 AromaticContact CG-CE2 3.58Å; Y184-Y601 HydrophobicContact CG-CE2 3.58Å; Y184-Y601 AromaticContact CG-CZ 3.75Å; S185-Y601 WeakPolarHBondContact O-CD1 3.15Å; S185-Y601 WeakPolarHBondContact O-CE1 3.48Å
602	H	29.3	Very low	28.8	Very low	140 Å²	140	144.6 Å²	144.6	65%	0.648	72%	0.723	S	S	*	*			trans	-149.1	135.2	167.2	-149.4	-66.4	0	0	0	113.3	I183	I183-H602 PolarHBondContact O-N 3.08Å
603	T	25.2	Very low	28.7	Very low	124 Å²	124	142.3 Å²	142.3	76%	0.761	72%	0.716	S	S	*	*			trans	-72.3	127.9	174.6	34.1	0	0	0	0	112.7
604	Q	28.6	Very low	28.7	Very low	142 Å²	142	142 Å²	142	66%	0.664	72%	0.719	S	S	*	*			trans	-146.9	132.6	156.2	-62.5	-177.9	-10.8	0	0	103.9
605	Q	25.1	Very low	28.8	Very low	193 Å²	193	140.4 Å²	140.4	90%	0.902	71%	0.711	S	S	*	*			cis	64.7	58.6	22	-131.6	-177.3	14.1	0	0	114.5
606	E	27.5	Very low	28.9	Very low	168 Å²	168	141 Å²	141	79%	0.785	71%	0.707	S	S	*	*			trans	-159.7	147	139.2	-113.6	169.1	-147.4	0	0	111.8
607	N	29.8	Very low	29	Very low	119 Å²	119	136.1 Å²	136.1	64%	0.636	69%	0.694	S	S	*	*			trans	58.8	72.9	158.4	-56.1	-26.7	0	0	0	120	T609	N607-T609 HydrophobicContact CB-CG2 4.49Å; N607-T609 PolarHBondContact O-N 3.46Å
608	Y	27.6	Very low	29.1	Very low	247 Å²	247	136.5 Å²	136.5	97%	0.969	68%	0.683	S	S	*	*			trans	-67.1	76.6	145.2	-102.8	-98.2	0	0	0	109.9
609	T	27.3	Very low	29.3	Very low	83 Å²	83	135.8 Å²	135.8	51%	0.509	68%	0.675	S	S	.	*			trans	-142.1	56.9	-177.9	59.7	0	0	0	0	113.6	N607	N607-T609 HydrophobicContact CB-CG2 4.49Å; N607-T609 PolarHBondContact O-N 3.46Å
610	D	27	Very low	29.6	Very low	125 Å²	125	140.3 Å²	140.3	67%	0.668	69%	0.686	S	S	*	*	S	Bend	trans	-150.7	43.4	166.7	-116	-23.7	0	0	0	114.4	N613	D610-N613 PolarHBondContact OD1-ND2 2.86Å
611	Y	29.3	Very low	29.7	Very low	225 Å²	225	139.3 Å²	139.3	88%	0.882	68%	0.682	S	S	*	*	S	Bend	trans	-128.9	4.5	159.4	-107.5	-87.5	0	0	0	113.9
612	E	30.2	Very low	30	Very low	141 Å²	141	142 Å²	142	66%	0.659	70%	0.698	S	S	*	*	S	Bend	trans	-91.3	-20.1	171.8	-64.2	-169.7	121.5	0	0	112.8	N614 I615	E612-N614 PolarHBondContact O-N 2.94Å; E612-I615 PolarHBondContact O-N 2.68Å; E612-I615 VanDerWaalsContact O-N 3.09Å
613	N	28.7	Very low	30.1	Very low	110 Å²	110	138.4 Å²	138.4	59%	0.588	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	4.1	-175.8	-78.9	-41.3	0	0	0	115.6	D610	D610-N613 PolarHBondContact OD1-ND2 2.86Å
614	N	32.1	Very low	30.3	Very low	142 Å²	142	137.8 Å²	137.8	76%	0.759	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	3.3	172.1	-132.7	-13.9	0	0	0	113.7	E612	E612-N614 PolarHBondContact O-N 2.94Å
615	I	32.7	Very low	30.5	Very low	117 Å²	117	138.8 Å²	138.8	60%	0.6	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-33.4	173.3	-64.5	178.2	0	0	0	110.8	E612 S617 M618	E612-I615 PolarHBondContact O-N 2.68Å; E612-I615 VanDerWaalsContact O-N 3.09Å; I615-S617 PolarHBondContact O-N 2.86Å; I615-M618 PolarHBondContact O-N 3.41Å
616	N	30	Very low	30.7	Very low	115 Å²	115	138 Å²	138	62%	0.615	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	16.1	179.3	-69.4	-35.6	0	0	0	115.5
617	S	33.6	Very low	30.7	Very low	84 Å²	84	135 Å²	135	59%	0.587	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	-8.8	175.6	-157.2	0	0	0	0	113.6	I615	I615-S617 PolarHBondContact O-N 2.86Å
618	M	31.7	Very low	30.8	Very low	126 Å²	126	135.7 Å²	135.7	62%	0.621	70%	0.703	S	S	*	*	S	Bend	trans	-84.9	-31.5	173.8	-87.2	-97.1	55.6	0	0	113.3	I615 K620 L621	I615-M618 PolarHBondContact O-N 3.41Å; M618-K620 PolarHBondContact O-N 2.88Å; M618-L621 HydrophobicContact CE-CB 3.94Å; M618-L621 HydrophobicContact CE-CD1 4.43Å; M618-L621 PolarHBondContact O-N 3.3Å
619	D	33.2	Very low	31	Very low	116 Å²	116	134.5 Å²	134.5	62%	0.62	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	3	-180	-64.4	-51.6	0	0	0	114.5
620	K	37.1	Very low	31.1	Very low	176 Å²	176	139 Å²	139	77%	0.765	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	-2	169.3	-70.3	-172	178	179	0	114.4	M618	M618-K620 PolarHBondContact O-N 2.88Å
621	L	32.8	Very low	31.3	Very low	127 Å²	127	135.7 Å²	135.7	67%	0.665	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-12	170.2	-118.5	160.2	0	0	0	113	M618 A623	M618-L621 HydrophobicContact CE-CB 3.94Å; M618-L621 HydrophobicContact CE-CD1 4.43Å; M618-L621 PolarHBondContact O-N 3.3Å; L621-A623 VanDerWaalsContact C-N 3.28Å
622	Q	31.1	Very low	31.5	Very low	162 Å²	162	131.9 Å²	131.9	76%	0.757	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-5.3	169.1	-159.2	74	-12.7	0	0	112.9
623	A	32.1	Very low	31.3	Very low	65 Å²	65	130.8 Å²	130.8	54%	0.537	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.4	12.7	-168.8	0	0	0	0	0	115.1	L621	L621-A623 VanDerWaalsContact C-N 3.28Å
624	C	29.5	Very low	31.6	Very low	110 Å²	110	133.4 Å²	133.4	74%	0.743	73%	0.725	S	S	*	*	S	Bend	trans	-123.2	7.1	-174	-147.1	0	0	0	0	114.7
625	I	32.1	Very low	31.4	Very low	164 Å²	164	131.8 Å²	131.8	84%	0.841	72%	0.72	S	S	*	*	S	Bend	trans	-121.9	3.5	177.2	-61.8	179.9	0	0	0	111.6
626	Q	29.9	Very low	31.4	Very low	177 Å²	177	131.8 Å²	131.8	83%	0.827	73%	0.726	S	S	*	*	S	Bend	trans	-134.4	54.9	-178.6	-68.1	-167.6	-13.8	0	0	114
627	S	27.9	Very low	31.3	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	73%	0.733	S	S	*	*			trans	-169.9	76	164.7	40.2	0	0	0	0	114.4
628	T	31.5	Very low	31.2	Very low	133 Å²	133	134.5 Å²	134.5	82%	0.816	74%	0.743	S	S	*	*	S	Bend	trans	-122	120.6	161.4	-53.7	0	0	0	0	109.7
629	Y	30.8	Very low	31.2	Very low	222 Å²	222	132.8 Å²	132.8	87%	0.871	74%	0.743	S	S	*	*			trans	60.1	88.8	174.7	-97.4	-97.4	0	0	0	118.7
630	I	29.7	Very low	31.1	Very low	176 Å²	176	133 Å²	133	90%	0.903	75%	0.749	S	S	*	*			trans	-69.2	132.2	149.9	-63.8	168.1	0	0	0	107.8
631	G	31	Very low	30.7	Very low	56 Å²	56	133.7 Å²	133.7	58%	0.577	75%	0.748	S	S	*	*			trans	-157.8	43.2	-165.7	0	0	0	0	0	118.2
632	T	32.9	Very low	30.6	Very low	145 Å²	145	131.4 Å²	131.4	89%	0.89	74%	0.743	S	S	*	*			trans	62.5	138.5	165.6	51.9	0	0	0	0	119.9
633	T	26.8	Very low	30.8	Very low	119 Å²	119	130 Å²	130	73%	0.73	74%	0.736	S	S	*	*			trans	-88.8	150.7	173.7	49.7	0	0	0	0	112.6
634	H	34.8	Very low	30.8	Very low	164 Å²	164	133.3 Å²	133.3	76%	0.759	74%	0.744	S	S	*	*			trans	172.3	104.1	137.7	-95.5	-63	0	0	0	109.5
635	T	28	Very low	31	Very low	109 Å²	109	135.5 Å²	135.5	67%	0.669	74%	0.743	S	S	*	*				82.2	150.4	87.1	54.8	0	0	0	0	116.5
636	T	32.6	Very low	31.2	Very low	116 Å²	116	134.4 Å²	134.4	71%	0.712	74%	0.739	S	S	*	*			trans	66.8	97.1	166.8	50.1	0	0	0	0	119.6
637	D	27.5	Very low	31.5	Very low	144 Å²	144	132.6 Å²	132.6	77%	0.77	73%	0.734	S	S	*	*				65.2	149.3	110.4	-54.7	-18.1	0	0	0	123.4
638	S	32.7	Very low	31.7	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	73%	0.733	S	S	*	*			trans	73.8	149	158.1	-72.9	0	0	0	0	119.6
639	S	30.1	Very low	31.8	Very low	90 Å²	90	134 Å²	134	63%	0.629	73%	0.728	S	S	*	*			cis	-171.5	172.5	-26.3	52.9	0	0	0	0	109.5
640	T	32.3	Very low	31.9	Very low	121 Å²	121	128.6 Å²	128.6	74%	0.742	72%	0.718	S	S	*	*			trans	62	112.6	145.8	41.9	0	0	0	0	120.4
641	Y	28.3	Very low	32	Very low	189 Å²	189	129.8 Å²	129.8	74%	0.741	71%	0.713	S	S	*	*				92.6	110	109.7	-152.5	-109.3	0	0	0	118.7
642	S	32	Very low	32.1	Very low	80 Å²	80	133.2 Å²	133.2	56%	0.559	72%	0.718	S	S	*	*				76.1	162.6	128.7	-63.7	0	0	0	0	118.7
643	Q	33.4	Very low	32.3	Very low	132 Å²	132	129.9 Å²	129.9	62%	0.617	70%	0.701	S	S	*	*			cis	-158.2	176.7	-1.4	-131.3	151.7	-5.6	0	0	111.7
644	L	33.2	Very low	32.9	Very low	135 Å²	135	131.1 Å²	131.1	71%	0.707	71%	0.708	S	S	*	*			trans	70.9	123.2	164.5	-59.9	144.3	0	0	0	114.3
645	E	32.6	Very low	32.8	Very low	156 Å²	156	126.6 Å²	126.6	73%	0.729	71%	0.706	S	S	*	*			cis	71.8	106	41.6	-53.9	176.1	125.9	0	0	113.4
646	D	38.2	Very low	33.4	Very low	140 Å²	140	127.4 Å²	127.4	75%	0.749	71%	0.713	S	S	*	*				-176.7	107.3	121.8	-90.7	-18.5	0	0	0	108.1
647	L	35.8	Very low	33.5	Very low	139 Å²	139	127.1 Å²	127.1	73%	0.728	72%	0.715	S	S	*	*				68.5	95.5	87.4	-72.3	179.9	0	0	0	114.4
648	N	32.5	Very low	34	Very low	132 Å²	132	124.9 Å²	124.9	71%	0.706	71%	0.711	S	S	*	*				-178.6	128.8	106.5	-87.1	-43.1	0	0	0	110.1
649	L	31.7	Very low	33.9	Very low	137 Å²	137	126.2 Å²	126.2	72%	0.717	71%	0.71	S	S	*	*				59.5	133.2	91.8	-58	-177.1	0	0	0	112.9
650	T	33.6	Very low	33.9	Very low	107 Å²	107	129.2 Å²	129.2	66%	0.656	72%	0.718	S	S	*	*			cis	-163.8	154.9	26.6	-5.4	0	0	0	0	110.5
651	Y	32.3	Very low	33.8	Very low	201 Å²	201	127.9 Å²	127.9	79%	0.788	71%	0.713	S	S	*	*			trans	39.2	144	136.4	-80.6	-116.2	0	0	0	120.6
652	D	33.7	Very low	33.9	Very low	129 Å²	129	123.7 Å²	123.7	69%	0.69	71%	0.712	S	S	*	*			cis	-170.6	173.5	-3.5	-137.7	-6.3	0	0	0	106.9
653	S	37	Very low	33.8	Very low	75 Å²	75	125.8 Å²	125.8	52%	0.524	72%	0.717	S	S	.	*			cis	-159.2	160.7	-5.6	-150.3	0	0	0	0	110.8
654	T	38.7	Very low	33.5	Very low	145 Å²	145	127 Å²	127	89%	0.89	72%	0.722	S	S	*	*			trans	62	154.4	171.4	72.9	0	0	0	0	116.4
655	G	33.4	Very low	33.3	Very low	69 Å²	69	126.8 Å²	126.8	71%	0.711	73%	0.727	S	S	*	*			cis	-168.5	147	-7.5	0	0	0	0	0	109.5
656	P	40.2	Very low	33.2	Very low	126 Å²	126	124.4 Å²	124.4	82%	0.818	73%	0.727	S	S	*	*			trans	-109.3	163.2	-159.5	40.4	-35.6	0	0	0	115.8
657	S	35.2	Very low	32.9	Very low	109 Å²	109	122.7 Å²	122.7	76%	0.762	73%	0.727	S	S	*	*			trans	175.5	111.7	144.7	-81.4	0	0	0	0	109.2
658	S	36.4	Very low	32.7	Very low	98 Å²	98	124.8 Å²	124.8	69%	0.685	73%	0.733	S	S	*	*				78.5	140.8	87.2	82.9	0	0	0	0	114.6
659	N	31	Very low	32.7	Very low	141 Å²	141	123.5 Å²	123.5	75%	0.754	73%	0.733	S	S	*	*			cis	-168.3	176.8	-18.8	-115.9	-11	0	0	0	110.3
660	L	31.4	Very low	32.7	Very low	152 Å²	152	125.2 Å²	125.2	80%	0.796	74%	0.742	S	S	*	*			trans	-13.6	159.3	148.6	-75.3	84.9	0	0	0	118.1
661	S	28.8	Very low	32.8	Very low	93 Å²	93	128.1 Å²	128.1	65%	0.65	75%	0.753	S	S	*	*			cis	174.7	166.6	-8.8	177.1	0	0	0	0	107.8
662	S	31.1	Very low	32.7	Very low	102 Å²	102	129.5 Å²	129.5	71%	0.713	76%	0.759	S	S	*	*			trans	67.8	161.7	162.2	86.5	0	0	0	0	116.1
663	N	29	Very low	32.9	Very low	123 Å²	123	130.3 Å²	130.3	66%	0.658	76%	0.758	S	S	*	*			cis	-155.6	171	-20.8	-121.2	26	0	0	0	109.1
664	E	28.4	Very low	33	Very low	158 Å²	158	135.1 Å²	135.1	74%	0.738	77%	0.77	S	S	*	*			trans	46.1	116.4	148.7	-65.3	161.3	-122.8	0	0	120.2
665	T	29.3	Very low	32.7	Very low	131 Å²	131	133.7 Å²	133.7	80%	0.804	76%	0.764	S	S	*	*				168.8	165.8	112.1	35.7	0	0	0	0	111.1
666	S	30.7	Very low	32.7	Very low	105 Å²	105	137 Å²	137	73%	0.734	77%	0.766	S	S	*	*			trans	62.8	128.1	178.1	66	0	0	0	0	114.9
667	S	31.5	Very low	32.5	Very low	105 Å²	105	137.5 Å²	137.5	73%	0.734	76%	0.761	S	S	*	*			cis	63.8	101.3	44.8	84	0	0	0	0	113.9
668	E	32	Very low	32.5	Very low	183 Å²	183	140.8 Å²	140.8	86%	0.855	77%	0.769	S	S	*	*				-167.3	159.1	129.6	-112.8	179.4	-167.9	0	0	116.1
669	C	30.5	Very low	32.4	Very low	105 Å²	105	141.1 Å²	141.1	71%	0.709	77%	0.77	S	S	*	*			trans	41.2	107.1	148.7	-66.8	0	0	0	0	122.1	N671	C669-N671 PolarHBondContact O-N 3.49Å
670	L	31.8	Very low	32.5	Very low	172 Å²	172	140.9 Å²	140.9	90%	0.901	77%	0.768	S	S	*	*			trans	-59.3	119.1	138.4	-69.3	166.1	0	0	0	110.6
671	N	36.5	Very low	32.7	Very low	169 Å²	169	144 Å²	144	90%	0.904	78%	0.776	S	S	*	*			trans	-164.2	129.5	138.7	-103.9	-36.2	0	0	0	110.7	C669	C669-N671 PolarHBondContact O-N 3.49Å
672	Y	30.7	Very low	32.8	Very low	230 Å²	230	145.1 Å²	145.1	90%	0.902	78%	0.783	S	S	*	*			trans	-127.7	100.3	-175.3	-164.7	-81.6	0	0	0	109
673	E	37.8	Very low	32.9	Very low	146 Å²	146	143.5 Å²	143.5	68%	0.682	78%	0.783	S	S	*	*			trans	-156.2	127.1	159.7	-137	174.9	-134.9	0	0	113.9
674	K	38.9	Very low	33.1	Very low	176 Å²	176	145.3 Å²	145.3	77%	0.765	79%	0.793	S	S	*	*			trans	73	90.5	156.1	-156.6	172.5	-173.4	-176.3	0	119.3
675	C	31.1	Very low	33.4	Very low	114 Å²	114	144.4 Å²	144.4	77%	0.77	80%	0.797	S	S	*	*			trans	-73.5	138.9	140.4	-62.9	0	0	0	0	110.2
676	N	35	Very low	33.6	Very low	139 Å²	139	143.9 Å²	143.9	74%	0.743	79%	0.794	S	S	*	*			trans	168.6	156.4	132.4	-90.2	10.1	0	0	0	110
677	D	35.1	Very low	33.9	Very low	136 Å²	136	144.3 Å²	144.3	73%	0.727	80%	0.797	S	S	*	*			trans	104.8	65.1	170.9	-52.6	-12.4	0	0	0	116.1
678	I	35.4	Very low	33.9	Very low	178 Å²	178	146.5 Å²	146.5	91%	0.913	80%	0.8	S	S	*	*			trans	-127.5	106.9	148.4	-59.7	-179.3	0	0	0	108.4
679	C	33.7	Very low	34.3	Very low	105 Å²	105	144.3 Å²	144.3	71%	0.709	80%	0.8	S	S	*	*			trans	-149.7	146.9	163.8	-159.1	0	0	0	0	109.7
680	N	33.7	Very low	34.3	Very low	136 Å²	136	146 Å²	146	73%	0.727	80%	0.802	S	S	*	*			trans	56	83.2	165.5	-61.9	-22.7	0	0	0	118.7
681	K	34.8	Very low	34.6	Very low	219 Å²	219	145.7 Å²	145.7	95%	0.952	80%	0.8	S	S	*	*				-151.6	70.3	122.7	-118.3	173.5	-172.3	177.3	0	113.6
682	S	32.2	Very low	34.3	Very low	115 Å²	115	142.4 Å²	142.4	80%	0.804	79%	0.786	S	S	*	*			trans	-87.8	141.9	152.1	47.5	0	0	0	0	108.9
683	G	33.7	Very low	34.6	Very low	68 Å²	68	138.5 Å²	138.5	70%	0.701	78%	0.781	S	S	*	*			trans	172.5	96.5	-179.8	0	0	0	0	0	113.7
684	N	32.8	Very low	34.6	Very low	162 Å²	162	136.3 Å²	136.3	87%	0.866	78%	0.778	S	S	*	*			trans	64.5	132.8	-179.5	-52	-30.8	0	0	0	113.1
685	V	34.7	Very low	34.6	Very low	139 Å²	139	134.3 Å²	134.3	84%	0.842	77%	0.774	S	S	*	*			cis	-128.1	152.1	43.8	171	0	0	0	0	113.4
686	T	33.2	Very low	35.1	Very low	120 Å²	120	134.5 Å²	134.5	74%	0.736	77%	0.768	S	S	*	*			trans	-51.9	139.6	178.2	47.9	0	0	0	0	116.7
687	S	36.4	Very low	35.2	Very low	113 Å²	113	132.1 Å²	132.1	79%	0.79	76%	0.755	S	S	*	*				-165	140.8	121.6	-82.9	0	0	0	0	113.7
688	N	32.7	Very low	35.2	Very low	151 Å²	151	134.9 Å²	134.9	81%	0.807	76%	0.756	S	S	*	*			trans	-25.9	152.4	166.9	-43.9	-39.6	0	0	0	116.3
689	T	39.4	Very low	35.3	Very low	137 Å²	137	132.4 Å²	132.4	84%	0.84	75%	0.745	S	S	*	*			cis	-147.4	165.8	42.8	45	0	0	0	0	115.4
690	N	31.5	Very low	35.3	Very low	142 Å²	142	132.8 Å²	132.8	76%	0.759	74%	0.744	S	S	*	*			trans	-89.1	151.7	179.8	-52.5	-57.3	0	0	0	113.5	T692	N690-T692 HydrophobicContact CB-CG2 4.28Å
691	L	36.4	Very low	35.4	Very low	165 Å²	165	133.7 Å²	133.7	86%	0.864	75%	0.747	S	S	*	*			trans	-173.6	74	151.9	-102.3	151.7	0	0	0	108.7
692	T	31.7	Very low	35.4	Very low	99 Å²	99	127.9 Å²	127.9	61%	0.607	73%	0.734	S	S	*	*				46.7	115.1	83.8	68.9	0	0	0	0	115.7	N690	N690-T692 HydrophobicContact CB-CG2 4.28Å
693	N	35.6	Very low	35.6	Very low	149 Å²	149	126.8 Å²	126.8	80%	0.797	73%	0.727	S	S	*	*			trans	137.1	137.4	159.3	-74.6	-10.7	0	0	0	109.7
694	T	39	Very low	35.8	Very low	99 Å²	99	131.1 Å²	131.1	61%	0.607	73%	0.728	S	S	*	*			cis	-163.1	140.2	-0.1	-117.3	0	0	0	0	110.2
695	I	39.3	Very low	36	Very low	134 Å²	134	128.8 Å²	128.8	69%	0.687	72%	0.716	S	S	*	*				43.2	131.4	127.2	-80.1	156	0	0	0	117.2
696	N	40.3	Very low	36.4	Very low	119 Å²	119	128.3 Å²	128.3	64%	0.636	71%	0.709	S	S	*	*			cis	-177.1	178.7	15.9	-104	3.5	0	0	0	107
697	N	38.6	Very low	36.6	Very low	89 Å²	89	129 Å²	129	48%	0.476	71%	0.707	S	S	.	*			cis	-167.6	171.5	-9.2	-113.9	-4	0	0	0	109.6
698	Y	35.2	Very low	36.5	Very low	193 Å²	193	128 Å²	128	76%	0.757	70%	0.699	S	S	*	*			trans	83.9	139.6	152.9	-53.1	-54.7	0	0	0	120.1
699	N	35.9	Very low	36.8	Very low	126 Å²	126	127.1 Å²	127.1	67%	0.674	70%	0.695	S	S	*	*			cis	-171	145.7	-37.5	-116.1	14	0	0	0	111
700	V	33.8	Very low	36.8	Very low	113 Å²	113	126.7 Å²	126.7	69%	0.685	69%	0.688	S	S	*	*			trans	37.9	122.1	132.6	-164.7	0	0	0	0	117.3
701	I	35.5	Very low	37.1	Very low	155 Å²	155	126 Å²	126	80%	0.795	68%	0.684	S	S	*	*				-165.3	116.5	81.8	-75.4	164.1	0	0	0	105.6
702	S	35.6	Very low	37.1	Very low	97 Å²	97	123.6 Å²	123.6	68%	0.678	68%	0.676	S	S	*	*				68.5	108.4	61.8	-173.8	0	0	0	0	116
703	S	36.8	Very low	37.4	Very low	93 Å²	93	122.1 Å²	122.1	65%	0.65	68%	0.681	S	S	*	*			trans	177.8	126.9	138.6	-90.3	0	0	0	0	116.7
704	H	36.9	Very low	37.4	Very low	158 Å²	158	122 Å²	122	73%	0.731	68%	0.678	S	S	*	*			trans	63.5	140.7	137.7	-62.4	68.5	0	0	0	119.6
705	N	38.6	Very low	37	Very low	113 Å²	113	122.7 Å²	122.7	60%	0.604	69%	0.686	S	S	*	*			cis	-166.6	135.5	-6	-117.6	11.2	0	0	0	112.2
706	N	42	Very low	36.8	Very low	130 Å²	130	121.3 Å²	121.3	70%	0.695	69%	0.688	S	S	*	*			trans	61.1	162	149.7	-41.9	-26.7	0	0	0	117.7
707	N	37	Very low	36.8	Very low	133 Å²	133	122.2 Å²	122.2	71%	0.711	70%	0.698	S	S	*	*			cis	-152.3	104.9	2.5	-155.4	47.9	0	0	0	107.6
708	C	34	Very low	37	Very low	92 Å²	92	122.8 Å²	122.8	62%	0.622	71%	0.709	S	S	*	*				79.6	141	89.8	-66	0	0	0	0	117.4
709	N	39.2	Very low	37.3	Very low	133 Å²	133	121 Å²	121	71%	0.711	71%	0.712	S	S	*	*			trans	77.7	152.4	158.2	-56.1	-18.3	0	0	0	117.8
710	N	39.3	Very low	37.9	Very low	129 Å²	129	123.4 Å²	123.4	69%	0.69	72%	0.721	S	S	*	*			cis	-172.7	159.1	-14.3	-100.3	-15.7	0	0	0	109.3
711	N	39.7	Very low	38.2	Very low	127 Å²	127	127.5 Å²	127.5	68%	0.679	73%	0.73	S	S	*	*			cis	-171.9	159.3	-28	-154.4	-4.9	0	0	0	111.5
712	T	35.9	Very low	38.4	Very low	115 Å²	115	127.8 Å²	127.8	71%	0.706	73%	0.732	S	S	*	*			trans	50.8	133	152.7	55.5	0	0	0	0	123.4
713	G	37.3	Very low	38.6	Very low	68 Å²	68	127.4 Å²	127.4	70%	0.701	73%	0.729	S	S	*	*			trans	145.9	71.6	154.9	0	0	0	0	0	115.6
714	I	36.2	Very low	38.8	Very low	146 Å²	146	129.1 Å²	129.1	75%	0.749	74%	0.741	S	S	*	*				76.4	124.1	75.4	-60.4	166.4	0	0	0	114.6
715	C	29.5	Very low	39.1	Very low	114 Å²	114	126.8 Å²	126.8	77%	0.77	74%	0.743	S	S	*	*			trans	65.7	150.5	159.8	83.3	0	0	0	0	119.8
716	S	35.9	Very low	39.7	Very low	105 Å²	105	128.4 Å²	128.4	73%	0.734	75%	0.752	S	S	*	*			cis	-162.5	135.3	-14.6	-110.3	0	0	0	0	114.7
717	V	39.7	Very low	40	Very low	137 Å²	137	128.8 Å²	128.8	83%	0.83	76%	0.759	S	S	*	*			trans	25.9	105.8	133.2	-168.4	0	0	0	0	121
718	S	43.9	Very low	40.3	Very low	101 Å²	101	127.6 Å²	127.6	71%	0.706	76%	0.76	S	S	*	*			trans	173.1	133	141.6	53.1	0	0	0	0	109
719	D	40.6	Very low	41.4	Very low	155 Å²	155	129.4 Å²	129.4	83%	0.829	77%	0.768	S	S	*	*			cis	-145.1	169.5	-1.2	-92.2	-45.2	0	0	0	111.3
720	M	48	Very low	42.4	Very low	177 Å²	177	132.7 Å²	132.7	87%	0.872	78%	0.776	S	S	*	*			trans	-111.4	138.1	-161.4	-59.7	172.4	-77.2	0	0	116
721	K	41.8	Very low	44	Very low	200 Å²	200	133.9 Å²	133.9	87%	0.87	78%	0.777	S	S	*	*			trans	-156.7	75.2	146.4	-128.3	167.2	-174.2	171.9	0	116.3
722	L	39.4	Very low	45.5	Very low	161 Å²	161	137.7 Å²	137.7	84%	0.843	79%	0.788	S	S	*	*			trans	4.7	109.6	145.5	-143.7	70.5	0	0	0	115.7
723	S	39.8	Very low	47.3	Very low	88 Å²	88	143.1 Å²	143.1	62%	0.615	80%	0.795	S	S	*	*				82.2	124.4	53.2	84.3	0	0	0	0	116.4
724	S	40.7	Very low	49.5	Very low	129 Å²	129	147.3 Å²	147.3	90%	0.902	80%	0.796	S	S	*	*			trans	-164	68	164.5	-81.8	0	0	0	0	112.1
725	S	42.4	Very low	51.8	Low	110 Å²	110	150.6 Å²	150.6	77%	0.769	80%	0.799	S	S	*	*			trans	-103.2	79.5	-179.3	53.4	0	0	0	0	112.2
726	N	51.1	Low	54.5	Low	147 Å²	147	147 Å²	147	79%	0.786	77%	0.774	S	S	*	*			trans	-101.5	105.2	173.6	-99.5	-17.3	0	0	0	111.3	C728	N726-C728 VanDerWaalsContact C-N 3.33Å; N726-C728 PolarHBondContact O-N 2.88Å
727	T	47.9	Very low	57.3	Low	138 Å²	138	152.8 Å²	152.8	85%	0.847	78%	0.779	S	S	*	*			trans	-74.6	77	-178.1	42	0	0	0	0	112	V729	T727-V729 PolarHBondContact O-N 3.36Å
728	C	43.5	Very low	60	Low	107 Å²	107	149.1 Å²	149.1	72%	0.723	75%	0.753	S	S	*	*			trans	-59.3	110.2	-179.3	-172.3	0	0	0	0	112.6	N726 K730	N726-C728 VanDerWaalsContact C-N 3.33Å; N726-C728 PolarHBondContact O-N 2.88Å; C728-K730 PolarHBondContact O-N 2.85Å
729	V	58.6	Low	62.5	Low	131 Å²	131	147.6 Å²	147.6	79%	0.794	74%	0.739	S	S	*	*			trans	-58.8	117	173.7	-177.2	0	0	0	0	109	T727 Q731	T727-V729 PolarHBondContact O-N 3.36Å; V729-Q731 PolarHBondContact O-N 2.92Å
730	K	59.1	Low	65.2	Low	202 Å²	202	145.1 Å²	145.1	88%	0.878	73%	0.731	S	S	*	*			trans	-66	93.7	-169.8	-67.7	173.8	-177.8	168.4	0	111.7	C728 K732	C728-K730 PolarHBondContact O-N 2.85Å; K730-K732 PolarHBondContact O-N 2.84Å
731	Q	72.7	Confident	67.6	Low	154 Å²	154	142.1 Å²	142.1	72%	0.72	72%	0.719	S	S	*	*			trans	-52.3	133.4	176.3	-77.1	-174.6	-14.2	0	0	112.2	V729 R733	V729-Q731 PolarHBondContact O-N 2.92Å; Q731-R733 PolarHBondContact O-N 2.69Å
732	K	72.1	Confident	70.3	Confident	206 Å²	206	133.8 Å²	133.8	90%	0.896	68%	0.683	S	S	*	*			trans	-80.3	102	-175.3	-171.5	175.3	-175.8	174.2	0	110.2	K730 H734	K730-K732 PolarHBondContact O-N 2.84Å; K732-H734 PolarHBondContact O-N 2.78Å
733	R	74.2	Confident	73	Confident	230 Å²	230	129.1 Å²	129.1	87%	0.868	66%	0.659	S	S	*	*			trans	-41.6	125.8	-177.6	-64.6	-176.6	-175.6	171.2	1.3	112.9	Q731 R735	Q731-R733 PolarHBondContact O-N 2.69Å; R733-R735 PolarHBondContact O-N 2.9Å
734	H	82	Confident	75.8	Confident	155 Å²	155	130 Å²	130	72%	0.718	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-59.5	129.9	178.7	-161.6	-54.7	0	0	0	111.6	K732	K732-H734 PolarHBondContact O-N 2.78Å
735	R	86	Confident	78.5	Confident	216 Å²	216	125 Å²	125	82%	0.815	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-78.9	122.2	174.2	-179.1	178.7	-179.7	175.5	1.2	109.6	R733 R737	R733-R735 PolarHBondContact O-N 2.9Å; R735-R737 PolarHBondContact O-N 3.21Å
736	T	86.3	Confident	81.2	Confident	38 Å²	38	119.8 Å²	119.8	23%	0.233	58%	0.582	C	S	.	*	P	Polyproline II helix	trans	-61.8	129.9	173.9	-54.8	0	0	0	0	110.5	F738 L770 R774	T736-F738 HydrophobicContact CG2-CD1 3.97Å; T736-F738 HydrophobicContact CG2-CE1 3.76Å; T736-F738 HydrophobicContact CG2-CZ 4.24Å; T736-L770 HydrophobicContact CG2-CD2 4.26Å; T736-R774 WeakPolarHBondContact OG1-CD 3.31Å; T736-R774 PolarHBondContact OG1-NE 3.31Å; T736-R774 PolarHBondContact OG1-NH1 3.27Å; T736-R774 VanDerWaalsContact OG1-NH1 3.17Å
737	R	93.7	Very high	83.4	Confident	226 Å²	226	116.7 Å²	116.7	85%	0.853	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-91.9	131.5	159.7	-67.4	173.7	65.6	-168.9	0.3	106.9	R735	R735-R737 PolarHBondContact O-N 3.21Å
738	F	96	Very high	85.8	Confident	61 Å²	61	116.7 Å²	116.7	27%	0.268	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-92.9	142.4	175.6	-56.4	-72.4	0	0	0	109.5	T736 Q742 L743 L746 L770 W778	T736-F738 HydrophobicContact CG2-CD1 3.97Å; T736-F738 HydrophobicContact CG2-CE1 3.76Å; T736-F738 HydrophobicContact CG2-CZ 4.24Å; F738-Q742 HydrophobicContact CB-CB 4.3Å; F738-L743 HydrophobicContact CB-CD1 4.46Å; F738-L743 HydrophobicContact CB-CD2 3.74Å; F738-L743 HydrophobicContact CB-CG 3.8Å; F738-L743 HydrophobicContact CD2-CD2 4.17Å; F738-L743 HydrophobicContact CG-CD2 4.19Å; F738-L746 HydrophobicContact CD1-CD1 4.41Å; F738-L770 HydrophobicContact CD1-CD1 3.74Å; F738-L770 HydrophobicContact CD1-CD2 4.18Å; F738-L770 HydrophobicContact CE1-CD1 3.72Å; F738-L770 HydrophobicContact CE1-CD2 4.18Å; F738-W778 AromaticContact CD2-CD1 3.97Å; F738-W778 AromaticContact CE2-CD1 3.66Å; F738-W778 HydrophobicContact CZ-CB 4.32Å; F738-W778 AromaticContact CZ-CD1 3.95Å
739	T	97.3	Very high	88.4	Confident	69 Å²	69	112.2 Å²	112.2	42%	0.423	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-71.9	159.5	172.3	69.9	0	0	0	0	110.8	N741 Q742 L743	T739-N741 PolarHBondContact O-N 2.79Å; T739-Q742 PolarHBondContact O-N 3.47Å; T739-Q742 WeakPolarHBondContact OG1-CB 3.33Å; T739-Q742 WeakPolarHBondContact OG1-CG 3.21Å; T739-Q742 PolarHBondContact OG1-N 3.04Å; T739-Q742 VanDerWaalsContact OG1-N 3.14Å; T739-L743 WeakPolarHBondContact O-CG 3.25Å; T739-L743 PolarHBondContact O-N 2.91Å
740	P	97.5	Very high	90.3	Very high	102 Å²	102	106.1 Å²	106.1	66%	0.662	48%	0.481	S	S	*	.	H	α-helix	trans	-56.3	-38.5	174.4	-26.3	35.8	0	0	0	112.7	L743 N744	P740-L743 PolarHBondContact O-N 3.28Å; P740-N744 PolarHBondContact O-N 2.84Å; P740-N744 PolarHBondContact O-OD1 2.82Å
741	N	97.2	Very high	92.1	Very high	115 Å²	115	101.1 Å²	101.1	62%	0.615	47%	0.471	S	S	*	.	H	α-helix	trans	-65	-45.6	176.7	-168.3	30.7	0	0	0	112.3	T739 L743 N744 E745	T739-N741 PolarHBondContact O-N 2.79Å; N741-L743 VanDerWaalsContact C-N 3.3Å; N741-L743 PolarHBondContact O-N 3.11Å; N741-N744 PolarHBondContact O-N 3.44Å; N741-E745 PolarHBondContact O-N 3.06Å
742	Q	98	Very high	93.2	Very high	24 Å²	24	101.8 Å²	101.8	11%	0.112	47%	0.472	C	S	.	.	H	α-helix	trans	-57.3	-43.4	173.4	-77.9	168.8	-13	0	0	111.6	F738 T739 L746 I768 L770	F738-Q742 HydrophobicContact CB-CB 4.3Å; T739-Q742 PolarHBondContact O-N 3.47Å; T739-Q742 WeakPolarHBondContact OG1-CB 3.33Å; T739-Q742 WeakPolarHBondContact OG1-CG 3.21Å; T739-Q742 PolarHBondContact OG1-N 3.04Å; T739-Q742 VanDerWaalsContact OG1-N 3.14Å; Q742-L746 VanDerWaalsContact O-CB 3.31Å; Q742-L746 WeakPolarHBondContact O-CB 3.46Å; Q742-L746 VanDerWaalsContact O-CD1 3.28Å; Q742-L746 WeakPolarHBondContact O-CD1 3.47Å; Q742-L746 WeakPolarHBondContact O-CG 3.42Å; Q742-L746 PolarHBondContact O-N 3.06Å; Q742-I768 HydrophobicContact CG-CB 4.03Å; Q742-I768 HydrophobicContact CG-CG1 4.28Å; Q742-I768 VanDerWaalsContact CG-O 3.31Å; Q742-I768 WeakPolarHBondContact CG-O 3.46Å; Q742-I768 PolarHBondContact NE2-O 3.46Å; Q742-L770 HydrophobicContact CG-CD1 4.46Å
743	L	97.8	Very high	94.4	Very high	64 Å²	64	94.3 Å²	94.3	34%	0.335	44%	0.444	S	S	.	.	H	α-helix	trans	-64.5	-43.7	177.5	-69.8	174.4	0	0	0	112	F738 T739 P740 N741 E745 L746 E747	F738-L743 HydrophobicContact CB-CD1 4.46Å; F738-L743 HydrophobicContact CB-CD2 3.74Å; F738-L743 HydrophobicContact CB-CG 3.8Å; F738-L743 HydrophobicContact CD2-CD2 4.17Å; F738-L743 HydrophobicContact CG-CD2 4.19Å; T739-L743 WeakPolarHBondContact O-CG 3.25Å; T739-L743 PolarHBondContact O-N 2.91Å; P740-L743 PolarHBondContact O-N 3.28Å; N741-L743 VanDerWaalsContact C-N 3.3Å; N741-L743 PolarHBondContact O-N 3.11Å; L743-E745 PolarHBondContact O-N 2.82Å; L743-L746 PolarHBondContact O-N 3.48Å; L743-E747 WeakPolarHBondContact O-CG 3.27Å; L743-E747 PolarHBondContact O-N 2.92Å
744	N	97.7	Very high	95.5	Very high	107 Å²	107	86 Å²	86	57%	0.572	42%	0.415	S	S	*	.	H	α-helix	trans	-59.9	-45.9	177.3	-69.8	-9.4	0	0	0	111.6	P740 N741 E747 R748	P740-N744 PolarHBondContact O-N 2.84Å; P740-N744 PolarHBondContact O-OD1 2.82Å; N741-N744 PolarHBondContact O-N 3.44Å; N744-E747 PolarHBondContact O-N 2.78Å; N744-R748 VanDerWaalsContact O-CB 3.26Å; N744-R748 WeakPolarHBondContact O-CB 3.26Å; N744-R748 PolarHBondContact O-N 3.22Å
745	E	97.9	Very high	96.3	Very high	24 Å²	24	86.3 Å²	86.3	11%	0.112	41%	0.411	C	S	.	.	H	α-helix	trans	-64.4	-41.9	175.7	-82.4	-59.3	93.3	0	0	113	N741 L743 R748 A749 L764 R767 I768	N741-E745 PolarHBondContact O-N 3.06Å; L743-E745 PolarHBondContact O-N 2.82Å; E745-R748 PolarHBondContact O-N 3.45Å; E745-R748 IonicContact OE1-CZ 3.41Å; E745-R748 IonicContact OE1-NE 2.94Å; E745-R748 PolarHBondContact OE1-NE 2.98Å; E745-R748 IonicContact OE1-NH2 3.51Å; E745-R748 PolarHBondContact OE1-NH2 3.4Å; E745-R748 IonicContact OE2-CZ 2.83Å; E745-R748 IonicContact OE2-NE 3.29Å; E745-R748 IonicContact OE2-NH2 2.66Å; E745-R748 PolarHBondContact OE2-NH2 3.19Å; E745-A749 WeakPolarHBondContact O-CB 3.36Å; E745-A749 PolarHBondContact O-N 3.1Å; E745-L764 HydrophobicContact CB-CD1 4.34Å; E745-R767 IonicContact OE2-NH1 3.77Å; E745-R767 PolarHBondContact OE2-NH1 3.06Å; E745-I768 HydrophobicContact CB-CG2 3.62Å; E745-I768 HydrophobicContact CG-CG2 3.76Å
746	L	98.5	Very high	96.8	Very high	0 Å²	0	76.4 Å²	76.4	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-64.7	-39.5	177	-72.8	163.2	0	0	0	111.6	F738 Q742 L743 F750 L764 I768 L770 V775 W778 F779	F738-L746 HydrophobicContact CD1-CD1 4.41Å; Q742-L746 VanDerWaalsContact O-CB 3.31Å; Q742-L746 WeakPolarHBondContact O-CB 3.46Å; Q742-L746 VanDerWaalsContact O-CD1 3.28Å; Q742-L746 WeakPolarHBondContact O-CD1 3.47Å; Q742-L746 WeakPolarHBondContact O-CG 3.42Å; Q742-L746 PolarHBondContact O-N 3.06Å; L743-L746 PolarHBondContact O-N 3.48Å; L746-F750 VanDerWaalsContact O-CB 3.25Å; L746-F750 WeakPolarHBondContact O-CB 3.46Å; L746-F750 PolarHBondContact O-N 3.47Å; L746-L764 HydrophobicContact CD2-CD2 4.05Å; L746-I768 HydrophobicContact CD1-CD1 4.14Å; L746-I768 HydrophobicContact CD2-CD1 3.83Å; L746-I768 HydrophobicContact CG-CD1 3.73Å; L746-L770 HydrophobicContact CD1-CD1 4.23Å; L746-V775 HydrophobicContact CD2-CG1 3.98Å; L746-V775 HydrophobicContact CD2-CG2 4.29Å; L746-W778 VanDerWaalsContact C-CH2 3.43Å; L746-W778 HydrophobicContact CB-CD2 3.86Å; L746-W778 HydrophobicContact CB-CE3 3.89Å; L746-W778 HydrophobicContact CB-CH2 3.67Å; L746-W778 HydrophobicContact CB-CZ2 3.6Å; L746-W778 HydrophobicContact CB-CZ3 3.81Å; L746-W778 HydrophobicContact CD1-CD2 3.98Å; L746-W778 HydrophobicContact CD1-CG 3.87Å; L746-W778 HydrophobicContact CD2-CD2 4.12Å; L746-W778 HydrophobicContact CD2-CE3 4Å; L746-W778 HydrophobicContact CD2-CG 4.38Å; L746-W778 HydrophobicContact CG-CD2 4.21Å; L746-W778 HydrophobicContact CG-CE3 4.39Å; L746-W778 WeakPolarHBondContact O-CH2 3.45Å; L746-W778 WeakPolarHBondContact O-CZ3 3.4Å; L746-F779 HydrophobicContact CD2-CD2 4.41Å; L746-F779 HydrophobicContact CD2-CE2 3.98Å
747	E	98.2	Very high	97.4	Very high	81 Å²	81	79.3 Å²	79.3	38%	0.379	39%	0.388	S	S	.	.	H	α-helix	trans	-72.9	-35.3	175.2	-58.4	-125.8	142.5	0	0	112.3	L743 N744 F750 S751 W778 R782	L743-E747 WeakPolarHBondContact O-CG 3.27Å; L743-E747 PolarHBondContact O-N 2.92Å; N744-E747 PolarHBondContact O-N 2.78Å; E747-F750 PolarHBondContact O-N 2.95Å; E747-S751 WeakPolarHBondContact O-CB 3.35Å; E747-S751 PolarHBondContact O-N 2.92Å; E747-S751 PolarHBondContact O-OG 3.49Å; E747-W778 HydrophobicContact CG-CH2 4.09Å; E747-W778 HydrophobicContact CG-CZ2 3.94Å; E747-R782 IonicContact OE1-CZ 3.14Å; E747-R782 IonicContact OE1-NE 3.95Å; E747-R782 PolarHBondContact OE1-NE 3.27Å; E747-R782 IonicContact OE1-NH2 2.69Å; E747-R782 PolarHBondContact OE1-NH2 3.25Å; E747-R782 IonicContact OE2-CZ 2.72Å; E747-R782 IonicContact OE2-NH2 3.19Å; E747-R782 PolarHBondContact OE2-NH2 3.28Å
748	R	97.6	Very high	97.5	Very high	139 Å²	139	71.2 Å²	71.2	53%	0.525	36%	0.361	S	S	.	.	H	α-helix	trans	-61.8	-44.2	172.2	-173.3	167.7	75.5	138.8	2	111.1	N744 E745 S751 K752	N744-R748 VanDerWaalsContact O-CB 3.26Å; N744-R748 WeakPolarHBondContact O-CB 3.26Å; N744-R748 PolarHBondContact O-N 3.22Å; E745-R748 PolarHBondContact O-N 3.45Å; E745-R748 IonicContact OE1-CZ 3.41Å; E745-R748 IonicContact OE1-NE 2.94Å; E745-R748 PolarHBondContact OE1-NE 2.98Å; E745-R748 IonicContact OE1-NH2 3.51Å; E745-R748 PolarHBondContact OE1-NH2 3.4Å; E745-R748 IonicContact OE2-CZ 2.83Å; E745-R748 IonicContact OE2-NE 3.29Å; E745-R748 IonicContact OE2-NH2 2.66Å; E745-R748 PolarHBondContact OE2-NH2 3.19Å; R748-S751 PolarHBondContact O-N 3.17Å; R748-K752 PolarHBondContact O-N 3.16Å
749	A	97.6	Very high	97.6	Very high	12 Å²	12	75.4 Å²	75.4	10%	0.099	38%	0.38	C	S	.	.	H	α-helix	trans	-68.9	-41.7	174.9	0	0	0	0	0	112.6	E745 S751 K752 T753 L764 F779	E745-A749 WeakPolarHBondContact O-CB 3.36Å; E745-A749 PolarHBondContact O-N 3.1Å; A749-S751 PolarHBondContact O-N 3.39Å; A749-K752 PolarHBondContact O-N 3.38Å; A749-K752 VanDerWaalsContact O-N 3.08Å; A749-T753 PolarHBondContact O-N 3.18Å; A749-L764 HydrophobicContact CB-CD1 4.27Å; A749-L764 HydrophobicContact CB-CD2 3.48Å; A749-L764 VanDerWaalsContact CB-CD2 3.48Å; A749-F779 HydrophobicContact CB-CZ 3.91Å
750	F	98.1	Very high	97.6	Very high	4 Å²	4	75 Å²	75	2%	0.018	37%	0.374	C	S	.	.	H	α-helix	trans	-59.7	-34.5	175.5	-170.2	-97.3	0	0	0	112.8	L746 E747 K752 T753 H754 W778 F779 R782 R783 W786	L746-F750 VanDerWaalsContact O-CB 3.25Å; L746-F750 WeakPolarHBondContact O-CB 3.46Å; L746-F750 PolarHBondContact O-N 3.47Å; E747-F750 PolarHBondContact O-N 2.95Å; F750-K752 VanDerWaalsContact C-N 3.34Å; F750-T753 CarbonylContact O-C 3.48Å; F750-T753 VanDerWaalsContact O-C 3.29Å; F750-H754 AromaticContact CD1-CD2 3.63Å; F750-H754 AromaticContact CE1-CD2 3.22Å; F750-H754 WeakPolarHBondContact CE1-CD2 3.37Å; F750-H754 AromaticContact CE1-NE2 3.63Å; F750-H754 HydrophobicContact CE2-CB 4.27Å; F750-H754 AromaticContact CE2-CD2 3.83Å; F750-H754 HydrophobicContact CZ-CB 4.39Å; F750-H754 AromaticContact CZ-CD2 3.33Å; F750-H754 WeakPolarHBondContact CZ-CD2 3.26Å; F750-H754 PolarHBondContact O-CD2 3.3Å; F750-H754 VanDerWaalsContact O-CD2 3.22Å; F750-W778 HydrophobicContact CB-CH2 4.01Å; F750-W778 HydrophobicContact CB-CZ3 3.94Å; F750-W778 HydrophobicContact CD2-CZ3 4.05Å; F750-W778 HydrophobicContact CG-CH2 4.38Å; F750-W778 HydrophobicContact CG-CZ3 4.25Å; F750-F779 HydrophobicContact CB-CE1 4.06Å; F750-F779 HydrophobicContact CB-CZ 4.39Å; F750-F779 AromaticContact CD2-CD1 3.75Å; F750-F779 HydrophobicContact CD2-CD1 3.75Å; F750-F779 AromaticContact CD2-CE1 3.81Å; F750-F779 HydrophobicContact CD2-CE1 3.81Å; F750-F779 HydrophobicContact CE2-CD1 4.45Å; F750-F779 HydrophobicContact CG-CE1 4.42Å; F750-R782 HydrophobicContact CD1-CG 3.8Å; F750-R782 HydrophobicContact CD2-CB 3.82Å; F750-R782 HydrophobicContact CD2-CG 3.49Å; F750-R782 VanDerWaalsContact CD2-CG 3.49Å; F750-R782 HydrophobicContact CE1-CG 3.77Å; F750-R782 VanDerWaalsContact CE1-NH1 3.33Å; F750-R782 HydrophobicContact CE2-CB 3.63Å; F750-R782 HydrophobicContact CE2-CG 3.45Å; F750-R782 VanDerWaalsContact CE2-CG 3.45Å; F750-R782 HydrophobicContact CG-CB 4.48Å; F750-R782 HydrophobicContact CG-CG 3.68Å; F750-R782 HydrophobicContact CZ-CB 4.14Å; F750-R782 HydrophobicContact CZ-CG 3.6Å; F750-R783 HydrophobicContact CE2-CG 3.89Å; F750-R783 HydrophobicContact CZ-CG 4.4Å; F750-W786 HydrophobicContact CE1-CB 4.33Å; F750-W786 HydrophobicContact CE1-CG 4.39Å; F750-W786 HydrophobicContact CZ-CB 3.96Å; F750-W786 HydrophobicContact CZ-CG 4.25Å
751	S	97.3	Very high	97.6	Very high	97 Å²	97	72 Å²	72	68%	0.678	35%	0.349	S	S	*	.	H	α-helix	trans	-73.6	-24.2	177.4	-54.5	0	0	0	0	113	E747 R748 A749	E747-S751 WeakPolarHBondContact O-CB 3.35Å; E747-S751 PolarHBondContact O-N 2.92Å; E747-S751 PolarHBondContact O-OG 3.49Å; R748-S751 PolarHBondContact O-N 3.17Å; A749-S751 PolarHBondContact O-N 3.39Å
752	K	96.8	Very high	97.7	Very high	168 Å²	168	70.4 Å²	70.4	73%	0.73	34%	0.338	S	S	*	.	H	α-helix	trans	-78.9	-44.9	170.2	-68.3	-175.2	176.8	-170.4	0	111.9	R748 A749 F750	R748-K752 PolarHBondContact O-N 3.16Å; A749-K752 PolarHBondContact O-N 3.38Å; A749-K752 VanDerWaalsContact O-N 3.08Å; F750-K752 VanDerWaalsContact C-N 3.34Å
753	T	97.2	Very high	97.7	Very high	49 Å²	49	74.2 Å²	74.2	30%	0.301	36%	0.356	S	S	.	.			trans	-152.6	134.7	171.3	173.4	0	0	0	0	112	A749 F750 Y755 M760 F779	A749-T753 PolarHBondContact O-N 3.18Å; F750-T753 CarbonylContact O-C 3.48Å; F750-T753 VanDerWaalsContact O-C 3.29Å; T753-Y755 PolarHBondContact O-N 3.12Å; T753-Y755 PolarHBondContact OG1-N 3.38Å; T753-Y755 PolarHBondContact OG1-O 3.37Å; T753-M760 HydrophobicContact CG2-CE 3.44Å; T753-M760 VanDerWaalsContact CG2-CE 3.44Å; T753-M760 HydrophobicContact CG2-SD 4.37Å; T753-F779 WeakPolarHBondContact O-CE1 3.47Å
754	H	97.4	Very high	97.7	Very high	56 Å²	56	71.3 Å²	71.3	26%	0.259	34%	0.34	S	S	.	.	S	Bend	trans	-71.4	-18.8	172.2	-56.2	133.9	0	0	0	112.9	F750 P756 R783 W786	F750-H754 AromaticContact CD1-CD2 3.63Å; F750-H754 AromaticContact CE1-CD2 3.22Å; F750-H754 WeakPolarHBondContact CE1-CD2 3.37Å; F750-H754 AromaticContact CE1-NE2 3.63Å; F750-H754 HydrophobicContact CE2-CB 4.27Å; F750-H754 AromaticContact CE2-CD2 3.83Å; F750-H754 HydrophobicContact CZ-CB 4.39Å; F750-H754 AromaticContact CZ-CD2 3.33Å; F750-H754 WeakPolarHBondContact CZ-CD2 3.26Å; F750-H754 PolarHBondContact O-CD2 3.3Å; F750-H754 VanDerWaalsContact O-CD2 3.22Å; H754-P756 WeakPolarHBondContact O-CD 3.37Å; H754-R783 HydrophobicContact CB-CG 4.35Å; H754-R783 VanDerWaalsContact O-CD 3.25Å; H754-R783 WeakPolarHBondContact O-CD 3.43Å; H754-R783 WeakPolarHBondContact O-CG 3.4Å; H754-R783 PolarHBondContact O-NH1 2.94Å; H754-W786 AromaticContact CE1-CE2 3.65Å; H754-W786 AromaticContact CE1-CZ2 3.64Å; H754-W786 AromaticContact CE1-NE1 3.66Å; H754-W786 AromaticContact ND1-CZ2 3.89Å; H754-W786 AromaticContact NE2-NE1 3.67Å
755	Y	98.2	Very high	97.7	Very high	161 Å²	161	66.4 Å²	66.4	63%	0.631	32%	0.315	S	S	*	.	S	Bend	trans	-125.3	78.7	-175.4	-64.1	-83.5	0	0	0	109.9	T753	T753-Y755 PolarHBondContact O-N 3.12Å; T753-Y755 PolarHBondContact OG1-N 3.38Å; T753-Y755 PolarHBondContact OG1-O 3.37Å
756	P	97.4	Very high	97.7	Very high	7 Å²	7	72.4 Å²	72.4	5%	0.045	35%	0.347	C	S	.	.			trans	-71.6	132.1	177.3	31.1	-38	0	0	0	111.1	H754 M760 R761 F779	H754-P756 WeakPolarHBondContact O-CD 3.37Å; P756-M760 HydrophobicContact CB-CE 3.51Å; P756-R761 HydrophobicContact CB-CG 3.71Å; P756-R761 HydrophobicContact CG-CG 3.62Å; P756-R761 PolarHBondContact O-NH1 2.81Å; P756-F779 HydrophobicContact CB-CE1 4.3Å; P756-F779 HydrophobicContact CB-CZ 4.42Å; P756-F779 HydrophobicContact CG-CB 4.36Å; P756-F779 HydrophobicContact CG-CD1 3.46Å; P756-F779 VanDerWaalsContact CG-CD1 3.46Å; P756-F779 HydrophobicContact CG-CD2 4.01Å; P756-F779 HydrophobicContact CG-CE1 3.58Å; P756-F779 HydrophobicContact CG-CE2 4.14Å; P756-F779 HydrophobicContact CG-CG 3.68Å; P756-F779 HydrophobicContact CG-CZ 3.93Å
757	D	97.5	Very high	97.6	Very high	99 Å²	99	78.3 Å²	78.3	53%	0.529	37%	0.369	S	S	.	.			trans	-69.2	165.7	172.2	-174.1	36.9	0	0	0	112.3	F759 M760 R761	D757-F759 PolarHBondContact O-N 3.13Å; D757-M760 PolarHBondContact O-N 3.18Å; D757-M760 VanDerWaalsContact O-N 3.16Å; D757-R761 VanDerWaalsContact C-NH1 3.26Å; D757-R761 WeakPolarHBondContact O-CG 3.33Å; D757-R761 PolarHBondContact O-N 3.01Å
758	I	97	Very high	97.5	Very high	57 Å²	57	75.3 Å²	75.3	29%	0.292	36%	0.355	S	S	.	.	H	α-helix	trans	-50.1	-55.3	-176.5	-177.7	60.4	0	0	0	112.2	M760 R761 E762 E772	I758-M760 VanDerWaalsContact C-N 3.29Å; I758-M760 PolarHBondContact O-N 3.4Å; I758-R761 VanDerWaalsContact CD1-NH2 3.34Å; I758-R761 WeakPolarHBondContact O-CA 3.26Å; I758-R761 WeakPolarHBondContact O-CB 3.25Å; I758-R761 PolarHBondContact O-N 3.43Å; I758-E762 HydrophobicContact CD1-CG 4.15Å; I758-E762 HydrophobicContact CG1-CG 4.43Å; I758-E762 WeakPolarHBondContact O-CG 3.11Å; I758-E762 PolarHBondContact O-N 3.45Å; I758-E772 HydrophobicContact CD1-CG 4.02Å
759	F	97.4	Very high	97.5	Very high	149 Å²	149	71.7 Å²	71.7	65%	0.654	36%	0.361	S	S	*	.	H	α-helix	trans	-59.5	-38.1	-178.8	-58.4	-67.4	0	0	0	112.6	D757 R761 E762 E763	D757-F759 PolarHBondContact O-N 3.13Å; F759-R761 VanDerWaalsContact C-N 3.34Å; F759-E762 PolarHBondContact O-N 3.4Å; F759-E763 VanDerWaalsContact O-CB 3.31Å; F759-E763 WeakPolarHBondContact O-CB 3.3Å; F759-E763 PolarHBondContact O-N 2.97Å
760	M	97.2	Very high	97.5	Very high	61 Å²	61	72.5 Å²	72.5	30%	0.3	36%	0.364	S	S	.	.	H	α-helix	trans	-76.2	-21.7	178.1	-152.1	-171.6	72	0	0	112.6	T753 P756 D757 I758 L764	T753-M760 HydrophobicContact CG2-CE 3.44Å; T753-M760 VanDerWaalsContact CG2-CE 3.44Å; T753-M760 HydrophobicContact CG2-SD 4.37Å; P756-M760 HydrophobicContact CB-CE 3.51Å; D757-M760 PolarHBondContact O-N 3.18Å; D757-M760 VanDerWaalsContact O-N 3.16Å; I758-M760 VanDerWaalsContact C-N 3.29Å; I758-M760 PolarHBondContact O-N 3.4Å; M760-L764 WeakPolarHBondContact O-CB 3.41Å; M760-L764 PolarHBondContact O-N 2.93Å
761	R	98.2	Very high	97.4	Very high	39 Å²	39	76.6 Å²	76.6	15%	0.147	39%	0.389	C	S	.	.	H	α-helix	trans	-77.2	-37.3	169.3	-64.6	-168.2	-50	-79.5	-4.5	111.5	P756 D757 I758 F759 A765 E772 V775	P756-R761 HydrophobicContact CB-CG 3.71Å; P756-R761 HydrophobicContact CG-CG 3.62Å; P756-R761 PolarHBondContact O-NH1 2.81Å; D757-R761 VanDerWaalsContact C-NH1 3.26Å; D757-R761 WeakPolarHBondContact O-CG 3.33Å; D757-R761 PolarHBondContact O-N 3.01Å; I758-R761 VanDerWaalsContact CD1-NH2 3.34Å; I758-R761 WeakPolarHBondContact O-CA 3.26Å; I758-R761 WeakPolarHBondContact O-CB 3.25Å; I758-R761 PolarHBondContact O-N 3.43Å; F759-R761 VanDerWaalsContact C-N 3.34Å; R761-A765 WeakPolarHBondContact O-CB 3.48Å; R761-A765 PolarHBondContact O-N 3.05Å; R761-E772 HydrophobicContact CB-CG 4.04Å; R761-E772 IonicContact CZ-OE1 3.98Å; R761-E772 IonicContact NE-OE1 3.75Å; R761-E772 PolarHBondContact NE-OE1 2.88Å; R761-E772 IonicContact NH2-OE1 3.99Å; R761-E772 PolarHBondContact NH2-OE1 3.15Å; R761-V775 HydrophobicContact CB-CG1 4.27Å; R761-V775 HydrophobicContact CG-CG1 4.35Å
762	E	98.4	Very high	97.5	Very high	80 Å²	80	74.1 Å²	74.1	37%	0.374	37%	0.367	S	S	.	.	H	α-helix	trans	-67.3	-50.5	176	-69	169.8	156.4	0	0	111.6	I758 F759 L764 A765 L766 E772	I758-E762 HydrophobicContact CD1-CG 4.15Å; I758-E762 HydrophobicContact CG1-CG 4.43Å; I758-E762 WeakPolarHBondContact O-CG 3.11Å; I758-E762 PolarHBondContact O-N 3.45Å; F759-E762 PolarHBondContact O-N 3.4Å; E762-L764 VanDerWaalsContact C-N 3.34Å; E762-L764 PolarHBondContact O-N 2.97Å; E762-A765 WeakPolarHBondContact O-CB 3.44Å; E762-A765 PolarHBondContact O-N 3.16Å; E762-A765 VanDerWaalsContact O-N 3.15Å; E762-L766 WeakPolarHBondContact O-CG 3.31Å; E762-L766 PolarHBondContact O-N 2.99Å; E762-E772 HydrophobicContact CG-CB 4.3Å; E762-E772 HydrophobicContact CG-CG 3.91Å
763	E	97.8	Very high	97.5	Very high	105 Å²	105	69 Å²	69	49%	0.491	35%	0.352	S	S	.	.	H	α-helix	trans	-59.5	-43.7	177.2	-165.5	-128.6	169.7	0	0	111.7	F759 R767	F759-E763 VanDerWaalsContact O-CB 3.31Å; F759-E763 WeakPolarHBondContact O-CB 3.3Å; F759-E763 PolarHBondContact O-N 2.97Å; E763-R767 WeakPolarHBondContact O-CB 3.5Å; E763-R767 PolarHBondContact O-N 3.25Å; E763-R767 IonicContact OE1-CZ 2.68Å; E763-R767 IonicContact OE1-NH2 2.84Å; E763-R767 PolarHBondContact OE1-NH2 3.05Å; E763-R767 IonicContact OE2-CZ 2.94Å; E763-R767 IonicContact OE2-NH2 3.73Å; E763-R767 PolarHBondContact OE2-NH2 3.18Å
764	L	97.9	Very high	97.5	Very high	2 Å²	2	71.6 Å²	71.6	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-67	-38.2	175.7	-177.8	60.7	0	0	0	112.3	E745 L746 A749 M760 E762 R767 I768 V775 F779	E745-L764 HydrophobicContact CB-CD1 4.34Å; L746-L764 HydrophobicContact CD2-CD2 4.05Å; A749-L764 HydrophobicContact CB-CD1 4.27Å; A749-L764 HydrophobicContact CB-CD2 3.48Å; A749-L764 VanDerWaalsContact CB-CD2 3.48Å; M760-L764 WeakPolarHBondContact O-CB 3.41Å; M760-L764 PolarHBondContact O-N 2.93Å; E762-L764 VanDerWaalsContact C-N 3.34Å; E762-L764 PolarHBondContact O-N 2.97Å; L764-R767 PolarHBondContact O-N 3.44Å; L764-I768 HydrophobicContact CD1-CD1 4.26Å; L764-I768 HydrophobicContact CD1-CG2 4.22Å; L764-I768 HydrophobicContact CG-CD1 4.14Å; L764-I768 WeakPolarHBondContact O-CD1 3.44Å; L764-I768 WeakPolarHBondContact O-CG1 3.38Å; L764-I768 PolarHBondContact O-N 3.05Å; L764-V775 HydrophobicContact CD2-CG1 4.01Å; L764-V775 HydrophobicContact CG-CG1 4.47Å; L764-F779 HydrophobicContact CD2-CE2 3.77Å; L764-F779 HydrophobicContact CD2-CZ 4.17Å
765	A	98	Very high	97.5	Very high	4 Å²	4	68.9 Å²	68.9	3%	0.033	34%	0.344	C	S	.	.	H	α-helix	trans	-63.6	-46.7	177.4	0	0	0	0	0	111.7	R761 E762 I768 G769 L770 V775	R761-A765 WeakPolarHBondContact O-CB 3.48Å; R761-A765 PolarHBondContact O-N 3.05Å; E762-A765 WeakPolarHBondContact O-CB 3.44Å; E762-A765 PolarHBondContact O-N 3.16Å; E762-A765 VanDerWaalsContact O-N 3.15Å; A765-I768 PolarHBondContact O-N 3.48Å; A765-G769 PolarHBondContact O-N 3.25Å; A765-G769 VanDerWaalsContact O-N 3.1Å; A765-L770 CarbonylContact C-O 3.43Å; A765-L770 WeakPolarHBondContact CB-O 3.47Å; A765-L770 PolarHBondContact O-N 2.77Å; A765-V775 HydrophobicContact CB-CG2 3.73Å
766	L	97.5	Very high	97.5	Very high	150 Å²	150	64.5 Å²	64.5	79%	0.785	33%	0.329	S	S	*	.	H	α-helix	trans	-58	-50.3	173.6	-70.5	170.6	0	0	0	111.3	E762 I768 G769	E762-L766 WeakPolarHBondContact O-CG 3.31Å; E762-L766 PolarHBondContact O-N 2.99Å; L766-I768 PolarHBondContact O-N 3.28Å; L766-I768 VanDerWaalsContact O-N 3.1Å; L766-G769 PolarHBondContact O-N 3.44Å
767	R	97	Very high	97.5	Very high	124 Å²	124	67 Å²	67	47%	0.468	34%	0.344	S	S	.	.	H	α-helix	trans	-59	-26.3	-177.4	-161.9	-168.5	-59.7	132.5	3.5	113.8	E745 E763 L764	E745-R767 IonicContact OE2-NH1 3.77Å; E745-R767 PolarHBondContact OE2-NH1 3.06Å; E763-R767 WeakPolarHBondContact O-CB 3.5Å; E763-R767 PolarHBondContact O-N 3.25Å; E763-R767 IonicContact OE1-CZ 2.68Å; E763-R767 IonicContact OE1-NH2 2.84Å; E763-R767 PolarHBondContact OE1-NH2 3.05Å; E763-R767 IonicContact OE2-CZ 2.94Å; E763-R767 IonicContact OE2-NH2 3.73Å; E763-R767 PolarHBondContact OE2-NH2 3.18Å; L764-R767 PolarHBondContact O-N 3.44Å
768	I	97	Very high	97.5	Very high	18 Å²	18	63.3 Å²	63.3	9%	0.092	32%	0.323	C	S	.	.	H	α-helix	trans	-118.2	8	-172.3	77.4	-167.4	0	0	0	114.4	Q742 E745 L746 L764 A765 L766 L770 V775	Q742-I768 HydrophobicContact CG-CB 4.03Å; Q742-I768 HydrophobicContact CG-CG1 4.28Å; Q742-I768 VanDerWaalsContact CG-O 3.31Å; Q742-I768 WeakPolarHBondContact CG-O 3.46Å; Q742-I768 PolarHBondContact NE2-O 3.46Å; E745-I768 HydrophobicContact CB-CG2 3.62Å; E745-I768 HydrophobicContact CG-CG2 3.76Å; L746-I768 HydrophobicContact CD1-CD1 4.14Å; L746-I768 HydrophobicContact CD2-CD1 3.83Å; L746-I768 HydrophobicContact CG-CD1 3.73Å; L764-I768 HydrophobicContact CD1-CD1 4.26Å; L764-I768 HydrophobicContact CD1-CG2 4.22Å; L764-I768 HydrophobicContact CG-CD1 4.14Å; L764-I768 WeakPolarHBondContact O-CD1 3.44Å; L764-I768 WeakPolarHBondContact O-CG1 3.38Å; L764-I768 PolarHBondContact O-N 3.05Å; A765-I768 PolarHBondContact O-N 3.48Å; L766-I768 PolarHBondContact O-N 3.28Å; L766-I768 VanDerWaalsContact O-N 3.1Å; I768-L770 HydrophobicContact CD1-CD1 3.77Å; I768-L770 HydrophobicContact CD1-CG 4.44Å; I768-L770 HydrophobicContact CG1-CB 4.19Å; I768-L770 HydrophobicContact CG1-CD1 3.85Å; I768-L770 HydrophobicContact CG1-CG 3.97Å; I768-V775 HydrophobicContact CD1-CG2 4.37Å
769	G	97.2	Very high	97.6	Very high	63 Å²	63	60.7 Å²	60.7	65%	0.649	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	44.6	177.8	0	0	0	0	0	113.5	A765 L766	A765-G769 PolarHBondContact O-N 3.25Å; A765-G769 VanDerWaalsContact O-N 3.1Å; L766-G769 PolarHBondContact O-N 3.44Å
770	L	96.4	Very high	97.6	Very high	29 Å²	29	57.9 Å²	57.9	15%	0.152	30%	0.299	C	S	.	.			trans	-127.1	167.8	174.2	-67.8	177.4	0	0	0	110.2	T736 F738 Q742 L746 A765 I768 V775	T736-L770 HydrophobicContact CG2-CD2 4.26Å; F738-L770 HydrophobicContact CD1-CD1 3.74Å; F738-L770 HydrophobicContact CD1-CD2 4.18Å; F738-L770 HydrophobicContact CE1-CD1 3.72Å; F738-L770 HydrophobicContact CE1-CD2 4.18Å; Q742-L770 HydrophobicContact CG-CD1 4.46Å; L746-L770 HydrophobicContact CD1-CD1 4.23Å; A765-L770 CarbonylContact C-O 3.43Å; A765-L770 WeakPolarHBondContact CB-O 3.47Å; A765-L770 PolarHBondContact O-N 2.77Å; I768-L770 HydrophobicContact CD1-CD1 3.77Å; I768-L770 HydrophobicContact CD1-CG 4.44Å; I768-L770 HydrophobicContact CG1-CB 4.19Å; I768-L770 HydrophobicContact CG1-CD1 3.85Å; I768-L770 HydrophobicContact CG1-CG 3.97Å; L770-V775 HydrophobicContact CB-CG2 4.24Å; L770-V775 HydrophobicContact CD1-CG2 4.4Å
771	T	97.2	Very high	97.6	Very high	90 Å²	90	59.5 Å²	59.5	55%	0.552	31%	0.309	S	S	*	.			trans	-87.4	151.4	166.5	65.6	0	0	0	0	110.8	S773 R774 V775	T771-S773 PolarHBondContact O-N 3.12Å; T771-S773 VanDerWaalsContact O-N 3.16Å; T771-R774 PolarHBondContact O-N 3.22Å; T771-R774 WeakPolarHBondContact OG1-CG 3.47Å; T771-V775 PolarHBondContact O-N 3.32Å
772	E	98.1	Very high	97.6	Very high	45 Å²	45	60 Å²	60	21%	0.21	31%	0.31	C	S	.	.	H	α-helix	trans	-46.2	-46.5	175.9	-176.9	-76.1	158.9	0	0	111.3	I758 R761 E762 R774 V775 Q776	I758-E772 HydrophobicContact CD1-CG 4.02Å; R761-E772 HydrophobicContact CB-CG 4.04Å; R761-E772 IonicContact CZ-OE1 3.98Å; R761-E772 IonicContact NE-OE1 3.75Å; R761-E772 PolarHBondContact NE-OE1 2.88Å; R761-E772 IonicContact NH2-OE1 3.99Å; R761-E772 PolarHBondContact NH2-OE1 3.15Å; E762-E772 HydrophobicContact CG-CB 4.3Å; E762-E772 HydrophobicContact CG-CG 3.91Å; E772-R774 VanDerWaalsContact C-N 3.31Å; E772-R774 PolarHBondContact O-N 2.89Å; E772-V775 CarbonylContact O-C 3.53Å; E772-V775 WeakPolarHBondContact O-CA 3.25Å; E772-V775 WeakPolarHBondContact O-CB 3.46Å; E772-V775 PolarHBondContact O-N 3.45Å; E772-Q776 WeakPolarHBondContact O-CB 3.33Å; E772-Q776 PolarHBondContact O-N 3.11Å
773	S	97.2	Very high	97.5	Very high	60 Å²	60	58.9 Å²	58.9	42%	0.42	30%	0.303	S	S	.	.	H	α-helix	trans	-64.4	-33.1	-177.9	-177.7	0	0	0	0	112.8	T771 Q776 V777	T771-S773 PolarHBondContact O-N 3.12Å; T771-S773 VanDerWaalsContact O-N 3.16Å; S773-Q776 PolarHBondContact O-N 3.45Å; S773-V777 WeakPolarHBondContact O-CB 3.48Å; S773-V777 VanDerWaalsContact O-CG2 3.27Å; S773-V777 WeakPolarHBondContact O-CG2 3.37Å; S773-V777 PolarHBondContact O-N 3.01Å
774	R	97	Very high	97.5	Very high	104 Å²	104	56.2 Å²	56.2	39%	0.392	30%	0.299	S	S	.	.	H	α-helix	trans	-70.3	-35.4	174	-63.8	-67.6	-173.6	166.3	8.7	111.2	T736 T771 E772 W778	T736-R774 WeakPolarHBondContact OG1-CD 3.31Å; T736-R774 PolarHBondContact OG1-NE 3.31Å; T736-R774 PolarHBondContact OG1-NH1 3.27Å; T736-R774 VanDerWaalsContact OG1-NH1 3.17Å; T771-R774 PolarHBondContact O-N 3.22Å; T771-R774 WeakPolarHBondContact OG1-CG 3.47Å; E772-R774 VanDerWaalsContact C-N 3.31Å; E772-R774 PolarHBondContact O-N 2.89Å; R774-W778 WeakPolarHBondContact O-CB 3.11Å; R774-W778 PolarHBondContact O-N 3Å
775	V	98.1	Very high	97.3	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-66.1	-48.9	171.1	178	0	0	0	0	110.4	L746 R761 L764 A765 I768 L770 T771 E772 V777 W778 F779	L746-V775 HydrophobicContact CD2-CG1 3.98Å; L746-V775 HydrophobicContact CD2-CG2 4.29Å; R761-V775 HydrophobicContact CB-CG1 4.27Å; R761-V775 HydrophobicContact CG-CG1 4.35Å; L764-V775 HydrophobicContact CD2-CG1 4.01Å; L764-V775 HydrophobicContact CG-CG1 4.47Å; A765-V775 HydrophobicContact CB-CG2 3.73Å; I768-V775 HydrophobicContact CD1-CG2 4.37Å; L770-V775 HydrophobicContact CB-CG2 4.24Å; L770-V775 HydrophobicContact CD1-CG2 4.4Å; T771-V775 PolarHBondContact O-N 3.32Å; E772-V775 CarbonylContact O-C 3.53Å; E772-V775 WeakPolarHBondContact O-CA 3.25Å; E772-V775 WeakPolarHBondContact O-CB 3.46Å; E772-V775 PolarHBondContact O-N 3.45Å; V775-V777 PolarHBondContact O-N 2.85Å; V775-W778 WeakPolarHBondContact O-CB 3.48Å; V775-W778 PolarHBondContact O-N 3.08Å; V775-W778 VanDerWaalsContact O-N 3.12Å; V775-F779 HydrophobicContact CG1-CD2 3.72Å; V775-F779 HydrophobicContact CG1-CE2 3.81Å; V775-F779 WeakPolarHBondContact O-CD2 3.37Å; V775-F779 PolarHBondContact O-N 3.31Å
776	Q	97.8	Very high	97.1	Very high	68 Å²	68	67.1 Å²	67.1	32%	0.318	34%	0.343	S	S	.	.	H	α-helix	trans	-53.9	-49.8	176.7	-168.6	-159.1	47.5	0	0	111.8	E772 S773 F779 Q780	E772-Q776 WeakPolarHBondContact O-CB 3.33Å; E772-Q776 PolarHBondContact O-N 3.11Å; S773-Q776 PolarHBondContact O-N 3.45Å; Q776-F779 PolarHBondContact O-N 2.83Å; Q776-Q780 WeakPolarHBondContact O-CG 3.49Å; Q776-Q780 PolarHBondContact O-N 3.29Å
777	V	97.5	Very high	96.8	Very high	60 Å²	60	67.6 Å²	67.6	36%	0.364	34%	0.339	S	S	.	.	H	α-helix	trans	-66	-37.8	176.9	169.7	0	0	0	0	111.8	S773 V775 N781	S773-V777 WeakPolarHBondContact O-CB 3.48Å; S773-V777 VanDerWaalsContact O-CG2 3.27Å; S773-V777 WeakPolarHBondContact O-CG2 3.37Å; S773-V777 PolarHBondContact O-N 3.01Å; V775-V777 PolarHBondContact O-N 2.85Å; V777-N781 WeakPolarHBondContact O-CB 3.46Å; V777-N781 PolarHBondContact O-N 3.22Å; V777-N781 PolarHBondContact O-ND2 2.95Å
778	W	98.1	Very high	96.2	Very high	22 Å²	22	69.7 Å²	69.7	8%	0.083	35%	0.351	C	S	.	.	H	α-helix	trans	-61.7	-46	173.3	-175.6	103.3	0	0	0	111.1	F738 L746 E747 F750 R774 V775 Q780 N781 R782	F738-W778 AromaticContact CD2-CD1 3.97Å; F738-W778 AromaticContact CE2-CD1 3.66Å; F738-W778 HydrophobicContact CZ-CB 4.32Å; F738-W778 AromaticContact CZ-CD1 3.95Å; L746-W778 VanDerWaalsContact C-CH2 3.43Å; L746-W778 HydrophobicContact CB-CD2 3.86Å; L746-W778 HydrophobicContact CB-CE3 3.89Å; L746-W778 HydrophobicContact CB-CH2 3.67Å; L746-W778 HydrophobicContact CB-CZ2 3.6Å; L746-W778 HydrophobicContact CB-CZ3 3.81Å; L746-W778 HydrophobicContact CD1-CD2 3.98Å; L746-W778 HydrophobicContact CD1-CG 3.87Å; L746-W778 HydrophobicContact CD2-CD2 4.12Å; L746-W778 HydrophobicContact CD2-CE3 4Å; L746-W778 HydrophobicContact CD2-CG 4.38Å; L746-W778 HydrophobicContact CG-CD2 4.21Å; L746-W778 HydrophobicContact CG-CE3 4.39Å; L746-W778 WeakPolarHBondContact O-CH2 3.45Å; L746-W778 WeakPolarHBondContact O-CZ3 3.4Å; E747-W778 HydrophobicContact CG-CH2 4.09Å; E747-W778 HydrophobicContact CG-CZ2 3.94Å; F750-W778 HydrophobicContact CB-CH2 4.01Å; F750-W778 HydrophobicContact CB-CZ3 3.94Å; F750-W778 HydrophobicContact CD2-CZ3 4.05Å; F750-W778 HydrophobicContact CG-CH2 4.38Å; F750-W778 HydrophobicContact CG-CZ3 4.25Å; R774-W778 WeakPolarHBondContact O-CB 3.11Å; R774-W778 PolarHBondContact O-N 3Å; V775-W778 WeakPolarHBondContact O-CB 3.48Å; V775-W778 PolarHBondContact O-N 3.08Å; V775-W778 VanDerWaalsContact O-N 3.12Å; W778-Q780 PolarHBondContact O-N 3.26Å; W778-N781 PolarHBondContact O-N 2.72Å; W778-R782 HydrophobicContact CD2-CB 4.4Å; W778-R782 HydrophobicContact CE3-CB 3.97Å; W778-R782 HydrophobicContact CH2-CB 3.86Å; W778-R782 HydrophobicContact CH2-CG 3.5Å; W778-R782 VanDerWaalsContact CH2-CG 3.5Å; W778-R782 HydrophobicContact CZ2-CB 4.31Å; W778-R782 HydrophobicContact CZ2-CG 4.06Å; W778-R782 HydrophobicContact CZ3-CB 3.68Å; W778-R782 HydrophobicContact CZ3-CG 3.76Å; W778-R782 WeakPolarHBondContact O-CB 3.28Å; W778-R782 PolarHBondContact O-N 3.49Å
779	F	98.4	Very high	95.2	Very high	1 Å²	1	77.7 Å²	77.7	0%	0.004	38%	0.38	C	S	.	.	H	α-helix	trans	-64.8	-40	178.9	-93.1	-94	0	0	0	112.8	L746 A749 F750 T753 P756 L764 V775 Q776 R782 R783	L746-F779 HydrophobicContact CD2-CD2 4.41Å; L746-F779 HydrophobicContact CD2-CE2 3.98Å; A749-F779 HydrophobicContact CB-CZ 3.91Å; F750-F779 HydrophobicContact CB-CE1 4.06Å; F750-F779 HydrophobicContact CB-CZ 4.39Å; F750-F779 AromaticContact CD2-CD1 3.75Å; F750-F779 HydrophobicContact CD2-CD1 3.75Å; F750-F779 AromaticContact CD2-CE1 3.81Å; F750-F779 HydrophobicContact CD2-CE1 3.81Å; F750-F779 HydrophobicContact CE2-CD1 4.45Å; F750-F779 HydrophobicContact CG-CE1 4.42Å; T753-F779 WeakPolarHBondContact O-CE1 3.47Å; P756-F779 HydrophobicContact CB-CE1 4.3Å; P756-F779 HydrophobicContact CB-CZ 4.42Å; P756-F779 HydrophobicContact CG-CB 4.36Å; P756-F779 HydrophobicContact CG-CD1 3.46Å; P756-F779 VanDerWaalsContact CG-CD1 3.46Å; P756-F779 HydrophobicContact CG-CD2 4.01Å; P756-F779 HydrophobicContact CG-CE1 3.58Å; P756-F779 HydrophobicContact CG-CE2 4.14Å; P756-F779 HydrophobicContact CG-CG 3.68Å; P756-F779 HydrophobicContact CG-CZ 3.93Å; L764-F779 HydrophobicContact CD2-CE2 3.77Å; L764-F779 HydrophobicContact CD2-CZ 4.17Å; V775-F779 HydrophobicContact CG1-CD2 3.72Å; V775-F779 HydrophobicContact CG1-CE2 3.81Å; V775-F779 WeakPolarHBondContact O-CD2 3.37Å; V775-F779 PolarHBondContact O-N 3.31Å; Q776-F779 PolarHBondContact O-N 2.83Å; F779-R782 PolarHBondContact O-N 3.39Å; F779-R783 WeakPolarHBondContact O-CB 3.35Å; F779-R783 WeakPolarHBondContact O-CG 3.33Å; F779-R783 PolarHBondContact O-N 2.66Å
780	Q	97.6	Very high	93.6	Very high	91 Å²	91	82.6 Å²	82.6	43%	0.425	38%	0.383	S	S	.	.	H	α-helix	trans	-57.4	-49.3	171.1	-72.4	170.7	4.7	0	0	111.2	Q776 W778 R782 R783 A784	Q776-Q780 WeakPolarHBondContact O-CG 3.49Å; Q776-Q780 PolarHBondContact O-N 3.29Å; W778-Q780 PolarHBondContact O-N 3.26Å; Q780-R782 PolarHBondContact O-N 3.39Å; Q780-R783 PolarHBondContact O-N 3.29Å; Q780-A784 WeakPolarHBondContact O-CB 3.43Å; Q780-A784 PolarHBondContact O-N 3.13Å
781	N	97.7	Very high	92	Very high	95 Å²	95	88.3 Å²	88.3	51%	0.508	41%	0.407	S	S	.	.	H	α-helix	trans	-63.9	-37.4	177.5	-81.1	-76.1	0	0	0	112.7	V777 W778 A784 K785	V777-N781 WeakPolarHBondContact O-CB 3.46Å; V777-N781 PolarHBondContact O-N 3.22Å; V777-N781 PolarHBondContact O-ND2 2.95Å; W778-N781 PolarHBondContact O-N 2.72Å; N781-A784 PolarHBondContact O-N 3.35Å; N781-K785 WeakPolarHBondContact O-CG 3.37Å; N781-K785 PolarHBondContact O-N 2.93Å
782	R	97.7	Very high	90	Very high	48 Å²	48	85.9 Å²	85.9	18%	0.181	39%	0.394	C	S	.	.	H	α-helix	trans	-71.1	-39.6	178.5	-164.9	64.8	169.6	65.7	-4.8	112	E747 F750 W778 F779 Q780 K785 W786	E747-R782 IonicContact OE1-CZ 3.14Å; E747-R782 IonicContact OE1-NE 3.95Å; E747-R782 PolarHBondContact OE1-NE 3.27Å; E747-R782 IonicContact OE1-NH2 2.69Å; E747-R782 PolarHBondContact OE1-NH2 3.25Å; E747-R782 IonicContact OE2-CZ 2.72Å; E747-R782 IonicContact OE2-NH2 3.19Å; E747-R782 PolarHBondContact OE2-NH2 3.28Å; F750-R782 HydrophobicContact CD1-CG 3.8Å; F750-R782 HydrophobicContact CD2-CB 3.82Å; F750-R782 HydrophobicContact CD2-CG 3.49Å; F750-R782 VanDerWaalsContact CD2-CG 3.49Å; F750-R782 HydrophobicContact CE1-CG 3.77Å; F750-R782 VanDerWaalsContact CE1-NH1 3.33Å; F750-R782 HydrophobicContact CE2-CB 3.63Å; F750-R782 HydrophobicContact CE2-CG 3.45Å; F750-R782 VanDerWaalsContact CE2-CG 3.45Å; F750-R782 HydrophobicContact CG-CB 4.48Å; F750-R782 HydrophobicContact CG-CG 3.68Å; F750-R782 HydrophobicContact CZ-CB 4.14Å; F750-R782 HydrophobicContact CZ-CG 3.6Å; W778-R782 HydrophobicContact CD2-CB 4.4Å; W778-R782 HydrophobicContact CE3-CB 3.97Å; W778-R782 HydrophobicContact CH2-CB 3.86Å; W778-R782 HydrophobicContact CH2-CG 3.5Å; W778-R782 VanDerWaalsContact CH2-CG 3.5Å; W778-R782 HydrophobicContact CZ2-CB 4.31Å; W778-R782 HydrophobicContact CZ2-CG 4.06Å; W778-R782 HydrophobicContact CZ3-CB 3.68Å; W778-R782 HydrophobicContact CZ3-CG 3.76Å; W778-R782 WeakPolarHBondContact O-CB 3.28Å; W778-R782 PolarHBondContact O-N 3.49Å; F779-R782 PolarHBondContact O-N 3.39Å; Q780-R782 PolarHBondContact O-N 3.39Å; R782-K785 PolarHBondContact O-N 3.31Å; R782-W786 WeakPolarHBondContact O-CB 3.49Å; R782-W786 PolarHBondContact O-N 3.38Å
783	R	97.5	Very high	87.9	Confident	58 Å²	58	87.6 Å²	87.6	22%	0.219	42%	0.424	C	S	.	.	H	α-helix	trans	-61.1	-42.1	168.9	-76.1	-164.3	-65.4	-88.9	5	112	F750 H754 F779 Q780 K785 W786 K787	F750-R783 HydrophobicContact CE2-CG 3.89Å; F750-R783 HydrophobicContact CZ-CG 4.4Å; H754-R783 HydrophobicContact CB-CG 4.35Å; H754-R783 VanDerWaalsContact O-CD 3.25Å; H754-R783 WeakPolarHBondContact O-CD 3.43Å; H754-R783 WeakPolarHBondContact O-CG 3.4Å; H754-R783 PolarHBondContact O-NH1 2.94Å; F779-R783 WeakPolarHBondContact O-CB 3.35Å; F779-R783 WeakPolarHBondContact O-CG 3.33Å; F779-R783 PolarHBondContact O-N 2.66Å; Q780-R783 PolarHBondContact O-N 3.29Å; R783-K785 PolarHBondContact O-N 2.91Å; R783-W786 PolarHBondContact O-N 3.37Å; R783-K787 PolarHBondContact O-N 2.86Å
784	A	96.6	Very high	85.9	Confident	49 Å²	49	89.9 Å²	89.9	41%	0.405	44%	0.435	S	S	.	.	H	α-helix	trans	-62	-42.8	177.1	0	0	0	0	0	112.3	Q780 N781 K788	Q780-A784 WeakPolarHBondContact O-CB 3.43Å; Q780-A784 PolarHBondContact O-N 3.13Å; N781-A784 PolarHBondContact O-N 3.35Å; A784-K788 PolarHBondContact O-N 3.44Å
785	K	94.5	Very high	83.4	Confident	145 Å²	145	91 Å²	91	63%	0.63	46%	0.456	S	S	*	.	H	α-helix	trans	-63.2	-41.3	172.2	-72.9	179.9	177.7	-176.4	0	112.6	N781 R782 R783	N781-K785 WeakPolarHBondContact O-CG 3.37Å; N781-K785 PolarHBondContact O-N 2.93Å; R782-K785 PolarHBondContact O-N 3.31Å; R783-K785 PolarHBondContact O-N 2.91Å
786	W	93.6	Very high	80.9	Confident	89 Å²	89	98.6 Å²	98.6	34%	0.337	49%	0.489	S	S	.	.	H	α-helix	trans	-64	-47	177.7	179.8	88.7	0	0	0	112	F750 H754 R782 R783 K788 R789	F750-W786 HydrophobicContact CE1-CB 4.33Å; F750-W786 HydrophobicContact CE1-CG 4.39Å; F750-W786 HydrophobicContact CZ-CB 3.96Å; F750-W786 HydrophobicContact CZ-CG 4.25Å; H754-W786 AromaticContact CE1-CE2 3.65Å; H754-W786 AromaticContact CE1-CZ2 3.64Å; H754-W786 AromaticContact CE1-NE1 3.66Å; H754-W786 AromaticContact ND1-CZ2 3.89Å; H754-W786 AromaticContact NE2-NE1 3.67Å; R782-W786 WeakPolarHBondContact O-CB 3.49Å; R782-W786 PolarHBondContact O-N 3.38Å; R783-W786 PolarHBondContact O-N 3.37Å; W786-K788 VanDerWaalsContact C-N 3.31Å; W786-K788 PolarHBondContact O-N 3.32Å; W786-R789 PolarHBondContact O-N 3.22Å; W786-R789 VanDerWaalsContact O-N 3.13Å
787	K	91.8	Very high	78.4	Confident	161 Å²	161	106 Å²	106	70%	0.7	51%	0.514	S	S	*	.	H	α-helix	trans	-57.4	-41.6	177.5	-170.8	168.8	79.9	162	0	112	R783 R789 K790	R783-K787 PolarHBondContact O-N 2.86Å; K787-R789 VanDerWaalsContact C-N 3.29Å; K787-R789 PolarHBondContact O-N 3.46Å; K787-K790 PolarHBondContact O-N 3.42Å
788	K	84.2	Confident	76.2	Confident	168 Å²	168	110 Å²	110	73%	0.73	53%	0.531	S	S	*	.	H	α-helix	trans	-59.9	-34.8	178.7	-74.8	-172.1	175.9	-168.2	0	113.3	A784 W786 K790 K791	A784-K788 PolarHBondContact O-N 3.44Å; W786-K788 VanDerWaalsContact C-N 3.31Å; W786-K788 PolarHBondContact O-N 3.32Å; K788-K790 VanDerWaalsContact C-N 3.28Å; K788-K790 PolarHBondContact O-N 2.86Å; K788-K791 PolarHBondContact O-N 3.44Å
789	R	75.4	Confident	73.5	Confident	186 Å²	186	115.1 Å²	115.1	70%	0.702	56%	0.564	S	S	*	*	H	α-helix	trans	-66.9	-20.7	-179.7	-70.8	-173.7	175.8	-174.3	-1.3	114.5	W786 K787	W786-R789 PolarHBondContact O-N 3.22Å; W786-R789 VanDerWaalsContact O-N 3.13Å; K787-R789 VanDerWaalsContact C-N 3.29Å; K787-R789 PolarHBondContact O-N 3.46Å
790	K	63.3	Low	71	Confident	165 Å²	165	120.9 Å²	120.9	72%	0.717	59%	0.594	S	S	*	*	H	α-helix	trans	-85.9	-16.6	178.7	-73.7	-162	175.3	-166.4	0	114.7	K787 K788	K787-K790 PolarHBondContact O-N 3.42Å; K788-K790 VanDerWaalsContact C-N 3.28Å; K788-K790 PolarHBondContact O-N 2.86Å
791	K	62.4	Low	68	Low	149 Å²	149	123 Å²	123	65%	0.648	61%	0.608	S	S	*	*	H	α-helix	trans	-96.6	-19.7	-178.6	-161.6	89.3	173.4	-166.2	0	112.7	K788 G793 S908	K788-K791 PolarHBondContact O-N 3.44Å; K791-G793 PolarHBondContact O-N 3.04Å; K791-S908 VanDerWaalsContact CE-OG 3.26Å; K791-S908 WeakPolarHBondContact CE-OG 3.33Å; K791-S908 PolarHBondContact NZ-OG 3.06Å
792	S	56.1	Low	65.2	Low	40 Å²	40	121.2 Å²	121.2	28%	0.28	60%	0.603	S	S	.	*			trans	-88.3	79.8	175.8	60.3	0	0	0	0	111.7	T794	S792-T794 CarbonylContact C-O 3.43Å; S792-T794 VanDerWaalsContact O-O 3.13Å
793	G	53.3	Low	62.3	Low	81 Å²	81	126.6 Å²	126.6	84%	0.835	64%	0.636	S	S	*	*			trans	-71	-20.3	166	0	0	0	0	0	112.8	K791	K791-G793 PolarHBondContact O-N 3.04Å
794	T	55.2	Low	59.5	Low	108 Å²	108	128.7 Å²	128.7	66%	0.663	66%	0.659	S	S	*	*	S	Bend	trans	-72	137.5	159.8	48.5	0	0	0	0	109.4	S792 F796	S792-T794 CarbonylContact C-O 3.43Å; S792-T794 VanDerWaalsContact O-O 3.13Å; T794-F796 PolarHBondContact O-N 3.38Å
795	P	45.6	Very low	56.6	Low	126 Å²	126	132.2 Å²	132.2	82%	0.818	67%	0.671	S	S	*	*			trans	-63.7	105.7	177.3	26	-33.3	0	0	0	109	R797	P795-R797 VanDerWaalsContact C-N 3.29Å; P795-R797 PolarHBondContact O-N 2.84Å
796	F	45.3	Very low	53.9	Low	161 Å²	161	132 Å²	132	71%	0.706	68%	0.682	S	S	*	*			trans	-66.9	93.1	178.3	-165.3	-82.4	0	0	0	108.4	T794 M798	T794-F796 PolarHBondContact O-N 3.38Å; F796-M798 PolarHBondContact O-N 2.83Å
797	R	44.3	Very low	51.3	Low	224 Å²	224	136.7 Å²	136.7	85%	0.845	70%	0.704	S	S	*	*			trans	-52.6	109.4	179.6	-169.1	-177.4	-166.4	-166.5	5.3	107.4	P795 T799	P795-R797 VanDerWaalsContact C-N 3.29Å; P795-R797 PolarHBondContact O-N 2.84Å; R797-T799 PolarHBondContact O-N 3.5Å
798	M	50.7	Low	48.5	Very low	143 Å²	143	136.6 Å²	136.6	70%	0.704	71%	0.712	S	S	*	*			trans	-60.5	102.8	172.4	-71.6	-96.9	-147.2	0	0	107	F796 I800	F796-M798 PolarHBondContact O-N 2.83Å; M798-I800 HydrophobicContact CB-CG1 4.36Å; M798-I800 PolarHBondContact O-N 3.33Å
799	T	42.8	Very low	46.4	Very low	129 Å²	129	135.3 Å²	135.3	79%	0.791	72%	0.718	S	S	*	*			trans	-67.8	73.1	153.2	27.6	0	0	0	0	108	R797	R797-T799 PolarHBondContact O-N 3.5Å
800	I	44.5	Very low	44.3	Very low	123 Å²	123	132 Å²	132	63%	0.631	72%	0.723	S	S	*	*			trans	-44.7	141.2	134.8	-60.5	174.9	0	0	0	106	M798 S802	M798-I800 HydrophobicContact CB-CG1 4.36Å; M798-I800 PolarHBondContact O-N 3.33Å; I800-S802 PolarHBondContact O-N 3.49Å; I800-S802 PolarHBondContact O-OG 3.39Å
801	N	36.3	Very low	43.1	Very low	134 Å²	134	131.6 Å²	131.6	72%	0.717	73%	0.728	S	S	*	*			trans	-75.9	56.9	-178.1	-159	26.5	0	0	0	111.1	N803 S804	N801-N803 PolarHBondContact O-N 3.2Å; N801-S804 PolarHBondContact O-N 3.06Å
802	S	37.4	Very low	41.7	Very low	59 Å²	59	129.8 Å²	129.8	41%	0.413	73%	0.73	S	S	.	*	G	3₁₀ helix	trans	-70.3	14.5	-171.8	-54.6	0	0	0	0	114.3	I800 S804 L805	I800-S802 PolarHBondContact O-N 3.49Å; I800-S802 PolarHBondContact O-OG 3.39Å; S802-S804 PolarHBondContact O-N 2.99Å; S802-L805 PolarHBondContact O-N 2.82Å
803	N	36.9	Very low	40.8	Very low	160 Å²	160	134.5 Å²	134.5	86%	0.856	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-75.2	1.5	163.9	-71.2	7	0	0	0	112.2	N801	N801-N803 PolarHBondContact O-N 3.2Å
804	S	39.8	Very low	40.1	Very low	103 Å²	103	137.2 Å²	137.2	72%	0.72	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-103.3	6.9	165.8	78.4	0	0	0	0	114.2	N801 S802	N801-S804 PolarHBondContact O-N 3.06Å; S802-S804 PolarHBondContact O-N 2.99Å
805	L	34.8	Very low	39.1	Very low	123 Å²	123	139.5 Å²	139.5	64%	0.644	76%	0.76	S	S	*	*	S	Bend	trans	-115.5	161.5	164.4	-95.7	73.1	0	0	0	108.6	S802	S802-L805 PolarHBondContact O-N 2.82Å
806	T	38.2	Very low	38.7	Very low	141 Å²	141	138.7 Å²	138.7	87%	0.865	76%	0.758	S	S	*	*	S	Bend	trans	65.8	28.8	-178.8	70.6	0	0	0	0	117.4
807	K	38.2	Very low	38.4	Very low	186 Å²	186	139.7 Å²	139.7	81%	0.809	77%	0.767	S	S	*	*	S	Bend	trans	-121.9	152.7	137.1	-69	-172.3	178.6	-177.3	0	107.9
808	N	34.6	Very low	38	Very low	159 Å²	159	137.8 Å²	137.8	85%	0.85	77%	0.765	S	S	*	*	S	Bend	trans	73.8	42.2	175.6	-50.2	-2.6	0	0	0	117.9
809	V	39.4	Very low	37.1	Very low	142 Å²	142	138.2 Å²	138.2	86%	0.861	77%	0.77	S	S	*	*			trans	-137.4	95.1	146.7	-175	0	0	0	0	109
810	S	31.8	Very low	36.8	Very low	116 Å²	116	139.9 Å²	139.9	81%	0.811	77%	0.772	S	S	*	*			trans	-156.9	66.9	175.8	-69.4	0	0	0	0	110.3
811	L	37.5	Very low	36.3	Very low	156 Å²	156	139 Å²	139	82%	0.817	77%	0.773	S	S	*	*			trans	-133.8	102.5	173.3	-70.5	176.1	0	0	0	105.9
812	T	33.2	Very low	36.1	Very low	112 Å²	112	140.5 Å²	140.5	69%	0.687	78%	0.781	S	S	*	*				103.4	98.7	64.9	46.8	0	0	0	0	110.9
813	T	37.1	Very low	35.9	Very low	138 Å²	138	141 Å²	141	85%	0.847	80%	0.795	S	S	*	*			trans	-153.2	83.3	155.2	13.4	0	0	0	0	111.4
814	N	38.2	Very low	35.9	Very low	138 Å²	138	140.5 Å²	140.5	74%	0.738	79%	0.792	S	S	*	*			trans	39.8	107.6	137.1	-53.5	-15.3	0	0	0	120.4
815	N	34.9	Very low	35.8	Very low	156 Å²	156	142.2 Å²	142.2	83%	0.834	79%	0.793	S	S	*	*				40.1	151.3	114.2	-67.8	-20	0	0	0	122.5
816	S	36.5	Very low	35.9	Very low	110 Å²	110	143.1 Å²	143.1	77%	0.769	80%	0.799	S	S	*	*			trans	83.9	136.9	175.1	-64.4	0	0	0	0	115.5
817	M	39	Very low	35.5	Very low	182 Å²	182	145.6 Å²	145.6	90%	0.897	79%	0.794	S	S	*	*			cis	-142.5	166.9	1.7	-126.5	-177.2	-61.6	0	0	112.3
818	K	36.5	Very low	35.3	Very low	184 Å²	184	142.4 Å²	142.4	80%	0.8	79%	0.786	S	S	*	*			trans	-96.9	165.8	178.2	-67	-177.3	175.7	-179.7	0	111.9
819	N	32.1	Very low	35.2	Very low	151 Å²	151	141.4 Å²	141.4	81%	0.807	78%	0.78	S	S	*	*			trans	72.6	160	167.9	-49.8	-17.9	0	0	0	112.6
820	I	36.8	Very low	34.8	Very low	165 Å²	165	143 Å²	143	85%	0.846	78%	0.782	S	S	*	*			cis	-131.6	167	27.3	-70.3	168.9	0	0	0	112.3
821	T	33.1	Very low	34.8	Very low	104 Å²	104	141.5 Å²	141.5	64%	0.638	78%	0.777	S	S	*	*			trans	-99.4	160.6	-169.6	51.7	0	0	0	0	115.6
822	N	32.5	Very low	34.5	Very low	165 Å²	165	139.3 Å²	139.3	88%	0.882	77%	0.774	S	S	*	*			trans	72	152.4	157.5	-53.8	-16.4	0	0	0	118.4
823	G	32.8	Very low	34.3	Very low	69 Å²	69	138.7 Å²	138.7	71%	0.711	78%	0.775	S	S	*	*			trans	143.2	65.7	164.6	0	0	0	0	0	118.1
824	D	37.4	Very low	34	Very low	151 Å²	151	139.5 Å²	139.5	81%	0.807	77%	0.774	S	S	*	*			trans	32.1	124.7	148.2	-56.7	-52.9	0	0	0	124.6
825	N	37.7	Very low	33.7	Very low	138 Å²	138	140 Å²	140	74%	0.738	78%	0.777	S	S	*	*			trans	-22.8	140	150.1	-44.3	-76.6	0	0	0	118.3
826	N	36	Very low	33.5	Very low	143 Å²	143	141.6 Å²	141.6	77%	0.765	78%	0.777	S	S	*	*				-167.7	119.4	105.7	-119.5	-6	0	0	0	116.6
827	Y	30.2	Very low	33.4	Very low	193 Å²	193	142.4 Å²	142.4	76%	0.757	77%	0.772	S	S	*	*			trans	45.2	133.3	133.6	-82.4	-111.6	0	0	0	124.5
828	N	34.7	Very low	33	Very low	119 Å²	119	140 Å²	140	64%	0.636	77%	0.77	S	S	*	*			trans	85.6	101.3	141.2	-70.4	-13.3	0	0	0	122.6
829	N	31.9	Very low	32.6	Very low	138 Å²	138	140.3 Å²	140.3	74%	0.738	77%	0.768	S	S	*	*				49.4	121.1	114.9	-53.5	-19	0	0	0	120.4
830	I	30.9	Very low	32.6	Very low	174 Å²	174	139.3 Å²	139.3	89%	0.892	76%	0.761	S	S	*	*				-164.1	154.7	99.4	-95.9	156.6	0	0	0	110.1
831	A	31.1	Very low	32.3	Very low	85 Å²	85	139.3 Å²	139.3	70%	0.702	76%	0.757	S	S	*	*			trans	-67.8	148.3	-165.6	0	0	0	0	0	116.3
832	S	31.6	Very low	32.3	Very low	110 Å²	110	142.2 Å²	142.2	77%	0.769	76%	0.764	S	S	*	*				-179.2	147.5	108.2	-76.7	0	0	0	0	115
833	S	30.3	Very low	32.2	Very low	99 Å²	99	141.3 Å²	141.3	69%	0.692	76%	0.758	S	S	*	*			trans	54.6	104.6	156	57.7	0	0	0	0	121.8
834	N	30.2	Very low	32.3	Very low	155 Å²	155	144.2 Å²	144.2	83%	0.829	76%	0.762	S	S	*	*				65.1	85.5	125.4	-55.6	-3.4	0	0	0	120.5
835	N	32.3	Very low	32.2	Very low	150 Å²	150	142.1 Å²	142.1	80%	0.802	76%	0.756	S	S	*	*			trans	-161.2	171.5	143.7	-127.4	-43.4	0	0	0	112.8
836	F	31	Very low	31.9	Very low	189 Å²	189	141.6 Å²	141.6	83%	0.829	76%	0.758	S	S	*	*			trans	82.5	131.8	167.7	-60.7	-75.1	0	0	0	122.2
837	N	33.2	Very low	31.7	Very low	127 Å²	127	138.6 Å²	138.6	68%	0.679	75%	0.753	S	S	*	*			trans	66.2	129.8	137.7	-162	26.2	0	0	0	121.6	Y839	N837-Y839 PolarHBondContact OD1-N 2.68Å; N837-Y839 VanDerWaalsContact OD1-N 3.17Å
838	P	31	Very low	31.8	Very low	131 Å²	131	137.8 Å²	137.8	85%	0.851	76%	0.756	S	S	*	*			trans	-122.3	76.3	155.1	38	-24.7	0	0	0	112.5
839	Y	28.5	Very low	31.6	Very low	190 Å²	190	137.6 Å²	137.6	75%	0.745	76%	0.76	S	S	*	*			trans	-129.5	110.3	163.2	-148.8	-99.5	0	0	0	109.3	N837	N837-Y839 PolarHBondContact OD1-N 2.68Å; N837-Y839 VanDerWaalsContact OD1-N 3.17Å
840	I	31.9	Very low	31.7	Very low	130 Å²	130	142 Å²	142	67%	0.667	77%	0.766	S	S	*	*	S	Bend	trans	76.4	134	174	-55.6	-62.9	0	0	0	117.5
841	Q	30.6	Very low	31.8	Very low	166 Å²	166	138.9 Å²	138.9	78%	0.776	76%	0.76	S	S	*	*			trans	79.5	99.5	164.5	-80.5	171	90.8	0	0	122.2
842	Q	31.7	Very low	31.9	Very low	164 Å²	164	141.6 Å²	141.6	77%	0.766	76%	0.762	S	S	*	*				64	126.1	127.8	-79.2	176.3	-31.2	0	0	124.4
843	L	30.4	Very low	31.9	Very low	146 Å²	146	143.6 Å²	143.6	76%	0.764	76%	0.763	S	S	*	*			trans	77.9	82.8	143.1	-61.2	165.8	0	0	0	121.7
844	V	35.1	Very low	32	Very low	131 Å²	131	142.1 Å²	142.1	79%	0.794	76%	0.764	S	S	*	*				46.1	134.4	108.4	173.8	0	0	0	0	119.3
845	P	35.3	Very low	32.2	Very low	106 Å²	106	142.9 Å²	142.9	69%	0.688	77%	0.767	S	S	*	*			cis	-141.3	-174.7	-15.2	34.2	-11.4	0	0	0	117.5
846	T	32	Very low	32.2	Very low	128 Å²	128	142.8 Å²	142.8	79%	0.785	77%	0.767	S	S	*	*			trans	105.7	128	141.8	-11.1	0	0	0	0	122.2
847	A	32.6	Very low	32.2	Very low	79 Å²	79	139 Å²	139	65%	0.653	76%	0.762	S	S	*	*			trans	68.3	106.3	146.3	0	0	0	0	0	124.4
848	Q	31.8	Very low	32.2	Very low	176 Å²	176	137.8 Å²	137.8	82%	0.822	76%	0.764	S	S	*	*				85.2	125.9	121.3	-68.4	-173.4	4.6	0	0	124
849	T	31.1	Very low	32.3	Very low	115 Å²	115	141.5 Å²	141.5	71%	0.706	76%	0.761	S	S	*	*			trans	84.3	112	143.5	50.5	0	0	0	0	124
850	R	33.1	Very low	32.7	Very low	232 Å²	232	140.6 Å²	140.6	88%	0.875	77%	0.768	S	S	*	*			trans	68.2	99.1	130.4	-63.2	-177.1	-178.4	-161.8	1.3	121.9
851	S	32.8	Very low	32.7	Very low	108 Å²	108	139.7 Å²	139.7	76%	0.755	76%	0.764	S	S	*	*				77.9	128.2	108	-154	0	0	0	0	123
852	L	33	Very low	33	Very low	142 Å²	142	139.4 Å²	139.4	74%	0.743	77%	0.767	S	S	*	*			trans	110.4	110.9	135.8	-137.2	72.4	0	0	0	120.4
853	D	31.5	Very low	33	Very low	151 Å²	151	138.4 Å²	138.4	81%	0.807	77%	0.766	S	S	*	*			trans	45.6	134.8	143.8	-56.4	-5.3	0	0	0	124.8
854	G	33.1	Very low	33.3	Very low	68 Å²	68	137.1 Å²	137.1	70%	0.701	77%	0.767	S	S	*	*				149.3	102.4	128.4	0	0	0	0	0	119.6
855	L	34	Very low	33.1	Very low	172 Å²	172	136.6 Å²	136.6	90%	0.901	76%	0.764	S	S	*	*				137.5	125.4	123.9	-70.7	170.9	0	0	0	119
856	N	33.2	Very low	33	Very low	148 Å²	148	138.4 Å²	138.4	79%	0.791	77%	0.768	S	S	*	*			trans	-27.9	168.6	152.3	-76.8	-15.6	0	0	0	118.6
857	C	30.4	Very low	33	Very low	109 Å²	109	136.3 Å²	136.3	74%	0.736	76%	0.758	S	S	*	*			cis	-165.7	-173.2	6.9	-120.1	0	0	0	0	109.5
858	S	33.9	Very low	32.8	Very low	101 Å²	101	141.2 Å²	141.2	71%	0.706	77%	0.765	S	S	*	*			cis	-166.4	160	-6.6	40.6	0	0	0	0	112.7
859	R	32.9	Very low	32.8	Very low	209 Å²	209	139.9 Å²	139.9	79%	0.789	76%	0.763	S	S	*	*			trans	0.7	151.8	149.9	-75.3	-174.3	165.7	119	0.1	123.3
860	L	36.5	Very low	32.7	Very low	171 Å²	171	141.4 Å²	141.4	90%	0.895	77%	0.766	S	S	*	*				-150.5	164.3	115.2	-105	172.5	0	0	0	111.2
861	D	31.9	Very low	32.6	Very low	111 Å²	111	139 Å²	139	59%	0.594	77%	0.765	S	S	*	*			trans	-125.3	172.9	-161.2	-55.3	-89.7	0	0	0	114.1
862	I	36.8	Very low	32.2	Very low	161 Å²	161	138.9 Å²	138.9	83%	0.826	76%	0.764	S	S	*	*				160.1	133.2	127.6	-80	161.9	0	0	0	115.6
863	N	32.4	Very low	32.4	Very low	142 Å²	142	137.4 Å²	137.4	76%	0.759	76%	0.763	S	S	*	*			trans	-5.7	150.2	168.1	-66.3	-20.3	0	0	0	125.4
864	P	35.8	Very low	32.2	Very low	119 Å²	119	136.8 Å²	136.8	77%	0.773	77%	0.765	S	S	*	*			trans	-103.5	157.5	149.7	39.4	-30.5	0	0	0	113.8
865	T	32.1	Very low	32	Very low	120 Å²	120	139.2 Å²	139.2	74%	0.736	77%	0.766	S	S	*	*			trans	-165.9	155	160.8	4.6	0	0	0	0	111.9
866	N	32.4	Very low	31.7	Very low	145 Å²	145	137.3 Å²	137.3	78%	0.775	75%	0.748	S	S	*	*			trans	67.7	151.3	160.3	-62	-7.3	0	0	0	117.1
867	S	31.5	Very low	31.5	Very low	83 Å²	83	137.8 Å²	137.8	58%	0.58	74%	0.743	S	S	*	*			cis	-167.7	154.6	-13.1	-105.7	0	0	0	0	112.9
868	F	29.6	Very low	31.4	Very low	182 Å²	182	136 Å²	136	80%	0.798	74%	0.744	S	S	*	*			trans	60.8	139.3	141.8	-83.3	-62.8	0	0	0	124.3
869	L	32	Very low	31.2	Very low	148 Å²	148	137.5 Å²	137.5	78%	0.775	74%	0.743	S	S	*	*			trans	65.6	153.7	155.4	-61	165.7	0	0	0	115.9
870	L	29	Very low	31.2	Very low	148 Å²	148	131.7 Å²	131.7	78%	0.775	74%	0.735	S	S	*	*			cis	150.8	172.6	-10.2	-150.2	82.6	0	0	0	103.6
871	Q	29.7	Very low	30.9	Very low	182 Å²	182	128.9 Å²	128.9	85%	0.85	73%	0.73	S	S	*	*			trans	73.9	99.5	165.2	-147.3	154.6	16.7	0	0	117.1
872	S	25.9	Very low	31	Very low	104 Å²	104	128.4 Å²	128.4	73%	0.727	74%	0.735	S	S	*	*			trans	-85.9	-175	157.6	53.1	0	0	0	0	110.1
873	P	37.1	Very low	30.6	Very low	111 Å²	111	127.7 Å²	127.7	72%	0.721	73%	0.733	S	S	*	*				-134.8	142.5	-53.3	34.2	-19.5	0	0	0	113.1
874	T	27.3	Very low	30.5	Very low	138 Å²	138	126.4 Å²	126.4	85%	0.847	73%	0.73	S	S	*	*			trans	-155.4	116.5	169	26.2	0	0	0	0	116.3
875	T	27.2	Very low	30.3	Very low	120 Å²	120	128.1 Å²	128.1	74%	0.736	73%	0.733	S	S	*	*				72.3	105	112.3	-51.7	0	0	0	0	122
876	Y	27.4	Very low	30	Very low	131 Å²	131	128.3 Å²	128.3	51%	0.514	74%	0.738	S	S	.	*				98.6	158.3	129	-123	-102.6	0	0	0	123.6	L310 S311	L310-Y876 PolarHBondContact O-OH 2.86Å; S311-Y876 VanDerWaalsContact CA-OH 3.28Å; S311-Y876 WeakPolarHBondContact CA-OH 3.37Å
877	F	29.5	Very low	30	Very low	159 Å²	159	127.1 Å²	127.1	70%	0.697	74%	0.738	S	S	*	*			trans	62.7	134.1	-179.3	-54.1	-75.3	0	0	0	116	A313	A313-F877 HydrophobicContact CB-CE1 4.24Å
878	G	29.2	Very low	29.7	Very low	72 Å²	72	130.4 Å²	130.4	74%	0.742	75%	0.748	S	S	*	*			cis	123.8	147.2	6.1	0	0	0	0	0	110.7
879	D	29.3	Very low	29.8	Very low	131 Å²	131	129.8 Å²	129.8	70%	0.701	75%	0.746	S	S	*	*			cis	-165.2	-176.2	-8.9	-155.7	-19.6	0	0	0	108.5
880	S	32	Very low	29.5	Very low	88 Å²	88	129.5 Å²	129.5	62%	0.615	74%	0.74	S	S	*	*			trans	71.3	114.5	166.3	-57.2	0	0	0	0	117.6
881	S	31	Very low	29.6	Very low	112 Å²	112	129.3 Å²	129.3	78%	0.783	74%	0.735	S	S	*	*				79.7	144	71.9	92.7	0	0	0	0	114.1
882	S	33.8	Very low	29.6	Very low	101 Å²	101	125.3 Å²	125.3	71%	0.706	73%	0.727	S	S	*	*			cis	-158.4	170.2	9.9	59.5	0	0	0	0	113.1
883	N	28.1	Very low	30	Very low	146 Å²	146	131.6 Å²	131.6	78%	0.781	74%	0.735	S	S	*	*			trans	-0.1	147.3	157.8	-50.4	-19.9	0	0	0	119.4
884	T	31.4	Very low	29.7	Very low	115 Å²	115	131.4 Å²	131.4	71%	0.706	74%	0.736	S	S	*	*				-167.8	148.1	58.6	46.9	0	0	0	0	116.1
885	N	30	Very low	30	Very low	155 Å²	155	130.1 Å²	130.1	83%	0.829	73%	0.733	S	S	*	*			trans	63	149.4	137.7	-57.5	-9.5	0	0	0	124.3
886	C	26	Very low	30.3	Very low	123 Å²	123	131 Å²	131	83%	0.831	74%	0.738	S	S	*	*			trans	-93.4	169.3	176.5	-44.9	0	0	0	0	112.4
887	P	32.9	Very low	30.3	Very low	121 Å²	121	136.3 Å²	136.3	79%	0.786	76%	0.757	S	S	*	*				-128.4	173.9	77.8	7.1	17.6	0	0	0	113.2
888	L	25.5	Very low	30.3	Very low	151 Å²	151	138.3 Å²	138.3	79%	0.791	77%	0.766	S	S	*	*			cis	88.9	150	37.2	-141.7	98.7	0	0	0	115
889	F	30.7	Very low	30.3	Very low	170 Å²	170	141.1 Å²	141.1	75%	0.746	77%	0.771	S	S	*	*			trans	72.7	155.7	-172.9	-67.8	-94	0	0	0	117.5
890	E	27.3	Very low	30.5	Very low	141 Å²	141	143.6 Å²	143.6	66%	0.659	78%	0.778	S	S	*	*			cis	-168.6	172.9	-49.5	-118.8	-165.5	-172.9	0	0	111.9
891	H	29.6	Very low	30.4	Very low	145 Å²	145	144.6 Å²	144.6	67%	0.671	79%	0.792	S	S	*	*			trans	3.5	133.8	164.3	-54.4	107.7	0	0	0	120.5
892	S	31.4	Very low	30.3	Very low	97 Å²	97	146.1 Å²	146.1	68%	0.678	79%	0.791	S	S	*	*				-179.4	144.5	71.7	-70.6	0	0	0	0	115.4
893	R	32.4	Very low	30.3	Very low	237 Å²	237	147.1 Å²	147.1	89%	0.894	80%	0.798	S	S	*	*			trans	50.5	143.4	134.3	-59.4	174.9	-171.7	-169.7	2.1	120.1
894	S	32.3	Very low	30.5	Very low	106 Å²	106	149.5 Å²	149.5	74%	0.741	80%	0.797	S	S	*	*			cis	-170.7	166.4	7.1	47.2	0	0	0	0	113.3
895	S	32.6	Very low	31.2	Very low	111 Å²	111	148 Å²	148	78%	0.776	79%	0.79	S	S	*	*			trans	71.5	147.5	161.7	-72.1	0	0	0	0	118.8
896	T	34.2	Very low	31.4	Very low	140 Å²	140	143 Å²	143	86%	0.859	76%	0.761	S	S	*	*			cis	-140.4	169.8	-0.9	4	0	0	0	0	111.5
897	R	28.1	Very low	32	Very low	242 Å²	242	141 Å²	141	91%	0.913	74%	0.738	S	S	*	*			trans	-93.5	150.5	-164.4	-57	178.8	-176.7	179.4	0.4	116.2
898	K	29.3	Very low	32.6	Very low	200 Å²	200	137.3 Å²	137.3	87%	0.87	72%	0.715	S	S	*	*			trans	-131.7	145	138.3	-84.6	-173.8	175.5	179.9	0	108.6
899	P	29.6	Very low	33.6	Very low	132 Å²	132	134.8 Å²	134.8	86%	0.857	70%	0.699	S	S	*	*			trans	-79.1	134.6	-179.3	31.3	-33.3	0	0	0	111.8
900	Q	32.3	Very low	34.3	Very low	183 Å²	183	127.9 Å²	127.9	86%	0.855	67%	0.67	S	S	*	*			trans	-104.7	139.8	160.6	-75.6	-175.9	-34.7	0	0	108.8	N902	Q900-N902 PolarHBondContact O-N 2.99Å
901	A	30.3	Very low	35.5	Very low	108 Å²	108	125.9 Å²	125.9	89%	0.893	66%	0.661	S	S	*	*			trans	-79.5	110.7	-177.8	0	0	0	0	0	111	S903	A901-S903 PolarHBondContact O-N 3.32Å
902	N	29.3	Very low	36.6	Very low	145 Å²	145	124.5 Å²	124.5	78%	0.775	65%	0.654	S	S	*	*			trans	-82.9	106.4	170.4	-73.9	-20.8	0	0	0	109.6	Q900	Q900-N902 PolarHBondContact O-N 2.99Å
903	S	34.1	Very low	37.3	Very low	122 Å²	122	121.6 Å²	121.6	85%	0.853	63%	0.631	S	S	*	*			trans	-76.1	140.7	163.9	-170.6	0	0	0	0	109.9	A901	A901-S903 PolarHBondContact O-N 3.32Å
904	Y	31.1	Very low	38.3	Very low	195 Å²	195	111.1 Å²	111.1	77%	0.765	59%	0.593	S	S	*	*			trans	-79.2	135.7	-152	-78.6	-98.1	0	0	0	115.3	F906	Y904-F906 VanDerWaalsContact C-N 3.29Å; Y904-F906 HydrophobicContact CD1-CB 4.32Å
905	P	46.2	Very low	39.3	Very low	83 Å²	83	110.3 Å²	110.3	54%	0.539	58%	0.581	S	S	.	*	S	Bend	trans	-76.3	-16.6	166.4	32.3	-34.9	0	0	0	113.3	F907 S908 Q909	P905-F907 PolarHBondContact O-N 3.4Å; P905-S908 PolarHBondContact O-N 3.45Å; P905-Q909 PolarHBondContact O-N 3.05Å
906	F	35.4	Very low	40.1	Very low	50 Å²	50	109 Å²	109	22%	0.219	57%	0.565	C	S	.	*	H	α-helix	trans	-47.9	-49.2	-168.3	-176.7	-97.5	0	0	0	114.6	Y904 S908 Q909 L910 L942 M991	Y904-F906 VanDerWaalsContact C-N 3.29Å; Y904-F906 HydrophobicContact CD1-CB 4.32Å; F906-S908 VanDerWaalsContact C-N 3.27Å; F906-S908 PolarHBondContact O-N 3.47Å; F906-Q909 WeakPolarHBondContact O-CB 3.48Å; F906-Q909 PolarHBondContact O-N 3.36Å; F906-L910 HydrophobicContact CD1-CD1 4.02Å; F906-L910 HydrophobicContact CE1-CD1 3.37Å; F906-L910 HydrophobicContact CE1-CG 4.11Å; F906-L910 HydrophobicContact CZ-CD1 3.8Å; F906-L910 HydrophobicContact CZ-CG 4.29Å; F906-L910 PolarHBondContact O-N 3.02Å; F906-L942 HydrophobicContact CD2-CD2 4.25Å; F906-L942 HydrophobicContact CE2-CD1 4.03Å; F906-L942 HydrophobicContact CE2-CD2 3.87Å; F906-M991 HydrophobicContact CD1-CE 3.82Å; F906-M991 HydrophobicContact CD1-SD 4.47Å; F906-M991 HydrophobicContact CE1-CE 3.58Å; F906-M991 HydrophobicContact CE1-SD 3.69Å; F906-M991 HydrophobicContact CZ-SD 4.49Å
907	F	38	Very low	40.8	Very low	82 Å²	82	104.5 Å²	104.5	36%	0.36	54%	0.535	S	S	.	.	H	α-helix	trans	-61.4	-36	-177.9	-149.9	-75.3	0	0	0	112.2	P905 Q909 E911 L988	P905-F907 PolarHBondContact O-N 3.4Å; F907-Q909 VanDerWaalsContact C-N 3.33Å; F907-E911 WeakPolarHBondContact O-CB 3.29Å; F907-E911 PolarHBondContact O-N 3.42Å; F907-L988 HydrophobicContact CD1-CD2 4.37Å; F907-L988 HydrophobicContact CD2-CD2 4.12Å; F907-L988 HydrophobicContact CE1-CD2 4.05Å; F907-L988 HydrophobicContact CE2-CD2 3.79Å; F907-L988 HydrophobicContact CG-CD2 4.41Å; F907-L988 HydrophobicContact CZ-CB 4.44Å; F907-L988 HydrophobicContact CZ-CD2 3.76Å
908	S	44.9	Very low	42.1	Very low	44 Å²	44	99.2 Å²	99.2	31%	0.308	52%	0.518	S	S	.	.	H	α-helix	trans	-80	-16.2	179.1	-53.7	0	0	0	0	112.9	K791 P905 F906 H912	K791-S908 VanDerWaalsContact CE-OG 3.26Å; K791-S908 WeakPolarHBondContact CE-OG 3.33Å; K791-S908 PolarHBondContact NZ-OG 3.06Å; P905-S908 PolarHBondContact O-N 3.45Å; F906-S908 VanDerWaalsContact C-N 3.27Å; F906-S908 PolarHBondContact O-N 3.47Å; S908-H912 WeakPolarHBondContact O-CB 3.31Å; S908-H912 PolarHBondContact O-N 3.46Å
909	Q	46.5	Very low	43.3	Very low	98 Å²	98	95.4 Å²	95.4	46%	0.458	51%	0.512	S	S	.	.	H	α-helix	trans	-77.7	-47.2	168.7	-68.7	169.5	-56	0	0	110.1	P905 F906 F907 E911 H912 I913	P905-Q909 PolarHBondContact O-N 3.05Å; F906-Q909 WeakPolarHBondContact O-CB 3.48Å; F906-Q909 PolarHBondContact O-N 3.36Å; F907-Q909 VanDerWaalsContact C-N 3.33Å; Q909-E911 PolarHBondContact O-N 3.22Å; Q909-H912 PolarHBondContact O-N 3.49Å; Q909-I913 VanDerWaalsContact O-CG1 3.3Å; Q909-I913 WeakPolarHBondContact O-CG1 3.18Å; Q909-I913 PolarHBondContact O-N 3.35Å
910	L	45.6	Very low	43.6	Very low	24 Å²	24	92.5 Å²	92.5	13%	0.126	49%	0.489	C	S	.	.	H	α-helix	trans	-58.9	-44	175.3	-71.6	-177.9	0	0	0	113.2	F906 H912 I913 T914 L988	F906-L910 HydrophobicContact CD1-CD1 4.02Å; F906-L910 HydrophobicContact CE1-CD1 3.37Å; F906-L910 HydrophobicContact CE1-CG 4.11Å; F906-L910 HydrophobicContact CZ-CD1 3.8Å; F906-L910 HydrophobicContact CZ-CG 4.29Å; F906-L910 PolarHBondContact O-N 3.02Å; L910-H912 VanDerWaalsContact C-N 3.32Å; L910-H912 PolarHBondContact O-N 3.27Å; L910-I913 HydrophobicContact CD2-CD1 4.01Å; L910-I913 PolarHBondContact O-N 3.41Å; L910-T914 PolarHBondContact O-N 2.88Å; L910-T914 VanDerWaalsContact O-N 3.12Å; L910-T914 PolarHBondContact O-OG1 3.02Å; L910-L988 HydrophobicContact CB-CD2 4.24Å; L910-L988 HydrophobicContact CD1-CD2 3.69Å
911	E	52.1	Low	44	Very low	99 Å²	99	88.6 Å²	88.6	46%	0.463	48%	0.479	S	S	.	.	H	α-helix	trans	-57.5	-44.6	175	-169.1	174.9	-148.7	0	0	111	F907 Q909 I913 T914 D915	F907-E911 WeakPolarHBondContact O-CB 3.29Å; F907-E911 PolarHBondContact O-N 3.42Å; Q909-E911 PolarHBondContact O-N 3.22Å; E911-I913 VanDerWaalsContact C-N 3.34Å; E911-I913 PolarHBondContact O-N 3.45Å; E911-T914 PolarHBondContact O-N 3.22Å; E911-T914 PolarHBondContact O-OG1 2.9Å; E911-T914 VanDerWaalsContact O-OG1 3.05Å; E911-D915 PolarHBondContact O-N 3Å; E911-D915 VanDerWaalsContact O-N 3.13Å
912	H	53.5	Low	44.2	Very low	117 Å²	117	91.7 Å²	91.7	54%	0.542	47%	0.469	S	S	.	.	H	α-helix	trans	-69.9	-26.2	178.1	-156.6	-36.1	0	0	0	113.5	S908 Q909 L910 N916	S908-H912 WeakPolarHBondContact O-CB 3.31Å; S908-H912 PolarHBondContact O-N 3.46Å; Q909-H912 PolarHBondContact O-N 3.49Å; L910-H912 VanDerWaalsContact C-N 3.32Å; L910-H912 PolarHBondContact O-N 3.27Å; H912-N916 PolarHBondContact CE1-OD1 3.18Å; H912-N916 PolarHBondContact ND1-ND2 3.19Å; H912-N916 PolarHBondContact ND1-OD1 3.17Å; H912-N916 WeakPolarHBondContact O-CB 3.33Å; H912-N916 PolarHBondContact O-N 2.89Å; H912-N916 PolarHBondContact O-ND2 3.43Å
913	I	45.1	Very low	44.4	Very low	36 Å²	36	89.5 Å²	89.5	19%	0.185	45%	0.453	C	S	.	.	H	α-helix	trans	-69.4	-48.8	173	-63.3	160.6	0	0	0	110.5	Q909 L910 E911 D915 N916 M917 L940	Q909-I913 VanDerWaalsContact O-CG1 3.3Å; Q909-I913 WeakPolarHBondContact O-CG1 3.18Å; Q909-I913 PolarHBondContact O-N 3.35Å; L910-I913 HydrophobicContact CD2-CD1 4.01Å; L910-I913 PolarHBondContact O-N 3.41Å; E911-I913 VanDerWaalsContact C-N 3.34Å; E911-I913 PolarHBondContact O-N 3.45Å; I913-D915 VanDerWaalsContact C-N 3.26Å; I913-D915 PolarHBondContact O-N 2.86Å; I913-N916 PolarHBondContact O-N 3.36Å; I913-N916 VanDerWaalsContact O-N 3.1Å; I913-M917 HydrophobicContact CG2-CE 3.75Å; I913-M917 HydrophobicContact CG2-CG 4.37Å; I913-M917 HydrophobicContact CG2-SD 4.41Å; I913-M917 WeakPolarHBondContact O-CG 3.49Å; I913-M917 PolarHBondContact O-N 3.13Å; I913-L940 HydrophobicContact CD1-CD1 3.62Å; I913-L940 HydrophobicContact CD1-CD2 3.34Å; I913-L940 HydrophobicContact CD1-CG 4.12Å; I913-L940 HydrophobicContact CG1-CD2 3.95Å
914	T	54.2	Low	44.5	Very low	17 Å²	17	89.1 Å²	89.1	10%	0.104	45%	0.445	C	S	.	.	H	α-helix	trans	-65.3	-30.3	179.8	51.3	0	0	0	0	112.4	L910 E911 K918 I984	L910-T914 PolarHBondContact O-N 2.88Å; L910-T914 VanDerWaalsContact O-N 3.12Å; L910-T914 PolarHBondContact O-OG1 3.02Å; E911-T914 PolarHBondContact O-N 3.22Å; E911-T914 PolarHBondContact O-OG1 2.9Å; E911-T914 VanDerWaalsContact O-OG1 3.05Å; T914-K918 VanDerWaalsContact O-CD 3.26Å; T914-K918 WeakPolarHBondContact O-CD 3.4Å; T914-K918 WeakPolarHBondContact O-CE 3.37Å; T914-K918 VanDerWaalsContact O-CG 3.25Å; T914-K918 WeakPolarHBondContact O-CG 3.46Å; T914-K918 PolarHBondContact O-N 2.72Å; T914-I984 HydrophobicContact CG2-CB 4.37Å; T914-I984 HydrophobicContact CG2-CD1 3.83Å; T914-I984 HydrophobicContact CG2-CG2 3.77Å
915	D	53.5	Low	44.5	Very low	89 Å²	89	88 Å²	88	48%	0.476	45%	0.447	S	S	.	.	H	α-helix	trans	-69.6	-43.6	168.3	-80.3	-5	0	0	0	112.1	E911 I913 M917 K918 V919	E911-D915 PolarHBondContact O-N 3Å; E911-D915 VanDerWaalsContact O-N 3.13Å; I913-D915 VanDerWaalsContact C-N 3.26Å; I913-D915 PolarHBondContact O-N 2.86Å; D915-M917 VanDerWaalsContact C-N 3.34Å; D915-M917 PolarHBondContact O-N 3.15Å; D915-K918 PolarHBondContact O-N 3.2Å; D915-K918 IonicContact OD1-NZ 2.86Å; D915-V919 WeakPolarHBondContact O-CG2 3.44Å; D915-V919 PolarHBondContact O-N 3.3Å
916	N	49.2	Very low	43.9	Very low	84 Å²	84	87.7 Å²	87.7	45%	0.449	45%	0.447	S	S	.	.	H	α-helix	trans	-62.2	-38	176.7	-74.1	-16.8	0	0	0	112.8	H912 I913 K918 V919 N920	H912-N916 PolarHBondContact CE1-OD1 3.18Å; H912-N916 PolarHBondContact ND1-ND2 3.19Å; H912-N916 PolarHBondContact ND1-OD1 3.17Å; H912-N916 WeakPolarHBondContact O-CB 3.33Å; H912-N916 PolarHBondContact O-N 2.89Å; H912-N916 PolarHBondContact O-ND2 3.43Å; I913-N916 PolarHBondContact O-N 3.36Å; I913-N916 VanDerWaalsContact O-N 3.1Å; N916-K918 VanDerWaalsContact C-N 3.31Å; N916-K918 PolarHBondContact O-N 2.87Å; N916-V919 PolarHBondContact O-N 3.48Å; N916-N920 PolarHBondContact O-N 2.86Å
917	M	48.2	Very low	43.6	Very low	45 Å²	45	93.5 Å²	93.5	22%	0.222	48%	0.48	C	S	.	.	H	α-helix	trans	-64.7	-32.8	175.5	-73	-173.3	-178.9	0	0	112.6	I913 D915 I980	I913-M917 HydrophobicContact CG2-CE 3.75Å; I913-M917 HydrophobicContact CG2-CG 4.37Å; I913-M917 HydrophobicContact CG2-SD 4.41Å; I913-M917 WeakPolarHBondContact O-CG 3.49Å; I913-M917 PolarHBondContact O-N 3.13Å; D915-M917 VanDerWaalsContact C-N 3.34Å; D915-M917 PolarHBondContact O-N 3.15Å; M917-I980 HydrophobicContact CE-CG2 4.08Å; M917-I980 HydrophobicContact SD-CG2 4.01Å
918	K	55.7	Low	43.6	Very low	130 Å²	130	94.5 Å²	94.5	57%	0.565	50%	0.497	S	S	*	.	H	α-helix	trans	-77.5	-21.6	177.5	-68.6	162.5	-163.6	157.1	0	113.4	T914 D915 N916	T914-K918 VanDerWaalsContact O-CD 3.26Å; T914-K918 WeakPolarHBondContact O-CD 3.4Å; T914-K918 WeakPolarHBondContact O-CE 3.37Å; T914-K918 VanDerWaalsContact O-CG 3.25Å; T914-K918 WeakPolarHBondContact O-CG 3.46Å; T914-K918 PolarHBondContact O-N 2.72Å; D915-K918 PolarHBondContact O-N 3.2Å; D915-K918 IonicContact OD1-NZ 2.86Å; N916-K918 VanDerWaalsContact C-N 3.31Å; N916-K918 PolarHBondContact O-N 2.87Å
919	V	54	Low	43.4	Very low	121 Å²	121	99.4 Å²	99.4	73%	0.733	52%	0.518	S	S	*	.	H	α-helix	trans	-87.7	-24.2	-174.9	169.4	0	0	0	0	113	D915 N916	D915-V919 WeakPolarHBondContact O-CG2 3.44Å; D915-V919 PolarHBondContact O-N 3.3Å; N916-V919 PolarHBondContact O-N 3.48Å
920	N	36.7	Very low	43.4	Very low	71 Å²	71	95.5 Å²	95.5	38%	0.38	51%	0.505	S	S	.	.			trans	-126.9	100.5	178.8	-173.2	14.1	0	0	0	113	N916 Y922 F923	N916-N920 PolarHBondContact O-N 2.86Å; N920-Y922 PolarHBondContact O-N 3.46Å; N920-Y922 PolarHBondContact OD1-N 2.89Å; N920-F923 HydrophobicContact CB-CD2 4.44Å
921	P	40.9	Very low	44.2	Very low	101 Å²	101	97 Å²	97	66%	0.656	52%	0.516	S	S	*	.	S	Bend	trans	-64.2	-20.3	173.7	-22.1	34.2	0	0	0	114.6	F923	P921-F923 PolarHBondContact O-N 3.49Å
922	Y	33.2	Very low	44.3	Very low	173 Å²	173	94.4 Å²	94.4	68%	0.678	50%	0.503	S	S	*	.			trans	-97.3	49.9	-173.4	-64.9	-85.8	0	0	0	112	N920 V924	N920-Y922 PolarHBondContact O-N 3.46Å; N920-Y922 PolarHBondContact OD1-N 2.89Å; Y922-V924 PolarHBondContact O-N 3.39Å
923	F	34.8	Very low	44.6	Very low	98 Å²	98	90.2 Å²	90.2	43%	0.43	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	6.5	-179.9	-130.5	-84.7	0	0	0	114.2	N920 P921	N920-F923 HydrophobicContact CB-CD2 4.44Å; P921-F923 PolarHBondContact O-N 3.49Å
924	V	36.3	Very low	45.5	Very low	115 Å²	115	93.1 Å²	93.1	70%	0.697	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-27.9	-174.3	-176.9	0	0	0	0	112.5	Y922 S926	Y922-V924 PolarHBondContact O-N 3.39Å; V924-S926 VanDerWaalsContact C-N 3.3Å; V924-S926 PolarHBondContact O-N 2.9Å
925	E	30.6	Very low	45.7	Very low	171 Å²	171	95.4 Å²	95.4	80%	0.799	51%	0.508	S	S	*	.			trans	-85.6	60.6	-175.3	-66.2	-173.4	161.7	0	0	113.3
926	S	33	Very low	45.9	Very low	76 Å²	76	92.5 Å²	92.5	53%	0.531	49%	0.493	S	S	.	.	S	Bend	trans	-154.8	124.6	157.4	55.3	0	0	0	0	111.6	V924 S928	V924-S926 VanDerWaalsContact C-N 3.3Å; V924-S926 PolarHBondContact O-N 2.9Å; S926-S928 PolarHBondContact O-N 3.48Å
927	N	30.5	Very low	46.7	Very low	173 Å²	173	92.8 Å²	92.8	93%	0.925	49%	0.491	S	S	*	.	S	Bend	trans	-68.4	91.4	-170.7	-69.2	-24.7	0	0	0	113.4
928	S	37.3	Very low	47.6	Very low	102 Å²	102	97.8 Å²	97.8	71%	0.713	51%	0.514	S	S	*	.			trans	177	89.4	145.1	33.7	0	0	0	0	111.3	S926 G930	S926-S928 PolarHBondContact O-N 3.48Å; S928-G930 PolarHBondContact O-N 3.33Å
929	I	40.6	Very low	47	Very low	147 Å²	147	99.2 Å²	99.2	75%	0.754	52%	0.516	S	S	*	.			trans	-78	79.8	166.6	-56.1	178.5	0	0	0	107.8
930	G	46.8	Very low	47.1	Very low	17 Å²	17	95.7 Å²	95.7	18%	0.175	49%	0.493	C	S	.	.			trans	-67.9	158.3	161.4	0	0	0	0	0	110.3	S928 I935	S928-G930 PolarHBondContact O-N 3.33Å; G930-I935 WeakPolarHBondContact O-CD1 3.46Å
931	P	63.1	Low	47.5	Very low	55 Å²	55	95 Å²	95	36%	0.357	50%	0.503	S	S	.	.			trans	-53.8	150.7	174.5	22.9	-33.9	0	0	0	110.9	D933 Q934 I935	P931-D933 PolarHBondContact O-N 3.33Å; P931-D933 VanDerWaalsContact O-N 3.07Å; P931-Q934 HydrophobicContact CG-CB 4.19Å; P931-Q934 HydrophobicContact CG-CG 3.93Å; P931-Q934 WeakPolarHBondContact O-CA 3.38Å; P931-Q934 WeakPolarHBondContact O-CB 3.26Å; P931-Q934 PolarHBondContact O-N 2.83Å; P931-I935 PolarHBondContact O-N 3.49Å
932	F	52.9	Low	47.8	Very low	45 Å²	45	92 Å²	92	20%	0.197	48%	0.481	C	S	.	.	H	α-helix	trans	-56.3	-34.4	-171.9	-175.3	-112.4	0	0	0	112.5	Q934 I935 L936 V951 L954 N955	F932-Q934 PolarHBondContact O-N 3.25Å; F932-I935 PolarHBondContact O-N 2.81Å; F932-L936 HydrophobicContact CD1-CD1 3.85Å; F932-L936 HydrophobicContact CD1-CG 4.23Å; F932-L936 HydrophobicContact CE1-CD1 3.6Å; F932-L936 HydrophobicContact CE1-CD2 4.2Å; F932-L936 HydrophobicContact CE1-CG 4Å; F932-L936 HydrophobicContact CE2-CD2 4.5Å; F932-L936 HydrophobicContact CZ-CD1 4.25Å; F932-L936 HydrophobicContact CZ-CD2 3.99Å; F932-L936 HydrophobicContact CZ-CG 4.2Å; F932-L936 WeakPolarHBondContact O-CG 3.22Å; F932-L936 PolarHBondContact O-N 2.91Å; F932-V951 HydrophobicContact CD1-CG1 4.37Å; F932-L954 HydrophobicContact CD1-CB 4.15Å; F932-L954 HydrophobicContact CD1-CD1 3.84Å; F932-L954 HydrophobicContact CE1-CD1 3.47Å; F932-L954 VanDerWaalsContact CE1-CD1 3.47Å; F932-L954 HydrophobicContact CG-CB 4.47Å; F932-L954 HydrophobicContact CZ-CD1 3.92Å; F932-N955 WeakPolarHBondContact CB-OD1 3.44Å; F932-N955 PolarHBondContact N-OD1 2.92Å
933	D	61.2	Low	48.6	Very low	29 Å²	29	88.5 Å²	88.5	16%	0.155	48%	0.48	C	S	.	.	H	α-helix	trans	-61.4	-39.5	173	-163.7	42.7	0	0	0	112.4	P931 Q937 M945	P931-D933 PolarHBondContact O-N 3.33Å; P931-D933 VanDerWaalsContact O-N 3.07Å; D933-Q937 WeakPolarHBondContact O-CB 3.47Å; D933-Q937 PolarHBondContact O-N 3.45Å; D933-M945 WeakPolarHBondContact OD1-CB 3.42Å; D933-M945 PolarHBondContact OD1-N 2.97Å
934	Q	63.6	Low	49.5	Very low	97 Å²	97	90.1 Å²	90.1	45%	0.453	49%	0.488	S	S	.	.	H	α-helix	trans	-65.5	-38.6	171.7	-80.6	-174.8	4.8	0	0	112.4	P931 F932 Q937 Q938	P931-Q934 HydrophobicContact CG-CB 4.19Å; P931-Q934 HydrophobicContact CG-CG 3.93Å; P931-Q934 WeakPolarHBondContact O-CA 3.38Å; P931-Q934 WeakPolarHBondContact O-CB 3.26Å; P931-Q934 PolarHBondContact O-N 2.83Å; F932-Q934 PolarHBondContact O-N 3.25Å; Q934-Q937 PolarHBondContact O-N 2.91Å; Q934-Q938 WeakPolarHBondContact O-CB 3.45Å; Q934-Q938 WeakPolarHBondContact O-CG 3.3Å; Q934-Q938 PolarHBondContact O-N 3.13Å
935	I	57.7	Low	50.2	Low	64 Å²	64	86.9 Å²	86.9	33%	0.328	47%	0.466	S	S	.	.	H	α-helix	trans	-66.5	-43.3	178.9	-61.6	177.1	0	0	0	110.4	G930 P931 F932 R939	G930-I935 WeakPolarHBondContact O-CD1 3.46Å; P931-I935 PolarHBondContact O-N 3.49Å; F932-I935 PolarHBondContact O-N 2.81Å; I935-R939 WeakPolarHBondContact O-CB 3.47Å; I935-R939 PolarHBondContact O-N 3.44Å
936	L	57.4	Low	51.3	Low	28 Å²	28	82.7 Å²	82.7	15%	0.147	45%	0.447	C	S	.	.	H	α-helix	trans	-61	-45	172	-66.9	176.7	0	0	0	111.4	F932 L940 M945	F932-L936 HydrophobicContact CD1-CD1 3.85Å; F932-L936 HydrophobicContact CD1-CG 4.23Å; F932-L936 HydrophobicContact CE1-CD1 3.6Å; F932-L936 HydrophobicContact CE1-CD2 4.2Å; F932-L936 HydrophobicContact CE1-CG 4Å; F932-L936 HydrophobicContact CE2-CD2 4.5Å; F932-L936 HydrophobicContact CZ-CD1 4.25Å; F932-L936 HydrophobicContact CZ-CD2 3.99Å; F932-L936 HydrophobicContact CZ-CG 4.2Å; F932-L936 WeakPolarHBondContact O-CG 3.22Å; F932-L936 PolarHBondContact O-N 2.91Å; L936-L940 HydrophobicContact CD2-CD1 3.62Å; L936-L940 WeakPolarHBondContact O-CA 3.42Å; L936-L940 WeakPolarHBondContact O-CB 3.5Å; L936-L940 PolarHBondContact O-N 3.48Å; L936-M945 HydrophobicContact CD1-CB 4.24Å; L936-M945 HydrophobicContact CD1-CG 4.01Å
937	Q	66.8	Low	52.5	Low	90 Å²	90	85.4 Å²	85.4	42%	0.421	46%	0.455	S	S	.	.	H	α-helix	trans	-70.1	-41.9	-175.3	-161	160	111.4	0	0	112.2	D933 Q934 G941 L942	D933-Q937 WeakPolarHBondContact O-CB 3.47Å; D933-Q937 PolarHBondContact O-N 3.45Å; Q934-Q937 PolarHBondContact O-N 2.91Å; Q937-G941 WeakPolarHBondContact O-CA 3.42Å; Q937-G941 PolarHBondContact O-N 3.41Å; Q937-G941 VanDerWaalsContact O-N 3.14Å; Q937-L942 WeakPolarHBondContact CG-O 3.22Å
938	Q	66.4	Low	53.4	Low	151 Å²	151	79.1 Å²	79.1	71%	0.706	42%	0.421	S	S	*	.	H	α-helix	trans	-68.6	-45.1	174.5	-73.2	-175.8	10.2	0	0	112.9	Q934	Q934-Q938 WeakPolarHBondContact O-CB 3.45Å; Q934-Q938 WeakPolarHBondContact O-CG 3.3Å; Q934-Q938 PolarHBondContact O-N 3.13Å
939	R	44	Very low	54.3	Low	159 Å²	159	78.5 Å²	78.5	60%	0.6	41%	0.414	S	S	*	.	H	α-helix	trans	-90.4	-21.7	-171.3	-62.8	-166.2	177.7	-154	3.5	114.3	I935	I935-R939 WeakPolarHBondContact O-CB 3.47Å; I935-R939 PolarHBondContact O-N 3.44Å
940	L	54.6	Low	55.1	Low	47 Å²	47	75.6 Å²	75.6	25%	0.246	40%	0.398	C	S	.	.	H	α-helix	trans	-120.5	-11.2	-176.3	-46.9	178.2	0	0	0	114	I913 L936 L942	I913-L940 HydrophobicContact CD1-CD1 3.62Å; I913-L940 HydrophobicContact CD1-CD2 3.34Å; I913-L940 HydrophobicContact CD1-CG 4.12Å; I913-L940 HydrophobicContact CG1-CD2 3.95Å; L936-L940 HydrophobicContact CD2-CD1 3.62Å; L936-L940 WeakPolarHBondContact O-CA 3.42Å; L936-L940 WeakPolarHBondContact O-CB 3.5Å; L936-L940 PolarHBondContact O-N 3.48Å; L940-L942 VanDerWaalsContact C-N 3.25Å; L940-L942 HydrophobicContact CB-CD1 4.01Å; L940-L942 HydrophobicContact CB-CG 3.89Å; L940-L942 HydrophobicContact CD1-CD1 3.93Å; L940-L942 PolarHBondContact O-N 2.81Å
941	G	45	Very low	55.7	Low	58 Å²	58	75.3 Å²	75.3	60%	0.598	39%	0.393	S	S	*	.			trans	68.1	22	-177.5	0	0	0	0	0	114.1	Q937 P943	Q937-G941 WeakPolarHBondContact O-CA 3.42Å; Q937-G941 PolarHBondContact O-N 3.41Å; Q937-G941 VanDerWaalsContact O-N 3.14Å; G941-P943 WeakPolarHBondContact O-CD 3.43Å
942	L	48	Very low	55.7	Low	38 Å²	38	75.2 Å²	75.2	20%	0.199	39%	0.393	C	S	.	.			trans	-86.7	116.2	-179	-64.7	176	0	0	0	111	F906 Q937 L940 M945	F906-L942 HydrophobicContact CD2-CD2 4.25Å; F906-L942 HydrophobicContact CE2-CD1 4.03Å; F906-L942 HydrophobicContact CE2-CD2 3.87Å; Q937-L942 WeakPolarHBondContact CG-O 3.22Å; L940-L942 VanDerWaalsContact C-N 3.25Å; L940-L942 HydrophobicContact CB-CD1 4.01Å; L940-L942 HydrophobicContact CB-CG 3.89Å; L940-L942 HydrophobicContact CD1-CD1 3.93Å; L940-L942 PolarHBondContact O-N 2.81Å; L942-M945 HydrophobicContact CB-CG 4.4Å; L942-M945 HydrophobicContact CD1-SD 4.23Å
943	P	49.3	Very low	56.3	Low	99 Å²	99	76.3 Å²	76.3	64%	0.643	40%	0.404	S	S	*	.			trans	-79.4	141.8	173.5	32.3	-33.4	0	0	0	111.3	G941	G941-P943 WeakPolarHBondContact O-CD 3.43Å
944	Q	54.4	Low	55.8	Low	131 Å²	131	75.8 Å²	75.8	61%	0.612	40%	0.401	S	S	*	.			trans	56.2	62	163.1	-61	-174	-0.5	0	0	116.1	H946	Q944-H946 VanDerWaalsContact C-N 3.26Å; Q944-H946 WeakPolarHBondContact CB-NE2 3.34Å; Q944-H946 WeakPolarHBondContact CG-NE2 3.36Å; Q944-H946 PolarHBondContact O-N 3.19Å
945	M	50.2	Low	55.7	Low	48 Å²	48	72.7 Å²	72.7	24%	0.236	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-81.7	-2.8	170.7	-61.3	-92.3	76.1	0	0	113.4	D933 L936 L942 N947 I948 V951	D933-M945 WeakPolarHBondContact OD1-CB 3.42Å; D933-M945 PolarHBondContact OD1-N 2.97Å; L936-M945 HydrophobicContact CD1-CB 4.24Å; L936-M945 HydrophobicContact CD1-CG 4.01Å; L942-M945 HydrophobicContact CB-CG 4.4Å; L942-M945 HydrophobicContact CD1-SD 4.23Å; M945-N947 PolarHBondContact O-N 3.15Å; M945-I948 HydrophobicContact CE-CD1 3.63Å; M945-I948 WeakPolarHBondContact O-CB 3.3Å; M945-I948 PolarHBondContact O-N 3.23Å; M945-I948 HydrophobicContact SD-CD1 3.93Å; M945-V951 HydrophobicContact CB-CG1 4.16Å; M945-V951 HydrophobicContact CB-CG2 4.29Å
946	H	55	Low	56.1	Low	83 Å²	83	76 Å²	76	38%	0.384	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-55.1	-24.7	-178	54.2	61.9	0	0	0	115.4	Q944 I948 S952	Q944-H946 VanDerWaalsContact C-N 3.26Å; Q944-H946 WeakPolarHBondContact CB-NE2 3.34Å; Q944-H946 WeakPolarHBondContact CG-NE2 3.36Å; Q944-H946 PolarHBondContact O-N 3.19Å; H946-I948 PolarHBondContact O-N 2.93Å; H946-S952 PolarHBondContact O-OG 2.8Å
947	N	56.7	Low	55.9	Low	132 Å²	132	76.8 Å²	76.8	71%	0.706	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-77	-4.8	178.5	-71.6	-5.5	0	0	0	114.1	M945 P949	M945-N947 PolarHBondContact O-N 3.15Å; N947-P949 WeakPolarHBondContact O-CD 3.26Å
948	I	51.3	Low	55.2	Low	42 Å²	42	74.2 Å²	74.2	22%	0.215	40%	0.399	C	S	.	.			trans	-88.3	118.4	176.1	-62.1	176.8	0	0	0	108.8	M945 H946 E950 V951 S952	M945-I948 HydrophobicContact CE-CD1 3.63Å; M945-I948 WeakPolarHBondContact O-CB 3.3Å; M945-I948 PolarHBondContact O-N 3.23Å; M945-I948 HydrophobicContact SD-CD1 3.93Å; H946-I948 PolarHBondContact O-N 2.93Å; I948-E950 HydrophobicContact CG2-CB 3.95Å; I948-E950 VanDerWaalsContact CG2-OE2 3.22Å; I948-E950 WeakPolarHBondContact CG2-OE2 3.38Å; I948-E950 PolarHBondContact O-N 3.34Å; I948-V951 HydrophobicContact CB-CB 4.07Å; I948-V951 HydrophobicContact CB-CG2 3.86Å; I948-V951 HydrophobicContact CD1-CG2 4.44Å; I948-V951 HydrophobicContact CG2-CB 4.37Å; I948-V951 HydrophobicContact CG2-CG2 3.91Å; I948-V951 PolarHBondContact O-N 3.25Å; I948-S952 PolarHBondContact O-N 3.19Å
949	P	55.8	Low	55	Low	88 Å²	88	72.3 Å²	72.3	57%	0.571	39%	0.394	S	S	*	.	H	α-helix	trans	-55.1	-36.3	179.7	-26.6	35	0	0	0	113.4	N947 V951 S952 T953	N947-P949 WeakPolarHBondContact O-CD 3.26Å; P949-V951 VanDerWaalsContact C-N 3.35Å; P949-V951 PolarHBondContact O-N 3.34Å; P949-S952 PolarHBondContact O-N 3.44Å; P949-T953 WeakPolarHBondContact O-CB 3.29Å; P949-T953 PolarHBondContact O-N 3.37Å; P949-T953 PolarHBondContact O-OG1 2.81Å
950	E	57.6	Low	55.6	Low	87 Å²	87	70.6 Å²	70.6	41%	0.407	39%	0.393	S	S	.	.	H	α-helix	trans	-65.5	-35.3	177.2	-64.7	74.6	-173.1	0	0	112.1	I948 T953 L954 L983	I948-E950 HydrophobicContact CG2-CB 3.95Å; I948-E950 VanDerWaalsContact CG2-OE2 3.22Å; I948-E950 WeakPolarHBondContact CG2-OE2 3.38Å; I948-E950 PolarHBondContact O-N 3.34Å; E950-T953 WeakPolarHBondContact O-CB 3.38Å; E950-T953 PolarHBondContact O-N 2.8Å; E950-L954 WeakPolarHBondContact O-CG 3.16Å; E950-L954 PolarHBondContact O-N 3.3Å; E950-L983 HydrophobicContact CB-CD2 3.99Å; E950-L983 HydrophobicContact CG-CD2 3.66Å
951	V	57.9	Low	55.2	Low	11 Å²	11	72.1 Å²	72.1	7%	0.067	40%	0.4	C	S	.	.	H	α-helix	trans	-74.8	-39.2	176.2	172.2	0	0	0	0	110.9	F932 M945 I948 P949 T953 L954 N955	F932-V951 HydrophobicContact CD1-CG1 4.37Å; M945-V951 HydrophobicContact CB-CG1 4.16Å; M945-V951 HydrophobicContact CB-CG2 4.29Å; I948-V951 HydrophobicContact CB-CB 4.07Å; I948-V951 HydrophobicContact CB-CG2 3.86Å; I948-V951 HydrophobicContact CD1-CG2 4.44Å; I948-V951 HydrophobicContact CG2-CB 4.37Å; I948-V951 HydrophobicContact CG2-CG2 3.91Å; I948-V951 PolarHBondContact O-N 3.25Å; P949-V951 VanDerWaalsContact C-N 3.35Å; P949-V951 PolarHBondContact O-N 3.34Å; V951-T953 VanDerWaalsContact C-N 3.28Å; V951-T953 PolarHBondContact O-N 3.4Å; V951-L954 PolarHBondContact O-N 3.08Å; V951-N955 PolarHBondContact O-N 2.99Å
952	S	63.2	Low	55.4	Low	52 Å²	52	76.5 Å²	76.5	36%	0.364	41%	0.409	S	S	.	.	H	α-helix	trans	-61	-39	169.7	-73.5	0	0	0	0	111.7	H946 I948 P949 N955 Q956	H946-S952 PolarHBondContact O-OG 2.8Å; I948-S952 PolarHBondContact O-N 3.19Å; P949-S952 PolarHBondContact O-N 3.44Å; S952-N955 PolarHBondContact O-N 2.95Å; S952-Q956 WeakPolarHBondContact O-CB 3.36Å; S952-Q956 WeakPolarHBondContact O-CG 3.18Å; S952-Q956 PolarHBondContact O-N 3.26Å
953	T	66.2	Low	55.7	Low	68 Å²	68	78.6 Å²	78.6	42%	0.417	43%	0.427	S	S	.	.	H	α-helix	trans	-65.3	-42.8	175.1	-54.3	0	0	0	0	111.9	P949 E950 V951 Q956 I957	P949-T953 WeakPolarHBondContact O-CB 3.29Å; P949-T953 PolarHBondContact O-N 3.37Å; P949-T953 PolarHBondContact O-OG1 2.81Å; E950-T953 WeakPolarHBondContact O-CB 3.38Å; E950-T953 PolarHBondContact O-N 2.8Å; V951-T953 VanDerWaalsContact C-N 3.28Å; V951-T953 PolarHBondContact O-N 3.4Å; T953-Q956 PolarHBondContact O-N 3.05Å; T953-I957 HydrophobicContact CG2-CD1 3.94Å; T953-I957 WeakPolarHBondContact O-CG1 3.39Å; T953-I957 PolarHBondContact O-N 2.81Å
954	L	51.7	Low	55.3	Low	19 Å²	19	81.2 Å²	81.2	10%	0.099	43%	0.431	C	S	.	.	H	α-helix	trans	-63.9	-44	175.2	-76.1	169.2	0	0	0	111.9	F932 E950 V951 I957 A958 W976 I980 L983	F932-L954 HydrophobicContact CD1-CB 4.15Å; F932-L954 HydrophobicContact CD1-CD1 3.84Å; F932-L954 HydrophobicContact CE1-CD1 3.47Å; F932-L954 VanDerWaalsContact CE1-CD1 3.47Å; F932-L954 HydrophobicContact CG-CB 4.47Å; F932-L954 HydrophobicContact CZ-CD1 3.92Å; E950-L954 WeakPolarHBondContact O-CG 3.16Å; E950-L954 PolarHBondContact O-N 3.3Å; V951-L954 PolarHBondContact O-N 3.08Å; L954-I957 PolarHBondContact O-N 3.3Å; L954-A958 WeakPolarHBondContact O-CB 3.25Å; L954-A958 PolarHBondContact O-N 3.42Å; L954-W976 HydrophobicContact CD2-CE3 4.23Å; L954-W976 HydrophobicContact CD2-CZ3 4.04Å; L954-I980 HydrophobicContact CD2-CG1 4.16Å; L954-L983 HydrophobicContact CD1-CD1 3.8Å; L954-L983 HydrophobicContact CD2-CD1 4.03Å; L954-L983 HydrophobicContact CG-CD1 3.91Å
955	N	60.1	Low	54.5	Low	31 Å²	31	82.3 Å²	82.3	17%	0.166	44%	0.441	C	S	.	.	H	α-helix	trans	-61.9	-44.2	174.8	-79.2	-27.9	0	0	0	111.9	F932 V951 S952 I957 A958 N959	F932-N955 WeakPolarHBondContact CB-OD1 3.44Å; F932-N955 PolarHBondContact N-OD1 2.92Å; V951-N955 PolarHBondContact O-N 2.99Å; S952-N955 PolarHBondContact O-N 2.95Å; N955-I957 VanDerWaalsContact C-N 3.25Å; N955-I957 PolarHBondContact O-N 2.8Å; N955-A958 PolarHBondContact O-N 2.82Å; N955-N959 WeakPolarHBondContact O-CB 3.42Å; N955-N959 PolarHBondContact O-N 2.99Å; N955-N959 PolarHBondContact O-OD1 2.94Å
956	Q	65.4	Low	54.1	Low	134 Å²	134	86.6 Å²	86.6	63%	0.626	47%	0.465	S	S	*	.	H	α-helix	trans	-57.5	-37.9	178.4	-84.9	-175.2	-10	0	0	113	S952 T953	S952-Q956 WeakPolarHBondContact O-CB 3.36Å; S952-Q956 WeakPolarHBondContact O-CG 3.18Å; S952-Q956 PolarHBondContact O-N 3.26Å; T953-Q956 PolarHBondContact O-N 3.05Å
957	I	53.6	Low	53.7	Low	44 Å²	44	93.6 Å²	93.6	23%	0.226	49%	0.488	C	S	.	.	H	α-helix	trans	-93.3	-25.9	-174.5	-47.6	163.5	0	0	0	111.6	T953 L954 N955 N959 Q960 W976	T953-I957 HydrophobicContact CG2-CD1 3.94Å; T953-I957 WeakPolarHBondContact O-CG1 3.39Å; T953-I957 PolarHBondContact O-N 2.81Å; L954-I957 PolarHBondContact O-N 3.3Å; N955-I957 VanDerWaalsContact C-N 3.25Å; N955-I957 PolarHBondContact O-N 2.8Å; I957-N959 VanDerWaalsContact C-N 3.28Å; I957-N959 PolarHBondContact O-N 3.41Å; I957-Q960 WeakPolarHBondContact O-CB 3.27Å; I957-Q960 PolarHBondContact O-N 2.63Å; I957-W976 HydrophobicContact CB-CH2 3.61Å; I957-W976 HydrophobicContact CB-CZ2 4.01Å; I957-W976 HydrophobicContact CD1-CH2 3.76Å; I957-W976 HydrophobicContact CG1-CH2 4.28Å; I957-W976 HydrophobicContact CG2-CH2 3.35Å; I957-W976 HydrophobicContact CG2-CZ2 3.26Å
958	A	53.6	Low	53.4	Low	36 Å²	36	94.7 Å²	94.7	30%	0.298	49%	0.489	S	S	.	.	H	α-helix	trans	-56	-46.3	162.8	0	0	0	0	0	110.6	L954 N955 Q960 M961	L954-A958 WeakPolarHBondContact O-CB 3.25Å; L954-A958 PolarHBondContact O-N 3.42Å; N955-A958 PolarHBondContact O-N 2.82Å; A958-Q960 PolarHBondContact O-N 3.29Å; A958-M961 PolarHBondContact O-N 3.38Å
959	N	60.3	Low	53	Low	111 Å²	111	95.8 Å²	95.8	59%	0.594	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-5.2	175.3	-64.2	1	0	0	0	114.6	N955 I957	N955-N959 WeakPolarHBondContact O-CB 3.42Å; N955-N959 PolarHBondContact O-N 2.99Å; N955-N959 PolarHBondContact O-OD1 2.94Å; I957-N959 VanDerWaalsContact C-N 3.28Å; I957-N959 PolarHBondContact O-N 3.41Å
960	Q	56.6	Low	52.8	Low	124 Å²	124	97.4 Å²	97.4	58%	0.579	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-18	172.7	-71.2	176.1	-10.7	0	0	112.5	I957 A958 S963	I957-Q960 WeakPolarHBondContact O-CB 3.27Å; I957-Q960 PolarHBondContact O-N 2.63Å; A958-Q960 PolarHBondContact O-N 3.29Å; Q960-S963 PolarHBondContact O-OG 3.37Å
961	M	47.1	Very low	52.7	Low	79 Å²	79	98.7 Å²	98.7	39%	0.389	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-81.3	-15.2	-172.6	-62.4	-166.3	71	0	0	114.5	A958 S963 T972 W976	A958-M961 PolarHBondContact O-N 3.38Å; M961-S963 PolarHBondContact O-N 3.01Å; M961-T972 HydrophobicContact CE-CG2 3.75Å; M961-W976 PolarHBondContact SD-NE1 2.97Å
962	D	49.5	Very low	52.9	Low	149 Å²	149	100.9 Å²	100.9	80%	0.797	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-62.9	3.1	176.9	-73.9	-23.9	0	0	0	114.9
963	S	53.7	Low	52.2	Low	83 Å²	83	99.7 Å²	99.7	58%	0.58	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-113.1	-17.3	-161.8	64.9	0	0	0	0	116.8	Q960 M961	Q960-S963 PolarHBondContact O-OG 3.37Å; M961-S963 PolarHBondContact O-N 3.01Å
964	Q	41	Very low	52	Low	154 Å²	154	100.2 Å²	100.2	72%	0.72	51%	0.512	S	S	*	.			trans	-145.8	121.1	-178.1	-65	-72.4	-96	0	0	111.3
965	N	37.4	Very low	52.6	Low	154 Å²	154	100.5 Å²	100.5	82%	0.824	52%	0.52	S	S	*	.			trans	-97.4	127.5	161.1	-62.2	-60	0	0	0	108
966	D	42.4	Very low	52.7	Low	137 Å²	137	100.8 Å²	100.8	73%	0.733	52%	0.519	S	S	*	.	S	Bend	trans	167.6	92.7	146.9	-102	-26.9	0	0	0	112.4	Q968 D969	D966-Q968 PolarHBondContact O-N 3.03Å; D966-D969 PolarHBondContact N-OD2 3.25Å
967	R	46.2	Very low	52.5	Low	231 Å²	231	97.3 Å²	97.3	87%	0.872	50%	0.502	S	S	*	.	S	Bend	trans	59.3	-31.6	165	-71.8	-175.6	171	-175	-1.8	118.5	D969 L970	R967-D969 PolarHBondContact N-OD2 3.13Å; R967-D969 VanDerWaalsContact N-OD2 3.08Å; R967-D969 PolarHBondContact O-N 2.84Å; R967-D969 VanDerWaalsContact O-N 3.11Å; R967-L970 PolarHBondContact O-N 2.61Å; R967-L970 VanDerWaalsContact O-N 3.16Å
968	Q	50.2	Low	53.2	Low	155 Å²	155	103 Å²	103	72%	0.724	52%	0.521	S	S	*	.	H	α-helix	trans	-55.4	-22.5	166.8	-63.8	-176.1	-3.7	0	0	110.9	D966 L970 D971 T972	D966-Q968 PolarHBondContact O-N 3.03Å; Q968-L970 PolarHBondContact O-N 3.38Å; Q968-D971 PolarHBondContact O-N 2.95Å; Q968-T972 WeakPolarHBondContact O-CB 3.36Å; Q968-T972 PolarHBondContact O-N 3.33Å; Q968-T972 PolarHBondContact O-OG1 3.43Å
969	D	44.5	Very low	54	Low	64 Å²	64	106.2 Å²	106.2	34%	0.342	53%	0.528	S	S	.	.	H	α-helix	trans	-48.8	-37.7	171.9	-56.6	-63.5	0	0	0	113.7	D966 R967 A973	D966-D969 PolarHBondContact N-OD2 3.25Å; R967-D969 PolarHBondContact N-OD2 3.13Å; R967-D969 VanDerWaalsContact N-OD2 3.08Å; R967-D969 PolarHBondContact O-N 2.84Å; R967-D969 VanDerWaalsContact O-N 3.11Å; D969-A973 WeakPolarHBondContact O-CB 3.38Å; D969-A973 PolarHBondContact O-N 3.27Å
970	L	50.4	Low	54.4	Low	122 Å²	122	102.2 Å²	102.2	64%	0.639	51%	0.506	S	S	*	.	H	α-helix	trans	-73.9	-47.3	-176.9	-173.4	64.2	0	0	0	112.6	R967 Q968 T972 A973 Q974	R967-L970 PolarHBondContact O-N 2.61Å; R967-L970 VanDerWaalsContact O-N 3.16Å; Q968-L970 PolarHBondContact O-N 3.38Å; L970-T972 VanDerWaalsContact C-N 3.3Å; L970-A973 PolarHBondContact O-N 3.49Å; L970-Q974 WeakPolarHBondContact O-CG 3.17Å; L970-Q974 PolarHBondContact O-N 2.8Å
971	D	54.8	Low	54.8	Low	114 Å²	114	98.6 Å²	98.6	61%	0.61	49%	0.491	S	S	*	.	H	α-helix	trans	-69.5	-32.8	175.4	-89	-24	0	0	0	111.3	Q968 Q974 G975	Q968-D971 PolarHBondContact O-N 2.95Å; D971-Q974 PolarHBondContact O-N 3.26Å; D971-G975 PolarHBondContact O-N 3.23Å
972	T	62.5	Low	55.9	Low	57 Å²	57	97.5 Å²	97.5	35%	0.35	49%	0.491	S	S	.	.	H	α-helix	trans	-67.7	-44.7	174.7	-61.8	0	0	0	0	110.9	M961 Q968 L970 G975 W976	M961-T972 HydrophobicContact CE-CG2 3.75Å; Q968-T972 WeakPolarHBondContact O-CB 3.36Å; Q968-T972 PolarHBondContact O-N 3.33Å; Q968-T972 PolarHBondContact O-OG1 3.43Å; L970-T972 VanDerWaalsContact C-N 3.3Å; T972-G975 CarbonylContact O-C 3.48Å; T972-G975 WeakPolarHBondContact O-CA 3.31Å; T972-G975 PolarHBondContact O-N 3.27Å; T972-G975 VanDerWaalsContact O-N 3.1Å; T972-W976 PolarHBondContact O-N 3.12Å
973	A	49.3	Very low	57	Low	27 Å²	27	92.5 Å²	92.5	22%	0.223	46%	0.464	C	S	.	.	H	α-helix	trans	-62.4	-41.1	172.6	0	0	0	0	0	112	D969 L970 G975 W976 H977	D969-A973 WeakPolarHBondContact O-CB 3.38Å; D969-A973 PolarHBondContact O-N 3.27Å; L970-A973 PolarHBondContact O-N 3.49Å; A973-G975 VanDerWaalsContact C-N 3.31Å; A973-G975 PolarHBondContact O-N 3.47Å; A973-W976 CarbonylContact O-C 3.58Å; A973-W976 WeakPolarHBondContact O-CA 3.02Å; A973-W976 WeakPolarHBondContact O-CB 3.37Å; A973-W976 PolarHBondContact O-N 2.75Å; A973-W976 VanDerWaalsContact O-N 3.11Å; A973-H977 PolarHBondContact O-CD2 3.44Å; A973-H977 PolarHBondContact O-N 2.78Å
974	Q	61.3	Low	57.8	Low	79 Å²	79	90 Å²	90	37%	0.369	44%	0.444	S	S	.	.	H	α-helix	trans	-61.7	-39.3	170.2	-75.3	-172	46.4	0	0	112.1	L970 D971 W976 H977 R978	L970-Q974 WeakPolarHBondContact O-CG 3.17Å; L970-Q974 PolarHBondContact O-N 2.8Å; D971-Q974 PolarHBondContact O-N 3.26Å; Q974-W976 VanDerWaalsContact C-N 3.3Å; Q974-W976 PolarHBondContact O-N 3.3Å; Q974-H977 PolarHBondContact O-N 3.23Å; Q974-R978 VanDerWaalsContact O-CG 3.27Å; Q974-R978 WeakPolarHBondContact O-CG 3.43Å; Q974-R978 PolarHBondContact O-N 3.39Å
975	G	65.2	Low	59.3	Low	25 Å²	25	86 Å²	86	26%	0.258	43%	0.431	S	S	.	.	H	α-helix	trans	-59.1	-39.4	170.5	0	0	0	0	0	112.5	D971 T972 A973 K979	D971-G975 PolarHBondContact O-N 3.23Å; T972-G975 CarbonylContact O-C 3.48Å; T972-G975 WeakPolarHBondContact O-CA 3.31Å; T972-G975 PolarHBondContact O-N 3.27Å; T972-G975 VanDerWaalsContact O-N 3.1Å; A973-G975 VanDerWaalsContact C-N 3.31Å; A973-G975 PolarHBondContact O-N 3.47Å; G975-K979 WeakPolarHBondContact O-CB 3.22Å; G975-K979 WeakPolarHBondContact O-CG 3.22Å; G975-K979 PolarHBondContact O-N 3.26Å
976	W	61.4	Low	61	Low	37 Å²	37	85 Å²	85	14%	0.14	42%	0.419	C	S	.	.	H	α-helix	trans	-67	-46.5	173.9	-73.6	117.8	0	0	0	113	L954 I957 M961 T972 A973 Q974 R978 K979 I980	L954-W976 HydrophobicContact CD2-CE3 4.23Å; L954-W976 HydrophobicContact CD2-CZ3 4.04Å; I957-W976 HydrophobicContact CB-CH2 3.61Å; I957-W976 HydrophobicContact CB-CZ2 4.01Å; I957-W976 HydrophobicContact CD1-CH2 3.76Å; I957-W976 HydrophobicContact CG1-CH2 4.28Å; I957-W976 HydrophobicContact CG2-CH2 3.35Å; I957-W976 HydrophobicContact CG2-CZ2 3.26Å; M961-W976 PolarHBondContact SD-NE1 2.97Å; T972-W976 PolarHBondContact O-N 3.12Å; A973-W976 CarbonylContact O-C 3.58Å; A973-W976 WeakPolarHBondContact O-CA 3.02Å; A973-W976 WeakPolarHBondContact O-CB 3.37Å; A973-W976 PolarHBondContact O-N 2.75Å; A973-W976 VanDerWaalsContact O-N 3.11Å; Q974-W976 VanDerWaalsContact C-N 3.3Å; Q974-W976 PolarHBondContact O-N 3.3Å; W976-R978 VanDerWaalsContact C-N 3.32Å; W976-R978 PolarHBondContact O-N 3.28Å; W976-K979 HydrophobicContact CD2-CD 4.35Å; W976-K979 HydrophobicContact CE3-CB 4.25Å; W976-K979 HydrophobicContact CE3-CD 3.66Å; W976-K979 HydrophobicContact CH2-CD 3.81Å; W976-K979 VanDerWaalsContact CH2-NZ 3.26Å; W976-K979 HydrophobicContact CZ2-CD 4.48Å; W976-K979 HydrophobicContact CZ3-CB 4.45Å; W976-K979 HydrophobicContact CZ3-CD 3.38Å; W976-K979 PolarHBondContact O-N 2.77Å; W976-K979 VanDerWaalsContact O-N 3.16Å; W976-I980 WeakPolarHBondContact O-CB 3.4Å; W976-I980 VanDerWaalsContact O-CG1 3.26Å; W976-I980 WeakPolarHBondContact O-CG1 2.92Å; W976-I980 PolarHBondContact O-N 3.36Å
977	H	62.1	Low	62.2	Low	61 Å²	61	82.3 Å²	82.3	28%	0.282	40%	0.402	S	S	.	.	H	α-helix	trans	-56.6	-46	173.3	-79.3	-73.7	0	0	0	111.5	A973 Q974 K979 I980 D981	A973-H977 PolarHBondContact O-CD2 3.44Å; A973-H977 PolarHBondContact O-N 2.78Å; Q974-H977 PolarHBondContact O-N 3.23Å; H977-K979 PolarHBondContact O-N 2.61Å; H977-I980 PolarHBondContact O-N 3.44Å; H977-D981 WeakPolarHBondContact O-CB 3.4Å; H977-D981 PolarHBondContact O-N 3.02Å
978	R	68.8	Low	63.4	Low	164 Å²	164	72.7 Å²	72.7	62%	0.619	37%	0.367	S	S	*	.	H	α-helix	trans	-63	-38.5	176.3	-66	172.2	-151	173.8	10	112.7	Q974 W976 S982	Q974-R978 VanDerWaalsContact O-CG 3.27Å; Q974-R978 WeakPolarHBondContact O-CG 3.43Å; Q974-R978 PolarHBondContact O-N 3.39Å; W976-R978 VanDerWaalsContact C-N 3.32Å; W976-R978 PolarHBondContact O-N 3.28Å; R978-S982 VanDerWaalsContact O-CB 3.29Å; R978-S982 WeakPolarHBondContact O-CB 3.45Å; R978-S982 PolarHBondContact O-N 2.92Å
979	K	70.3	Confident	64.4	Low	103 Å²	103	69.7 Å²	69.7	45%	0.448	36%	0.357	S	S	.	.	H	α-helix	trans	-66.7	-46.8	174.1	-77.1	172.8	-178.7	174.4	0	111.7	G975 W976 H977 S982 L983	G975-K979 WeakPolarHBondContact O-CB 3.22Å; G975-K979 WeakPolarHBondContact O-CG 3.22Å; G975-K979 PolarHBondContact O-N 3.26Å; W976-K979 HydrophobicContact CD2-CD 4.35Å; W976-K979 HydrophobicContact CE3-CB 4.25Å; W976-K979 HydrophobicContact CE3-CD 3.66Å; W976-K979 HydrophobicContact CH2-CD 3.81Å; W976-K979 VanDerWaalsContact CH2-NZ 3.26Å; W976-K979 HydrophobicContact CZ2-CD 4.48Å; W976-K979 HydrophobicContact CZ3-CB 4.45Å; W976-K979 HydrophobicContact CZ3-CD 3.38Å; W976-K979 PolarHBondContact O-N 2.77Å; W976-K979 VanDerWaalsContact O-N 3.16Å; H977-K979 PolarHBondContact O-N 2.61Å; K979-S982 WeakPolarHBondContact O-CB 3.35Å; K979-S982 PolarHBondContact O-N 2.81Å; K979-L983 WeakPolarHBondContact O-CB 3.29Å; K979-L983 VanDerWaalsContact O-CG 3.28Å; K979-L983 WeakPolarHBondContact O-CG 3.22Å; K979-L983 PolarHBondContact O-N 3.49Å
980	I	67.1	Low	65.7	Low	27 Å²	27	69.8 Å²	69.8	14%	0.138	36%	0.362	C	S	.	.	H	α-helix	trans	-64.2	-46.5	-179.8	-69.6	166	0	0	0	110.3	M917 L954 W976 H977 S982 L983 I984	M917-I980 HydrophobicContact CE-CG2 4.08Å; M917-I980 HydrophobicContact SD-CG2 4.01Å; L954-I980 HydrophobicContact CD2-CG1 4.16Å; W976-I980 WeakPolarHBondContact O-CB 3.4Å; W976-I980 VanDerWaalsContact O-CG1 3.26Å; W976-I980 WeakPolarHBondContact O-CG1 2.92Å; W976-I980 PolarHBondContact O-N 3.36Å; H977-I980 PolarHBondContact O-N 3.44Å; I980-S982 VanDerWaalsContact C-N 3.3Å; I980-S982 PolarHBondContact O-N 2.79Å; I980-L983 PolarHBondContact O-N 2.97Å; I980-I984 HydrophobicContact CG2-CD1 3.68Å; I980-I984 HydrophobicContact CG2-CG1 4.34Å; I980-I984 WeakPolarHBondContact O-CB 3.01Å; I980-I984 WeakPolarHBondContact O-CG1 3.41Å; I980-I984 PolarHBondContact O-N 3.46Å
981	D	66.5	Low	66.3	Low	49 Å²	49	67.1 Å²	67.1	26%	0.262	35%	0.347	S	S	.	.	H	α-helix	trans	-58.9	-40.7	172.9	-87.3	-18.2	0	0	0	111.6	H977 T985	H977-D981 WeakPolarHBondContact O-CB 3.4Å; H977-D981 PolarHBondContact O-N 3.02Å; D981-T985 WeakPolarHBondContact O-CB 3.48Å; D981-T985 PolarHBondContact O-N 3.39Å; D981-T985 PolarHBondContact O-OG1 3.3Å
982	S	70.2	Confident	67	Low	56 Å²	56	65.5 Å²	65.5	39%	0.392	34%	0.336	S	S	.	.	H	α-helix	trans	-64.7	-41.9	175.8	-170.5	0	0	0	0	112.3	R978 K979 I980 T985 K986	R978-S982 VanDerWaalsContact O-CB 3.29Å; R978-S982 WeakPolarHBondContact O-CB 3.45Å; R978-S982 PolarHBondContact O-N 2.92Å; K979-S982 WeakPolarHBondContact O-CB 3.35Å; K979-S982 PolarHBondContact O-N 2.81Å; I980-S982 VanDerWaalsContact C-N 3.3Å; I980-S982 PolarHBondContact O-N 2.79Å; S982-T985 PolarHBondContact O-N 3.32Å; S982-K986 WeakPolarHBondContact O-CB 3.13Å; S982-K986 VanDerWaalsContact O-CG 3.3Å; S982-K986 WeakPolarHBondContact O-CG 3.4Å; S982-K986 PolarHBondContact O-N 3.22Å
983	L	71.1	Confident	67.3	Low	44 Å²	44	68.9 Å²	68.9	23%	0.23	35%	0.348	C	S	.	.	H	α-helix	trans	-69	-44.5	178.1	-69.9	174.3	0	0	0	112	E950 L954 K979 I980 T985 K986 Q987	E950-L983 HydrophobicContact CB-CD2 3.99Å; E950-L983 HydrophobicContact CG-CD2 3.66Å; L954-L983 HydrophobicContact CD1-CD1 3.8Å; L954-L983 HydrophobicContact CD2-CD1 4.03Å; L954-L983 HydrophobicContact CG-CD1 3.91Å; K979-L983 WeakPolarHBondContact O-CB 3.29Å; K979-L983 VanDerWaalsContact O-CG 3.28Å; K979-L983 WeakPolarHBondContact O-CG 3.22Å; K979-L983 PolarHBondContact O-N 3.49Å; I980-L983 PolarHBondContact O-N 2.97Å; L983-T985 VanDerWaalsContact C-N 3.33Å; L983-T985 PolarHBondContact O-N 3.19Å; L983-K986 PolarHBondContact O-N 3.33Å; L983-Q987 WeakPolarHBondContact O-CB 3.34Å; L983-Q987 PolarHBondContact O-N 3.09Å
984	I	71.8	Confident	68.2	Low	29 Å²	29	73.1 Å²	73.1	15%	0.149	36%	0.363	C	S	.	.	H	α-helix	trans	-61.9	-43.3	173.7	-65.9	169.7	0	0	0	109.8	T914 I980 K986 Q987 L988	T914-I984 HydrophobicContact CG2-CB 4.37Å; T914-I984 HydrophobicContact CG2-CD1 3.83Å; T914-I984 HydrophobicContact CG2-CG2 3.77Å; I980-I984 HydrophobicContact CG2-CD1 3.68Å; I980-I984 HydrophobicContact CG2-CG1 4.34Å; I980-I984 WeakPolarHBondContact O-CB 3.01Å; I980-I984 WeakPolarHBondContact O-CG1 3.41Å; I980-I984 PolarHBondContact O-N 3.46Å; I984-K986 PolarHBondContact O-N 3.19Å; I984-Q987 PolarHBondContact O-N 3.45Å; I984-L988 HydrophobicContact CG2-CD1 3.76Å; I984-L988 HydrophobicContact CG2-CG 4.14Å; I984-L988 WeakPolarHBondContact O-CB 3.35Å; I984-L988 VanDerWaalsContact O-CG 3.26Å; I984-L988 WeakPolarHBondContact O-CG 3.24Å; I984-L988 PolarHBondContact O-N 2.78Å
985	T	71.2	Confident	68.1	Low	72 Å²	72	73.1 Å²	73.1	44%	0.442	36%	0.363	S	S	.	.	H	α-helix	trans	-63.4	-41.6	176.6	-59.1	0	0	0	0	111.9	D981 S982 L983 N989	D981-T985 WeakPolarHBondContact O-CB 3.48Å; D981-T985 PolarHBondContact O-N 3.39Å; D981-T985 PolarHBondContact O-OG1 3.3Å; S982-T985 PolarHBondContact O-N 3.32Å; L983-T985 VanDerWaalsContact C-N 3.33Å; L983-T985 PolarHBondContact O-N 3.19Å; T985-N989 VanDerWaalsContact O-CB 3.29Å; T985-N989 WeakPolarHBondContact O-CB 3.41Å; T985-N989 PolarHBondContact O-N 2.81Å; T985-N989 PolarHBondContact O-ND2 3.19Å
986	K	73.6	Confident	67.6	Low	133 Å²	133	76.7 Å²	76.7	58%	0.578	37%	0.373	S	S	*	.	H	α-helix	trans	-61.7	-44.2	173.1	-78.3	176.4	-179.2	-175.4	0	111.7	S982 L983 I984 N989 S990	S982-K986 WeakPolarHBondContact O-CB 3.13Å; S982-K986 VanDerWaalsContact O-CG 3.3Å; S982-K986 WeakPolarHBondContact O-CG 3.4Å; S982-K986 PolarHBondContact O-N 3.22Å; L983-K986 PolarHBondContact O-N 3.33Å; I984-K986 PolarHBondContact O-N 3.19Å; K986-N989 PolarHBondContact O-N 3.24Å; K986-S990 VanDerWaalsContact O-CB 3.27Å; K986-S990 WeakPolarHBondContact O-CB 3.4Å; K986-S990 PolarHBondContact O-N 2.96Å
987	Q	68.5	Low	67.3	Low	79 Å²	79	79.6 Å²	79.6	37%	0.369	39%	0.391	S	S	.	.	H	α-helix	trans	-68.3	-42.2	179.8	-172.3	62.5	10.8	0	0	111.9	L983 I984 N989 S990 M991	L983-Q987 WeakPolarHBondContact O-CB 3.34Å; L983-Q987 PolarHBondContact O-N 3.09Å; I984-Q987 PolarHBondContact O-N 3.45Å; Q987-N989 VanDerWaalsContact C-N 3.34Å; Q987-N989 PolarHBondContact O-N 3.19Å; Q987-S990 PolarHBondContact O-N 3.41Å; Q987-M991 HydrophobicContact CG-CG 4.49Å; Q987-M991 HydrophobicContact CG-SD 4.19Å; Q987-M991 WeakPolarHBondContact O-CB 3.16Å; Q987-M991 VanDerWaalsContact O-CG 3.3Å; Q987-M991 WeakPolarHBondContact O-CG 3.29Å; Q987-M991 PolarHBondContact O-N 2.93Å
988	L	70.4	Confident	66.8	Low	29 Å²	29	81.5 Å²	81.5	15%	0.152	40%	0.4	C	S	.	.	H	α-helix	trans	-62.5	-40.3	173.6	-70.4	173.3	0	0	0	111.5	F907 L910 I984 H992	F907-L988 HydrophobicContact CD1-CD2 4.37Å; F907-L988 HydrophobicContact CD2-CD2 4.12Å; F907-L988 HydrophobicContact CE1-CD2 4.05Å; F907-L988 HydrophobicContact CE2-CD2 3.79Å; F907-L988 HydrophobicContact CG-CD2 4.41Å; F907-L988 HydrophobicContact CZ-CB 4.44Å; F907-L988 HydrophobicContact CZ-CD2 3.76Å; L910-L988 HydrophobicContact CB-CD2 4.24Å; L910-L988 HydrophobicContact CD1-CD2 3.69Å; I984-L988 HydrophobicContact CG2-CD1 3.76Å; I984-L988 HydrophobicContact CG2-CG 4.14Å; I984-L988 WeakPolarHBondContact O-CB 3.35Å; I984-L988 VanDerWaalsContact O-CG 3.26Å; I984-L988 WeakPolarHBondContact O-CG 3.24Å; I984-L988 PolarHBondContact O-N 2.78Å; L988-H992 WeakPolarHBondContact O-CB 3.29Å; L988-H992 PolarHBondContact O-N 3.25Å
989	N	72	Confident	65.8	Low	93 Å²	93	78.7 Å²	78.7	50%	0.497	39%	0.392	S	S	.	.	H	α-helix	trans	-68.5	-40.1	174.7	-73.8	-22.6	0	0	0	112.4	T985 K986 Q987 H992 Q993	T985-N989 VanDerWaalsContact O-CB 3.29Å; T985-N989 WeakPolarHBondContact O-CB 3.41Å; T985-N989 PolarHBondContact O-N 2.81Å; T985-N989 PolarHBondContact O-ND2 3.19Å; K986-N989 PolarHBondContact O-N 3.24Å; Q987-N989 VanDerWaalsContact C-N 3.34Å; Q987-N989 PolarHBondContact O-N 3.19Å; N989-H992 PolarHBondContact O-N 2.86Å; N989-Q993 WeakPolarHBondContact O-CB 3.29Å; N989-Q993 WeakPolarHBondContact O-CG 3.35Å; N989-Q993 PolarHBondContact O-N 3.16Å
990	S	72.3	Confident	64.5	Low	66 Å²	66	77.1 Å²	77.1	46%	0.462	39%	0.394	S	S	.	.	H	α-helix	trans	-64.1	-45.9	176	-177.9	0	0	0	0	111.2	K986 Q987 Q993 H994	K986-S990 VanDerWaalsContact O-CB 3.27Å; K986-S990 WeakPolarHBondContact O-CB 3.4Å; K986-S990 PolarHBondContact O-N 2.96Å; Q987-S990 PolarHBondContact O-N 3.41Å; S990-Q993 CarbonylContact O-C 3.53Å; S990-Q993 PolarHBondContact O-N 2.71Å; S990-H994 PolarHBondContact O-N 3.32Å
991	M	61.8	Low	63.2	Low	65 Å²	65	79.6 Å²	79.6	32%	0.32	41%	0.414	S	S	.	.	H	α-helix	trans	-67.7	-36.5	174.6	-70.7	-177.1	65.7	0	0	112.5	F906 Q987 H994 E995	F906-M991 HydrophobicContact CD1-CE 3.82Å; F906-M991 HydrophobicContact CD1-SD 4.47Å; F906-M991 HydrophobicContact CE1-CE 3.58Å; F906-M991 HydrophobicContact CE1-SD 3.69Å; F906-M991 HydrophobicContact CZ-SD 4.49Å; Q987-M991 HydrophobicContact CG-CG 4.49Å; Q987-M991 HydrophobicContact CG-SD 4.19Å; Q987-M991 WeakPolarHBondContact O-CB 3.16Å; Q987-M991 VanDerWaalsContact O-CG 3.3Å; Q987-M991 WeakPolarHBondContact O-CG 3.29Å; Q987-M991 PolarHBondContact O-N 2.93Å; M991-H994 PolarHBondContact O-N 2.9Å; M991-E995 WeakPolarHBondContact O-CB 3.37Å; M991-E995 PolarHBondContact O-N 3.36Å
992	H	69.9	Low	61.8	Low	80 Å²	80	80.5 Å²	80.5	37%	0.37	42%	0.421	S	S	.	.	H	α-helix	trans	-69	-35.4	173.6	-170.3	64.6	0	0	0	111.5	L988 N989 E995 Q996	L988-H992 WeakPolarHBondContact O-CB 3.29Å; L988-H992 PolarHBondContact O-N 3.25Å; N989-H992 PolarHBondContact O-N 2.86Å; H992-E995 PolarHBondContact O-N 2.86Å; H992-Q996 PolarHBondContact NE2-NE2 2.87Å; H992-Q996 VanDerWaalsContact O-CB 3.22Å; H992-Q996 WeakPolarHBondContact O-CB 3.3Å; H992-Q996 WeakPolarHBondContact O-CG 3.33Å; H992-Q996 PolarHBondContact O-N 2.64Å
993	Q	68.1	Low	59.9	Low	128 Å²	128	82.4 Å²	82.4	60%	0.598	43%	0.434	S	S	*	.	H	α-helix	trans	-66.3	-38.6	169.4	-78	-177.9	-2.8	0	0	111.8	N989 S990 Q996 N997	N989-Q993 WeakPolarHBondContact O-CB 3.29Å; N989-Q993 WeakPolarHBondContact O-CG 3.35Å; N989-Q993 PolarHBondContact O-N 3.16Å; S990-Q993 CarbonylContact O-C 3.53Å; S990-Q993 PolarHBondContact O-N 2.71Å; Q993-Q996 PolarHBondContact O-N 3.23Å; Q993-N997 WeakPolarHBondContact O-CB 3.33Å; Q993-N997 PolarHBondContact O-N 3.49Å; Q993-N997 PolarHBondContact O-ND2 3.31Å; Q993-N997 PolarHBondContact O-OD1 3.41Å
994	H	68.9	Low	57.9	Low	116 Å²	116	87.4 Å²	87.4	54%	0.537	46%	0.461	S	S	.	.	H	α-helix	trans	-63.2	-44.1	172.7	-160.7	-77.4	0	0	0	111.2	S990 M991 N997 E998	S990-H994 PolarHBondContact O-N 3.32Å; M991-H994 PolarHBondContact O-N 2.9Å; H994-N997 PolarHBondContact O-N 2.88Å; H994-E998 IonicContact CE1-OE1 3.01Å; H994-E998 PolarHBondContact CE1-OE1 3.16Å; H994-E998 IonicContact CE1-OE2 2.78Å; H994-E998 IonicContact ND1-OE1 2.69Å; H994-E998 IonicContact ND1-OE2 3.7Å; H994-E998 PolarHBondContact ND1-OE2 3.45Å; H994-E998 WeakPolarHBondContact O-CB 3.16Å; H994-E998 WeakPolarHBondContact O-CG 3.47Å; H994-E998 PolarHBondContact O-N 3.09Å
995	E	59.4	Low	55.8	Low	79 Å²	79	94.6 Å²	94.6	37%	0.369	49%	0.491	S	S	.	.	H	α-helix	trans	-69.2	-34.5	178.3	-161.6	-167.7	176.2	0	0	112.3	M991 H992 K999	M991-E995 WeakPolarHBondContact O-CB 3.37Å; M991-E995 PolarHBondContact O-N 3.36Å; H992-E995 PolarHBondContact O-N 2.86Å; E995-K999 HydrophobicContact CG-CD 4.43Å; E995-K999 VanDerWaalsContact O-CB 3.29Å; E995-K999 WeakPolarHBondContact O-CB 3.47Å; E995-K999 WeakPolarHBondContact O-CD 3.4Å; E995-K999 WeakPolarHBondContact O-CG 3.41Å; E995-K999 PolarHBondContact O-N 3.47Å; E995-K999 WeakPolarHBondContact OE1-CE 3.22Å; E995-K999 IonicContact OE1-NZ 2.63Å; E995-K999 PolarHBondContact OE1-NZ 3.45Å; E995-K999 IonicContact OE2-NZ 3.89Å
996	Q	53.8	Low	53.8	Low	101 Å²	101	97.9 Å²	97.9	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-69.1	-40.6	171.5	-71.7	-89	8.5	0	0	111.2	H992 Q993 K999 S1000	H992-Q996 PolarHBondContact NE2-NE2 2.87Å; H992-Q996 VanDerWaalsContact O-CB 3.22Å; H992-Q996 WeakPolarHBondContact O-CB 3.3Å; H992-Q996 WeakPolarHBondContact O-CG 3.33Å; H992-Q996 PolarHBondContact O-N 2.64Å; Q993-Q996 PolarHBondContact O-N 3.23Å; Q996-K999 CarbonylContact O-C 3.6Å; Q996-K999 PolarHBondContact O-N 3.28Å; Q996-S1000 WeakPolarHBondContact O-CB 3.32Å; Q996-S1000 PolarHBondContact O-N 2.98Å; Q996-S1000 PolarHBondContact O-OG 2.93Å
997	N	55.3	Low	51.6	Low	98 Å²	98	98.8 Å²	98.8	52%	0.524	52%	0.517	S	S	.	.	H	α-helix	trans	-74	-35.5	179	-70.4	-14.2	0	0	0	112.1	Q993 H994 S1000 S1001	Q993-N997 WeakPolarHBondContact O-CB 3.33Å; Q993-N997 PolarHBondContact O-N 3.49Å; Q993-N997 PolarHBondContact O-ND2 3.31Å; Q993-N997 PolarHBondContact O-OD1 3.41Å; H994-N997 PolarHBondContact O-N 2.88Å; N997-S1000 WeakPolarHBondContact CA-OG 3.46Å; N997-S1000 PolarHBondContact O-N 3.38Å; N997-S1000 PolarHBondContact O-OG 3.11Å; N997-S1001 VanDerWaalsContact O-CB 3.27Å; N997-S1001 WeakPolarHBondContact O-CB 3.27Å; N997-S1001 PolarHBondContact O-N 3.26Å; N997-S1001 PolarHBondContact O-OG 3.34Å
998	E	51.8	Low	49.6	Very low	101 Å²	101	100.8 Å²	100.8	47%	0.472	52%	0.524	S	S	.	.	H	α-helix	trans	-65.4	-42.2	168.3	-79.1	178.6	131.1	0	0	110	H994 S1001 T1002	H994-E998 IonicContact CE1-OE1 3.01Å; H994-E998 PolarHBondContact CE1-OE1 3.16Å; H994-E998 IonicContact CE1-OE2 2.78Å; H994-E998 IonicContact ND1-OE1 2.69Å; H994-E998 IonicContact ND1-OE2 3.7Å; H994-E998 PolarHBondContact ND1-OE2 3.45Å; H994-E998 WeakPolarHBondContact O-CB 3.16Å; H994-E998 WeakPolarHBondContact O-CG 3.47Å; H994-E998 PolarHBondContact O-N 3.09Å; E998-S1001 PolarHBondContact O-OG 3.42Å; E998-T1002 VanDerWaalsContact O-CB 3.24Å; E998-T1002 WeakPolarHBondContact O-CB 3.32Å; E998-T1002 VanDerWaalsContact O-CG2 3.29Å; E998-T1002 WeakPolarHBondContact O-CG2 3.46Å; E998-T1002 PolarHBondContact O-N 3.06Å; E998-T1002 PolarHBondContact O-OG1 3.25Å
999	K	47.5	Very low	47.5	Very low	104 Å²	104	105.3 Å²	105.3	45%	0.452	56%	0.558	S	S	.	*	H	α-helix	trans	-66.5	-37.9	174.4	-74.8	166.8	-169.6	167.3	0	112.6	E995 Q996 C1003	E995-K999 HydrophobicContact CG-CD 4.43Å; E995-K999 VanDerWaalsContact O-CB 3.29Å; E995-K999 WeakPolarHBondContact O-CB 3.47Å; E995-K999 WeakPolarHBondContact O-CD 3.4Å; E995-K999 WeakPolarHBondContact O-CG 3.41Å; E995-K999 PolarHBondContact O-N 3.47Å; E995-K999 WeakPolarHBondContact OE1-CE 3.22Å; E995-K999 IonicContact OE1-NZ 2.63Å; E995-K999 PolarHBondContact OE1-NZ 3.45Å; E995-K999 IonicContact OE2-NZ 3.89Å; Q996-K999 CarbonylContact O-C 3.6Å; Q996-K999 PolarHBondContact O-N 3.28Å; K999-C1003 WeakPolarHBondContact O-CB 3.27Å; K999-C1003 PolarHBondContact O-N 3.34Å; K999-C1003 PolarHBondContact O-SG 3.36Å
1000	S	42.8	Very low	45.5	Very low	70 Å²	70	106.6 Å²	106.6	49%	0.49	57%	0.57	S	S	.	*	H	α-helix	trans	-75.1	-34.1	178.1	68.6	0	0	0	0	112.8	Q996 N997	Q996-S1000 WeakPolarHBondContact O-CB 3.32Å; Q996-S1000 PolarHBondContact O-N 2.98Å; Q996-S1000 PolarHBondContact O-OG 2.93Å; N997-S1000 WeakPolarHBondContact CA-OG 3.46Å; N997-S1000 PolarHBondContact O-N 3.38Å; N997-S1000 PolarHBondContact O-OG 3.11Å
1001	S	40.9	Very low	43.5	Very low	80 Å²	80	109.1 Å²	109.1	56%	0.559	58%	0.582	S	S	*	*	H	α-helix	trans	-82.6	-20.3	174.6	60.7	0	0	0	0	114.4	N997 E998	N997-S1001 VanDerWaalsContact O-CB 3.27Å; N997-S1001 WeakPolarHBondContact O-CB 3.27Å; N997-S1001 PolarHBondContact O-N 3.26Å; N997-S1001 PolarHBondContact O-OG 3.34Å; E998-S1001 PolarHBondContact O-OG 3.42Å
1002	T	35.9	Very low	42.1	Very low	67 Å²	67	111.1 Å²	111.1	41%	0.411	59%	0.594	S	S	.	*	H	α-helix	trans	-93.7	-12.6	169.3	61.7	0	0	0	0	113.7	E998 D1004 F1005 N1006	E998-T1002 VanDerWaalsContact O-CB 3.24Å; E998-T1002 WeakPolarHBondContact O-CB 3.32Å; E998-T1002 VanDerWaalsContact O-CG2 3.29Å; E998-T1002 WeakPolarHBondContact O-CG2 3.46Å; E998-T1002 PolarHBondContact O-N 3.06Å; E998-T1002 PolarHBondContact O-OG1 3.25Å; T1002-D1004 VanDerWaalsContact C-N 3.25Å; T1002-D1004 PolarHBondContact O-N 2.72Å; T1002-F1005 CarbonylContact O-C 3.25Å; T1002-F1005 VanDerWaalsContact O-C 3.25Å; T1002-F1005 WeakPolarHBondContact O-CA 3.49Å; T1002-F1005 PolarHBondContact O-N 3.21Å; T1002-N1006 PolarHBondContact O-N 2.81Å
1003	C	30.3	Very low	40.1	Very low	97 Å²	97	110.8 Å²	110.8	66%	0.655	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-25	170.3	-92.4	0	0	0	0	113.3	K999 F1005	K999-C1003 WeakPolarHBondContact O-CB 3.27Å; K999-C1003 PolarHBondContact O-N 3.34Å; K999-C1003 PolarHBondContact O-SG 3.36Å; C1003-F1005 VanDerWaalsContact C-N 3.27Å
1004	D	30	Very low	38.5	Very low	149 Å²	149	108.7 Å²	108.7	80%	0.797	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-2.8	167.8	-81	-36.8	0	0	0	113.2	T1002	T1002-D1004 VanDerWaalsContact C-N 3.25Å; T1002-D1004 PolarHBondContact O-N 2.72Å
1005	F	28.6	Very low	36.9	Very low	179 Å²	179	106.2 Å²	106.2	79%	0.785	59%	0.589	S	S	*	*	S	Bend	trans	-142.1	27.6	-173.9	-107.8	-78.9	0	0	0	116	T1002 C1003	T1002-F1005 CarbonylContact O-C 3.25Å; T1002-F1005 VanDerWaalsContact O-C 3.25Å; T1002-F1005 WeakPolarHBondContact O-CA 3.49Å; T1002-F1005 PolarHBondContact O-N 3.21Å; C1003-F1005 VanDerWaalsContact C-N 3.27Å
1006	N	27.7	Very low	35.7	Very low	141 Å²	141	108.7 Å²	108.7	75%	0.754	60%	0.604	S	S	*	*			trans	-158.2	71	167.5	-98.9	-47.7	0	0	0	114.3	T1002	T1002-N1006 PolarHBondContact O-N 2.81Å
1007	L	27.4	Very low	34.8	Very low	153 Å²	153	110.4 Å²	110.4	80%	0.801	62%	0.615	S	S	*	*			trans	-126.1	30	173.1	-155.3	80.2	0	0	0	114.5
1008	F	26.1	Very low	33.7	Very low	120 Å²	120	114.5 Å²	114.5	53%	0.526	62%	0.624	S	S	.	*			trans	-139.2	80.1	176.3	-82.1	-73.7	0	0	0	113.8	D1015	F1008-D1015 HydrophobicContact CE1-CB 4.45Å; F1008-D1015 HydrophobicContact CE2-CB 4.21Å; F1008-D1015 HydrophobicContact CZ-CB 3.66Å
1009	S	27.8	Very low	32.9	Very low	124 Å²	124	116 Å²	116	87%	0.867	63%	0.634	S	S	*	*	S	Bend	trans	-118	11.2	160.1	66.3	0	0	0	0	114
1010	T	29.1	Very low	32.1	Very low	121 Å²	121	120.6 Å²	120.6	74%	0.742	65%	0.649	S	S	*	*	S	Bend	trans	-129.1	98.3	156.2	44.1	0	0	0	0	108	N1012	T1010-N1012 PolarHBondContact O-N 3.12Å; T1010-N1012 VanDerWaalsContact O-N 3.11Å
1011	T	30.9	Very low	31.7	Very low	118 Å²	118	122.6 Å²	122.6	72%	0.724	66%	0.658	S	S	*	*			trans	-72.7	105	-171.3	48.5	0	0	0	0	112.1
1012	N	31.5	Very low	31.4	Very low	107 Å²	107	126.8 Å²	126.8	57%	0.572	67%	0.666	S	S	*	*			trans	-87.4	133.8	168.1	-150.4	3.4	0	0	0	109	T1010 C1014	T1010-N1012 PolarHBondContact O-N 3.12Å; T1010-N1012 VanDerWaalsContact O-N 3.11Å; N1012-C1014 VanDerWaalsContact C-N 3.3Å; N1012-C1014 PolarHBondContact O-N 3.34Å; N1012-C1014 VanDerWaalsContact O-N 3.1Å
1013	P	28.8	Very low	31.2	Very low	74 Å²	74	131.2 Å²	131.2	48%	0.481	69%	0.688	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.8	-13.5	-161.8	-25.7	36.9	0	0	0	117.6
1014	C	33.7	Very low	31.3	Very low	84 Å²	84	133.3 Å²	133.3	57%	0.568	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-27	-164	-61.7	0	0	0	0	115.6	N1012 L1016	N1012-C1014 VanDerWaalsContact C-N 3.3Å; N1012-C1014 PolarHBondContact O-N 3.34Å; N1012-C1014 VanDerWaalsContact O-N 3.1Å; C1014-L1016 PolarHBondContact O-N 2.83Å
1015	D	35.3	Very low	31.3	Very low	64 Å²	64	133.8 Å²	133.8	34%	0.342	69%	0.694	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.9	-13.9	-169.1	-64.6	-67.4	0	0	0	114.2	F1008 L1017 R1018	F1008-D1015 HydrophobicContact CE1-CB 4.45Å; F1008-D1015 HydrophobicContact CE2-CB 4.21Å; F1008-D1015 HydrophobicContact CZ-CB 3.66Å; D1015-L1017 PolarHBondContact O-N 3.09Å; D1015-R1018 PolarHBondContact O-N 2.81Å
1016	L	33.6	Very low	31.3	Very low	130 Å²	130	134.5 Å²	134.5	68%	0.681	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-14.4	175.4	-92.2	163.9	0	0	0	114.4	C1014	C1014-L1016 PolarHBondContact O-N 2.83Å
1017	L	34.9	Very low	31.3	Very low	137 Å²	137	135.5 Å²	135.5	72%	0.717	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-27.8	175.4	-68.2	174.1	0	0	0	113	D1015	D1015-L1017 PolarHBondContact O-N 3.09Å
1018	R	32.6	Very low	31.3	Very low	185 Å²	185	134.2 Å²	134.2	70%	0.698	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-29.7	-172.3	-171.3	165.3	-78.8	162.4	-5.7	113.6	D1015	D1015-R1018 PolarHBondContact O-N 2.81Å
1019	N	34.8	Very low	31.5	Very low	131 Å²	131	135.3 Å²	135.3	70%	0.701	72%	0.718	S	S	*	*	S	Bend	trans	-92.1	-2.2	177.4	-73.1	-13.7	0	0	0	114.2
1020	R	31.8	Very low	31.7	Very low	201 Å²	201	136.3 Å²	136.3	76%	0.758	71%	0.713	S	S	*	*	S	Bend	trans	-94.8	3.1	179.2	-145.5	168.9	-173.5	141.6	0.8	114.4
1021	V	34	Very low	31.8	Very low	112 Å²	112	136 Å²	136	68%	0.679	71%	0.712	S	S	*	*	S	Bend	trans	-113.7	-7.7	-176.4	-178.9	0	0	0	0	112.6
1022	K	35.3	Very low	31.8	Very low	169 Å²	169	135.6 Å²	135.6	74%	0.735	71%	0.712	S	S	*	*	S	Bend	trans	-96.2	-10.2	-177	-74.4	-171	171.9	-174.2	0	116.2
1023	N	32.1	Very low	31.9	Very low	160 Å²	160	137.6 Å²	137.6	86%	0.856	72%	0.722	S	S	*	*	S	Bend	trans	-107	48.9	179	-83.3	-0.2	0	0	0	112.6
1024	L	30.8	Very low	32.1	Very low	140 Å²	140	141.4 Å²	141.4	73%	0.733	74%	0.738	S	S	*	*	S	Bend	trans	-130.2	4.1	-179.7	-86.8	169.8	0	0	0	114.9
1025	N	30.4	Very low	31.9	Very low	160 Å²	160	144 Å²	144	86%	0.856	75%	0.745	S	S	*	*	S	Bend	trans	-118.6	6.5	-172.2	-80.7	2.3	0	0	0	115.7
1026	E	28.8	Very low	31.7	Very low	194 Å²	194	147 Å²	147	91%	0.907	76%	0.761	S	S	*	*			trans	-125.9	80.3	177.1	-70.8	-166.6	142.4	0	0	112.3
1027	I	27.5	Very low	31.6	Very low	162 Å²	162	147.8 Å²	147.8	83%	0.831	76%	0.761	S	S	*	*			trans	-134.9	138	157.9	-50.4	-178.4	0	0	0	107.1
1028	V	27.2	Very low	31.5	Very low	125 Å²	125	147.9 Å²	147.9	76%	0.758	76%	0.762	S	S	*	*			trans	71.5	84.2	-178.6	-161	0	0	0	0	116
1029	T	31.4	Very low	31.4	Very low	143 Å²	143	143.7 Å²	143.7	88%	0.877	76%	0.762	S	S	*	*				-147.8	129.8	129.1	-60.6	0	0	0	0	108.1
1030	I	31.9	Very low	31.3	Very low	146 Å²	146	141.9 Å²	141.9	75%	0.749	76%	0.759	S	S	*	*			trans	-107.6	138.3	-174.6	-66	174.6	0	0	0	108.7
1031	P	30.3	Very low	31.4	Very low	114 Å²	114	138.6 Å²	138.6	74%	0.74	76%	0.756	S	S	*	*			trans	-69.1	146.4	-176.9	27.9	-36	0	0	0	112.8
1032	P	31.5	Very low	31.4	Very low	109 Å²	109	140.7 Å²	140.7	71%	0.708	76%	0.761	S	S	*	*			trans	-81.9	160.5	178.8	33.9	-35.7	0	0	0	113.2
1033	N	33.2	Very low	31.4	Very low	149 Å²	149	139 Å²	139	80%	0.797	76%	0.76	S	S	*	*			trans	70.9	103.2	170.3	-53.7	-32.5	0	0	0	116.9
1034	L	33.1	Very low	31.6	Very low	154 Å²	154	136.3 Å²	136.3	81%	0.806	75%	0.753	S	S	*	*				-171.5	112.6	108.1	-94.3	163.4	0	0	0	112
1035	I	30.6	Very low	31.9	Very low	139 Å²	139	137.4 Å²	137.4	71%	0.713	76%	0.757	S	S	*	*			trans	67.9	110.6	144.2	-63.1	174.7	0	0	0	120.4
1036	N	30.5	Very low	32.2	Very low	128 Å²	128	135.8 Å²	135.8	68%	0.684	75%	0.748	S	S	*	*			trans	63.3	116.5	141.8	-75.3	-25.3	0	0	0	124.2
1037	Q	31.6	Very low	32.4	Very low	145 Å²	145	135 Å²	135	68%	0.678	74%	0.742	S	S	*	*				84.2	120.6	121	-70.6	178.1	36.7	0	0	121.9
1038	N	31.3	Very low	33	Very low	139 Å²	139	133 Å²	133	74%	0.743	74%	0.74	S	S	*	*			trans	70.3	143.5	143.6	-51.4	-16.2	0	0	0	118.4
1039	S	31.2	Very low	33.1	Very low	98 Å²	98	131.9 Å²	131.9	69%	0.685	74%	0.736	S	S	*	*			cis	-170.8	139.4	-19.2	47.9	0	0	0	0	110.4
1040	S	33.4	Very low	33.3	Very low	93 Å²	93	131.3 Å²	131.3	65%	0.65	73%	0.733	S	S	*	*			trans	46	118.1	147.1	64.5	0	0	0	0	121.2
1041	N	33.6	Very low	33.4	Very low	131 Å²	131	130.6 Å²	130.6	70%	0.701	74%	0.735	S	S	*	*				148.7	135.2	105.7	-90.8	-16.4	0	0	0	116.8
1042	M	34.8	Very low	33.5	Very low	156 Å²	156	128.7 Å²	128.7	77%	0.768	74%	0.736	S	S	*	*			trans	63.4	151.5	134.9	-57	-76.3	166.8	0	0	121.2
1043	D	33.7	Very low	33.6	Very low	134 Å²	134	130.2 Å²	130.2	72%	0.717	74%	0.744	S	S	*	*			cis	-169.2	165.4	-36.1	-146.1	-23.7	0	0	0	110.4
1044	S	36.1	Very low	33.3	Very low	103 Å²	103	129.7 Å²	129.7	72%	0.72	75%	0.746	S	S	*	*			trans	64.7	158.3	169.1	75.5	0	0	0	0	116.9
1045	M	38.5	Very low	33.2	Very low	164 Å²	164	129.1 Å²	129.1	81%	0.808	75%	0.749	S	S	*	*			cis	-163.3	167.1	4.1	-126.7	164.7	171.2	0	0	106.9
1046	D	35.8	Very low	33.2	Very low	126 Å²	126	128.1 Å²	128.1	67%	0.674	75%	0.75	S	S	*	*			cis	-158.2	-165.7	-2.9	-151.3	-25.7	0	0	0	110.4
1047	F	33.2	Very low	33.1	Very low	178 Å²	178	128.8 Å²	128.8	78%	0.781	75%	0.752	S	S	*	*			trans	-105.9	-161.2	-177.9	-86.6	-100.4	0	0	0	112.9
1048	P	39.5	Very low	32.9	Very low	119 Å²	119	127.7 Å²	127.7	77%	0.773	76%	0.755	S	S	*	*			cis	-120.8	166.5	-16.1	14.2	11.9	0	0	0	113.2
1049	C	29.5	Very low	32.8	Very low	101 Å²	101	128 Å²	128	68%	0.682	76%	0.757	S	S	*	*			cis	85.8	116.3	39.8	-168.9	0	0	0	0	116.8
1050	T	35.7	Very low	32.9	Very low	132 Å²	132	127.4 Å²	127.4	81%	0.81	75%	0.753	S	S	*	*			trans	-160	95.6	153.8	15.4	0	0	0	0	114.8
1051	T	34.9	Very low	32.8	Very low	131 Å²	131	128 Å²	128	80%	0.804	75%	0.753	S	S	*	*			trans	40.6	127.4	135.9	58.4	0	0	0	0	124.2
1052	G	32.6	Very low	32.9	Very low	74 Å²	74	127.1 Å²	127.1	76%	0.763	75%	0.748	S	S	*	*			trans	106.2	134.3	147.7	0	0	0	0	0	116
1053	T	33	Very low	32.9	Very low	141 Å²	141	125.8 Å²	125.8	87%	0.865	74%	0.744	S	S	*	*			cis	-151.7	147.2	-3.9	-32	0	0	0	0	109.2
1054	T	26.1	Very low	32.9	Very low	138 Å²	138	125.7 Å²	125.7	85%	0.847	74%	0.742	S	S	*	*			trans	-90.9	127.5	-179.6	27.6	0	0	0	0	113.4
1055	T	32.5	Very low	32.9	Very low	141 Å²	141	126.1 Å²	126.1	87%	0.865	74%	0.735	S	S	*	*			trans	-141.6	150.8	158.3	2.9	0	0	0	0	110.5
1056	T	28.9	Very low	32.8	Very low	118 Å²	118	122.5 Å²	122.5	72%	0.724	72%	0.722	S	S	*	*			trans	-90.7	150	-164.2	44.1	0	0	0	0	114.7
1057	I	28.5	Very low	32.9	Very low	142 Å²	142	120.2 Å²	120.2	73%	0.728	71%	0.713	S	S	*	*				36.1	114.6	128.8	-45.9	166	0	0	0	114.7
1058	T	29.2	Very low	33	Very low	122 Å²	122	115.6 Å²	115.6	75%	0.748	70%	0.7	S	S	*	*				-151.6	145.3	74.6	45.7	0	0	0	0	115.8
1059	N	29.2	Very low	32.8	Very low	145 Å²	145	112.3 Å²	112.3	78%	0.775	68%	0.682	S	S	*	*			trans	12.6	119.6	140.9	-48.8	-1.9	0	0	0	119.2
1060	S	31.7	Very low	33.3	Very low	87 Å²	87	114.4 Å²	114.4	61%	0.608	68%	0.682	S	S	*	*			trans	-144.7	123.5	131.5	-178.6	0	0	0	0	108.4
1061	T	32.8	Very low	33.4	Very low	105 Å²	105	114.8 Å²	114.8	64%	0.644	68%	0.675	S	S	*	*			trans	-132.6	12.7	-178.3	46.2	0	0	0	0	112.8
1062	D	34.7	Very low	33.3	Very low	113 Å²	113	110.4 Å²	110.4	60%	0.604	65%	0.649	S	S	*	*	S	Bend	trans	-96.5	-26.8	-166.7	-57.8	-48.8	0	0	0	113.2	I1064	D1062-I1064 VanDerWaalsContact C-N 3.29Å; D1062-I1064 PolarHBondContact O-N 3.22Å
1063	D	34.4	Very low	33.6	Very low	127 Å²	127	111.8 Å²	111.8	68%	0.679	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-7.3	-175.1	-66.2	-51.2	0	0	0	115.5
1064	I	35.2	Very low	33.9	Very low	133 Å²	133	108.2 Å²	108.2	68%	0.682	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-18.6	-178	-62.5	175.5	0	0	0	112	D1062 T1068	D1062-I1064 VanDerWaalsContact C-N 3.29Å; D1062-I1064 PolarHBondContact O-N 3.22Å; I1064-T1068 PolarHBondContact O-OG1 3.34Å
1065	I	34.3	Very low	34.4	Very low	112 Å²	112	107 Å²	107	57%	0.574	61%	0.611	S	S	*	*	H	α-helix	trans	-85.3	-29.9	-175.5	-61.7	176.4	0	0	0	111.5	T1068	I1065-T1068 PolarHBondContact O-OG1 3.1Å
1066	T	36.4	Very low	34.6	Very low	87 Å²	87	103.3 Å²	103.3	53%	0.534	59%	0.591	S	S	.	*	H	α-helix	trans	-69.8	-48.5	-178.7	44.1	0	0	0	0	113.1	T1068 A1069	T1066-T1068 VanDerWaalsContact C-N 3.28Å; T1066-T1068 PolarHBondContact O-N 3.01Å; T1066-A1069 PolarHBondContact O-N 3.28Å
1067	T	37.8	Very low	35.1	Very low	79 Å²	79	102.7 Å²	102.7	49%	0.485	58%	0.583	S	S	.	*	H	α-helix	trans	-68.5	-21.9	-177	44.1	0	0	0	0	114.3
1068	T	37.3	Very low	35.5	Very low	81 Å²	81	102.1 Å²	102.1	50%	0.497	58%	0.581	S	S	.	*	H	α-helix	trans	-83.5	-27.5	175.8	46.9	0	0	0	0	113	I1064 I1065 T1066 C1072	I1064-T1068 PolarHBondContact O-OG1 3.34Å; I1065-T1068 PolarHBondContact O-OG1 3.1Å; T1066-T1068 VanDerWaalsContact C-N 3.28Å; T1066-T1068 PolarHBondContact O-N 3.01Å; T1068-C1072 PolarHBondContact O-N 3.4Å; T1068-C1072 PolarHBondContact O-SG 3.08Å
1069	A	35.2	Very low	35.8	Very low	50 Å²	50	103.9 Å²	103.9	41%	0.413	58%	0.583	S	S	.	*	H	α-helix	trans	-68.2	-40.4	176.7	0	0	0	0	0	112.9	T1066 Q1071 C1072 N1073	T1066-A1069 PolarHBondContact O-N 3.28Å; A1069-Q1071 PolarHBondContact O-N 3.44Å; A1069-C1072 PolarHBondContact O-N 3.49Å; A1069-N1073 PolarHBondContact O-N 2.81Å; A1069-N1073 VanDerWaalsContact O-N 3.17Å; A1069-N1073 PolarHBondContact O-ND2 3.25Å
1070	E	38.2	Very low	36.1	Very low	144 Å²	144	102.9 Å²	102.9	67%	0.673	58%	0.577	S	S	*	*	H	α-helix	trans	-66	-39.2	-178.7	-63.7	-171.9	139.3	0	0	112.5	N1073 A1074	E1070-N1073 PolarHBondContact O-N 3.17Å; E1070-A1074 PolarHBondContact O-N 3.01Å; E1070-A1074 VanDerWaalsContact O-N 3.08Å
1071	Q	38.6	Very low	36.4	Very low	141 Å²	141	103.8 Å²	103.8	66%	0.659	58%	0.579	S	S	*	*	H	α-helix	trans	-69.6	-34.9	178.9	-62.9	-171.9	10.6	0	0	112.6	A1069 A1074 L1075	A1069-Q1071 PolarHBondContact O-N 3.44Å; Q1071-A1074 PolarHBondContact O-N 3.42Å; Q1071-L1075 PolarHBondContact O-N 3.02Å
1072	C	33.5	Very low	36.9	Very low	39 Å²	39	108 Å²	108	26%	0.264	59%	0.588	S	S	.	*	H	α-helix	trans	-67	-39.3	174.1	-64.5	0	0	0	0	111.9	T1068 A1069 A1074 L1075 S1076	T1068-C1072 PolarHBondContact O-N 3.4Å; T1068-C1072 PolarHBondContact O-SG 3.08Å; A1069-C1072 PolarHBondContact O-N 3.49Å; C1072-A1074 VanDerWaalsContact C-N 3.35Å; C1072-A1074 PolarHBondContact O-N 3.47Å; C1072-L1075 PolarHBondContact O-N 2.8Å; C1072-S1076 PolarHBondContact O-N 2.76Å
1073	N	37.8	Very low	36.9	Very low	103 Å²	103	108 Å²	108	55%	0.551	59%	0.587	S	S	*	*	H	α-helix	trans	-65.3	-35.3	175.1	-80.4	-34.5	0	0	0	112.7	A1069 E1070 N1077	A1069-N1073 PolarHBondContact O-N 2.81Å; A1069-N1073 VanDerWaalsContact O-N 3.17Å; A1069-N1073 PolarHBondContact O-ND2 3.25Å; E1070-N1073 PolarHBondContact O-N 3.17Å; N1073-N1077 PolarHBondContact O-N 3.07Å; N1073-N1077 PolarHBondContact O-ND2 3.35Å
1074	A	39.5	Very low	37.3	Very low	66 Å²	66	104.1 Å²	104.1	55%	0.545	57%	0.57	S	S	.	*	H	α-helix	trans	-64.3	-41.5	174.6	0	0	0	0	0	112.7	E1070 Q1071 C1072 L1078	E1070-A1074 PolarHBondContact O-N 3.01Å; E1070-A1074 VanDerWaalsContact O-N 3.08Å; Q1071-A1074 PolarHBondContact O-N 3.42Å; C1072-A1074 VanDerWaalsContact C-N 3.35Å; C1072-A1074 PolarHBondContact O-N 3.47Å; A1074-L1078 PolarHBondContact O-N 2.91Å
1075	L	36.7	Very low	37.6	Very low	112 Å²	112	106.4 Å²	106.4	59%	0.586	58%	0.575	S	S	*	*	H	α-helix	trans	-71.5	-40.6	179.4	-88.7	159.1	0	0	0	113.3	Q1071 C1072 N1077 L1078 M1079	Q1071-L1075 PolarHBondContact O-N 3.02Å; C1072-L1075 PolarHBondContact O-N 2.8Å; L1075-N1077 PolarHBondContact O-N 3.27Å; L1075-L1078 PolarHBondContact O-N 3.28Å; L1075-L1078 VanDerWaalsContact O-N 3.09Å; L1075-M1079 PolarHBondContact O-N 3.3Å
1076	S	37	Very low	37.8	Very low	63 Å²	63	108 Å²	108	44%	0.441	58%	0.58	S	S	.	*	H	α-helix	trans	-59.3	-45.4	177.4	-173.2	0	0	0	0	111.9	C1072 L1078 M1079 L1080	C1072-S1076 PolarHBondContact O-N 2.76Å; S1076-L1078 PolarHBondContact O-N 3.35Å; S1076-M1079 PolarHBondContact O-N 2.89Å; S1076-L1080 PolarHBondContact O-N 2.99Å
1077	N	38.2	Very low	38.4	Very low	105 Å²	105	109.3 Å²	109.3	56%	0.561	58%	0.58	S	S	*	*	H	α-helix	trans	-66.2	-20.7	176.6	-75.7	-67.6	0	0	0	113.6	N1073 L1075 T1081	N1073-N1077 PolarHBondContact O-N 3.07Å; N1073-N1077 PolarHBondContact O-ND2 3.35Å; L1075-N1077 PolarHBondContact O-N 3.27Å; N1077-T1081 VanDerWaalsContact O-CG2 3.3Å; N1077-T1081 WeakPolarHBondContact O-CG2 3.5Å
1078	L	37.3	Very low	38.6	Very low	131 Å²	131	109.9 Å²	109.9	69%	0.686	58%	0.58	S	S	*	*	H	α-helix	trans	-80.3	-27.4	178.9	-158.7	71	0	0	0	113.2	A1074 L1075 S1076 T1081	A1074-L1078 PolarHBondContact O-N 2.91Å; L1075-L1078 PolarHBondContact O-N 3.28Å; L1075-L1078 VanDerWaalsContact O-N 3.09Å; S1076-L1078 PolarHBondContact O-N 3.35Å; L1078-T1081 PolarHBondContact O-OG1 3.27Å
1079	M	36.6	Very low	38.8	Very low	159 Å²	159	110.2 Å²	110.2	78%	0.783	58%	0.579	S	S	*	*	H	α-helix	trans	-86.1	-29.8	174.3	-71.3	-157	176.3	0	0	113.5	L1075 S1076 T1081	L1075-M1079 PolarHBondContact O-N 3.3Å; S1076-M1079 PolarHBondContact O-N 2.89Å; M1079-T1081 PolarHBondContact O-N 3.5Å
1080	L	35.8	Very low	39.4	Very low	124 Å²	124	113.3 Å²	113.3	65%	0.649	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-76.1	-1	-176.6	-72.8	168	0	0	0	115	S1076	S1076-L1080 PolarHBondContact O-N 2.99Å
1081	T	37.9	Very low	39.5	Very low	106 Å²	106	114.6 Å²	114.6	65%	0.65	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-91.5	8.4	-174.4	44	0	0	0	0	115.3	N1077 L1078 M1079	N1077-T1081 VanDerWaalsContact O-CG2 3.3Å; N1077-T1081 WeakPolarHBondContact O-CG2 3.5Å; L1078-T1081 PolarHBondContact O-OG1 3.27Å; M1079-T1081 PolarHBondContact O-N 3.5Å
1082	K	42.3	Very low	39.9	Very low	193 Å²	193	113.5 Å²	113.5	84%	0.839	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-130	10.6	-176.8	-75	-165.5	174.7	-175	0	116.5
1083	I	35.3	Very low	40.2	Very low	112 Å²	112	117.3 Å²	117.3	57%	0.574	61%	0.607	S	S	*	*	S	Bend	trans	-127.8	123.5	173.1	-60	174.2	0	0	0	107	E1087 L1088	I1083-E1087 HydrophobicContact CG2-CB 4.07Å; I1083-L1088 HydrophobicContact CG2-CB 4.35Å
1084	S	43.5	Very low	40.1	Very low	46 Å²	46	115.7 Å²	115.7	32%	0.322	60%	0.604	S	S	.	*			trans	-69.9	153.8	177.8	67.1	0	0	0	0	111.3	E1086 E1087 L1088	S1084-E1086 PolarHBondContact O-N 3.23Å; S1084-E1087 VanDerWaalsContact CB-OE2 3.22Å; S1084-E1087 WeakPolarHBondContact CB-OE2 3.4Å; S1084-E1087 PolarHBondContact N-OE2 3.3Å; S1084-E1087 PolarHBondContact O-N 3.26Å; S1084-E1087 WeakPolarHBondContact OG-CB 3.3Å; S1084-E1087 VanDerWaalsContact OG-CD 3.28Å; S1084-E1087 WeakPolarHBondContact OG-CG 3.26Å; S1084-E1087 PolarHBondContact OG-N 3.45Å; S1084-E1087 PolarHBondContact OG-OE2 2.93Å; S1084-L1088 PolarHBondContact O-N 3.36Å; S1084-L1088 VanDerWaalsContact O-N 3.09Å
1085	K	40.5	Very low	39.7	Very low	181 Å²	181	118.9 Å²	118.9	79%	0.787	62%	0.619	S	S	*	*	H	α-helix	trans	-60.4	-24.9	173.8	-114.3	176.3	178	176.3	0	112.5	N1089	K1085-N1089 WeakPolarHBondContact O-CB 3.12Å; K1085-N1089 VanDerWaalsContact O-CG 3.25Å; K1085-N1089 PolarHBondContact O-N 2.93Å; K1085-N1089 PolarHBondContact O-ND2 3.38Å
1086	E	38.5	Very low	39.5	Very low	146 Å²	146	118.8 Å²	118.8	68%	0.682	63%	0.627	S	S	*	*	H	α-helix	trans	-78.5	-42.8	176.2	-67.2	174.9	116.9	0	0	111.7	S1084 L1088 N1089 N1090	S1084-E1086 PolarHBondContact O-N 3.23Å; E1086-L1088 PolarHBondContact O-N 3.04Å; E1086-N1089 PolarHBondContact O-N 3.36Å; E1086-N1090 VanDerWaalsContact O-CB 3.29Å; E1086-N1090 WeakPolarHBondContact O-CB 3.24Å; E1086-N1090 PolarHBondContact O-N 3.48Å; E1086-N1090 PolarHBondContact O-ND2 3.03Å; E1086-N1090 VanDerWaalsContact O-ND2 3.13Å
1087	E	48.6	Very low	39.1	Very low	114 Å²	114	130.6 Å²	130.6	53%	0.533	67%	0.665	S	S	.	*	H	α-helix	trans	-60.5	-43.4	173.2	-75	160.8	124.7	0	0	111.9	I1083 S1084 N1090 F1091	I1083-E1087 HydrophobicContact CG2-CB 4.07Å; S1084-E1087 VanDerWaalsContact CB-OE2 3.22Å; S1084-E1087 WeakPolarHBondContact CB-OE2 3.4Å; S1084-E1087 PolarHBondContact N-OE2 3.3Å; S1084-E1087 PolarHBondContact O-N 3.26Å; S1084-E1087 WeakPolarHBondContact OG-CB 3.3Å; S1084-E1087 VanDerWaalsContact OG-CD 3.28Å; S1084-E1087 WeakPolarHBondContact OG-CG 3.26Å; S1084-E1087 PolarHBondContact OG-N 3.45Å; S1084-E1087 PolarHBondContact OG-OE2 2.93Å; E1087-N1090 PolarHBondContact O-N 3.5Å; E1087-F1091 WeakPolarHBondContact O-CB 3.48Å; E1087-F1091 PolarHBondContact O-N 3.19Å
1088	L	41.6	Very low	39.1	Very low	91 Å²	91	131.9 Å²	131.9	48%	0.476	67%	0.67	S	S	.	*	H	α-helix	trans	-64.5	-43.2	177.3	-169.4	68.3	0	0	0	111.7	I1083 S1084 E1086 F1091 I1092	I1083-L1088 HydrophobicContact CG2-CB 4.35Å; S1084-L1088 PolarHBondContact O-N 3.36Å; S1084-L1088 VanDerWaalsContact O-N 3.09Å; E1086-L1088 PolarHBondContact O-N 3.04Å; L1088-F1091 PolarHBondContact O-N 2.8Å; L1088-I1092 HydrophobicContact CD1-CD1 4.45Å; L1088-I1092 HydrophobicContact CG-CD1 4.03Å; L1088-I1092 WeakPolarHBondContact O-CG1 3.35Å; L1088-I1092 PolarHBondContact O-N 3.5Å
1089	N	41.8	Very low	39.2	Very low	89 Å²	89	131.9 Å²	131.9	48%	0.476	67%	0.669	S	S	.	*	H	α-helix	trans	-65.9	-37.1	175.3	-78.5	-13.4	0	0	0	112.3	K1085 E1086 F1091 I1092 N1093	K1085-N1089 WeakPolarHBondContact O-CB 3.12Å; K1085-N1089 VanDerWaalsContact O-CG 3.25Å; K1085-N1089 PolarHBondContact O-N 2.93Å; K1085-N1089 PolarHBondContact O-ND2 3.38Å; E1086-N1089 PolarHBondContact O-N 3.36Å; N1089-F1091 VanDerWaalsContact C-N 3.31Å; N1089-I1092 PolarHBondContact O-N 3.21Å; N1089-N1093 WeakPolarHBondContact O-CB 3.41Å; N1089-N1093 PolarHBondContact O-N 3.27Å; N1089-N1093 PolarHBondContact O-ND2 3.32Å
1090	N	48.2	Very low	39.4	Very low	114 Å²	114	130.4 Å²	130.4	61%	0.61	66%	0.662	S	S	*	*	H	α-helix	trans	-69.4	-29.9	176.1	-72.4	-29.8	0	0	0	112.1	E1086 E1087 S1094	E1086-N1090 VanDerWaalsContact O-CB 3.29Å; E1086-N1090 WeakPolarHBondContact O-CB 3.24Å; E1086-N1090 PolarHBondContact O-N 3.48Å; E1086-N1090 PolarHBondContact O-ND2 3.03Å; E1086-N1090 VanDerWaalsContact O-ND2 3.13Å; E1087-N1090 PolarHBondContact O-N 3.5Å; N1090-S1094 WeakPolarHBondContact O-CB 3.46Å; N1090-S1094 PolarHBondContact O-N 3.15Å; N1090-S1094 PolarHBondContact O-OG 3.43Å
1091	F	40.9	Very low	39.6	Very low	171 Å²	171	130.8 Å²	130.8	75%	0.75	66%	0.663	S	S	*	*	H	α-helix	trans	-75.5	-32.7	174.6	-156.9	-86.8	0	0	0	112.7	E1087 L1088 N1089 S1094	E1087-F1091 WeakPolarHBondContact O-CB 3.48Å; E1087-F1091 PolarHBondContact O-N 3.19Å; L1088-F1091 PolarHBondContact O-N 2.8Å; N1089-F1091 VanDerWaalsContact C-N 3.31Å; F1091-S1094 PolarHBondContact O-OG 3.25Å
1092	I	46.9	Very low	39.7	Very low	118 Å²	118	132.3 Å²	132.3	61%	0.605	66%	0.664	S	S	*	*	H	α-helix	trans	-78.8	-33.9	177.5	-68.8	167.8	0	0	0	111.9	L1088 N1089	L1088-I1092 HydrophobicContact CD1-CD1 4.45Å; L1088-I1092 HydrophobicContact CG-CD1 4.03Å; L1088-I1092 WeakPolarHBondContact O-CG1 3.35Å; L1088-I1092 PolarHBondContact O-N 3.5Å; N1089-I1092 PolarHBondContact O-N 3.21Å
1093	N	40.2	Very low	39.5	Very low	119 Å²	119	128.3 Å²	128.3	64%	0.636	65%	0.652	S	S	*	*	S	Bend	trans	-99.5	11.8	-174.5	-65.2	-76.9	0	0	0	114.7	N1089 P1095	N1089-N1093 WeakPolarHBondContact O-CB 3.41Å; N1089-N1093 PolarHBondContact O-N 3.27Å; N1089-N1093 PolarHBondContact O-ND2 3.32Å; N1093-P1095 VanDerWaalsContact O-CD 3.29Å; N1093-P1095 WeakPolarHBondContact O-CD 3.31Å
1094	S	35.3	Very low	39.8	Very low	69 Å²	69	129.4 Å²	129.4	48%	0.483	66%	0.658	S	S	.	*			trans	-91.6	109.9	177.6	52.8	0	0	0	0	111.9	N1090 F1091 S1096	N1090-S1094 WeakPolarHBondContact O-CB 3.46Å; N1090-S1094 PolarHBondContact O-N 3.15Å; N1090-S1094 PolarHBondContact O-OG 3.43Å; F1091-S1094 PolarHBondContact O-OG 3.25Å; S1094-S1096 PolarHBondContact O-N 2.92Å
1095	P	29.9	Very low	39.5	Very low	134 Å²	134	135.8 Å²	135.8	87%	0.87	68%	0.684	S	S	*	*			trans	-79.1	114.9	-178.7	30.8	-33.7	0	0	0	111.3	N1093	N1093-P1095 VanDerWaalsContact O-CD 3.29Å; N1093-P1095 WeakPolarHBondContact O-CD 3.31Å
1096	S	33.8	Very low	39.5	Very low	109 Å²	109	132.1 Å²	132.1	76%	0.762	68%	0.675	S	S	*	*			trans	-144	122	172.6	65.4	0	0	0	0	113.8	S1094	S1094-S1096 PolarHBondContact O-N 2.92Å
1097	Y	27.8	Very low	39.5	Very low	311 Å²	311	130.8 Å²	130.8	100%	1.22	68%	0.675	S	S	*	*			trans	-22.8	0	154.3	-91.5	-96.8	0	0	0	116.2

Retrieved 1,097 of 1,097 residues in 447.8 ms (Link to these results)

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